*HEADER    METAL BINDING PROTEIN                   13-APR-04   1VFI              
*TITLE     SOLUTION STRUCTURE OF VANABIN2 (RUH-017), A VANADIUM-                 
*TITLE    2 BINDING PROTEIN FROM ASCIDIA SYDNEIENSIS SAMEA                       
*COMPND    MOL_ID: 1;                                                            
*COMPND   2 MOLECULE: VANADIUM-BINDING PROTEIN 2;                                
*COMPND   3 CHAIN: A;                                                            
*COMPND   4 FRAGMENT: RESIDUES 1-95;                                             
*COMPND   5 SYNONYM: VANABIN2, RUH-017;                                          
*COMPND   6 ENGINEERED: YES                                                      
*SOURCE    MOL_ID: 1;                                                            
*SOURCE   2 ORGANISM_SCIENTIFIC: ASCIDIA SYDNEIENSIS SAMEA;                      
*SOURCE   3 ORGANISM_COMMON: VANADIUM-RICH ASCIDIAN;                             
*SOURCE   4 EXPRESSION_SYSTEM: ESCHERICHIA COLI;                                 
*SOURCE   5 EXPRESSION_SYSTEM_COMMON: BACTERIA;                                  
*SOURCE   6 EXPRESSION_SYSTEM_STRAIN: BL21;                                      
*SOURCE   7 EXPRESSION_SYSTEM_VECTOR_TYPE: PLASMID;                              
*SOURCE   8 EXPRESSION_SYSTEM_PLASMID: PMAL-C                                    
*KEYWDS    NMR, VANADIUM-BINDING, ASCIDIAN                                       
*EXPDTA    NMR, 20 STRUCTURES                                                    
*AUTHOR    T.HAMADA, H.HIROTA, M.ASANUMA, F.HAYASHI, N.KOBAYASHI,                
*AUTHOR   2 T.UEKI, H.MICHIBATA, S.YOKOYAMA                                      
*REVDAT   1   22-MAR-05 1VFI    0                                                

 95 LYS  HN     95 LYS  HB3     3.89            #peak     3 #SUP  4.39
 95 LYS  HN     95 LYS  HB2     3.66            #peak     4 #SUP  4.02
 95 LYS  HN     95 LYS  QG      3.88            #peak     5 #SUP  4.13
 16 PRO  HA     18 GLU  HN      4.47            #peak     8 #SUP  2.91
 18 GLU  HN     19 PRO  HD2     3.54            #peak    10 #SUP  6.58
 18 GLU  HN     18 GLU  HG2     4.10            #peak    11 #SUP  6.31
 18 GLU  HN     18 GLU  HB3     3.16            #peak    12 #SUP  6.83
 18 GLU  HN     18 GLU  HB2     3.36            #peak    13 #SUP  6.83
  7 VAL  HA      8 ASP  HN      3.47            #peak    14 #SUP  4.09
 52 GLN  HN     53 ASP  HN      3.48            #peak    16 #SUP  6.39
 53 ASP  HN     54 LYS  HN      3.51            #peak    17 #SUP  7.84
 50 GLU  HA     53 ASP  HN      4.02            #peak    19 #SUP  5.29
 20 LEU  HA     53 ASP  HN      4.42            #peak    20 #SUP  4.94
 53 ASP  HN     53 ASP  HB3     3.29            #peak    21 #SUP  5.01
 53 ASP  HN     53 ASP  HB2     3.16            #peak    22 #SUP  4.51
 52 GLN  HB3    53 ASP  HN      3.88            #peak    23 #SUP  5.78
 20 LEU  QD1    53 ASP  HN      4.21            #peak    24 #SUP  6.63
 52 GLN  HB2    53 ASP  HN      4.33            #peak    25 #SUP  5.17
  7 VAL  QG1     8 ASP  HN      4.72            #peak    27 #SUP  3.54
 73 ALA  HN     73 ALA  QB      2.96            #peak    31 #SUP  4.09
 27 CYS  HN     28 ALA  HN      2.84            #peak    32 #SUP  5.44
 28 ALA  HN     29 GLU  HN      3.34            #peak    33 #SUP  5.69
 27 CYS  HB3    28 ALA  HN      3.72            #peak    36 #SUP  3.87
 28 ALA  HN     28 ALA  QB      3.01            #peak    38 #SUP  4.30
 21 THR  HB     22 ALA  HN      3.25            #peak    40 #SUP  4.14
 21 THR  QG2    22 ALA  HN      4.22            #peak    45 #SUP  4.87
 86 CYS  HN     87 ARG  HN      3.71            #peak    47 #SUP  6.65
 85 THR  HB     86 CYS  HN      4.00            #peak    48 #SUP  3.55
 86 CYS  HN     86 CYS  HB3     3.65            #peak    49 #SUP  4.57
 86 CYS  HN     86 CYS  HB2     3.52            #peak    50 #SUP  4.92
 64 HIS  HA     68 ARG  HN      5.31            #peak    53 #SUP  2.09
 68 ARG  HN     68 ARG  HB3     3.77            #peak    57 #SUP  6.39
 68 ARG  HN     68 ARG  HB2     3.48            #peak    58 #SUP  6.50
 10 LYS  HN     10 LYS  HB3     3.64            #peak    60 #SUP  3.83
 10 LYS  HN     10 LYS  HG3     5.50            #peak    61 #SUP  3.87
 65 LYS  HN     66 ALA  HN      3.99            #peak    63 #SUP  4.58
 65 LYS  QB     66 ALA  HN      3.42            #peak    65 #SUP  3.76
 66 ALA  HN     66 ALA  QB      3.22            #peak    66 #SUP  3.15
 63 CYS  HN     64 HIS  HN      3.74            #peak    67 #SUP  4.28
 64 HIS  HN     64 HIS  HB2     3.73            #peak    69 #SUP  4.53
 64 HIS  HN     64 HIS  HB3     3.83            #peak    70 #SUP  4.47
 60 ARG  HN     61 MET  HN      3.71            #peak    71 #SUP  8.32
 59 CYS  HB3    60 ARG  HN      3.56            #peak    76 #SUP  6.05
 59 CYS  HB2    60 ARG  HN      3.85            #peak    77 #SUP  5.36
 60 ARG  HN     60 ARG  HB3     3.26            #peak    78 #SUP  7.51
 60 ARG  HN     60 ARG  HG3     3.26            #peak    79 #SUP  6.69
 60 ARG  HN     60 ARG  HG2     4.32            #peak    80 #SUP  7.12
 25 GLU  HN     26 LYS  HN      3.11            #peak    82 #SUP  7.93
 25 GLU  HB3    26 LYS  HN      3.32            #peak    85 #SUP  5.58
 26 LYS  HN     26 LYS  HB3     3.16            #peak    86 #SUP  7.01
 26 LYS  HN     26 LYS  HB2     3.16            #peak    87 #SUP  6.87
 26 LYS  HN     26 LYS  HG3     4.13            #peak    88 #SUP  6.36
 26 LYS  HN     26 LYS  HG2     4.85            #peak    89 #SUP  5.89
 42 ARG  HN     42 ARG  QD      4.32            #peak    95 #SUP  5.03
 42 ARG  HN     42 ARG  QB      2.82            #peak    96 #SUP  5.75
 41 ARG  QB     42 ARG  HN      3.67            #peak    97 #SUP  4.73
 24 LYS  HN     25 GLU  HN      3.55            #peak    98 #SUP  7.43
 22 ALA  HA     25 GLU  HN      3.82            #peak   100 #SUP  3.00
 25 GLU  HN     25 GLU  HG3     3.89            #peak   103 #SUP  5.41
 25 GLU  HN     25 GLU  HB3     3.22            #peak   104 #SUP  6.38
 25 GLU  HN     25 GLU  HB2     3.52            #peak   105 #SUP  6.77
 24 LYS  HB3    25 GLU  HN      3.38            #peak   106 #SUP  5.85
 43 ASN  HN     44 CYS  HN      3.00            #peak   107 #SUP  7.59
 44 CYS  HN     44 CYS  HB3     3.24            #peak   111 #SUP  4.34
 44 CYS  HN     44 CYS  HB2     3.26            #peak   112 #SUP  4.66
 43 ASN  HB3    44 CYS  HN      3.53            #peak   113 #SUP  6.27
 50 GLU  HN     51 PRO  QD      3.15            #peak   117 #SUP  7.94
 50 GLU  HN     50 GLU  HG2     4.18            #peak   118 #SUP  6.11
 50 GLU  HN     50 GLU  HB3     3.41            #peak   119 #SUP  6.57
 50 GLU  HN     50 GLU  HB2     3.18            #peak   120 #SUP  5.99
 31 CYS  HN     32 GLU  HN      3.53            #peak   121 #SUP  5.10
 32 GLU  HN     32 GLU  HG3     3.71            #peak   124 #SUP  4.87
 32 GLU  HN     32 GLU  HG2     4.33            #peak   125 #SUP  4.87
 32 GLU  HN     32 GLU  HB3     3.23            #peak   126 #SUP  5.29
 32 GLU  HN     32 GLU  HB2     3.57            #peak   127 #SUP  5.29
 75 GLU  HN     75 GLU  HG2     3.69            #peak   128 #SUP  6.58
 72 CYS  HA     75 GLU  HN      4.67            #peak   130 #SUP  2.00
 75 GLU  HN     75 GLU  HB3     3.53            #peak   131 #SUP  6.58
 74 SER  QB     75 GLU  HN      3.84            #peak   135 #SUP  4.99
  6 PRO  HA      7 VAL  HN      3.03            #peak   136 #SUP  5.97
  6 PRO  HB3     7 VAL  HN      4.08            #peak   138 #SUP  4.99
  7 VAL  HN      7 VAL  HB      3.49            #peak   139 #SUP  4.17
  6 PRO  HB2     7 VAL  HN      4.20            #peak   140 #SUP  5.12
  7 VAL  HN      7 VAL  QG2     3.65            #peak   141 #SUP  4.68
  7 VAL  HN      7 VAL  QG1     4.58            #peak   142 #SUP  4.57
 45 LYS  HN     46 LYS  HN      3.95            #peak   143 #SUP  5.65
 44 CYS  HB3    45 LYS  HN      3.97            #peak   146 #SUP  5.11
 44 CYS  HB2    45 LYS  HN      3.77            #peak   147 #SUP  5.72
 45 LYS  HN     45 LYS  HB3     3.02            #peak   148 #SUP  6.90
 45 LYS  HN     45 LYS  HB2     3.23            #peak   149 #SUP  5.85
 45 LYS  HN     45 LYS  HG3     4.61            #peak   150 #SUP  6.16
 41 ARG  HN     42 ARG  HN      3.59            #peak   152 #SUP  5.28
 40 CYS  HB3    41 ARG  HN      3.58            #peak   155 #SUP  4.99
 41 ARG  HN     41 ARG  HG3     2.99            #peak   156 #SUP  5.84
 90 MET  HN     91 LYS  HN      3.45            #peak   157 #SUP  6.61
 89 CYS  HN     90 MET  HN      3.38            #peak   158 #SUP  6.16
 87 ARG  HA     90 MET  HN      4.25            #peak   160 #SUP  5.41
 89 CYS  HB3    90 MET  HN      3.41            #peak   161 #SUP  5.38
 89 CYS  HB2    90 MET  HN      3.89            #peak   162 #SUP  5.38
 90 MET  HN     90 MET  HG3     3.35            #peak   163 #SUP  7.54
 90 MET  HN     90 MET  HG2     3.32            #peak   164 #SUP  6.93
 90 MET  HN     90 MET  HB3     3.22            #peak   165 #SUP  7.61
 39 THR  HN     40 CYS  HN      3.57            #peak   167 #SUP  5.34
 40 CYS  HN     40 CYS  HB3     3.22            #peak   169 #SUP  4.57
 37 LYS  HA     41 ARG  HN      4.37            #peak   170 #SUP  3.80
 40 CYS  HB2    41 ARG  HN      3.88            #peak   171 #SUP  4.99
 41 ARG  HN     41 ARG  QB      3.52            #peak   172 #SUP  6.44
 41 ARG  HN     41 ARG  HG2     4.36            #peak   173 #SUP  6.06
 12 GLN  HN     12 GLN  HG3     4.31            #peak   178 #SUP  5.38
 12 GLN  HN     12 GLN  HG2     4.72            #peak   179 #SUP  5.51
 12 GLN  HN     12 GLN  HB3     3.66            #peak   180 #SUP  4.80
 87 ARG  HN     88 ALA  HN      3.58            #peak   181 #SUP  7.20
 84 ASP  HA     88 ALA  HN      4.73            #peak   183 #SUP  3.53
 85 THR  HA     88 ALA  HN      4.26            #peak   185 #SUP  3.44
 87 ARG  QB     88 ALA  HN      3.43            #peak   187 #SUP  6.07
 40 CYS  HN     41 ARG  HN      3.70            #peak   189 #SUP  5.49
 37 LYS  HA     40 CYS  HN      3.70            #peak   190 #SUP  2.49
 39 THR  HB     40 CYS  HN      3.40            #peak   191 #SUP  4.80
 40 CYS  HN     40 CYS  HB2     3.20            #peak   192 #SUP  4.57
 66 ALA  HN     67 CYS  HN      4.11            #peak   194 #SUP  4.17
 67 CYS  HN     67 CYS  HB3     3.61            #peak   196 #SUP  3.15
 66 ALA  QB     67 CYS  HN      3.76            #peak   198 #SUP  3.56
 61 MET  HN     62 LYS  HN      3.72            #peak   199 #SUP  9.38
 62 LYS  HN     63 CYS  HN      3.56            #peak   200 #SUP  6.83
 58 ALA  HA     62 LYS  HN      5.43            #peak   202 #SUP  5.04
 61 MET  HB3    62 LYS  HN      4.02            #peak   204 #SUP  7.44
 62 LYS  HN     62 LYS  QD      4.94            #peak   205 #SUP  8.09
 62 LYS  HN     62 LYS  HG3     4.55            #peak   206 #SUP  7.01
 57 ASP  HN     58 ALA  HN      3.53            #peak   207 #SUP  5.40
 58 ALA  HN     59 CYS  HN      3.57            #peak   208 #SUP  4.89
 57 ASP  HB3    58 ALA  HN      3.90            #peak   212 #SUP  4.87
 57 ASP  HB2    58 ALA  HN      3.96            #peak   213 #SUP  4.87
 58 ALA  HN     58 ALA  QB      2.88            #peak   214 #SUP  7.31
 19 PRO  HA     23 CYS  HN      4.83            #peak   215 #SUP  2.31
 23 CYS  HN     24 LYS  HN      3.48            #peak   216 #SUP  6.27
 22 ALA  HN     23 CYS  HN      3.21            #peak   217 #SUP  5.32
 20 LEU  HA     23 CYS  HN      4.07            #peak   219 #SUP  4.34
 23 CYS  HN     23 CYS  HB3     3.08            #peak   220 #SUP  4.44
 23 CYS  HN     23 CYS  HB2     3.23            #peak   221 #SUP  3.86
 22 ALA  QB     23 CYS  HN      3.35            #peak   222 #SUP  5.44
 54 LYS  HA     57 ASP  HN      4.23            #peak   227 #SUP  2.96
 56 CYS  QB     57 ASP  HN      3.34            #peak   228 #SUP  5.39
 57 ASP  HN     57 ASP  HB3     3.15            #peak   229 #SUP  5.72
 20 LEU  HA     24 LYS  HN      5.42            #peak   231 #SUP  2.97
 23 CYS  HB3    24 LYS  HN      4.57            #peak   232 #SUP  5.66
 23 CYS  HB2    24 LYS  HN      3.90            #peak   237 #SUP  5.66
 24 LYS  HN     24 LYS  HB3     3.27            #peak   238 #SUP  7.52
 24 LYS  HN     24 LYS  HB2     3.58            #peak   239 #SUP  7.88
 24 LYS  HN     24 LYS  HG3     3.68            #peak   240 #SUP  7.55
 24 LYS  HN     24 LYS  QD      4.46            #peak   241 #SUP  7.27
 24 LYS  HN     24 LYS  HG2     4.42            #peak   242 #SUP  7.48
 56 CYS  HN     57 ASP  HN      3.47            #peak   243 #SUP  5.87
 56 CYS  HN     57 ASP  HA      5.50            #peak   246 #SUP  4.32
 56 CYS  HN     56 CYS  QB      2.94            #peak   248 #SUP  6.63
 55 VAL  HB     56 CYS  HN      3.66            #peak   249 #SUP  5.67
 55 VAL  QG1    56 CYS  HN      4.32            #peak   250 #SUP  5.07
 55 VAL  QG2    56 CYS  HN      4.21            #peak   251 #SUP  6.28
 90 MET  HB3    91 LYS  HN      3.86            #peak   255 #SUP  6.75
 91 LYS  HN     91 LYS  QB      2.89            #peak   256 #SUP  7.08
 91 LYS  HN     91 LYS  QD      5.50            #peak   257 #SUP  5.42
 91 LYS  HN     91 LYS  HG2     4.57            #peak   258 #SUP  6.75
 63 CYS  HN     63 CYS  HB3     3.15            #peak   260 #SUP  4.17
 17 CYS  HA     20 LEU  HN      4.40            #peak   264 #SUP  1.50
 19 PRO  HD2    20 LEU  HN      4.17            #peak   267 #SUP  8.04
 20 LEU  HN     20 LEU  HB3     3.25            #peak   268 #SUP  7.92
 19 PRO  HB3    20 LEU  HN      4.11            #peak   269 #SUP  7.93
 19 PRO  HG2    20 LEU  HN      3.80            #peak   270 #SUP  7.95
 20 LEU  HN     52 GLN  HB2     5.02            #peak   271 #SUP  3.61
 20 LEU  HN     20 LEU  HB2     3.45            #peak   272 #SUP  7.92
 20 LEU  HN     20 LEU  QD2     4.66            #peak   273 #SUP  7.33
 20 LEU  HN     20 LEU  QD1     5.31            #peak   274 #SUP  7.92
 60 ARG  HA     63 CYS  HN      4.63            #peak   277 #SUP  3.16
 47 ALA  HN     48 ASP  HN      3.50            #peak   278 #SUP  3.27
 46 LYS  HN     47 ALA  HN      3.45            #peak   279 #SUP  4.73
 44 CYS  HA     47 ALA  HN      4.17            #peak   280 #SUP  2.96
 46 LYS  QB     47 ALA  HN      3.42            #peak   283 #SUP  5.04
 47 ALA  HN     47 ALA  QB      3.04            #peak   284 #SUP  5.07
 93 ASN  HN     94 CYS  HN      3.20            #peak   285 #SUP  7.08
 90 MET  HA     94 CYS  HN      4.05            #peak   288 #SUP  3.78
 94 CYS  HN     94 CYS  HB3     3.68            #peak   289 #SUP  5.01
 93 ASN  HB3    94 CYS  HN      4.15            #peak   290 #SUP  6.54
 93 ASN  HB2    94 CYS  HN      4.98            #peak   291 #SUP  6.11
 29 GLU  HN     29 GLU  HG3     3.83            #peak   297 #SUP  6.89
 29 GLU  HN     29 GLU  HB2     3.05            #peak   298 #SUP  5.21
 28 ALA  QB     29 GLU  HN      3.32            #peak   299 #SUP  5.18
 88 ALA  HN     89 CYS  HN      3.35            #peak   301 #SUP  5.33
 14 THR  HN     14 THR  HB      3.59            #peak   302 #SUP  2.76
 89 CYS  HN     89 CYS  HB3     3.20            #peak   304 #SUP  4.14
 89 CYS  HN     89 CYS  HB2     3.28            #peak   305 #SUP  4.14
 88 ALA  QB     89 CYS  HN      3.29            #peak   306 #SUP  3.58
 54 LYS  HN     55 VAL  HN      3.42            #peak   307 #SUP 10.00
 55 VAL  HN     56 CYS  HN      3.34            #peak   308 #SUP  7.43
 52 GLN  HA     55 VAL  HN      3.59            #peak   309 #SUP  5.57
 55 VAL  HN     55 VAL  HB      3.04            #peak   311 #SUP  7.12
 54 LYS  HB3    55 VAL  HN      3.63            #peak   312 #SUP  7.43
 54 LYS  HB2    55 VAL  HN      4.22            #peak   313 #SUP  7.12
 54 LYS  QD     55 VAL  HN      4.64            #peak   314 #SUP  6.43
 55 VAL  HN     55 VAL  QG1     3.06            #peak   315 #SUP  6.38
 55 VAL  HN     55 VAL  QG2     3.63            #peak   316 #SUP  7.61
 42 ARG  HN     43 ASN  HN      3.53            #peak   317 #SUP  6.40
 43 ASN  HN     43 ASN  HB3     3.02            #peak   321 #SUP  6.31
 42 ARG  QB     43 ASN  HN      3.10            #peak   322 #SUP  6.58
 42 ARG  HG2    43 ASN  HN      5.06            #peak   323 #SUP  5.12
 57 ASP  HA     61 MET  HN      4.71            #peak   326 #SUP  4.58
 61 MET  HN     61 MET  HB3     3.38            #peak   328 #SUP  7.00
 61 MET  HN     61 MET  HB2     3.84            #peak   329 #SUP  7.00
 60 ARG  HB3    61 MET  HN      3.78            #peak   330 #SUP  6.30
 60 ARG  HB2    61 MET  HN      4.35            #peak   331 #SUP  6.10
 86 CYS  HB3    87 ARG  HN      3.54            #peak   336 #SUP  4.99
 86 CYS  HB2    87 ARG  HN      3.72            #peak   337 #SUP  5.60
 87 ARG  HN     87 ARG  HG3     3.01            #peak   338 #SUP  6.52
 87 ARG  HN     87 ARG  HG2     4.23            #peak   339 #SUP  6.61
 20 LEU  HN     21 THR  HN      3.66            #peak   340 #SUP  7.09
 21 THR  HN     21 THR  HB      3.41            #peak   341 #SUP  5.00
 20 LEU  HB3    21 THR  HN      3.73            #peak   344 #SUP  6.79
 21 THR  HN     22 ALA  QB      5.15            #peak   345 #SUP  3.66
 21 THR  HN     21 THR  QG2     4.53            #peak   347 #SUP  5.66
 38 LYS  HN     39 THR  HN      4.38            #peak   348 #SUP  3.45
 38 LYS  HN     38 LYS  QB      3.38            #peak   350 #SUP  3.29
 37 LYS  HB2    38 LYS  HN      4.40            #peak   351 #SUP  2.92
 38 LYS  HN     38 LYS  QD      4.52            #peak   352 #SUP  3.83
 38 LYS  HN     38 LYS  HG3     5.50            #peak   353 #SUP  3.43
 64 HIS  HN     65 LYS  HN      4.76            #peak   354 #SUP  4.53
 64 HIS  HB2    65 LYS  HN      4.05            #peak   358 #SUP  4.87
 65 LYS  HN     65 LYS  QB      3.24            #peak   359 #SUP  5.17
 65 LYS  HN     65 LYS  HG3     3.94            #peak   360 #SUP  5.38
 20 LEU  QD1    21 THR  HN      5.04            #peak   362 #SUP  6.79
 26 LYS  HN     27 CYS  HN      3.41            #peak   363 #SUP  5.95
 24 LYS  HA     27 CYS  HN      3.87            #peak   365 #SUP  3.85
 27 CYS  HN     27 CYS  HB3     3.30            #peak   366 #SUP  4.98
 26 LYS  HB3    27 CYS  HN      3.78            #peak   368 #SUP  6.08
 26 LYS  HB2    27 CYS  HN      4.00            #peak   369 #SUP  5.94
 39 THR  HN     39 THR  HB      3.09            #peak   373 #SUP  4.46
 68 ARG  HN     69 ALA  HN      3.94            #peak   375 #SUP  6.62
 69 ALA  HN     70 ALA  HN      3.59            #peak   376 #SUP  4.39
 68 ARG  HB3    69 ALA  HN      3.54            #peak   379 #SUP  6.33
 68 ARG  HB2    69 ALA  HN      3.95            #peak   380 #SUP  6.14
 69 ALA  HN     69 ALA  QB      3.01            #peak   381 #SUP  5.19
 53 ASP  HB2    54 LYS  HN      3.93            #peak   393 #SUP  5.38
 54 LYS  HN     54 LYS  HB3     3.27            #peak   394 #SUP  7.78
 54 LYS  HN     54 LYS  HB2     3.78            #peak   395 #SUP  7.61
 54 LYS  HN     54 LYS  HG3     3.64            #peak   396 #SUP  8.14
 51 PRO  QD     52 GLN  HN      3.62            #peak   402 #SUP  7.30
 52 GLN  HN     52 GLN  HG3     4.12            #peak   403 #SUP  8.73
 51 PRO  HB3    52 GLN  HN      4.45            #peak   404 #SUP  6.71
 52 GLN  HN     52 GLN  HB3     3.59            #peak   405 #SUP  7.52
 51 PRO  HB2    52 GLN  HN      3.59            #peak   406 #SUP  6.65
 14 THR  HB     15 THR  HN      4.96            #peak   407 #SUP  2.52
 33 THR  HA     34 SER  HN      3.52            #peak   409 #SUP  2.72
 34 SER  HN     34 SER  HB3     3.39            #peak   411 #SUP  2.69
 46 LYS  HN     46 LYS  QB      2.96            #peak   413 #SUP  5.80
 59 CYS  HN     60 ARG  HN      3.46            #peak   414 #SUP  7.78
 59 CYS  HN     59 CYS  HB3     3.25            #peak   417 #SUP  5.62
 59 CYS  HN     59 CYS  HB2     3.23            #peak   418 #SUP  4.55
 58 ALA  QB     59 CYS  HN      3.19            #peak   419 #SUP  4.44
 28 ALA  HA     31 CYS  HN      4.64            #peak   424 #SUP  2.96
 31 CYS  HN     31 CYS  HB3     3.97            #peak   425 #SUP  3.73
 31 CYS  HN     31 CYS  HB2     3.39            #peak   426 #SUP  3.73
 70 ALA  HN     71 ASN  HN      3.58            #peak   427 #SUP  5.07
 70 ALA  HN     70 ALA  QB      2.89            #peak   430 #SUP  4.90
 68 ARG  HA     72 CYS  HN      4.16            #peak   434 #SUP  2.05
 71 ASN  HB3    72 CYS  HN      3.69            #peak   435 #SUP  5.47
 48 ASP  HN     48 ASP  HB3     3.35            #peak   443 #SUP  4.87
 48 ASP  HN     48 ASP  HB2     3.80            #peak   444 #SUP  4.29
 47 ALA  QB     48 ASP  HN      3.52            #peak   445 #SUP  5.29
 29 GLU  HN     30 SER  HN      3.37            #peak   446 #SUP  8.25
 30 SER  HN     31 CYS  HN      3.58            #peak   447 #SUP  6.40
 26 LYS  HA     30 SER  HN      4.39            #peak   449 #SUP  3.16
 30 SER  HN     30 SER  HB3     3.25            #peak   450 #SUP  4.98
 29 GLU  HB2    30 SER  HN      3.44            #peak   451 #SUP  6.47
 93 ASN  HN     93 ASN  HD21    4.22            #peak   461 #SUP  6.64
 90 MET  HA     93 ASN  HN      4.04            #peak   463 #SUP  1.94
 92 THR  HB     93 ASN  HN      3.54            #peak   464 #SUP  7.18
 93 ASN  HN     93 ASN  HB3     3.42            #peak   466 #SUP  6.51
 93 ASN  HN     93 ASN  HB2     3.91            #peak   467 #SUP  5.94
 92 THR  QG2    93 ASN  HN      4.27            #peak   468 #SUP  6.34
 48 ASP  HN     49 CYS  HN      3.22            #peak   469 #SUP  5.06
 49 CYS  HN     50 GLU  HN      3.35            #peak   470 #SUP  6.43
 49 CYS  HN     49 CYS  HB2     3.61            #peak   474 #SUP  5.46
 75 GLU  HN     76 CYS  HN      3.48            #peak   476 #SUP  6.23
 76 CYS  HN     77 PRO  HD3     4.13            #peak   479 #SUP  6.53
 76 CYS  HN     76 CYS  HB3     3.31            #peak   480 #SUP  4.86
 76 CYS  HN     76 CYS  HB2     3.99            #peak   481 #SUP  4.23
 75 GLU  HB3    76 CYS  HN      4.03            #peak   482 #SUP  4.99
 71 ASN  HN     71 ASN  HD21    4.39            #peak   484 #SUP  5.60
 71 ASN  HN     71 ASN  HB3     3.45            #peak   486 #SUP  6.18
 71 ASN  HN     71 ASN  HB2     3.83            #peak   487 #SUP  6.18
 70 ALA  QB     71 ASN  HN      3.57            #peak   488 #SUP  6.89
 91 LYS  QB     92 THR  HN      3.43            #peak   489 #SUP  6.01
 91 LYS  HN     92 THR  HN      3.40            #peak   491 #SUP  5.36
 92 THR  HN     93 ASN  HN      3.45            #peak   492 #SUP  5.77
 92 THR  HN     92 THR  HB      3.08            #peak   493 #SUP  5.61
 12 GLN  HB3    12 GLN  HE22    5.50            #peak   498 #SUP  3.93
 74 SER  HN     74 SER  QB      3.42            #peak   504 #SUP  4.33
 73 ALA  QB     74 SER  HN      3.62            #peak   505 #SUP  4.00
 35 ALA  HN     36 ASP  HN      5.35            #peak   507 #SUP  2.29
 43 ASN  HB3    43 ASN  HD22    3.92            #peak   509 #SUP  4.18
 74 SER  HN     75 GLU  HN      3.90            #peak   514 #SUP  4.96
 73 ALA  HN     74 SER  HN      4.11            #peak   515 #SUP  3.89
 17 CYS  HN     18 GLU  HN      3.26            #peak   516 #SUP  4.71
 14 THR  HA     17 CYS  HN      4.74            #peak   519 #SUP  3.11
 16 PRO  HD3    17 CYS  HN      4.41            #peak   520 #SUP  7.60
 16 PRO  HD2    17 CYS  HN      3.06            #peak   521 #SUP  7.60
 17 CYS  HN     17 CYS  HB2     3.67            #peak   522 #SUP  4.53
 16 PRO  HG2    17 CYS  HN      3.84            #peak   523 #SUP  6.97
 16 PRO  HB2    17 CYS  HN      3.89            #peak   524 #SUP  6.89
 52 GLN  HG2    52 GLN  HE22    3.67            #peak   527 #SUP  4.56
 52 GLN  HG3    52 GLN  HE21    4.00            #peak   529 #SUP  4.30
 52 GLN  HG2    52 GLN  HE21    3.98            #peak   530 #SUP  3.92
 63 CYS  HB3    64 HIS  HN      4.39            #peak   534 #SUP  4.28
 64 HIS  HA     67 CYS  HN      4.19            #peak   535 #SUP  3.24
 18 GLU  HN     19 PRO  HD3     3.54            #peak   537 #SUP  7.75
 24 LYS  HB2    25 GLU  HN      4.17            #peak   538 #SUP  6.32
 62 LYS  HN     62 LYS  QB      3.01            #peak   539 #SUP  8.15
 63 CYS  HA     66 ALA  HN      5.02            #peak   543 #SUP  0.75
 15 THR  HN     16 PRO  HG3     4.57            #peak   544 #SUP  3.17
 20 LEU  HG     21 THR  HN      4.86            #peak   546 #SUP  6.23
 24 LYS  HA     28 ALA  HN      4.15            #peak   547 #SUP  3.12
 61 MET  HN     63 CYS  HN      4.43            #peak   553 #SUP  3.32
 87 ARG  HN     87 ARG  QB      2.94            #peak   557 #SUP  7.12
 91 LYS  HN     91 LYS  HG3     4.27            #peak   558 #SUP  6.39
 94 CYS  HN     94 CYS  HB2     3.57            #peak   559 #SUP  4.28
 94 CYS  HN     95 LYS  HN      3.86            #peak   560 #SUP  4.64
 30 SER  HN     30 SER  HB2     3.25            #peak   561 #SUP  4.98
 29 GLU  HB3    30 SER  HN      3.70            #peak   562 #SUP  6.96
 91 LYS  HG2    92 THR  HN      4.63            #peak   563 #SUP  5.66
 15 THR  HA     17 CYS  HN      4.90            #peak   566 #SUP  6.42
 31 CYS  HA     34 SER  HN      4.17            #peak   568 #SUP  1.50
 86 CYS  HA     89 CYS  HN      3.33            #peak   569 #SUP  4.31
 88 ALA  HA     91 LYS  HN      3.48            #peak   570 #SUP  2.13
 91 LYS  HG3    92 THR  HN      4.82            #peak   571 #SUP  5.15
 10 LYS  HN     10 LYS  HB2     3.53            #peak   572 #SUP  3.69
 12 GLN  HN     12 GLN  HB2     3.70            #peak   573 #SUP  4.81
 71 ASN  HN     72 CYS  HN      3.35            #peak   574 #SUP  6.79
 72 CYS  HN     72 CYS  HB2     3.76            #peak   575 #SUP  3.83
 63 CYS  HN     63 CYS  HB2     3.23            #peak   577 #SUP  5.31
 29 GLU  HN     29 GLU  HG2     3.35            #peak   578 #SUP  5.21
  7 VAL  HN     94 CYS  HA      5.50            #peak   580 #SUP  1.50
  5 ALA  HN      5 ALA  QB      3.68            #peak   581 #SUP  2.12
  7 VAL  QG1    12 GLN  HE21    5.28            #peak   583 #SUP  1.50
 55 VAL  HN     58 ALA  HN      5.01            #peak   585 #SUP  3.85
 53 ASP  HA     55 VAL  HN      5.50            #peak   586 #SUP  4.17
 55 VAL  HN     56 CYS  QB      5.19            #peak   587 #SUP  4.65
 54 LYS  HG2    55 VAL  HN      5.50            #peak   588 #SUP  7.85
 17 CYS  HN     20 LEU  QD2     4.79            #peak   590 #SUP  0.02
 14 THR  QG2    18 GLU  HN      5.50            #peak   591 #SUP  4.81
 19 PRO  HG3    20 LEU  HN      5.50            #peak   592 #SUP  7.93
 21 THR  HN     22 ALA  HN      3.50            #peak   594 #SUP  6.41
 20 LEU  HN     22 ALA  HN      5.50            #peak   596 #SUP  3.07
 22 ALA  HN     24 LYS  HN      5.50            #peak   597 #SUP  3.10
 21 THR  HN     23 CYS  HN      4.47            #peak   598 #SUP  2.96
 24 LYS  HN     26 LYS  HN      5.50            #peak   601 #SUP  2.12
 25 GLU  HN     27 CYS  HN      4.39            #peak   602 #SUP  3.14
 27 CYS  HN     28 ALA  QB      5.09            #peak   604 #SUP  3.66
 27 CYS  HN     29 GLU  HN      4.57            #peak   606 #SUP  3.37
 28 ALA  HN     30 SER  HN      4.60            #peak   607 #SUP  3.51
 30 SER  HN     32 GLU  HN      5.23            #peak   608 #SUP  2.33
 29 GLU  HN     31 CYS  HN      5.50            #peak   609 #SUP  2.76
 59 CYS  HN     61 MET  HN      4.61            #peak   610 #SUP  3.75
 33 THR  HB     34 SER  HN      4.76            #peak   611 #SUP  2.72
 39 THR  HN     41 ARG  HN      5.17            #peak   616 #SUP  3.08
 39 THR  HA     43 ASN  HN      5.33            #peak   617 #SUP  5.08
 39 THR  QG2    43 ASN  HN      5.50            #peak   618 #SUP  5.49
 41 ARG  HN     43 ASN  HN      4.94            #peak   619 #SUP  2.99
 43 ASN  HN     45 LYS  HN      5.26            #peak   620 #SUP  2.99
 43 ASN  HN     43 ASN  HD22    5.50            #peak   621 #SUP  4.76
 42 ARG  QB     44 CYS  HN      4.68            #peak   622 #SUP  3.26
 27 CYS  HB2    44 CYS  HN      5.50            #peak   623 #SUP  1.50
 40 CYS  HA     44 CYS  HN      5.40            #peak   624 #SUP  3.16
 42 ARG  HN     44 CYS  HN      5.50            #peak   625 #SUP  3.73
 44 CYS  HN     45 LYS  HN      3.74            #peak   626 #SUP  5.61
 45 LYS  HN     47 ALA  HN      5.16            #peak   629 #SUP  2.72
 45 LYS  HA     48 ASP  HN      4.75            #peak   630 #SUP  2.22
 49 CYS  HN     50 GLU  HG3     5.50            #peak   631 #SUP  2.68
 48 ASP  HB3    49 CYS  HN      4.34            #peak   632 #SUP  4.82
 45 LYS  HA     49 CYS  HN      4.42            #peak   633 #SUP  2.25
 46 LYS  HA     50 GLU  HN      5.50            #peak   635 #SUP  0.75
 52 GLN  HN     52 GLN  HE22    5.28            #peak   636 #SUP  5.98
 49 CYS  HA     52 GLN  HE21    5.42            #peak   637 #SUP  1.79
 23 CYS  HB3    52 GLN  HE21    5.50            #peak   638 #SUP  1.50
 20 LEU  QD2    53 ASP  HN      5.34            #peak   639 #SUP  4.00
 49 CYS  HB2    53 ASP  HN      5.50            #peak   640 #SUP  2.25
 49 CYS  HB3    53 ASP  HN      4.98            #peak   641 #SUP  3.70
 50 GLU  HN     53 ASP  HN      5.50            #peak   642 #SUP  1.72
 53 ASP  HN     55 VAL  HN      5.50            #peak   643 #SUP  5.74
 52 GLN  HN     54 LYS  HN      5.50            #peak   644 #SUP  4.28
 54 LYS  HN     55 VAL  HB      4.72            #peak   646 #SUP  5.66
 55 VAL  HN     57 ASP  HN      5.27            #peak   647 #SUP  4.98
 52 GLN  HN     55 VAL  HN      5.38            #peak   648 #SUP  4.10
 56 CYS  HN     58 ALA  HN      4.77            #peak   649 #SUP  4.66
 54 LYS  HN     56 CYS  HN      5.48            #peak   650 #SUP  3.26
 17 CYS  HA     56 CYS  HN      5.39            #peak   651 #SUP  0.75
 57 ASP  HN     58 ALA  QB      5.19            #peak   652 #SUP  4.39
 58 ALA  HN     59 CYS  HB3     5.38            #peak   653 #SUP  4.33
 58 ALA  HN     60 ARG  HN      5.50            #peak   656 #SUP  3.71
 62 LYS  HN     62 LYS  HG2     5.16            #peak   660 #SUP  6.77
 62 LYS  HN     63 CYS  HB2     5.18            #peak   661 #SUP  4.40
 60 ARG  HN     62 LYS  HN      5.50            #peak   662 #SUP  3.49
 63 CYS  HN     66 ALA  QB      3.81            #peak   663 #SUP  0.75
 65 LYS  HN     67 CYS  HN      5.08            #peak   664 #SUP  2.60
 64 HIS  HB3    65 LYS  HN      4.18            #peak   666 #SUP  4.87
 65 LYS  HN     65 LYS  QE      5.50            #peak   667 #SUP  3.64
 68 ARG  HN     70 ALA  QB      4.61            #peak   668 #SUP  3.97
 68 ARG  HN     68 ARG  QD      5.10            #peak   669 #SUP  5.93
 68 ARG  HN     70 ALA  HN      5.50            #peak   670 #SUP  4.70
 68 ARG  HN     71 ASN  HN      5.50            #peak   671 #SUP  4.97
 66 ALA  HA     69 ALA  HN      4.38            #peak   672 #SUP  0.75
 71 ASN  HN     71 ASN  HD22    5.34            #peak   673 #SUP  5.60
 68 ARG  HA     71 ASN  HN      5.50            #peak   674 #SUP  3.07
 67 CYS  HA     71 ASN  HN      4.97            #peak   675 #SUP  5.29
 67 CYS  HB2    71 ASN  HN      5.50            #peak   677 #SUP  1.72
 70 ALA  QB     71 ASN  HD21    5.05            #peak   678 #SUP  4.29
 70 ALA  QB     72 CYS  HN      5.50            #peak   682 #SUP  4.88
 72 CYS  HN     73 ALA  QB      4.83            #peak   683 #SUP  2.63
 70 ALA  HN     72 CYS  HN      4.45            #peak   684 #SUP  3.80
 73 ALA  HN     75 GLU  HN      5.50            #peak   685 #SUP  2.72
 69 ALA  HA     73 ALA  HN      5.50            #peak   686 #SUP  0.94
 75 GLU  HN     76 CYS  HB3     5.50            #peak   688 #SUP  4.05
 75 GLU  HN     75 GLU  HG3     5.47            #peak   689 #SUP  5.99
 72 CYS  HB2    76 CYS  HN      5.50            #peak   690 #SUP  2.31
 72 CYS  HB3    76 CYS  HN      5.00            #peak   691 #SUP  3.50
 84 ASP  HA     86 CYS  HN      5.14            #peak   693 #SUP  4.06
 75 GLU  HB2    86 CYS  HN      4.80            #peak   695 #SUP  2.25
 88 ALA  HN     90 MET  HN      4.37            #peak   696 #SUP  2.99
 86 CYS  HN     88 ALA  HN      4.39            #peak   697 #SUP  4.05
 87 ARG  HG2    88 ALA  HN      4.52            #peak   698 #SUP  5.61
 87 ARG  HN     89 CYS  HN      5.26            #peak   699 #SUP  2.69
 14 THR  HN     16 PRO  HD2     5.12            #peak   700 #SUP  2.29
 75 GLU  HG3    89 CYS  HN      5.50            #peak   701 #SUP  2.25
 87 ARG  HA     91 LYS  HN      5.37            #peak   703 #SUP  3.60
 90 MET  HG3    91 LYS  HN      5.50            #peak   704 #SUP  6.27
 92 THR  HN     94 CYS  HN      4.69            #peak   705 #SUP  3.31
 89 CYS  HA     93 ASN  HD21    4.41            #peak   706 #SUP  1.73
 94 CYS  HN     95 LYS  HA      5.50            #peak   710 #SUP  4.16
 93 ASN  HD21   94 CYS  HN      5.50            #peak   711 #SUP  5.93
 94 CYS  HB3    95 LYS  HN      4.66            #peak   712 #SUP  3.56
 92 THR  HB     93 ASN  HD21    4.77            #peak     2 #SUP  5.99
 15 THR  HA     18 GLU  HB3     3.96            #peak     6 #SUP  4.48
 15 THR  HA     18 GLU  HN      4.43            #peak     7 #SUP  6.03
 14 THR  HA     14 THR  QG2     3.38            #peak    20 #SUP  2.19
 21 THR  HA     24 LYS  HN      4.60            #peak    25 #SUP  3.30
 21 THR  HA     24 LYS  HB3     3.79            #peak    28 #SUP  1.50
 21 THR  HA     24 LYS  QD      3.99            #peak    29 #SUP  2.13
 51 PRO  HA     54 LYS  HN      4.27            #peak    31 #SUP  8.29
 51 PRO  HA     54 LYS  HB3     3.48            #peak    36 #SUP  4.97
 15 THR  HB     16 PRO  HD3     3.00            #peak    39 #SUP  4.98
 55 VAL  HA     58 ALA  QB      3.25            #peak    41 #SUP  3.72
 55 VAL  HA     55 VAL  QG2     3.02            #peak    44 #SUP  4.75
 55 VAL  HA     58 ALA  HN      3.97            #peak    45 #SUP  2.96
 39 THR  HA     42 ARG  QB      3.44            #peak    46 #SUP  5.91
 39 THR  HA     42 ARG  QD      4.94            #peak    47 #SUP  4.52
 19 PRO  HA     22 ALA  HN      4.63            #peak    48 #SUP  4.00
 85 THR  HA     85 THR  HB      2.79            #peak    56 #SUP  2.31
 31 CYS  HA     34 SER  HB3     3.86            #peak    68 #SUP  1.50
 34 SER  HN     34 SER  HB2     3.79            #peak    71 #SUP  2.69
 31 CYS  HA     34 SER  HB2     4.26            #peak    72 #SUP  1.50
 34 SER  HB2    37 LYS  HG3     4.62            #peak    75 #SUP  0.75
 30 SER  HB2    31 CYS  HN      4.72            #peak    80 #SUP  4.54
 50 GLU  HA     54 LYS  HN      4.80            #peak    84 #SUP  3.87
 50 GLU  HA     53 ASP  HB3     3.48            #peak    86 #SUP  2.25
 50 GLU  HA     53 ASP  HB2     3.72            #peak    87 #SUP  2.25
 50 GLU  HA     50 GLU  HG2     3.62            #peak    88 #SUP  5.27
 18 GLU  HA     21 THR  HN      4.32            #peak    91 #SUP  2.18
 18 GLU  HA     22 ALA  HN      4.36            #peak    92 #SUP  3.76
 18 GLU  HA     18 GLU  HG2     4.23            #peak    94 #SUP  5.31
 30 SER  HA     30 SER  HB2     2.98            #peak    98 #SUP  3.22
 59 CYS  HA     62 LYS  QD      4.73            #peak   106 #SUP  1.50
 23 CYS  HA     26 LYS  HB3     3.55            #peak   109 #SUP  1.48
 39 THR  QG2    40 CYS  HA      4.33            #peak   111 #SUP  3.66
 89 CYS  HA     89 CYS  HB3     2.98            #peak   112 #SUP  2.96
 37 LYS  HA     40 CYS  HB3     3.44            #peak   116 #SUP  2.49
 37 LYS  HA     40 CYS  HB2     3.70            #peak   117 #SUP  2.49
 37 LYS  HA     37 LYS  HG3     3.56            #peak   119 #SUP  2.97
 24 LYS  HA     24 LYS  QD      4.27            #peak   124 #SUP  5.66
 24 LYS  HA     24 LYS  HG2     3.23            #peak   125 #SUP  5.76
 59 CYS  HA     62 LYS  HN      5.23            #peak   127 #SUP  3.30
 40 CYS  HA     43 ASN  HN      4.53            #peak   129 #SUP  5.55
 40 CYS  HA     43 ASN  HB3     3.89            #peak   131 #SUP  2.25
 67 CYS  HA     70 ALA  QB      3.59            #peak   135 #SUP  3.57
 60 ARG  HA     60 ARG  HB2     2.89            #peak   139 #SUP  6.21
 64 HIS  HA     64 HIS  HD2     4.45            #peak   141 #SUP  2.83
 60 ARG  HA     60 ARG  HG2     3.26            #peak   145 #SUP  5.75
 65 LYS  HA     68 ARG  HN      4.77            #peak   150 #SUP  2.70
 38 LYS  HA     38 LYS  HG3     3.62            #peak   153 #SUP  4.56
 38 LYS  HA     38 LYS  HG2     3.60            #peak   154 #SUP  4.56
 38 LYS  HA     38 LYS  QB      2.63            #peak   156 #SUP  4.20
 65 LYS  HA     65 LYS  HG3     3.54            #peak   157 #SUP  3.63
 87 ARG  HA     87 ARG  QB      2.68            #peak   158 #SUP  5.61
 87 ARG  HA     90 MET  HG3     5.08            #peak   162 #SUP  3.74
 87 ARG  HA     90 MET  HG2     5.47            #peak   163 #SUP  3.24
 87 ARG  HA     90 MET  HB3     3.63            #peak   164 #SUP  3.75
 87 ARG  HA     87 ARG  HG2     3.46            #peak   165 #SUP  5.31
 45 LYS  HA     45 LYS  HG3     3.68            #peak   168 #SUP  6.61
 45 LYS  HA     49 CYS  HB2     3.47            #peak   170 #SUP  3.25
 54 LYS  HA     57 ASP  HB3     3.78            #peak   176 #SUP  1.50
 54 LYS  HA     57 ASP  HB2     3.74            #peak   177 #SUP  1.50
 54 LYS  HA     54 LYS  HG2     3.36            #peak   178 #SUP  5.64
 54 LYS  HA     54 LYS  HG3     3.23            #peak   179 #SUP  5.50
 62 LYS  HA     62 LYS  QB      2.55            #peak   180 #SUP  5.55
 62 LYS  HA     62 LYS  HG3     3.49            #peak   181 #SUP  4.59
 44 CYS  HA     48 ASP  HN      4.88            #peak   193 #SUP  2.13
 29 GLU  HA     32 GLU  HG3     4.01            #peak   194 #SUP  0.75
 25 GLU  HA     28 ALA  HN      3.68            #peak   196 #SUP  1.26
 25 GLU  HA     25 GLU  HG2     3.48            #peak   200 #SUP  3.44
 25 GLU  HA     28 ALA  QB      3.09            #peak   202 #SUP  0.75
 42 ARG  HA     42 ARG  QD      5.32            #peak   205 #SUP  4.44
 52 GLN  HA     52 GLN  HG3     3.32            #peak   209 #SUP  5.82
 52 GLN  HA     52 GLN  HG2     3.59            #peak   210 #SUP  5.52
 52 GLN  HA     55 VAL  QG1     3.85            #peak   212 #SUP  2.97
 75 GLU  HA     75 GLU  HG3     3.89            #peak   215 #SUP  4.72
 75 GLU  HA     75 GLU  HG2     3.30            #peak   216 #SUP  5.18
 68 ARG  HA     68 ARG  HG2     3.86            #peak   222 #SUP  5.44
 26 LYS  HA     26 LYS  HG3     3.92            #peak   230 #SUP  6.01
 26 LYS  HA     29 GLU  HB2     3.54            #peak   233 #SUP  2.25
 86 CYS  HA     89 CYS  HB2     4.30            #peak   236 #SUP  2.94
 86 CYS  HA     89 CYS  HB3     3.90            #peak   238 #SUP  1.50
 75 GLU  HB2    86 CYS  HA      3.46            #peak   240 #SUP  5.73
 91 LYS  HA     91 LYS  QB      2.77            #peak   243 #SUP  5.54
 91 LYS  HA     91 LYS  QD      3.99            #peak   244 #SUP  3.93
 91 LYS  HA     91 LYS  HG3     3.69            #peak   245 #SUP  4.85
 12 GLN  HA     12 GLN  HG3     4.01            #peak   248 #SUP  5.07
 12 GLN  HA     12 GLN  HG2     3.67            #peak   249 #SUP  5.21
 95 LYS  HA     95 LYS  QG      3.77            #peak   252 #SUP  4.23
 61 MET  HA     64 HIS  HB2     3.53            #peak   255 #SUP  2.36
 61 MET  HA     64 HIS  HB3     3.77            #peak   256 #SUP  2.39
 20 LEU  HA     23 CYS  HB3     3.97            #peak   266 #SUP  3.87
 20 LEU  HA     52 GLN  HB2     3.66            #peak   268 #SUP  6.16
 20 LEU  HA     20 LEU  QD2     4.07            #peak   274 #SUP  5.00
 20 LEU  HA     20 LEU  QD1     3.44            #peak   275 #SUP  5.98
 56 CYS  HA     59 CYS  HN      4.63            #peak   276 #SUP  1.50
 16 PRO  HB2    56 CYS  HA      4.15            #peak   277 #SUP  1.27
 17 CYS  HA     56 CYS  HA      3.80            #peak   279 #SUP  1.26
 84 ASP  HA     87 ARG  HN      4.49            #peak   282 #SUP  3.24
 84 ASP  HA     87 ARG  QD      3.97            #peak   283 #SUP  3.93
 84 ASP  HA     84 ASP  QB      2.89            #peak   284 #SUP  1.00
 84 ASP  HA     87 ARG  QB      3.34            #peak   285 #SUP  3.21
 56 CYS  HA     56 CYS  QB      2.83            #peak   288 #SUP  3.92
 57 ASP  HA     60 ARG  HN      4.14            #peak   291 #SUP  6.11
 20 LEU  HG     53 ASP  HA      4.17            #peak   293 #SUP  3.75
 20 LEU  QD2    53 ASP  HA      3.24            #peak   295 #SUP  6.83
 20 LEU  QD1    53 ASP  HA      3.71            #peak   298 #SUP  9.25
 27 CYS  HA     30 SER  HN      4.18            #peak   301 #SUP  3.44
 27 CYS  HA     30 SER  HB2     3.70            #peak   303 #SUP  1.50
 90 MET  HA     94 CYS  HB2     4.13            #peak   312 #SUP  3.14
 79 HIS  HA     79 HIS  HD2     3.95            #peak   313 #SUP  1.31
  9 CYS  HA     12 GLN  HN      4.21            #peak   315 #SUP  3.00
  9 CYS  HA     63 CYS  HB2     3.95            #peak   316 #SUP  0.75
  9 CYS  HA     12 GLN  HG2     4.40            #peak   318 #SUP  3.00
  9 CYS  HA     12 GLN  HB2     3.63            #peak   319 #SUP  3.00
 28 ALA  HA     41 ARG  HD3     3.86            #peak   328 #SUP  2.96
 28 ALA  HA     41 ARG  HG2     3.65            #peak   331 #SUP  2.96
 28 ALA  HA     41 ARG  HG3     4.16            #peak   332 #SUP  1.50
 82 LYS  HA     82 LYS  QG      3.59            #peak   340 #SUP  3.25
 43 ASN  HA     46 LYS  HN      4.74            #peak   349 #SUP  1.40
 43 ASN  HA     46 LYS  QB      3.45            #peak   351 #SUP  1.50
 58 ALA  HA     61 MET  HN      4.43            #peak   352 #SUP  6.73
 58 ALA  HA     61 MET  QE      4.28            #peak   355 #SUP  3.06
 88 ALA  HA     91 LYS  QB      3.32            #peak   359 #SUP  1.50
 88 ALA  HA     91 LYS  QD      4.30            #peak   360 #SUP  1.50
 22 ALA  HA     25 GLU  HG2     5.08            #peak   363 #SUP  4.75
 22 ALA  HA     25 GLU  HB2     3.75            #peak   365 #SUP  3.00
 13 CYS  HA     16 PRO  HD3     4.12            #peak   371 #SUP  3.74
 94 CYS  HA     95 LYS  HN      3.39            #peak   386 #SUP  4.64
 49 CYS  HA     52 GLN  HB3     4.60            #peak   394 #SUP  3.82
 18 GLU  HB2    19 PRO  HD3     3.07            #peak   404 #SUP  7.67
 18 GLU  HB3    19 PRO  HD3     3.38            #peak   407 #SUP  7.67
 76 CYS  HN     77 PRO  HD2     4.87            #peak   415 #SUP  5.50
 50 GLU  HA     51 PRO  QD      3.70            #peak   418 #SUP  7.82
 51 PRO  QD     52 GLN  HG3     4.20            #peak   422 #SUP  5.83
 50 GLU  HB3    51 PRO  QD      3.08            #peak   423 #SUP  7.05
 50 GLU  HB2    51 PRO  QD      2.95            #peak   424 #SUP  7.05
 15 THR  QG2    16 PRO  HD3     3.93            #peak   429 #SUP  6.58
 13 CYS  HA     16 PRO  HD2     3.51            #peak   430 #SUP  5.96
 15 THR  HB     16 PRO  HD2     3.50            #peak   431 #SUP  5.63
 17 CYS  HN     17 CYS  HB3     3.71            #peak   440 #SUP  4.53
 14 THR  HA     17 CYS  HB2     4.55            #peak   442 #SUP  1.70
 72 CYS  HB3    75 GLU  HB3     4.26            #peak   455 #SUP  4.97
 41 ARG  QB     41 ARG  HD3     3.21            #peak   458 #SUP  4.27
 28 ALA  QB     41 ARG  HD3     3.56            #peak   460 #SUP  2.95
 68 ARG  HB3    68 ARG  QD      3.88            #peak   462 #SUP  6.43
 42 ARG  QB     42 ARG  QD      2.64            #peak   468 #SUP  4.44
 87 ARG  HG2    87 ARG  QD      2.60            #peak   469 #SUP  4.44
 87 ARG  HG3    87 ARG  QD      2.49            #peak   470 #SUP  4.30
 93 ASN  HB3    93 ASN  HD21    3.70            #peak   473 #SUP  5.88
 93 ASN  HB2    93 ASN  HD21    4.11            #peak   476 #SUP  5.21
 37 LYS  HG2    37 LYS  QE      3.63            #peak   481 #SUP  4.30
 32 GLU  HA     37 LYS  QE      3.52            #peak   482 #SUP  1.50
 37 LYS  HB2    37 LYS  QE      3.37            #peak   483 #SUP  4.76
 67 CYS  HN     67 CYS  HB2     3.63            #peak   488 #SUP  3.86
 53 ASP  HB3    54 LYS  HN      3.53            #peak   492 #SUP  6.05
 20 LEU  QD1    53 ASP  HB2     3.89            #peak   498 #SUP  4.49
 48 ASP  HB2    49 CYS  HN      4.66            #peak   500 #SUP  4.46
 78 LYS  HG3    78 LYS  QE      4.03            #peak   502 #SUP  3.07
 20 LEU  HA     23 CYS  HB2     3.64            #peak   512 #SUP  3.87
 72 CYS  HB3    89 CYS  HB2     5.36            #peak   516 #SUP  0.75
 75 GLU  HB3    89 CYS  HB2     4.24            #peak   517 #SUP  3.83
 75 GLU  HB2    89 CYS  HB2     4.38            #peak   518 #SUP  3.86
 90 MET  QE     94 CYS  HB2     3.80            #peak   521 #SUP  3.87
 45 LYS  HB2    45 LYS  HE2     4.64            #peak   524 #SUP  4.19
 75 GLU  HB3    89 CYS  HB3     4.48            #peak   534 #SUP  3.87
 75 GLU  HG2    89 CYS  HB3     4.61            #peak   539 #SUP  3.84
 75 GLU  HB2    89 CYS  HB3     4.62            #peak   541 #SUP  3.87
 75 GLU  HG2    89 CYS  HB2     4.11            #peak   542 #SUP  3.87
 75 GLU  HG3    89 CYS  HB2     3.75            #peak   545 #SUP  6.00
 24 LYS  HB2    24 LYS  QE      3.76            #peak   547 #SUP  4.08
 24 LYS  HG3    24 LYS  QE      4.13            #peak   548 #SUP  4.15
 45 LYS  QD     45 LYS  HE3     3.00            #peak   550 #SUP  4.89
 57 ASP  HN     57 ASP  HB2     3.64            #peak   557 #SUP  5.11
 13 CYS  HB2    60 ARG  HG3     4.60            #peak   572 #SUP  1.87
 28 ALA  HA     31 CYS  HB3     4.20            #peak   576 #SUP  1.50
 31 CYS  HB3    41 ARG  HG3     4.57            #peak   578 #SUP  2.00
 31 CYS  HB3    41 ARG  HG2     4.95            #peak   579 #SUP  2.00
 28 ALA  HA     31 CYS  HB2     3.98            #peak   580 #SUP  1.50
 13 CYS  HB3    60 ARG  HG3     4.76            #peak   586 #SUP  2.31
 20 LEU  HB3    20 LEU  QD2     3.71            #peak   591 #SUP  5.44
 20 LEU  HB2    52 GLN  HB2     4.97            #peak   593 #SUP  5.42
 45 LYS  HA     49 CYS  HB3     4.13            #peak   600 #SUP  4.31
 36 ASP  HB3    39 THR  HB      4.09            #peak   605 #SUP  2.86
 36 ASP  HB2    39 THR  HB      4.38            #peak   607 #SUP  2.00
 60 ARG  HA     63 CYS  HB2     4.24            #peak   611 #SUP  1.50
 20 LEU  HB2    56 CYS  QB      5.08            #peak   618 #SUP  1.50
 20 LEU  QD2    56 CYS  QB      3.59            #peak   619 #SUP  2.96
 13 CYS  HB2    59 CYS  HB3     3.91            #peak   628 #SUP  2.25
 16 PRO  HG2    59 CYS  HB3     4.70            #peak   630 #SUP  3.88
 13 CYS  HB2    59 CYS  HB2     4.52            #peak   632 #SUP  0.94
 16 PRO  HG2    59 CYS  HB2     4.10            #peak   636 #SUP  5.91
 16 PRO  HB2    59 CYS  HB2     4.13            #peak   637 #SUP  4.69
  9 CYS  HB2    63 CYS  HB2     3.33            #peak   645 #SUP  2.00
 24 LYS  HA     27 CYS  HB3     3.30            #peak   650 #SUP  2.25
 27 CYS  HN     27 CYS  HB2     3.78            #peak   652 #SUP  4.98
 27 CYS  HB2    28 ALA  HN      4.01            #peak   654 #SUP  3.87
 75 GLU  HG3    89 CYS  HB3     4.14            #peak   657 #SUP  6.00
 43 ASN  HN     43 ASN  HB2     3.51            #peak   677 #SUP  6.00
 43 ASN  HB2    44 CYS  HN      3.82            #peak   678 #SUP  5.68
 43 ASN  HB2    43 ASN  HD22    3.97            #peak   679 #SUP  3.76
 40 CYS  HA     43 ASN  HB2     4.30            #peak   680 #SUP  3.73
 15 THR  HA     18 GLU  HG2     3.58            #peak   682 #SUP  3.49
 14 THR  QG2    18 GLU  HG2     4.47            #peak   683 #SUP  4.64
 18 GLU  HB3    18 GLU  HG2     2.71            #peak   684 #SUP  5.44
 18 GLU  HN     18 GLU  HG3     4.43            #peak   685 #SUP  6.10
 18 GLU  HA     18 GLU  HG3     3.54            #peak   686 #SUP  5.18
 14 THR  QG2    18 GLU  HG3     4.60            #peak   688 #SUP  2.90
 25 GLU  HN     25 GLU  HG2     3.71            #peak   692 #SUP  5.89
 21 THR  QG2    25 GLU  HG2     4.17            #peak   694 #SUP  2.00
 50 GLU  HN     50 GLU  HG3     4.06            #peak   696 #SUP  6.48
 50 GLU  HA     50 GLU  HG3     3.68            #peak   697 #SUP  5.31
 46 LYS  HA     50 GLU  HG3     3.27            #peak   698 #SUP  2.21
 50 GLU  HG3    51 PRO  QD      4.10            #peak   699 #SUP  6.83
 25 GLU  HB2    25 GLU  HG3     2.72            #peak   700 #SUP  3.27
 28 ALA  QB     29 GLU  HG3     5.14            #peak   714 #SUP  3.28
 29 GLU  HA     29 GLU  HG2     3.32            #peak   715 #SUP  4.90
 29 GLU  HG2    30 SER  HN      4.67            #peak   716 #SUP  6.49
 32 GLU  HA     32 GLU  HG3     3.67            #peak   720 #SUP  4.00
 80 GLU  QG     81 HIS  HD2     4.80            #peak   724 #SUP  1.94
 80 GLU  HA     80 GLU  QG      3.74            #peak   725 #SUP  2.90
 80 GLU  HB3    80 GLU  QG      2.95            #peak   726 #SUP  2.57
 52 GLN  HG3    52 GLN  HE22    3.79            #peak   733 #SUP  4.89
 51 PRO  HG2    52 GLN  HG2     4.39            #peak   738 #SUP  5.62
 52 GLN  HN     52 GLN  HG2     4.86            #peak   739 #SUP  8.14
 62 LYS  QB     63 CYS  HN      3.40            #peak   772 #SUP  5.99
 62 LYS  QB     62 LYS  HG2     2.92            #peak   773 #SUP  5.64
 61 MET  HN     61 MET  HG3     4.13            #peak   779 #SUP  8.32
 61 MET  HA     61 MET  HG3     4.11            #peak   780 #SUP  6.61
 58 ALA  HA     61 MET  HG3     4.60            #peak   781 #SUP  4.50
 61 MET  HN     61 MET  HG2     4.29            #peak   783 #SUP  8.22
 61 MET  HA     61 MET  HG2     4.15            #peak   784 #SUP  6.55
 58 ALA  HA     61 MET  HG2     4.82            #peak   785 #SUP  4.50
 61 MET  HB2    61 MET  HG2     2.85            #peak   787 #SUP  5.61
 61 MET  HB3    61 MET  HG3     2.77            #peak   795 #SUP  5.95
 61 MET  HB3    61 MET  HG2     2.88            #peak   796 #SUP  5.61
 52 GLN  HA     55 VAL  HB      3.59            #peak   801 #SUP  2.25
 58 ALA  HA     61 MET  HB2     4.01            #peak   805 #SUP  4.05
 61 MET  HB2    61 MET  HG3     2.91            #peak   806 #SUP  5.95
 54 LYS  HB3    54 LYS  QD      3.19            #peak   810 #SUP  4.23
 59 CYS  HA     62 LYS  QB      3.15            #peak   812 #SUP  1.50
 62 LYS  QB     62 LYS  QD      3.02            #peak   814 #SUP  6.24
 91 LYS  QB     91 LYS  QE      3.55            #peak   818 #SUP  1.86
 82 LYS  HB3    82 LYS  QG      2.98            #peak   821 #SUP  2.91
 62 LYS  QB     62 LYS  QE      3.97            #peak   830 #SUP  4.99
 16 PRO  HB3    59 CYS  HB2     4.37            #peak   836 #SUP  2.95
 45 LYS  HB3    45 LYS  HE3     4.48            #peak   841 #SUP  5.06
 45 LYS  HB2    46 LYS  HN      3.92            #peak   848 #SUP  4.91
 64 HIS  HB2    90 MET  QE      4.88            #peak   862 #SUP  2.40
 19 PRO  HB2    20 LEU  HN      4.65            #peak   870 #SUP  7.85
 90 MET  HN     90 MET  HB2     3.85            #peak   898 #SUP  7.61
 32 GLU  HB2    33 THR  QG2     4.48            #peak   917 #SUP  3.55
 87 ARG  QB     87 ARG  QD      3.10            #peak   928 #SUP  4.86
 32 GLU  HB3    32 GLU  HG2     3.05            #peak   937 #SUP  4.44
 29 GLU  HB2    29 GLU  HG3     2.71            #peak   938 #SUP  5.17
 45 LYS  HA     45 LYS  QD      3.72            #peak   941 #SUP  6.07
 24 LYS  QD     24 LYS  QE      2.83            #peak   943 #SUP  3.60
 24 LYS  HG2    24 LYS  QD      2.99            #peak   945 #SUP  5.91
 29 GLU  HA     29 GLU  HB2     2.97            #peak   950 #SUP  4.90
 38 LYS  HA     38 LYS  QD      4.70            #peak   960 #SUP  4.74
 62 LYS  HG2    62 LYS  QD      2.40            #peak   961 #SUP  4.61
 12 GLN  HB2    12 GLN  HG2     2.88            #peak   963 #SUP  5.44
 12 GLN  HB3    12 GLN  HG2     2.79            #peak   966 #SUP  5.42
 25 GLU  HB2    26 LYS  HA      3.46            #peak   968 #SUP  4.94
 54 LYS  QD     54 LYS  QE      2.40            #peak   973 #SUP  2.86
 25 GLU  HB2    26 LYS  HN      4.11            #peak   983 #SUP  6.79
 54 LYS  HN     54 LYS  QD      4.23            #peak   986 #SUP  7.33
 46 LYS  HA     46 LYS  HD2     3.77            #peak   987 #SUP  2.92
 46 LYS  HA     46 LYS  HD3     4.16            #peak   991 #SUP  2.69
 26 LYS  HA     26 LYS  QD      3.49            #peak   992 #SUP  5.48
 13 CYS  HA     16 PRO  HG2     4.52            #peak   994 #SUP  3.74
 26 LYS  HB3    26 LYS  QD      3.62            #peak  1022 #SUP  5.17
 60 ARG  HA     60 ARG  HG3     4.01            #peak  1025 #SUP  5.53
 42 ARG  HN     42 ARG  HG3     4.51            #peak  1044 #SUP  5.17
 42 ARG  QB     42 ARG  HG3     2.70            #peak  1045 #SUP  4.44
 42 ARG  HA     42 ARG  HG2     4.01            #peak  1048 #SUP  4.43
 42 ARG  HG2    42 ARG  QD      2.92            #peak  1049 #SUP  3.61
 42 ARG  QB     42 ARG  HG2     2.87            #peak  1050 #SUP  4.44
 14 THR  QG2    18 GLU  HB3     4.37            #peak  1058 #SUP  5.02
 18 GLU  HB2    19 PRO  HD2     4.04            #peak  1062 #SUP  6.25
 49 CYS  HB3    52 GLN  HB3     4.56            #peak  1075 #SUP  2.96
 20 LEU  HA     52 GLN  HB3     3.49            #peak  1078 #SUP  4.59
 20 LEU  QD1    52 GLN  HB3     4.25            #peak  1080 #SUP  5.69
 20 LEU  QD1    24 LYS  HG3     4.36            #peak  1089 #SUP  2.17
 68 ARG  HA     68 ARG  HG3     3.85            #peak  1100 #SUP  5.65
 24 LYS  HG2    24 LYS  QE      4.10            #peak  1106 #SUP  4.28
 45 LYS  HG3    45 LYS  HE3     4.24            #peak  1108 #SUP  5.77
 54 LYS  HG3    54 LYS  QE      3.91            #peak  1112 #SUP  3.66
 54 LYS  HB2    54 LYS  HG3     2.93            #peak  1119 #SUP  5.08
 54 LYS  HN     54 LYS  HG2     4.27            #peak  1120 #SUP  8.15
 62 LYS  HG3    62 LYS  QE      3.87            #peak  1127 #SUP  3.45
 10 LYS  HA     10 LYS  HG3     3.81            #peak  1130 #SUP  4.31
 62 LYS  HA     62 LYS  HG2     3.72            #peak  1132 #SUP  4.29
 10 LYS  HG2    10 LYS  QD      2.95            #peak  1134 #SUP  2.58
 26 LYS  HG3    26 LYS  QE      3.96            #peak  1136 #SUP  2.61
 26 LYS  HG3    26 LYS  QD      2.56            #peak  1141 #SUP  4.43
 46 LYS  HN     46 LYS  QG      4.82            #peak  1142 #SUP  3.95
 26 LYS  HA     26 LYS  HG2     3.53            #peak  1143 #SUP  5.56
 20 LEU  QD1    23 CYS  HB2     4.25            #peak  1153 #SUP  2.92
 20 LEU  HB3    20 LEU  QD1     4.09            #peak  1155 #SUP  6.00
 20 LEU  HB2    20 LEU  QD1     3.56            #peak  1157 #SUP  6.00
 20 LEU  QD1    49 CYS  HB3     3.54            #peak  1166 #SUP  4.00
 20 LEU  QD1    49 CYS  HB2     4.03            #peak  1167 #SUP  2.96
 20 LEU  QD1    52 GLN  HB2     3.70            #peak  1169 #SUP  7.51
 15 THR  QG2    16 PRO  HD2     4.77            #peak  1172 #SUP  7.28
 21 THR  HA     21 THR  QG2     3.14            #peak  1173 #SUP  3.37
 39 THR  QG2    40 CYS  HN      4.51            #peak  1176 #SUP  4.87
 39 THR  QG2    43 ASN  HD21    4.14            #peak  1177 #SUP  2.08
 85 THR  QG2    86 CYS  HN      4.68            #peak  1179 #SUP  4.15
 85 THR  HA     85 THR  QG2     3.25            #peak  1181 #SUP  2.63
 75 GLU  HG2    85 THR  QG2     4.10            #peak  1182 #SUP  4.68
 21 THR  QG2    22 ALA  HA      3.65            #peak  1183 #SUP  2.71
 33 THR  HA     33 THR  QG2     3.02            #peak  1185 #SUP  2.28
 92 THR  HN     92 THR  QG2     4.23            #peak  1186 #SUP  6.02
 92 THR  QG2    93 ASN  HD22    4.43            #peak  1187 #SUP  4.26
 92 THR  QG2    93 ASN  HD21    4.87            #peak  1188 #SUP  5.23
 92 THR  QG2    93 ASN  HA      4.30            #peak  1189 #SUP  4.07
 92 THR  HA     92 THR  QG2     3.24            #peak  1191 #SUP  4.95
 14 THR  HN     14 THR  QG2     4.84            #peak  1197 #SUP  2.31
 55 VAL  QG2    56 CYS  HA      3.97            #peak  1202 #SUP  3.27
 52 GLN  HA     55 VAL  QG2     4.25            #peak  1203 #SUP  2.25
 16 PRO  HB3    55 VAL  QG2     3.75            #peak  1205 #SUP  1.50
  6 PRO  HA      7 VAL  QG2     4.70            #peak  1207 #SUP  4.52
 35 ALA  HN     35 ALA  QB      3.92            #peak  1208 #SUP  2.31
 70 ALA  QB     71 ASN  HD22    5.07            #peak  1211 #SUP  4.15
 44 CYS  HA     47 ALA  QB      3.52            #peak  1214 #SUP  1.50
 69 ALA  QB     70 ALA  HN      3.93            #peak  1221 #SUP  3.15
 22 ALA  HN     22 ALA  QB      2.90            #peak  1226 #SUP  4.92
 88 ALA  HN     88 ALA  QB      2.76            #peak  1227 #SUP  4.04
 19 PRO  HA     22 ALA  QB      3.24            #peak  1230 #SUP  1.50
 63 CYS  HA     66 ALA  QB      3.12            #peak  1233 #SUP  2.00
 28 ALA  QB     41 ARG  HG2     4.53            #peak  1238 #SUP  2.96
 28 ALA  QB     41 ARG  HD2     4.08            #peak  1244 #SUP  1.50
 90 MET  QE     94 CYS  HB3     3.37            #peak  1246 #SUP  3.87
 90 MET  HG3    90 MET  QE      3.50            #peak  1247 #SUP  5.30
 90 MET  HG2    90 MET  QE      3.72            #peak  1248 #SUP  4.97
 74 SER  HA     74 SER  QB      3.01            #peak  1249 #SUP  3.28
 90 MET  HB2    90 MET  QE      2.96            #peak  1251 #SUP  5.31
 13 CYS  HA     16 PRO  HG3     4.90            #peak  1270 #SUP  3.75
 85 THR  HA     89 CYS  HN      5.31            #peak  1271 #SUP  3.36
 75 GLU  HB2    85 THR  QG2     3.76            #peak  1272 #SUP  6.98
 75 GLU  HG3    85 THR  QG2     4.09            #peak  1273 #SUP  4.45
 16 PRO  HB2    55 VAL  QG2     4.35            #peak  1274 #SUP  2.96
 16 PRO  HG3    59 CYS  HB2     4.49            #peak  1280 #SUP  4.75
 17 CYS  HA     20 LEU  HB3     5.16            #peak  1282 #SUP  1.50
 18 GLU  HA     21 THR  HB      3.30            #peak  1286 #SUP  2.18
 20 LEU  HB2    21 THR  HN      4.76            #peak  1291 #SUP  6.79
 65 LYS  QB     66 ALA  HA      4.93            #peak  1293 #SUP  2.43
 22 ALA  QB     23 CYS  HB3     5.50            #peak  1294 #SUP  3.33
 29 GLU  HA     32 GLU  HN      4.60            #peak  1297 #SUP  2.00
 26 LYS  HA     29 GLU  HN      3.88            #peak  1298 #SUP  3.87
 35 ALA  QB     36 ASP  HN      5.22            #peak  1303 #SUP  3.20
 51 PRO  HA     54 LYS  QD      3.45            #peak  1304 #SUP  5.28
 41 ARG  HA     44 CYS  HN      4.27            #peak  1306 #SUP  3.58
 55 VAL  HA     55 VAL  QG1     2.87            #peak  1325 #SUP  3.97
 16 PRO  HA     55 VAL  QG2     4.07            #peak  1326 #SUP  1.50
 58 ALA  QB     59 CYS  HA      4.69            #peak  1328 #SUP  3.28
 87 ARG  HN     87 ARG  QD      4.62            #peak  1339 #SUP  6.01
 61 MET  HG3    61 MET  QE      2.85            #peak  1345 #SUP  3.60
 15 THR  HA     15 THR  QG2     2.87            #peak  1351 #SUP  4.75
 14 THR  QG2    18 GLU  HB2     4.98            #peak  1352 #SUP  5.03
 59 CYS  HA     59 CYS  HB2     2.95            #peak  1355 #SUP  3.31
 23 CYS  HA     26 LYS  QD      4.53            #peak  1356 #SUP  1.48
 73 ALA  QB     74 SER  HA      4.27            #peak  1357 #SUP  2.86
 27 CYS  HB2    44 CYS  HB2     3.72            #peak  1358 #SUP  2.96
 30 SER  HB3    31 CYS  HN      5.02            #peak  1361 #SUP  4.54
 31 CYS  HB2    41 ARG  HG2     4.78            #peak  1362 #SUP  2.31
 31 CYS  HB2    41 ARG  HG3     4.09            #peak  1363 #SUP  2.31
 32 GLU  HA     32 GLU  HG2     4.01            #peak  1364 #SUP  4.00
 32 GLU  HA     32 GLU  HB3     2.91            #peak  1365 #SUP  4.44
 32 GLU  HA     32 GLU  HB2     2.89            #peak  1366 #SUP  4.44
 33 THR  HA     33 THR  HB      3.03            #peak  1369 #SUP  2.00
 35 ALA  QB     36 ASP  HA      5.22            #peak  1371 #SUP  2.62
 39 THR  HA     39 THR  QG2     3.02            #peak  1376 #SUP  3.78
 39 THR  HN     39 THR  QG2     4.17            #peak  1377 #SUP  4.77
 41 ARG  HA     41 ARG  HG2     3.42            #peak  1378 #SUP  4.33
 41 ARG  HA     41 ARG  QB      3.01            #peak  1379 #SUP  4.76
 41 ARG  HA     41 ARG  HG3     2.97            #peak  1380 #SUP  4.19
 41 ARG  HA     44 CYS  HB2     3.90            #peak  1381 #SUP  1.50
 45 LYS  HG2    45 LYS  HE3     3.85            #peak  1387 #SUP  5.00
 18 GLU  HB3    19 PRO  HD2     3.58            #peak  1413 #SUP  6.25
  7 VAL  HA      7 VAL  QG1     3.44            #peak  1414 #SUP  4.56
  7 VAL  HA      7 VAL  QG2     3.30            #peak  1415 #SUP  4.68
 14 THR  QG2    18 GLU  HA      4.59            #peak  1424 #SUP  3.66
 75 GLU  HA     85 THR  QG2     3.58            #peak  1431 #SUP  4.75
 75 GLU  HB3    85 THR  QG2     4.37            #peak  1432 #SUP  3.00
 23 CYS  HA     26 LYS  HB2     3.45            #peak  1438 #SUP  1.49
 22 ALA  QB     23 CYS  HA      4.19            #peak  1439 #SUP  3.19
 37 LYS  HA     41 ARG  HG3     5.13            #peak  1443 #SUP  1.75
 41 ARG  HA     44 CYS  HB3     3.71            #peak  1447 #SUP  1.50
 41 ARG  QB     41 ARG  HD2     3.97            #peak  1449 #SUP  4.27
 38 LYS  HG2    42 ARG  QD      3.42            #peak  1451 #SUP  1.11
 54 LYS  HA     54 LYS  HB2     2.72            #peak  1453 #SUP  4.46
 29 GLU  HA     29 GLU  HB3     3.00            #peak  1454 #SUP  5.10
 42 ARG  HA     42 ARG  HG3     3.67            #peak  1458 #SUP  4.44
 39 THR  HA     42 ARG  HN      4.22            #peak  1463 #SUP  2.47
 57 ASP  HA     60 ARG  HB3     3.05            #peak  1468 #SUP  4.23
 56 CYS  HA     59 CYS  HB3     4.13            #peak  1471 #SUP  1.50
 60 ARG  HA     60 ARG  HB3     3.04            #peak  1472 #SUP  6.21
 61 MET  HB2    62 LYS  HN      4.50            #peak  1474 #SUP  7.44
 65 LYS  HG3    65 LYS  QE      3.77            #peak  1480 #SUP  2.55
 64 HIS  HA     67 CYS  HB2     3.86            #peak  1481 #SUP  2.25
 71 ASN  HB2    72 CYS  HN      5.50            #peak  1482 #SUP  5.60
 89 CYS  HA     93 ASN  HD22    5.02            #peak  1486 #SUP  1.16
 77 PRO  HB3    78 LYS  HA      4.59            #peak  1489 #SUP  3.19
 75 GLU  HA     86 CYS  HA      4.75            #peak  1497 #SUP  4.75
 90 MET  HB3    90 MET  QE      3.68            #peak  1504 #SUP  5.44
 91 LYS  HA     91 LYS  HG2     3.88            #peak  1505 #SUP  5.06
  9 CYS  HA     12 GLN  HB3     3.61            #peak  1509 #SUP  3.00
 82 LYS  QD     82 LYS  QE      2.40            #peak  1510 #SUP  1.70
 15 THR  HA     18 GLU  HB2     4.87            #peak  1518 #SUP  4.49
 15 THR  QG2    18 GLU  HB2     5.50            #peak  1519 #SUP  3.16
 15 THR  QG2    16 PRO  HB3     4.50            #peak  1520 #SUP  5.30
 15 THR  QG2    16 PRO  HG3     5.16            #peak  1521 #SUP  5.93
 17 CYS  HA     20 LEU  HB2     5.50            #peak  1522 #SUP  1.50
 19 PRO  HB3    52 GLN  HB2     4.75            #peak  1525 #SUP  1.75
 20 LEU  HB2    20 LEU  QD2     3.77            #peak  1526 #SUP  5.44
 20 LEU  QD2    24 LYS  QD      3.79            #peak  1527 #SUP  0.02
 20 LEU  QD1    23 CYS  HB3     3.97            #peak  1528 #SUP  2.92
 21 THR  QG2    25 GLU  HG3     4.55            #peak  1529 #SUP  2.00
 22 ALA  HA     25 GLU  HG3     4.62            #peak  1532 #SUP  4.75
 85 THR  HA     88 ALA  QB      3.33            #peak  1533 #SUP  3.30
 24 LYS  HA     24 LYS  HG3     3.22            #peak  1535 #SUP  5.81
 22 ALA  HA     25 GLU  HB3     3.25            #peak  1547 #SUP  3.00
 46 LYS  HA     46 LYS  QG      3.27            #peak  1552 #SUP  3.99
 26 LYS  QD     26 LYS  QE      2.99            #peak  1553 #SUP  2.11
 27 CYS  HB3    44 CYS  HB2     4.76            #peak  1554 #SUP  0.75
 26 LYS  HA     29 GLU  HG3     4.02            #peak  1555 #SUP  2.22
 29 GLU  HB3    30 SER  HA      4.50            #peak  1556 #SUP  2.41
 30 SER  HA     30 SER  HB3     3.00            #peak  1558 #SUP  3.22
 27 CYS  HA     30 SER  HB3     3.93            #peak  1560 #SUP  1.50
 32 GLU  HB2    32 GLU  HG2     2.86            #peak  1561 #SUP  4.44
 32 GLU  HB3    33 THR  QG2     4.52            #peak  1564 #SUP  3.55
 34 SER  HB2    37 LYS  HA      3.51            #peak  1565 #SUP  2.00
 34 SER  HB3    37 LYS  HA      3.75            #peak  1566 #SUP  0.75
 37 LYS  HG3    37 LYS  QE      4.07            #peak  1568 #SUP  3.99
 32 GLU  HA     37 LYS  HG3     4.96            #peak  1570 #SUP  1.50
 37 LYS  HG2    37 LYS  QD      2.79            #peak  1572 #SUP  3.08
 91 LYS  QB     91 LYS  HG3     2.53            #peak  1573 #SUP  4.08
 39 THR  QG2    43 ASN  HD22    4.95            #peak  1574 #SUP  2.59
 39 THR  HB     40 CYS  HA      4.17            #peak  1575 #SUP  3.04
 27 CYS  HB2    44 CYS  HB3     4.11            #peak  1576 #SUP  1.50
 42 ARG  HA     45 LYS  HB2     4.41            #peak  1577 #SUP  0.75
 45 LYS  HA     45 LYS  HG2     3.65            #peak  1580 #SUP  6.09
 46 LYS  HA     46 LYS  QB      2.69            #peak  1586 #SUP  5.62
 46 LYS  QB     46 LYS  QG      2.62            #peak  1587 #SUP  3.90
 46 LYS  QB     46 LYS  QE      3.72            #peak  1588 #SUP  2.22
 51 PRO  HA     54 LYS  QE      5.50            #peak  1589 #SUP  3.53
 51 PRO  HG3    52 GLN  HN      4.73            #peak  1592 #SUP  6.72
 20 LEU  HB2    52 GLN  HB3     5.50            #peak  1594 #SUP  3.78
 51 PRO  HG2    52 GLN  HG3     3.70            #peak  1597 #SUP  6.28
 51 PRO  HA     54 LYS  HG2     4.68            #peak  1600 #SUP  6.22
 56 CYS  HA     59 CYS  HB2     4.07            #peak  1601 #SUP  1.50
 57 ASP  HA     60 ARG  HG3     3.39            #peak  1602 #SUP  3.72
 58 ALA  HA     61 MET  HB3     3.93            #peak  1603 #SUP  4.05
 60 ARG  HB3    60 ARG  QD      3.43            #peak  1606 #SUP  5.33
 60 ARG  HB2    60 ARG  QD      2.93            #peak  1608 #SUP  5.03
 57 ASP  HA     60 ARG  QD      4.14            #peak  1610 #SUP  3.66
 61 MET  HA     61 MET  QE      4.99            #peak  1611 #SUP  4.13
  9 CYS  HB2    63 CYS  HB3     4.32            #peak  1614 #SUP  0.75
 64 HIS  HA     67 CYS  HB3     4.08            #peak  1615 #SUP  1.73
 65 LYS  HA     68 ARG  HB3     2.94            #peak  1617 #SUP  2.23
 62 LYS  HA     62 LYS  QD      4.34            #peak  1618 #SUP  4.92
 67 CYS  HB2    68 ARG  HN      4.00            #peak  1621 #SUP  4.36
 68 ARG  HN     68 ARG  HG2     5.07            #peak  1622 #SUP  5.63
 68 ARG  HG3    69 ALA  HN      5.37            #peak  1626 #SUP  5.72
 76 CYS  HA     86 CYS  HB2     4.07            #peak  1631 #SUP  0.75
 80 GLU  HN     81 HIS  HA      5.39            #peak  1636 #SUP  1.52
 82 LYS  HB3    82 LYS  QE      3.95            #peak  1637 #SUP  4.00
 83 SER  HA     84 ASP  QB      5.28            #peak  1638 #SUP  1.60
 83 SER  HA     83 SER  HB2     2.59            #peak  1640 #SUP  2.21
 87 ARG  HA     87 ARG  HG3     3.00            #peak  1642 #SUP  5.27
 87 ARG  HA     87 ARG  QD      4.59            #peak  1643 #SUP  4.74
 87 ARG  QB     87 ARG  HG2     2.80            #peak  1644 #SUP  5.31
 89 CYS  HA     92 THR  HN      3.84            #peak  1646 #SUP  1.32
 90 MET  HA     94 CYS  HB3     4.07            #peak  1649 #SUP  3.15
 64 HIS  HB3    90 MET  QE      3.92            #peak  1652 #SUP  2.40
 95 LYS  HB3    95 LYS  QD      4.04            #peak  1656 #SUP  1.90
 72 CYS  HB3    89 CYS  HB3     4.15            #peak  1657 #SUP  0.75
 77 PRO  HD2    80 GLU  HB2     3.75            #peak  1659 #SUP  0.75
 80 GLU  HB2    80 GLU  QG      2.85            #peak  1661 #SUP  2.90
 80 GLU  HB3    83 SER  HB3     3.43            #peak  1668 #SUP  0.75
 39 THR  HA     42 ARG  HG2     5.45            #peak  1669 #SUP  2.56
 42 ARG  HA     42 ARG  QB      2.66            #peak  1671 #SUP  5.00
 65 LYS  HA     65 LYS  HG2     3.68            #peak  1673 #SUP  2.60
 65 LYS  HA     68 ARG  HB2     3.42            #peak  1674 #SUP  2.20
 60 ARG  HA     63 CYS  HB3     3.58            #peak  1676 #SUP  1.50
 13 CYS  HA     16 PRO  HB3     5.07            #peak  1677 #SUP  3.75
 25 GLU  HA     25 GLU  HB3     3.00            #peak  1678 #SUP  3.97
 42 ARG  HA     45 LYS  HN      3.98            #peak  1679 #SUP  2.00
  7 VAL  HA      8 ASP  HB2     5.50            #peak  1683 #SUP  3.66
 90 MET  HA     90 MET  QE      4.20            #peak  1686 #SUP  5.31
  9 CYS  HA     12 GLN  HG3     4.94            #peak  1688 #SUP  3.00
 10 LYS  HA     13 CYS  HB3     5.36            #peak  1689 #SUP  0.75
 10 LYS  HA     13 CYS  HB2     5.05            #peak  1690 #SUP  0.75
 45 LYS  HB3    46 LYS  HN      4.92            #peak  1691 #SUP  5.22
 20 LEU  QD1    53 ASP  HB3     4.68            #peak  1693 #SUP  2.78
 49 CYS  HA     52 GLN  HN      5.00            #peak  1694 #SUP  3.20
 67 CYS  HA     70 ALA  HN      4.74            #peak  1695 #SUP  3.72
 20 LEU  QD1    24 LYS  QD      3.44            #peak  1698 #SUP  2.77
 90 MET  HA     90 MET  HG2     3.90            #peak  1699 #SUP  5.27
 90 MET  HA     90 MET  HG3     4.12            #peak  1700 #SUP  5.97
 68 ARG  HN     90 MET  QE      4.66            #peak  1701 #SUP  1.50
 64 HIS  HD2    90 MET  QE      5.26            #peak  1702 #SUP  2.40
 68 ARG  HA     90 MET  QE      4.50            #peak  1703 #SUP  1.50
 68 ARG  HG2    90 MET  QE      4.82            #peak  1704 #SUP  1.50
 68 ARG  HB2    68 ARG  QD      3.37            #peak  1705 #SUP  6.16
  7 VAL  QG1    67 CYS  HB3     5.04            #peak  1707 #SUP  2.00
  7 VAL  QG1    67 CYS  HB2     5.23            #peak  1708 #SUP  0.75
  7 VAL  QG1    12 GLN  HE22    5.50            #peak  1710 #SUP  1.50
  7 VAL  QG2    71 ASN  HD22    4.73            #peak  1714 #SUP  1.50
  7 VAL  QG2    71 ASN  HD21    5.24            #peak  1715 #SUP  1.50
  7 VAL  QG2    67 CYS  HB3     5.21            #peak  1717 #SUP  2.00
  7 VAL  QG2    70 ALA  QB      5.50            #peak  1718 #SUP  1.50
  6 PRO  HA     93 ASN  HB2     5.50            #peak  1722 #SUP  0.75
  6 PRO  HA      7 VAL  HA      4.51            #peak  1723 #SUP  5.01
  6 PRO  HA     93 ASN  HA      4.25            #peak  1724 #SUP  2.96
  5 ALA  HA      6 PRO  HD2     3.15            #peak  1727 #SUP  5.76
  5 ALA  HA      6 PRO  HD3     3.15            #peak  1728 #SUP  5.76
  5 ALA  QB      6 PRO  HD2     3.84            #peak  1729 #SUP  4.66
  5 ALA  QB      6 PRO  HD3     3.68            #peak  1730 #SUP  4.52
  5 ALA  HA      6 PRO  QG      4.70            #peak  1735 #SUP  5.74
  5 ALA  HA      6 PRO  HB3     5.50            #peak  1736 #SUP  5.20
  5 ALA  QB      6 PRO  QG      5.37            #peak  1737 #SUP  4.77
  8 ASP  HA     95 LYS  HN      5.50            #peak  1742 #SUP  1.50
  8 ASP  HA     95 LYS  HB2     4.61            #peak  1743 #SUP  1.50
  9 CYS  HB3    60 ARG  HA      5.50            #peak  1746 #SUP  0.75
  7 VAL  QG1    12 GLN  HG3     5.23            #peak  1750 #SUP  1.50
 13 CYS  HA     16 PRO  HB2     5.32            #peak  1751 #SUP  3.75
 14 THR  HA     16 PRO  HD2     4.31            #peak  1753 #SUP  4.71
 15 THR  QG2    16 PRO  HA      5.13            #peak  1756 #SUP  6.18
 14 THR  HA     17 CYS  HB3     4.76            #peak  1764 #SUP  1.70
 18 GLU  HG3    19 PRO  HD3     5.18            #peak  1765 #SUP  6.91
 19 PRO  HD3    20 LEU  HN      5.48            #peak  1770 #SUP  8.04
 18 GLU  HG2    19 PRO  HD3     5.23            #peak  1771 #SUP  7.16
 20 LEU  HB3    52 GLN  HB2     5.10            #peak  1773 #SUP  4.04
 20 LEU  HB3    56 CYS  QB      4.85            #peak  1774 #SUP  1.50
 20 LEU  QD2    24 LYS  QE      5.17            #peak  1776 #SUP  0.75
 20 LEU  QD2    53 ASP  HB2     5.18            #peak  1777 #SUP  2.96
 20 LEU  QD2    56 CYS  HN      5.43            #peak  1778 #SUP  0.75
 32 GLU  HA     37 LYS  QD      4.48            #peak  1783 #SUP  1.50
 37 LYS  HB3    37 LYS  QE      4.12            #peak  1784 #SUP  4.36
 38 LYS  HA     38 LYS  QE      5.00            #peak  1785 #SUP  3.84
 38 LYS  HA     42 ARG  QD      4.49            #peak  1786 #SUP  2.15
 38 LYS  HA     41 ARG  HN      5.16            #peak  1787 #SUP  2.68
 38 LYS  HG2    39 THR  HN      5.50            #peak  1788 #SUP  2.48
 36 ASP  HB3    39 THR  HA      5.50            #peak  1789 #SUP  2.75
 36 ASP  HB2    39 THR  HA      5.50            #peak  1790 #SUP  2.00
 39 THR  HB     42 ARG  QB      5.41            #peak  1792 #SUP  1.50
 39 THR  QG2    42 ARG  QB      4.63            #peak  1793 #SUP  4.94
 36 ASP  HB3    39 THR  QG2     4.93            #peak  1794 #SUP  1.42
 39 THR  QG2    42 ARG  QD      5.38            #peak  1795 #SUP  3.77
 34 SER  HB2    40 CYS  HB2     4.88            #peak  1798 #SUP  2.00
 34 SER  HB3    40 CYS  HB3     5.39            #peak  1800 #SUP  2.00
 34 SER  HB3    40 CYS  HB2     5.38            #peak  1801 #SUP  2.00
 34 SER  HB2    40 CYS  HB3     4.95            #peak  1802 #SUP  2.00
 38 LYS  HA     41 ARG  QB      5.23            #peak  1805 #SUP  0.93
 43 ASN  HA     46 LYS  QG      4.60            #peak  1807 #SUP  1.50
 43 ASN  HB3    44 CYS  HA      4.84            #peak  1808 #SUP  3.66
 44 CYS  HB2    45 LYS  HB3     5.50            #peak  1809 #SUP  3.83
 45 LYS  HA     45 LYS  HE3     5.50            #peak  1810 #SUP  5.17
 20 LEU  QD1    45 LYS  HG2     5.26            #peak  1812 #SUP  2.97
 20 LEU  QD1    45 LYS  HG3     5.37            #peak  1813 #SUP  2.97
 20 LEU  QD1    45 LYS  HE2     5.50            #peak  1814 #SUP  3.00
 20 LEU  QD1    45 LYS  HE3     5.50            #peak  1815 #SUP  3.00
 94 CYS  HA     95 LYS  HA      5.19            #peak  1817 #SUP  4.13
 46 LYS  QB     47 ALA  HA      5.50            #peak  1818 #SUP  3.52
 46 LYS  HN     47 ALA  QB      4.75            #peak  1819 #SUP  3.20
 47 ALA  QB     48 ASP  HA      5.17            #peak  1820 #SUP  4.13
 47 ALA  QB     48 ASP  HB3     4.59            #peak  1821 #SUP  3.99
 46 LYS  QB     47 ALA  QB      4.75            #peak  1822 #SUP  4.12
 48 ASP  HA     50 GLU  HN      4.73            #peak  1823 #SUP  1.72
 49 CYS  HA     52 GLN  HE22    5.24            #peak  1826 #SUP  2.20
 49 CYS  HA     52 GLN  HB2     5.50            #peak  1827 #SUP  3.82
 20 LEU  QD1    49 CYS  HA      5.40            #peak  1828 #SUP  1.50
 45 LYS  HG3    49 CYS  HB2     4.68            #peak  1829 #SUP  2.00
 20 LEU  HA     49 CYS  HB2     5.50            #peak  1830 #SUP  2.00
 49 CYS  HB2    50 GLU  HA      5.50            #peak  1831 #SUP  4.01
 49 CYS  HB2    50 GLU  HN      5.50            #peak  1832 #SUP  5.48
 49 CYS  HB3    52 GLN  HB2     5.48            #peak  1835 #SUP  2.87
 45 LYS  HG3    49 CYS  HB3     4.89            #peak  1836 #SUP  2.92
 45 LYS  HG2    49 CYS  HB3     5.40            #peak  1837 #SUP  1.47
 20 LEU  QD2    49 CYS  HB3     5.50            #peak  1838 #SUP  1.50
 50 GLU  HG2    51 PRO  QD      4.70            #peak  1839 #SUP  7.21
 46 LYS  HD2    50 GLU  HG2     4.57            #peak  1840 #SUP  0.75
 46 LYS  HD2    50 GLU  HG3     4.37            #peak  1841 #SUP  2.76
 46 LYS  QE     50 GLU  HG3     4.70            #peak  1842 #SUP  1.07
 51 PRO  HA     54 LYS  HB2     4.00            #peak  1843 #SUP  4.97
 51 PRO  HA     55 VAL  HN      5.40            #peak  1844 #SUP  7.68
 49 CYS  HA     51 PRO  QD      4.49            #peak  1845 #SUP  5.21
 23 CYS  HB2    52 GLN  HB3     5.50            #peak  1847 #SUP  0.02
 23 CYS  HB3    52 GLN  HG2     5.50            #peak  1848 #SUP  1.50
 23 CYS  HB3    52 GLN  HG3     5.40            #peak  1849 #SUP  1.50
 20 LEU  HB2    53 ASP  HA      5.07            #peak  1851 #SUP  5.91
 20 LEU  HB3    53 ASP  HA      5.50            #peak  1852 #SUP  4.62
 20 LEU  HA     53 ASP  HA      5.26            #peak  1853 #SUP  7.19
 53 ASP  HB3    54 LYS  HA      4.68            #peak  1855 #SUP  3.55
 50 GLU  HB3    54 LYS  HG2     5.50            #peak  1858 #SUP  0.24
 51 PRO  HA     54 LYS  HG3     5.50            #peak  1860 #SUP  5.23
 51 PRO  HA     55 VAL  QG1     5.32            #peak  1861 #SUP  3.56
 55 VAL  QG2    56 CYS  QB      4.99            #peak  1863 #SUP  3.87
 52 GLN  HB3    53 ASP  HA      5.50            #peak  1864 #SUP  3.94
 57 ASP  HA     58 ALA  QB      5.35            #peak  1866 #SUP  4.39
 56 CYS  QB     57 ASP  HA      5.50            #peak  1867 #SUP  3.87
 57 ASP  HA     60 ARG  HA      5.50            #peak  1868 #SUP  4.38
 57 ASP  HB2    58 ALA  QB      5.21            #peak  1870 #SUP  4.39
 57 ASP  HB3    58 ALA  QB      5.50            #peak  1871 #SUP  4.39
 56 CYS  QB     57 ASP  HB3     5.50            #peak  1873 #SUP  3.31
 55 VAL  QG1    58 ALA  QB      4.40            #peak  1874 #SUP  2.14
 55 VAL  QG2    58 ALA  QB      4.61            #peak  1875 #SUP  2.13
 16 PRO  HG2    59 CYS  HA      5.50            #peak  1876 #SUP  1.50
 16 PRO  HD3    59 CYS  HB2     5.41            #peak  1878 #SUP  3.00
 16 PRO  HB2    59 CYS  HB3     4.38            #peak  1880 #SUP  2.85
 16 PRO  HG3    59 CYS  HB3     5.34            #peak  1881 #SUP  2.96
 13 CYS  HB3    59 CYS  HB3     5.50            #peak  1882 #SUP  1.61
 58 ALA  QB     59 CYS  HB3     5.50            #peak  1883 #SUP  3.84
  9 CYS  HB2    60 ARG  HA      4.28            #peak  1884 #SUP  0.75
 59 CYS  HN     60 ARG  HA      5.50            #peak  1885 #SUP  5.21
 13 CYS  HB3    60 ARG  HG2     4.76            #peak  1886 #SUP  0.99
 61 MET  HG2    62 LYS  QD      5.38            #peak  1888 #SUP  5.53
 61 MET  HG3    62 LYS  QD      5.16            #peak  1889 #SUP  5.72
 61 MET  HG2    62 LYS  QE      4.72            #peak  1890 #SUP  4.48
 61 MET  HG3    62 LYS  QE      4.76            #peak  1891 #SUP  4.70
 61 MET  HG2    62 LYS  HN      5.50            #peak  1892 #SUP  8.37
 61 MET  HG3    62 LYS  HN      5.41            #peak  1893 #SUP  8.77
 61 MET  HN     61 MET  QE      5.17            #peak  1894 #SUP  5.70
 62 LYS  QB     63 CYS  HB2     5.19            #peak  1895 #SUP  4.66
 63 CYS  HB2    64 HIS  HN      5.50            #peak  1898 #SUP  4.28
 66 ALA  HA     70 ALA  HN      5.50            #peak  1904 #SUP  1.27
  7 VAL  QG2    67 CYS  HA      4.67            #peak  1906 #SUP  0.75
 67 CYS  HA     71 ASN  HD21    4.87            #peak  1907 #SUP  1.74
 67 CYS  HB2    68 ARG  HB2     5.50            #peak  1909 #SUP  3.81
 68 ARG  HA     72 CYS  HB2     4.20            #peak  1912 #SUP  4.09
 68 ARG  HG2    72 CYS  HB2     5.26            #peak  1915 #SUP  2.25
 68 ARG  HG2    76 CYS  HB3     4.49            #peak  1916 #SUP  1.22
 68 ARG  QD     72 CYS  HB2     4.87            #peak  1918 #SUP  2.20
 68 ARG  HA     68 ARG  QD      4.77            #peak  1919 #SUP  5.76
 69 ALA  HA     72 CYS  HN      5.50            #peak  1921 #SUP  2.25
 69 ALA  HA     73 ALA  HA      4.42            #peak  1923 #SUP  0.94
 68 ARG  HB3    69 ALA  QB      4.61            #peak  1925 #SUP  4.35
 68 ARG  QD     69 ALA  QB      5.14            #peak  1926 #SUP  3.85
 70 ALA  QB     71 ASN  HA      5.50            #peak  1928 #SUP  4.51
 69 ALA  HN     70 ALA  QB      5.50            #peak  1930 #SUP  3.25
 72 CYS  HA     75 GLU  HB3     4.69            #peak  1931 #SUP  2.96
 68 ARG  HG3    72 CYS  HB2     4.28            #peak  1932 #SUP  3.86
 72 CYS  HB2    75 GLU  HB3     4.83            #peak  1933 #SUP  2.96
 72 CYS  HB3    75 GLU  HB2     4.71            #peak  1934 #SUP  1.84
 68 ARG  HG3    72 CYS  HB3     4.60            #peak  1935 #SUP  0.75
 72 CYS  HB3    73 ALA  HA      5.50            #peak  1936 #SUP  2.54
 73 ALA  HA     76 CYS  HN      4.74            #peak  1938 #SUP  1.32
 72 CYS  HA     73 ALA  QB      5.50            #peak  1939 #SUP  3.33
 74 SER  HA     76 CYS  HN      5.20            #peak  1941 #SUP  2.11
 73 ALA  QB     74 SER  QB      5.15            #peak  1942 #SUP  2.86
 74 SER  QB     75 GLU  HG2     5.15            #peak  1943 #SUP  3.53
 75 GLU  HA     77 PRO  HD3     5.12            #peak  1944 #SUP  2.00
 75 GLU  HG2    86 CYS  HA      5.41            #peak  1949 #SUP  4.26
 72 CYS  HB3    75 GLU  HG3     5.50            #peak  1951 #SUP  1.84
 75 GLU  HG3    86 CYS  HA      4.66            #peak  1952 #SUP  4.26
 76 CYS  HA     77 PRO  HD2     3.39            #peak  1953 #SUP  5.08
 76 CYS  HA     77 PRO  HD3     3.32            #peak  1954 #SUP  7.03
 75 GLU  HA     76 CYS  HA      4.64            #peak  1955 #SUP  4.99
 76 CYS  HA     86 CYS  HA      4.84            #peak  1956 #SUP  2.91
 76 CYS  HN     77 PRO  HA      5.50            #peak  1959 #SUP  5.03
 77 PRO  HA     78 LYS  HB2     5.13            #peak  1961 #SUP  3.98
 76 CYS  HA     77 PRO  HG2     5.50            #peak  1963 #SUP  5.22
 78 LYS  QE     79 HIS  HA      4.89            #peak  1964 #SUP  1.84
 78 LYS  QD     79 HIS  QB      5.46            #peak  1966 #SUP  1.91
 77 PRO  HD2    80 GLU  QG      4.73            #peak  1968 #SUP  0.75
 79 HIS  QB     80 GLU  QG      5.01            #peak  1969 #SUP  2.08
 82 LYS  HA     87 ARG  QD      4.57            #peak  1971 #SUP  1.50
 82 LYS  HA     82 LYS  QE      5.50            #peak  1972 #SUP  3.60
 82 LYS  HA     87 ARG  HG3     4.38            #peak  1973 #SUP  1.50
 82 LYS  HA     87 ARG  HG2     3.95            #peak  1974 #SUP  1.50
 82 LYS  HB2    82 LYS  QE      5.50            #peak  1975 #SUP  4.00
 80 GLU  QG     83 SER  HB3     5.50            #peak  1979 #SUP  0.75
 84 ASP  HA     88 ALA  QB      5.21            #peak  1980 #SUP  2.98
 84 ASP  QB     85 THR  HA      5.50            #peak  1981 #SUP  1.32
 84 ASP  QB     87 ARG  QD      5.50            #peak  1982 #SUP  0.75
 85 THR  HB     88 ALA  QB      5.26            #peak  1983 #SUP  0.99
 75 GLU  HB2    85 THR  HB      5.44            #peak  1984 #SUP  1.84
 85 THR  QG2    89 CYS  HB2     5.50            #peak  1985 #SUP  2.00
 85 THR  QG2    89 CYS  HN      5.50            #peak  1986 #SUP  2.96
 85 THR  QG2    86 CYS  HA      4.62            #peak  1989 #SUP  2.79
 86 CYS  HB2    87 ARG  HA      5.50            #peak  1990 #SUP  3.99
 86 CYS  HN     87 ARG  QB      5.50            #peak  1992 #SUP  4.37
 87 ARG  HG3    88 ALA  HN      5.50            #peak  1994 #SUP  5.53
 75 GLU  HG3    89 CYS  HA      5.50            #peak  1995 #SUP  2.25
 90 MET  HB2    91 LYS  HN      5.15            #peak  1996 #SUP  6.61
 90 MET  HN     90 MET  QE      5.42            #peak  1997 #SUP  7.02
 90 MET  QE     94 CYS  HN      5.49            #peak  1998 #SUP  3.87
 90 MET  QE     94 CYS  HA      5.50            #peak  1999 #SUP  2.25
 64 HIS  HA     90 MET  QE      4.41            #peak  2000 #SUP  2.40
 87 ARG  HA     90 MET  QE      5.50            #peak  2001 #SUP  3.24
 91 LYS  QB     92 THR  HA      5.13            #peak  2003 #SUP  4.31
 91 LYS  HG2    92 THR  HA      4.76            #peak  2004 #SUP  3.40
 92 THR  HB     93 ASN  HD22    4.77            #peak  2005 #SUP  4.82
  6 PRO  HB3    93 ASN  HA      4.31            #peak  2006 #SUP  1.50
  6 PRO  QG     93 ASN  HA      4.73            #peak  2007 #SUP  1.50
 92 THR  HB     93 ASN  HB3     5.18            #peak  2009 #SUP  6.16
  7 VAL  HB     94 CYS  HA      4.71            #peak  2011 #SUP  1.50
  7 VAL  QG1    94 CYS  HA      5.50            #peak  2012 #SUP  1.50
  8 ASP  HA     95 LYS  HB3     5.50            #peak  2014 #SUP  1.50
 61 MET  HA     65 LYS  HN      5.50            #peak  2016 #SUP  3.16
 61 MET  HA     64 HIS  HN      5.50            #peak  2017 #SUP  2.69
 20 LEU  HA     49 CYS  HB3     4.61            #peak  2018 #SUP  2.96
 24 LYS  HA     27 CYS  HB2     4.31            #peak  2019 #SUP  2.25
 29 GLU  HG3    30 SER  HN      5.50            #peak  2020 #SUP  6.72

  Entry H atom name         Submitted Coord H atom name
  Start of MODEL    1
    1   1H    ILE   1           H        ILE   1 -18.533  17.182   4.538
    2    HA   ILE   1           HA       ILE   1 -16.269  16.545   4.877
    3    HB   ILE   1           HB       ILE   1 -16.575  14.816   2.425
    4   1HG1  ILE   1          1HG1      ILE   1 -17.946  13.719   3.968
    5   2HG1  ILE   1          2HG1      ILE   1 -16.395  12.918   4.129
    6   1HG2  ILE   1          1HG2      ILE   1 -14.382  14.908   4.512
    7   2HG2  ILE   1          2HG2      ILE   1 -14.420  13.929   3.026
    8   3HG2  ILE   1          3HG2      ILE   1 -14.308  15.703   2.922
    9   1HD1  ILE   1          1HD1      ILE   1 -17.723  14.875   6.014
   10   2HD1  ILE   1          2HD1      ILE   1 -16.973  13.301   6.372
   11   3HD1  ILE   1          3HD1      ILE   1 -15.950  14.715   6.020
   12    H    SER   2           H        SER   2 -14.854  18.108   4.224
   13    HA   SER   2           HA       SER   2 -15.416  19.276   1.611
   14   1HB   SER   2          1HB       SER   2 -14.762  21.495   2.604
   15   2HB   SER   2          2HB       SER   2 -16.237  20.831   3.278
   16    HG   SER   2           HG       SER   2 -14.290  21.699   4.710
   17    H    GLU   3           H        GLU   3 -13.415  20.666   0.850
   18    HA   GLU   3           HA       GLU   3 -11.193  18.919   0.963
   19   1HB   GLU   3          1HB       GLU   3 -12.142  21.056  -0.719
   20   2HB   GLU   3          2HB       GLU   3 -10.500  21.440  -0.244
   21   1HG   GLU   3          1HG       GLU   3 -10.876  18.591  -0.988
   22   2HG   GLU   3          2HG       GLU   3 -11.215  19.704  -2.299
   23    H    PHE   4           H        PHE   4 -10.418  18.888   3.128
   24    HA   PHE   4           HA       PHE   4  -8.621  20.981   3.750
   25   1HB   PHE   4          1HB       PHE   4 -11.365  20.763   5.015
   26   2HB   PHE   4          2HB       PHE   4 -10.039  21.103   6.109
   27    HD1  PHE   4           1HD      PHE   4 -12.500  22.577   4.175
   28    HD2  PHE   4           2HD      PHE   4  -8.402  23.040   5.175
   29    HE1  PHE   4           1HE      PHE   4 -12.629  25.011   3.575
   30    HE2  PHE   4           2HE      PHE   4  -8.531  25.474   4.575
   31    HZ   PHE   4           HZ       PHE   4 -10.643  26.430   3.782
   32    H    ALA   5           H        ALA   5  -7.713  20.572   6.121
   33    HA   ALA   5           HA       ALA   5  -6.738  19.190   7.548
   34   1HB   ALA   5          1HB       ALA   5  -8.292  16.765   7.189
   35   2HB   ALA   5          2HB       ALA   5  -8.220  17.861   8.590
   36   3HB   ALA   5          3HB       ALA   5  -9.365  18.184   7.266
   37    HA   PRO   6           HA       PRO   6  -4.114  16.666   5.214
   38   1HB   PRO   6          1HB       PRO   6  -3.111  14.881   7.023
   39   2HB   PRO   6          2HB       PRO   6  -2.548  16.535   6.897
   40   1HG   PRO   6          1HG       PRO   6  -4.299  15.326   8.948
   41   2HG   PRO   6          2HG       PRO   6  -3.393  16.824   9.023
   42   1HD   PRO   6          1HD       PRO   6  -6.214  16.546   8.588
   43   2HD   PRO   6          2HD       PRO   6  -5.289  18.034   8.548
   44    H    VAL   7           H        VAL   7  -3.721  14.732   4.025
   45    HA   VAL   7           HA       VAL   7  -6.086  13.011   4.216
   46    HB   VAL   7           HB       VAL   7  -4.160  13.578   1.956
   47   1HG1  VAL   7          1HG1      VAL   7  -5.979  12.248   0.648
   48   2HG1  VAL   7          2HG1      VAL   7  -4.740  11.356   1.565
   49   3HG1  VAL   7          3HG1      VAL   7  -6.375  11.555   2.240
   50   1HG2  VAL   7          1HG2      VAL   7  -5.619  15.103   1.186
   51   2HG2  VAL   7          2HG2      VAL   7  -7.027  14.080   1.557
   52   3HG2  VAL   7          3HG2      VAL   7  -6.297  15.085   2.831
   53    H    ASP   8           H        ASP   8  -5.762  10.663   3.911
   54    HA   ASP   8           HA       ASP   8  -3.206   9.908   5.077
   55   1HB   ASP   8          1HB       ASP   8  -5.899   8.466   5.007
   56   2HB   ASP   8          2HB       ASP   8  -4.443   7.776   5.696
   57    H    CYS   9           H        CYS   9  -3.059   7.211   4.446
   58    HA   CYS   9           HA       CYS   9  -3.633   6.918   1.624
   59   1HB   CYS   9          1HB       CYS   9  -0.860   7.064   2.766
   60   2HB   CYS   9          2HB       CYS   9  -1.189   6.043   1.380
   61    H    LYS  10           H        LYS  10  -1.988   5.587   4.580
   62    HA   LYS  10           HA       LYS  10  -2.018   2.942   3.994
   63   1HB   LYS  10          1HB       LYS  10  -1.536   4.528   6.232
   64   2HB   LYS  10          2HB       LYS  10  -2.821   3.459   6.757
   65   1HG   LYS  10          1HG       LYS  10  -1.443   1.516   5.770
   66   2HG   LYS  10          2HG       LYS  10  -0.126   2.656   5.577
   67   1HD   LYS  10          1HD       LYS  10   0.458   2.282   7.734
   68   2HD   LYS  10          2HD       LYS  10  -1.040   3.039   8.238
   69   1HE   LYS  10          1HE       LYS  10  -2.221   0.863   8.122
   70   2HE   LYS  10          2HE       LYS  10  -0.778   0.083   7.504
   71   1HZ   LYS  10          1HZ       LYS  10  -1.079  -0.181   9.895
   72   2HZ   LYS  10          2HZ       LYS  10   0.333   0.560   9.541
   73   3HZ   LYS  10          3HZ       LYS  10  -0.926   1.431  10.111
   74    H    GLY  11           H        GLY  11  -4.701   4.759   5.646
   75   1HA   GLY  11          1HA       GLY  11  -6.505   2.604   5.642
   76   2HA   GLY  11          2HA       GLY  11  -6.894   4.303   5.824
   77    H    GLN  12           H        GLN  12  -5.784   5.215   3.264
   78    HA   GLN  12           HA       GLN  12  -8.010   4.442   1.654
   79   1HB   GLN  12          1HB       GLN  12  -5.856   6.541   1.524
   80   2HB   GLN  12          2HB       GLN  12  -6.676   6.119   0.033
   81   1HG   GLN  12          1HG       GLN  12  -8.225   6.792   2.568
   82   2HG   GLN  12          2HG       GLN  12  -7.692   8.041   1.461
   83   1HE2  GLN  12          1HE2      GLN  12  -9.224   8.685   0.171
   84   2HE2  GLN  12          2HE2      GLN  12 -10.448   7.718  -0.582
   85    H    CYS  13           H        CYS  13  -6.897   2.100   1.823
   86    HA   CYS  13           HA       CYS  13  -5.838   1.641  -0.784
   87   1HB   CYS  13          1HB       CYS  13  -4.068   1.365   1.628
   88   2HB   CYS  13          2HB       CYS  13  -3.866   0.298   0.253
   89    H    THR  14           H        THR  14  -8.273   0.908   0.200
   90    HA   THR  14           HA       THR  14  -7.975  -1.791   1.299
   91    HB   THR  14           HB       THR  14 -10.250   0.233   1.083
   92    HG1  THR  14           1HG      THR  14  -8.920   0.459   2.930
   93   1HG2  THR  14          1HG2      THR  14 -11.797  -1.428   1.333
   94   2HG2  THR  14          2HG2      THR  14 -10.516  -2.635   1.065
   95   3HG2  THR  14          3HG2      THR  14 -10.882  -2.078   2.715
   96    H    THR  15           H        THR  15  -9.180   0.019  -1.549
   97    HA   THR  15           HA       THR  15 -10.344  -2.235  -2.795
   98    HB   THR  15           HB       THR  15  -9.682   0.611  -3.396
   99    HG1  THR  15           1HG      THR  15 -11.894   0.358  -4.101
  100   1HG2  THR  15          1HG2      THR  15 -10.144  -1.422  -5.641
  101   2HG2  THR  15          2HG2      THR  15 -10.064   0.347  -5.821
  102   3HG2  THR  15          3HG2      THR  15  -8.607  -0.569  -5.366
  103    HA   PRO  16           HA       PRO  16  -6.150  -2.600  -4.906
  104   1HB   PRO  16          1HB       PRO  16  -3.990  -1.261  -3.900
  105   2HB   PRO  16          2HB       PRO  16  -4.952  -0.662  -5.236
  106   1HG   PRO  16          1HG       PRO  16  -4.920   0.245  -2.423
  107   2HG   PRO  16          2HG       PRO  16  -5.531   1.079  -3.838
  108   1HD   PRO  16          1HD       PRO  16  -7.082  -0.260  -1.830
  109   2HD   PRO  16          2HD       PRO  16  -7.684   0.473  -3.304
  110    H    CYS  17           H        CYS  17  -6.567  -2.570  -1.548
  111    HA   CYS  17           HA       CYS  17  -4.742  -4.859  -1.394
  112   1HB   CYS  17          1HB       CYS  17  -5.508  -3.124   0.948
  113   2HB   CYS  17          2HB       CYS  17  -4.240  -4.329   0.857
  114    H    GLU  18           H        GLU  18  -7.616  -4.694  -2.265
  115    HA   GLU  18           HA       GLU  18  -9.155  -5.564  -0.055
  116   1HB   GLU  18          1HB       GLU  18  -9.665  -4.602  -2.653
  117   2HB   GLU  18          2HB       GLU  18 -10.246  -6.255  -2.690
  118   1HG   GLU  18          1HG       GLU  18 -11.180  -5.352  -0.219
  119   2HG   GLU  18          2HG       GLU  18 -11.314  -3.916  -1.216
  120    HA   PRO  19           HA       PRO  19  -8.473  -9.745  -2.199
  121   1HB   PRO  19          1HB       PRO  19  -6.608  -9.968  -4.184
  122   2HB   PRO  19          2HB       PRO  19  -8.315  -9.731  -4.496
  123   1HG   PRO  19          1HG       PRO  19  -6.105  -7.780  -4.711
  124   2HG   PRO  19          2HG       PRO  19  -7.711  -7.701  -5.408
  125   1HD   PRO  19          1HD       PRO  19  -6.765  -6.271  -3.108
  126   2HD   PRO  19          2HD       PRO  19  -8.401  -6.281  -3.736
  127    H    LEU  20           H        LEU  20  -5.687  -7.727  -1.758
  128    HA   LEU  20           HA       LEU  20  -3.937  -9.806  -1.052
  129   1HB   LEU  20          1HB       LEU  20  -2.795  -7.933  -1.581
  130   2HB   LEU  20          2HB       LEU  20  -4.004  -6.855  -0.912
  131    HG   LEU  20           HG       LEU  20  -3.172  -7.636   1.400
  132   1HD1  LEU  20          1HD1      LEU  20  -1.333  -8.905   1.635
  133   2HD1  LEU  20          2HD1      LEU  20  -1.725  -9.453  -0.013
  134   3HD1  LEU  20          3HD1      LEU  20  -0.515  -8.172   0.234
  135   1HD2  LEU  20          1HD2      LEU  20  -1.002  -6.114   0.042
  136   2HD2  LEU  20          2HD2      LEU  20  -2.653  -5.454  -0.044
  137   3HD2  LEU  20          3HD2      LEU  20  -1.898  -5.760   1.539
  138    H    THR  21           H        THR  21  -5.644  -7.391   1.069
  139    HA   THR  21           HA       THR  21  -5.029  -8.519   3.478
  140    HB   THR  21           HB       THR  21  -7.386  -6.944   2.383
  141    HG1  THR  21           1HG      THR  21  -5.317  -5.919   2.801
  142   1HG2  THR  21          1HG2      THR  21  -7.406  -6.678   5.184
  143   2HG2  THR  21          2HG2      THR  21  -8.639  -7.521   4.216
  144   3HG2  THR  21          3HG2      THR  21  -7.290  -8.436   4.931
  145    H    ALA  22           H        ALA  22  -7.790  -9.395   1.315
  146    HA   ALA  22           HA       ALA  22  -8.923 -11.269   3.010
  147   1HB   ALA  22          1HB       ALA  22 -10.255 -10.713   1.203
  148   2HB   ALA  22          2HB       ALA  22  -8.894 -10.729   0.055
  149   3HB   ALA  22          3HB       ALA  22  -9.592 -12.262   0.630
  150    H    CYS  23           H        CYS  23  -6.077 -11.424   0.863
  151    HA   CYS  23           HA       CYS  23  -5.859 -14.222   0.875
  152   1HB   CYS  23          1HB       CYS  23  -4.719 -12.344  -0.592
  153   2HB   CYS  23          2HB       CYS  23  -3.458 -12.456   0.620
  154    H    LYS  24           H        LYS  24  -4.231 -11.571   2.765
  155    HA   LYS  24           HA       LYS  24  -2.722 -13.234   4.392
  156   1HB   LYS  24          1HB       LYS  24  -3.510 -10.410   4.297
  157   2HB   LYS  24          2HB       LYS  24  -3.273 -10.995   5.931
  158   1HG   LYS  24          1HG       LYS  24  -1.010 -11.487   5.587
  159   2HG   LYS  24          2HG       LYS  24  -1.219 -11.779   3.872
  160   1HD   LYS  24          1HD       LYS  24  -0.207  -9.709   3.716
  161   2HD   LYS  24          2HD       LYS  24  -1.860  -9.153   3.884
  162   1HE   LYS  24          1HE       LYS  24  -0.037  -9.588   6.291
  163   2HE   LYS  24          2HE       LYS  24  -0.115  -8.058   5.440
  164   1HZ   LYS  24          1HZ       LYS  24  -1.656  -7.939   7.162
  165   2HZ   LYS  24          2HZ       LYS  24  -2.569  -8.182   5.830
  166   3HZ   LYS  24          3HZ       LYS  24  -2.286  -9.415   6.863
  167    H    GLU  25           H        GLU  25  -6.052 -11.888   4.830
  168    HA   GLU  25           HA       GLU  25  -6.453 -12.877   7.354
  169   1HB   GLU  25          1HB       GLU  25  -8.013 -11.653   5.267
  170   2HB   GLU  25          2HB       GLU  25  -8.925 -13.018   5.879
  171   1HG   GLU  25          1HG       GLU  25  -7.609 -11.254   7.925
  172   2HG   GLU  25          2HG       GLU  25  -8.969 -10.569   7.057
  173    H    LYS  26           H        LYS  26  -7.824 -14.314   4.299
  174    HA   LYS  26           HA       LYS  26  -8.735 -16.639   5.260
  175   1HB   LYS  26          1HB       LYS  26  -8.500 -15.612   2.812
  176   2HB   LYS  26          2HB       LYS  26  -7.178 -16.756   2.708
  177   1HG   LYS  26          1HG       LYS  26  -9.514 -18.008   3.953
  178   2HG   LYS  26          2HG       LYS  26  -9.947 -17.307   2.406
  179   1HD   LYS  26          1HD       LYS  26  -7.722 -18.476   1.553
  180   2HD   LYS  26          2HD       LYS  26  -7.892 -19.455   2.997
  181   1HE   LYS  26          1HE       LYS  26  -9.405 -20.748   1.911
  182   2HE   LYS  26          2HE       LYS  26 -10.489 -19.373   1.824
  183   1HZ   LYS  26          1HZ       LYS  26  -9.519 -20.548  -0.299
  184   2HZ   LYS  26          2HZ       LYS  26  -9.896 -18.959  -0.285
  185   3HZ   LYS  26          3HZ       LYS  26  -8.343 -19.431  -0.102
  186    H    CYS  27           H        CYS  27  -5.295 -15.841   4.546
  187    HA   CYS  27           HA       CYS  27  -4.346 -18.426   5.073
  188   1HB   CYS  27          1HB       CYS  27  -2.944 -15.747   5.163
  189   2HB   CYS  27          2HB       CYS  27  -2.134 -17.296   5.289
  190    H    ALA  28           H        ALA  28  -4.421 -15.353   7.026
  191    HA   ALA  28           HA       ALA  28  -3.291 -16.136   9.322
  192   1HB   ALA  28          1HB       ALA  28  -5.834 -14.750   9.809
  193   2HB   ALA  28          2HB       ALA  28  -4.164 -14.189  10.062
  194   3HB   ALA  28          3HB       ALA  28  -4.916 -14.047   8.456
  195    H    GLU  29           H        GLU  29  -6.638 -16.932   8.221
  196    HA   GLU  29           HA       GLU  29  -7.357 -18.223  10.575
  197   1HB   GLU  29          1HB       GLU  29  -8.375 -18.176   7.741
  198   2HB   GLU  29          2HB       GLU  29  -8.987 -19.423   8.810
  199   1HG   GLU  29          1HG       GLU  29  -9.031 -16.428   9.417
  200   2HG   GLU  29          2HG       GLU  29 -10.402 -17.351   8.836
  201    H    SER  30           H        SER  30  -6.210 -19.542   7.384
  202    HA   SER  30           HA       SER  30  -6.183 -22.174   8.204
  203   1HB   SER  30          1HB       SER  30  -5.472 -20.675   5.887
  204   2HB   SER  30          2HB       SER  30  -4.057 -21.627   6.292
  205    HG   SER  30           HG       SER  30  -5.090 -23.466   5.804
  206    H    CYS  31           H        CYS  31  -4.030 -19.486   8.891
  207    HA   CYS  31           HA       CYS  31  -2.032 -21.357   9.922
  208   1HB   CYS  31          1HB       CYS  31  -1.829 -18.461   9.094
  209   2HB   CYS  31          2HB       CYS  31  -0.584 -19.268  10.028
  210    H    GLU  32           H        GLU  32  -4.290 -21.328  11.440
  211    HA   GLU  32           HA       GLU  32  -4.192 -19.188  13.322
  212   1HB   GLU  32          1HB       GLU  32  -6.018 -21.355  12.614
  213   2HB   GLU  32          2HB       GLU  32  -5.808 -21.276  14.352
  214   1HG   GLU  32          1HG       GLU  32  -6.179 -18.697  14.082
  215   2HG   GLU  32          2HG       GLU  32  -6.783 -19.084  12.483
  216    H    THR  33           H        THR  33  -2.981 -19.120  15.173
  217    HA   THR  33           HA       THR  33  -1.376 -19.750  16.607
  218    HB   THR  33           HB       THR  33  -2.197 -21.444  18.186
  219    HG1  THR  33           1HG      THR  33  -3.279 -23.153  17.276
  220   1HG2  THR  33          1HG2      THR  33  -4.734 -20.371  16.881
  221   2HG2  THR  33          2HG2      THR  33  -4.431 -20.684  18.606
  222   3HG2  THR  33          3HG2      THR  33  -3.655 -19.298  17.803
  223    H    SER  34           H        SER  34  -0.937 -20.588  13.811
  224    HA   SER  34           HA       SER  34   0.175 -23.198  14.008
  225   1HB   SER  34          1HB       SER  34  -0.498 -21.318  11.920
  226   2HB   SER  34          2HB       SER  34   1.174 -21.796  11.707
  227    HG   SER  34           HG       SER  34   0.541 -24.004  11.649
  228    H    ALA  35           H        ALA  35   2.498 -23.699  13.735
  229    HA   ALA  35           HA       ALA  35   4.135 -22.256  15.425
  230   1HB   ALA  35          1HB       ALA  35   4.675 -24.241  13.192
  231   2HB   ALA  35          2HB       ALA  35   5.967 -23.599  14.234
  232   3HB   ALA  35          3HB       ALA  35   4.633 -24.537  14.947
  233    H    ASP  36           H        ASP  36   4.787 -20.175  15.205
  234    HA   ASP  36           HA       ASP  36   5.676 -18.387  14.358
  235   1HB   ASP  36          1HB       ASP  36   6.398 -19.906  11.819
  236   2HB   ASP  36          2HB       ASP  36   7.196 -18.490  12.474
  237    H    LYS  37           H        LYS  37   3.142 -18.057  14.151
  238    HA   LYS  37           HA       LYS  37   1.670 -18.356  11.928
  239   1HB   LYS  37          1HB       LYS  37   1.317 -17.105  14.287
  240   2HB   LYS  37          2HB       LYS  37   1.471 -15.697  13.255
  241   1HG   LYS  37          1HG       LYS  37  -0.263 -16.800  11.697
  242   2HG   LYS  37          2HG       LYS  37  -0.526 -17.983  12.963
  243   1HD   LYS  37          1HD       LYS  37  -0.593 -15.200  13.968
  244   2HD   LYS  37          2HD       LYS  37  -1.810 -15.506  12.745
  245   1HE   LYS  37          1HE       LYS  37  -1.695 -17.756  14.600
  246   2HE   LYS  37          2HE       LYS  37  -1.889 -16.263  15.496
  247   1HZ   LYS  37          1HZ       LYS  37  -4.016 -16.919  14.920
  248   2HZ   LYS  37          2HZ       LYS  37  -3.685 -15.752  13.826
  249   3HZ   LYS  37          3HZ       LYS  37  -3.617 -17.324  13.389
  250    H    LYS  38           H        LYS  38   3.790 -15.474  12.581
  251    HA   LYS  38           HA       LYS  38   3.434 -14.106  10.299
  252   1HB   LYS  38          1HB       LYS  38   5.433 -14.279  12.354
  253   2HB   LYS  38          2HB       LYS  38   6.235 -14.084  10.808
  254   1HG   LYS  38          1HG       LYS  38   5.759 -11.863  11.646
  255   2HG   LYS  38          2HG       LYS  38   4.674 -12.149  10.300
  256   1HD   LYS  38          1HD       LYS  38   2.784 -12.332  11.667
  257   2HD   LYS  38          2HD       LYS  38   3.697 -12.921  13.042
  258   1HE   LYS  38          1HE       LYS  38   3.258 -10.754  13.770
  259   2HE   LYS  38          2HE       LYS  38   4.795 -10.485  12.971
  260   1HZ   LYS  38          1HZ       LYS  38   2.249 -10.209  11.547
  261   2HZ   LYS  38          2HZ       LYS  38   2.927  -8.965  12.359
  262   3HZ   LYS  38          3HZ       LYS  38   3.716  -9.645  11.102
  263    H    THR  39           H        THR  39   6.164 -16.485  10.640
  264    HA   THR  39           HA       THR  39   6.896 -16.614   8.034
  265    HB   THR  39           HB       THR  39   6.690 -18.974   9.976
  266    HG1  THR  39           1HG      THR  39   8.568 -16.752   9.578
  267   1HG2  THR  39          1HG2      THR  39   8.767 -19.712   8.918
  268   2HG2  THR  39          2HG2      THR  39   7.583 -19.434   7.619
  269   3HG2  THR  39          3HG2      THR  39   8.851 -18.227   7.941
  270    H    CYS  40           H        CYS  40   4.389 -18.753   9.557
  271    HA   CYS  40           HA       CYS  40   3.693 -20.170   7.377
  272   1HB   CYS  40          1HB       CYS  40   2.793 -20.371   9.714
  273   2HB   CYS  40          2HB       CYS  40   1.705 -19.044   9.356
  274    H    ARG  41           H        ARG  41   1.984 -17.133   8.460
  275    HA   ARG  41           HA       ARG  41   0.473 -16.793   6.261
  276   1HB   ARG  41          1HB       ARG  41   1.808 -14.707   8.051
  277   2HB   ARG  41          2HB       ARG  41   0.601 -14.282   6.854
  278   1HG   ARG  41          1HG       ARG  41  -0.774 -16.260   8.073
  279   2HG   ARG  41          2HG       ARG  41   0.274 -15.839   9.412
  280   1HD   ARG  41          1HD       ARG  41  -0.733 -13.393   8.209
  281   2HD   ARG  41          2HD       ARG  41  -2.083 -14.464   8.529
  282    HE   ARG  41           HE       ARG  41  -0.459 -14.544  10.839
  283   1HH1  ARG  41          2HH2      ARG  41  -2.322 -12.145   9.063
  284   2HH1  ARG  41          1HH2      ARG  41  -2.651 -11.178  10.462
  285   1HH2  ARG  41          2HH1      ARG  41  -0.893 -13.269  12.685
  286   2HH2  ARG  41          1HH1      ARG  41  -1.833 -11.822  12.536
  287    H    ARG  42           H        ARG  42   3.818 -15.513   6.871
  288    HA   ARG  42           HA       ARG  42   4.160 -14.019   4.683
  289   1HB   ARG  42          1HB       ARG  42   5.817 -15.189   6.652
  290   2HB   ARG  42          2HB       ARG  42   6.517 -15.733   5.140
  291   1HG   ARG  42          1HG       ARG  42   7.597 -13.699   5.252
  292   2HG   ARG  42          2HG       ARG  42   6.131 -13.133   4.477
  293   1HD   ARG  42          1HD       ARG  42   5.995 -13.277   7.459
  294   2HD   ARG  42          2HD       ARG  42   7.135 -12.104   6.830
  295    HE   ARG  42           HE       ARG  42   4.713 -11.815   5.358
  296   1HH1  ARG  42          2HH2      ARG  42   5.905 -11.338   8.634
  297   2HH1  ARG  42          1HH2      ARG  42   4.777 -10.075   8.998
  298   1HH2  ARG  42          2HH1      ARG  42   3.224 -10.149   5.837
  299   2HH2  ARG  42          1HH1      ARG  42   3.242  -9.394   7.396
  300    H    ASN  43           H        ASN  43   4.658 -17.607   4.956
  301    HA   ASN  43           HA       ASN  43   5.491 -17.952   2.339
  302   1HB   ASN  43          1HB       ASN  43   4.675 -19.626   4.619
  303   2HB   ASN  43          2HB       ASN  43   4.121 -20.322   3.110
  304   1HD2  ASN  43          1HD2      ASN  43   6.403 -20.710   5.199
  305   2HD2  ASN  43          2HD2      ASN  43   7.803 -21.037   4.233
  306    H    CYS  44           H        CYS  44   2.274 -17.933   3.963
  307    HA   CYS  44           HA       CYS  44   0.815 -18.917   1.784
  308   1HB   CYS  44          1HB       CYS  44   0.168 -18.685   4.280
  309   2HB   CYS  44          2HB       CYS  44  -0.309 -17.052   3.859
  310    H    LYS  45           H        LYS  45   2.328 -15.847   2.554
  311    HA   LYS  45           HA       LYS  45   0.630 -14.244   0.922
  312   1HB   LYS  45          1HB       LYS  45   2.502 -13.778   2.902
  313   2HB   LYS  45          2HB       LYS  45   3.337 -13.238   1.460
  314   1HG   LYS  45          1HG       LYS  45   0.712 -12.249   1.140
  315   2HG   LYS  45          2HG       LYS  45   1.045 -12.025   2.846
  316   1HD   LYS  45          1HD       LYS  45   3.370 -11.270   1.226
  317   2HD   LYS  45          2HD       LYS  45   1.942 -10.397   0.707
  318   1HE   LYS  45          1HE       LYS  45   1.907  -9.119   2.597
  319   2HE   LYS  45          2HE       LYS  45   2.110 -10.512   3.641
  320   1HZ   LYS  45          1HZ       LYS  45   4.494 -10.087   2.288
  321   2HZ   LYS  45          2HZ       LYS  45   4.019  -8.651   2.903
  322   3HZ   LYS  45          3HZ       LYS  45   4.204  -9.940   3.888
  323    H    LYS  46           H        LYS  46   3.167 -16.534   0.348
  324    HA   LYS  46           HA       LYS  46   3.803 -15.327  -2.227
  325   1HB   LYS  46          1HB       LYS  46   5.702 -16.008  -0.914
  326   2HB   LYS  46          2HB       LYS  46   5.035 -17.608  -0.662
  327   1HG   LYS  46          1HG       LYS  46   6.511 -18.015  -2.434
  328   2HG   LYS  46          2HG       LYS  46   5.013 -17.746  -3.303
  329   1HD   LYS  46          1HD       LYS  46   6.522 -16.361  -4.468
  330   2HD   LYS  46          2HD       LYS  46   5.743 -15.229  -3.380
  331   1HE   LYS  46          1HE       LYS  46   8.101 -14.785  -3.208
  332   2HE   LYS  46          2HE       LYS  46   7.667 -15.628  -1.734
  333   1HZ   LYS  46          1HZ       LYS  46   8.400 -17.388  -3.845
  334   2HZ   LYS  46          2HZ       LYS  46   9.606 -16.368  -3.430
  335   3HZ   LYS  46          3HZ       LYS  46   8.931 -17.338  -2.302
  336    H    ALA  47           H        ALA  47   1.866 -17.829  -0.709
  337    HA   ALA  47           HA       ALA  47   1.629 -19.716  -2.645
  338   1HB   ALA  47          1HB       ALA  47  -0.010 -18.632  -0.449
  339   2HB   ALA  47          2HB       ALA  47  -0.971 -19.388  -1.743
  340   3HB   ALA  47          3HB       ALA  47   0.300 -20.321  -0.917
  341    H    ASP  48           H        ASP  48  -0.471 -16.754  -2.362
  342    HA   ASP  48           HA       ASP  48  -0.337 -16.415  -5.177
  343   1HB   ASP  48          1HB       ASP  48  -2.208 -18.200  -4.584
  344   2HB   ASP  48          2HB       ASP  48  -3.123 -16.808  -4.041
  345    H    CYS  49           H        CYS  49   0.455 -14.817  -2.955
  346    HA   CYS  49           HA       CYS  49  -1.550 -12.688  -3.082
  347   1HB   CYS  49          1HB       CYS  49   0.156 -12.957  -0.647
  348   2HB   CYS  49          2HB       CYS  49  -1.413 -12.201  -0.842
  349    H    GLU  50           H        GLU  50   0.936 -13.435  -4.674
  350    HA   GLU  50           HA       GLU  50   2.923 -11.605  -3.788
  351   1HB   GLU  50          1HB       GLU  50   2.638 -13.683  -5.858
  352   2HB   GLU  50          2HB       GLU  50   3.525 -12.287  -6.437
  353   1HG   GLU  50          1HG       GLU  50   4.630 -12.640  -3.913
  354   2HG   GLU  50          2HG       GLU  50   4.293 -14.295  -4.384
  355    HA   PRO  51           HA       PRO  51   1.157  -9.220  -7.497
  356   1HB   PRO  51          1HB       PRO  51  -1.216 -10.002  -8.603
  357   2HB   PRO  51          2HB       PRO  51   0.343 -10.466  -9.254
  358   1HG   PRO  51          1HG       PRO  51  -1.577 -12.094  -7.704
  359   2HG   PRO  51          2HG       PRO  51  -0.245 -12.629  -8.710
  360   1HD   PRO  51          1HD       PRO  51  -0.299 -12.531  -5.844
  361   2HD   PRO  51          2HD       PRO  51   1.070 -12.955  -6.852
  362    H    GLN  52           H        GLN  52  -1.305 -10.557  -5.399
  363    HA   GLN  52           HA       GLN  52  -2.902  -8.307  -5.378
  364   1HB   GLN  52          1HB       GLN  52  -2.449 -10.421  -3.227
  365   2HB   GLN  52          2HB       GLN  52  -3.752  -9.250  -3.189
  366   1HG   GLN  52          1HG       GLN  52  -4.672 -10.120  -5.299
  367   2HG   GLN  52          2HG       GLN  52  -3.300 -11.190  -5.503
  368   1HE2  GLN  52          1HE2      GLN  52  -5.273 -12.637  -5.673
  369   2HE2  GLN  52          2HE2      GLN  52  -5.792 -13.444  -4.231
  370    H    ASP  53           H        ASP  53  -0.128  -9.282  -3.269
  371    HA   ASP  53           HA       ASP  53  -0.336  -7.182  -1.504
  372   1HB   ASP  53          1HB       ASP  53   1.156  -9.293  -1.414
  373   2HB   ASP  53          2HB       ASP  53   2.274  -8.438  -2.457
  374    H    LYS  54           H        LYS  54   1.365  -7.572  -4.669
  375    HA   LYS  54           HA       LYS  54   2.843  -5.233  -4.638
  376   1HB   LYS  54          1HB       LYS  54   1.709  -6.956  -6.837
  377   2HB   LYS  54          2HB       LYS  54   2.596  -5.492  -7.209
  378   1HG   LYS  54          1HG       LYS  54   4.548  -6.313  -5.906
  379   2HG   LYS  54          2HG       LYS  54   3.661  -7.754  -5.452
  380   1HD   LYS  54          1HD       LYS  54   3.368  -8.002  -8.112
  381   2HD   LYS  54          2HD       LYS  54   4.802  -6.995  -8.141
  382   1HE   LYS  54          1HE       LYS  54   5.960  -8.627  -6.616
  383   2HE   LYS  54          2HE       LYS  54   4.532  -9.642  -6.634
  384   1HZ   LYS  54          1HZ       LYS  54   6.517  -9.857  -8.364
  385   2HZ   LYS  54          2HZ       LYS  54   4.993 -10.346  -8.684
  386   3HZ   LYS  54          3HZ       LYS  54   5.515  -8.895  -9.223
  387    H    VAL  55           H        VAL  55  -0.472  -5.841  -5.993
  388    HA   VAL  55           HA       VAL  55  -1.009  -3.347  -6.923
  389    HB   VAL  55           HB       VAL  55  -2.752  -5.397  -5.560
  390   1HG1  VAL  55          1HG1      VAL  55  -3.771  -3.053  -7.187
  391   2HG1  VAL  55          2HG1      VAL  55  -4.713  -4.242  -6.257
  392   3HG1  VAL  55          3HG1      VAL  55  -3.702  -3.047  -5.409
  393   1HG2  VAL  55          1HG2      VAL  55  -3.505  -5.811  -7.908
  394   2HG2  VAL  55          2HG2      VAL  55  -2.264  -4.663  -8.465
  395   3HG2  VAL  55          3HG2      VAL  55  -1.782  -6.161  -7.634
  396    H    CYS  56           H        CYS  56  -0.897  -4.492  -3.541
  397    HA   CYS  56           HA       CYS  56  -2.190  -2.314  -2.394
  398   1HB   CYS  56          1HB       CYS  56  -1.456  -4.599  -1.397
  399   2HB   CYS  56          2HB       CYS  56   0.053  -3.784  -1.039
  400    H    ASP  57           H        ASP  57   1.380  -3.050  -2.554
  401    HA   ASP  57           HA       ASP  57   2.372  -0.781  -1.634
  402   1HB   ASP  57          1HB       ASP  57   3.547  -2.848  -2.703
  403   2HB   ASP  57          2HB       ASP  57   3.431  -1.985  -4.223
  404    H    ALA  58           H        ALA  58   1.463  -1.415  -5.109
  405    HA   ALA  58           HA       ALA  58   2.094   0.919  -6.277
  406   1HB   ALA  58          1HB       ALA  58   0.684   0.239  -7.968
  407   2HB   ALA  58          2HB       ALA  58   0.764  -1.277  -7.040
  408   3HB   ALA  58          3HB       ALA  58  -0.632  -0.190  -6.848
  409    H    CYS  59           H        CYS  59  -0.974   0.255  -4.449
  410    HA   CYS  59           HA       CYS  59  -2.107   2.724  -4.758
  411   1HB   CYS  59          1HB       CYS  59  -3.330   0.882  -3.831
  412   2HB   CYS  59          2HB       CYS  59  -2.255   0.780  -2.451
  413    H    ARG  60           H        ARG  60  -0.017   1.515  -2.027
  414    HA   ARG  60           HA       ARG  60   0.114   3.893  -0.693
  415   1HB   ARG  60          1HB       ARG  60   2.176   1.643  -0.910
  416   2HB   ARG  60          2HB       ARG  60   2.286   2.936   0.268
  417   1HG   ARG  60          1HG       ARG  60  -0.214   2.210   0.857
  418   2HG   ARG  60          2HG       ARG  60   0.249   0.705   0.088
  419   1HD   ARG  60          1HD       ARG  60   2.434   1.302   1.775
  420   2HD   ARG  60          2HD       ARG  60   1.033   1.767   2.720
  421    HE   ARG  60           HE       ARG  60   0.423  -0.749   1.576
  422   1HH1  ARG  60          2HH2      ARG  60   2.760   0.587   3.842
  423   2HH1  ARG  60          1HH2      ARG  60   2.946  -0.894   4.722
  424   1HH2  ARG  60          2HH1      ARG  60   0.668  -2.703   2.736
  425   2HH2  ARG  60          1HH1      ARG  60   1.747  -2.778   4.088
  426    H    MET  61           H        MET  61   1.802   2.758  -3.599
  427    HA   MET  61           HA       MET  61   3.857   4.704  -3.447
  428   1HB   MET  61          1HB       MET  61   4.389   2.735  -4.699
  429   2HB   MET  61          2HB       MET  61   2.831   2.709  -5.501
  430   1HG   MET  61          1HG       MET  61   3.530   4.110  -7.178
  431   2HG   MET  61          2HG       MET  61   4.370   5.176  -6.069
  432   1HE   MET  61          1HE       MET  61   5.834   1.673  -8.452
  433   2HE   MET  61          2HE       MET  61   4.226   2.428  -8.334
  434   3HE   MET  61          3HE       MET  61   5.547   3.272  -9.178
  435    H    LYS  62           H        LYS  62   0.778   4.322  -5.313
  436    HA   LYS  62           HA       LYS  62   1.107   6.722  -6.759
  437   1HB   LYS  62          1HB       LYS  62  -0.699   4.526  -6.682
  438   2HB   LYS  62          2HB       LYS  62  -1.656   5.980  -6.483
  439   1HG   LYS  62          1HG       LYS  62  -1.530   6.148  -8.757
  440   2HG   LYS  62          2HG       LYS  62   0.081   6.778  -8.475
  441   1HD   LYS  62          1HD       LYS  62  -0.485   3.798  -8.797
  442   2HD   LYS  62          2HD       LYS  62  -0.095   4.837 -10.153
  443   1HE   LYS  62          1HE       LYS  62   1.848   5.341  -8.078
  444   2HE   LYS  62          2HE       LYS  62   1.712   3.604  -8.267
  445   1HZ   LYS  62          1HZ       LYS  62   2.675   5.561 -10.132
  446   2HZ   LYS  62          2HZ       LYS  62   3.107   3.997  -9.945
  447   3HZ   LYS  62          3HZ       LYS  62   1.762   4.378 -10.790
  448    H    CYS  63           H        CYS  63  -0.977   5.863  -3.906
  449    HA   CYS  63           HA       CYS  63  -2.114   8.238  -3.433
  450   1HB   CYS  63          1HB       CYS  63  -2.340   6.078  -2.134
  451   2HB   CYS  63          2HB       CYS  63  -0.914   6.553  -1.232
  452    H    HIS  64           H        HIS  64   1.206   7.173  -2.419
  453    HA   HIS  64           HA       HIS  64   1.989   9.316  -0.981
  454   1HB   HIS  64          1HB       HIS  64   3.192   7.091  -2.119
  455   2HB   HIS  64          2HB       HIS  64   4.058   8.424  -2.857
  456    HD1  HIS  64           1HD      HIS  64   5.485   6.547  -0.858
  457    HD2  HIS  64           2HD      HIS  64   3.637  10.155   0.219
  458    HE1  HIS  64           1HE      HIS  64   6.581   7.288   1.324
  459    H    LYS  65           H        LYS  65   2.097   8.987  -4.591
  460    HA   LYS  65           HA       LYS  65   3.047  11.654  -4.911
  461   1HB   LYS  65          1HB       LYS  65   3.744  10.371  -6.662
  462   2HB   LYS  65          2HB       LYS  65   2.309   9.366  -6.661
  463   1HG   LYS  65          1HG       LYS  65   0.985  11.237  -7.648
  464   2HG   LYS  65          2HG       LYS  65   2.403  12.266  -7.622
  465   1HD   LYS  65          1HD       LYS  65   2.960   9.700  -8.949
  466   2HD   LYS  65          2HD       LYS  65   1.621  10.536  -9.709
  467   1HE   LYS  65          1HE       LYS  65   4.232  11.965  -9.058
  468   2HE   LYS  65          2HE       LYS  65   4.012  11.092 -10.562
  469   1HZ   LYS  65          1HZ       LYS  65   2.672  13.497  -9.644
  470   2HZ   LYS  65          2HZ       LYS  65   3.285  13.150 -11.118
  471   3HZ   LYS  65          3HZ       LYS  65   1.860  12.502 -10.653
  472    H    ALA  66           H        ALA  66  -0.123   9.979  -5.478
  473    HA   ALA  66           HA       ALA  66  -1.593  12.055  -6.385
  474   1HB   ALA  66          1HB       ALA  66  -3.239  10.722  -4.514
  475   2HB   ALA  66          2HB       ALA  66  -3.052  10.351  -6.245
  476   3HB   ALA  66          3HB       ALA  66  -2.038   9.519  -5.042
  477    H    CYS  67           H        CYS  67  -0.723  11.331  -2.950
  478    HA   CYS  67           HA       CYS  67  -2.227  13.349  -1.809
  479   1HB   CYS  67          1HB       CYS  67  -1.322  11.639  -0.438
  480   2HB   CYS  67          2HB       CYS  67   0.319  11.983  -0.947
  481    H    ARG  68           H        ARG  68   1.335  13.299  -2.601
  482    HA   ARG  68           HA       ARG  68   1.966  15.802  -2.001
  483   1HB   ARG  68          1HB       ARG  68   3.595  14.184  -2.891
  484   2HB   ARG  68          2HB       ARG  68   2.825  14.207  -4.465
  485   1HG   ARG  68          1HG       ARG  68   3.384  16.928  -3.901
  486   2HG   ARG  68          2HG       ARG  68   4.801  16.060  -3.344
  487   1HD   ARG  68          1HD       ARG  68   3.611  15.435  -6.068
  488   2HD   ARG  68          2HD       ARG  68   4.668  16.818  -5.868
  489    HE   ARG  68           HE       ARG  68   6.071  14.752  -4.652
  490   1HH1  ARG  68          2HH2      ARG  68   4.646  15.216  -7.836
  491   2HH1  ARG  68          1HH2      ARG  68   5.796  14.201  -8.639
  492   1HH2  ARG  68          2HH1      ARG  68   7.590  13.413  -5.712
  493   2HH2  ARG  68          1HH1      ARG  68   7.482  13.169  -7.423
  494    H    ALA  69           H        ALA  69   0.821  14.750  -5.302
  495    HA   ALA  69           HA       ALA  69   0.630  17.315  -6.359
  496   1HB   ALA  69          1HB       ALA  69  -0.978  16.127  -7.972
  497   2HB   ALA  69          2HB       ALA  69   0.660  15.444  -7.830
  498   3HB   ALA  69          3HB       ALA  69  -0.704  14.665  -6.994
  499    H    ALA  70           H        ALA  70  -1.533  15.416  -4.263
  500    HA   ALA  70           HA       ALA  70  -3.783  17.123  -4.687
  501   1HB   ALA  70          1HB       ALA  70  -3.048  14.822  -2.889
  502   2HB   ALA  70          2HB       ALA  70  -4.461  15.824  -2.481
  503   3HB   ALA  70          3HB       ALA  70  -4.393  14.975  -4.044
  504    H    ASN  71           H        ASN  71  -2.691  16.413  -1.382
  505    HA   ASN  71           HA       ASN  71  -3.296  18.723  -0.284
  506   1HB   ASN  71          1HB       ASN  71  -1.151  16.696   0.248
  507   2HB   ASN  71          2HB       ASN  71  -0.940  18.229   1.068
  508   1HD2  ASN  71          1HD2      ASN  71  -2.959  15.419   0.649
  509   2HD2  ASN  71          2HD2      ASN  71  -3.948  15.607   2.058
  510    H    CYS  72           H        CYS  72   0.186  18.001  -1.095
  511    HA   CYS  72           HA       CYS  72   0.855  20.742  -1.133
  512   1HB   CYS  72          1HB       CYS  72   2.403  18.340  -2.128
  513   2HB   CYS  72          2HB       CYS  72   3.053  19.956  -1.931
  514    H    ALA  73           H        ALA  73   2.136  21.572  -3.237
  515    HA   ALA  73           HA       ALA  73   1.430  20.614  -5.749
  516   1HB   ALA  73          1HB       ALA  73  -0.831  21.544  -4.634
  517   2HB   ALA  73          2HB       ALA  73  -0.183  23.086  -5.243
  518   3HB   ALA  73          3HB       ALA  73  -0.480  21.738  -6.368
  519    H    SER  74           H        SER  74   1.897  23.594  -3.746
  520    HA   SER  74           HA       SER  74   3.482  24.725  -5.854
  521   1HB   SER  74          1HB       SER  74   2.001  25.709  -3.581
  522   2HB   SER  74          2HB       SER  74   3.659  26.253  -3.422
  523    HG   SER  74           HG       SER  74   3.395  27.607  -5.066
  524    H    GLU  75           H        GLU  75   3.840  23.099  -2.703
  525    HA   GLU  75           HA       GLU  75   6.543  23.833  -2.371
  526   1HB   GLU  75          1HB       GLU  75   4.937  21.564  -1.114
  527   2HB   GLU  75          2HB       GLU  75   6.511  22.102  -0.564
  528   1HG   GLU  75          1HG       GLU  75   4.217  24.078  -0.804
  529   2HG   GLU  75          2HG       GLU  75   4.353  23.050   0.608
  530    H    CYS  76           H        CYS  76   4.913  21.641  -4.453
  531    HA   CYS  76           HA       CYS  76   7.471  20.411  -5.092
  532   1HB   CYS  76          1HB       CYS  76   5.050  18.661  -5.124
  533   2HB   CYS  76          2HB       CYS  76   6.745  18.227  -5.031
  534    HA   PRO  77           HA       PRO  77   5.622  21.862  -8.852
  535   1HB   PRO  77          1HB       PRO  77   7.928  22.000 -10.312
  536   2HB   PRO  77          2HB       PRO  77   7.349  23.316  -9.311
  537   1HG   PRO  77          1HG       PRO  77   9.571  21.435  -8.797
  538   2HG   PRO  77          2HG       PRO  77   9.248  22.985  -8.045
  539   1HD   PRO  77          1HD       PRO  77   8.767  20.394  -6.912
  540   2HD   PRO  77          2HD       PRO  77   8.338  21.941  -6.209
  541    H    LYS  78           H        LYS  78   6.211  21.193 -11.371
  542    HA   LYS  78           HA       LYS  78   5.128  18.645 -11.538
  543   1HB   LYS  78          1HB       LYS  78   6.011  20.733 -13.319
  544   2HB   LYS  78          2HB       LYS  78   6.558  19.183 -13.926
  545   1HG   LYS  78          1HG       LYS  78   3.975  18.568 -13.135
  546   2HG   LYS  78          2HG       LYS  78   3.787  20.234 -13.645
  547   1HD   LYS  78          1HD       LYS  78   3.512  19.243 -15.711
  548   2HD   LYS  78          2HD       LYS  78   5.260  19.368 -15.740
  549   1HE   LYS  78          1HE       LYS  78   5.575  17.090 -15.427
  550   2HE   LYS  78          2HE       LYS  78   4.158  16.918 -14.411
  551   1HZ   LYS  78          1HZ       LYS  78   3.548  15.917 -16.362
  552   2HZ   LYS  78          2HZ       LYS  78   2.904  17.404 -16.564
  553   3HZ   LYS  78          3HZ       LYS  78   4.295  17.007 -17.321
  554    H    HIS  79           H        HIS  79   8.518  19.621 -12.430
  555    HA   HIS  79           HA       HIS  79   9.292  16.892 -11.706
  556   1HB   HIS  79          1HB       HIS  79  10.767  18.813 -13.523
  557   2HB   HIS  79          2HB       HIS  79  11.133  17.121 -13.250
  558    HD1  HIS  79           1HD      HIS  79  10.343  18.551 -16.049
  559    HD2  HIS  79           2HD      HIS  79   7.893  16.114 -13.672
  560    HE1  HIS  79           1HE      HIS  79   8.554  17.605 -17.603
  561    H    GLU  80           H        GLU  80  10.474  16.637  -9.880
  562    HA   GLU  80           HA       GLU  80  12.084  18.915  -9.056
  563   1HB   GLU  80          1HB       GLU  80  11.407  18.618  -6.724
  564   2HB   GLU  80          2HB       GLU  80   9.985  18.884  -7.714
  565   1HG   GLU  80          1HG       GLU  80  10.076  16.172  -7.856
  566   2HG   GLU  80          2HG       GLU  80  10.889  16.381  -6.318
  567    H    HIS  81           H        HIS  81  13.134  17.699  -6.677
  568    HA   HIS  81           HA       HIS  81  14.068  15.089  -7.341
  569   1HB   HIS  81          1HB       HIS  81  16.432  15.642  -7.537
  570   2HB   HIS  81          2HB       HIS  81  15.500  16.372  -8.829
  571    HD1  HIS  81           1HD      HIS  81  18.278  17.500  -8.059
  572    HD2  HIS  81           2HD      HIS  81  14.649  18.938  -6.524
  573    HE1  HIS  81           1HE      HIS  81  18.726  19.890  -7.286
  574    H    LYS  82           H        LYS  82  12.775  15.087  -5.248
  575    HA   LYS  82           HA       LYS  82  12.667  14.982  -3.045
  576   1HB   LYS  82          1HB       LYS  82  15.499  14.384  -3.672
  577   2HB   LYS  82          2HB       LYS  82  15.176  14.800  -2.001
  578   1HG   LYS  82          1HG       LYS  82  13.289  13.093  -2.005
  579   2HG   LYS  82          2HG       LYS  82  13.780  12.618  -3.618
  580   1HD   LYS  82          1HD       LYS  82  15.863  12.670  -1.425
  581   2HD   LYS  82          2HD       LYS  82  14.721  11.341  -1.468
  582   1HE   LYS  82          1HE       LYS  82  15.409  11.288  -4.071
  583   2HE   LYS  82          2HE       LYS  82  16.855  12.077  -3.471
  584   1HZ   LYS  82          1HZ       LYS  82  16.081   9.862  -1.873
  585   2HZ   LYS  82          2HZ       LYS  82  16.378   9.431  -3.420
  586   3HZ   LYS  82          3HZ       LYS  82  17.529  10.198  -2.550
  587    H    SER  83           H        SER  83  12.012  17.406  -3.686
  588    HA   SER  83           HA       SER  83  13.784  19.402  -2.850
  589   1HB   SER  83          1HB       SER  83  12.168  20.295  -4.232
  590   2HB   SER  83          2HB       SER  83  10.916  19.214  -3.654
  591    HG   SER  83           HG       SER  83  11.879  21.649  -2.453
  592    H    ASP  84           H        ASP  84  13.941  20.532  -0.857
  593    HA   ASP  84           HA       ASP  84  13.318  19.038   1.400
  594   1HB   ASP  84          1HB       ASP  84  13.912  22.029   1.273
  595   2HB   ASP  84          2HB       ASP  84  14.155  20.979   2.656
  596    H    THR  85           H        THR  85  12.037  22.197   0.102
  597    HA   THR  85           HA       THR  85  10.079  22.607   2.026
  598    HB   THR  85           HB       THR  85  11.087  23.991  -0.091
  599    HG1  THR  85           1HG      THR  85   9.866  25.056   1.493
  600   1HG2  THR  85          1HG2      THR  85   9.788  22.678  -1.795
  601   2HG2  THR  85          2HG2      THR  85   8.285  23.071  -0.926
  602   3HG2  THR  85          3HG2      THR  85   9.226  24.365  -1.705
  603    H    CYS  86           H        CYS  86  10.260  20.204  -0.486
  604    HA   CYS  86           HA       CYS  86   7.425  19.849  -0.632
  605   1HB   CYS  86          1HB       CYS  86   8.970  19.389  -2.525
  606   2HB   CYS  86          2HB       CYS  86   9.649  18.051  -1.619
  607    H    ARG  87           H        ARG  87  10.222  17.790   0.488
  608    HA   ARG  87           HA       ARG  87   8.758  15.883   1.714
  609   1HB   ARG  87          1HB       ARG  87  11.462  17.042   2.552
  610   2HB   ARG  87          2HB       ARG  87  10.825  15.529   3.163
  611   1HG   ARG  87          1HG       ARG  87  10.588  14.837   0.650
  612   2HG   ARG  87          2HG       ARG  87  11.635  16.200   0.310
  613   1HD   ARG  87          1HD       ARG  87  13.135  14.361   0.535
  614   2HD   ARG  87          2HD       ARG  87  13.263  15.202   2.067
  615    HE   ARG  87           HE       ARG  87  11.193  13.141   2.097
  616   1HH1  ARG  87          2HH2      ARG  87  14.638  13.739   2.494
  617   2HH1  ARG  87          1HH2      ARG  87  14.898  12.337   3.477
  618   1HH2  ARG  87          2HH1      ARG  87  11.536  11.291   3.394
  619   2HH2  ARG  87          1HH1      ARG  87  13.121  10.935   3.993
  620    H    ALA  88           H        ALA  88   9.396  19.203   2.731
  621    HA   ALA  88           HA       ALA  88   8.717  18.744   5.482
  622   1HB   ALA  88          1HB       ALA  88   8.550  21.472   4.993
  623   2HB   ALA  88          2HB       ALA  88  10.013  20.596   5.502
  624   3HB   ALA  88          3HB       ALA  88   9.725  20.919   3.776
  625    H    CYS  89           H        CYS  89   7.120  19.824   2.462
  626    HA   CYS  89           HA       CYS  89   4.775  20.718   3.747
  627   1HB   CYS  89          1HB       CYS  89   5.276  21.576   1.595
  628   2HB   CYS  89          2HB       CYS  89   5.425  19.975   0.898
  629    H    MET  90           H        MET  90   5.640  17.725   1.857
  630    HA   MET  90           HA       MET  90   3.235  16.444   2.311
  631   1HB   MET  90          1HB       MET  90   6.066  15.593   1.598
  632   2HB   MET  90          2HB       MET  90   4.879  14.347   1.929
  633   1HG   MET  90          1HG       MET  90   3.932  16.496   0.088
  634   2HG   MET  90          2HG       MET  90   5.254  15.533  -0.540
  635   1HE   MET  90          1HE       MET  90   5.423  13.187  -0.527
  636   2HE   MET  90          2HE       MET  90   4.499  12.374   0.759
  637   3HE   MET  90          3HE       MET  90   4.082  12.096  -0.949
  638    H    LYS  91           H        LYS  91   6.132  16.816   4.324
  639    HA   LYS  91           HA       LYS  91   5.704  14.640   6.030
  640   1HB   LYS  91          1HB       LYS  91   7.832  15.548   6.139
  641   2HB   LYS  91          2HB       LYS  91   7.256  17.202   6.156
  642   1HG   LYS  91          1HG       LYS  91   6.409  16.936   8.458
  643   2HG   LYS  91          2HG       LYS  91   6.817  15.232   8.447
  644   1HD   LYS  91          1HD       LYS  91   9.131  15.635   8.584
  645   2HD   LYS  91          2HD       LYS  91   9.008  17.221   7.851
  646   1HE   LYS  91          1HE       LYS  91   7.862  18.074   9.922
  647   2HE   LYS  91          2HE       LYS  91   8.033  16.492  10.655
  648   1HZ   LYS  91          1HZ       LYS  91  10.473  16.773  10.205
  649   2HZ   LYS  91          2HZ       LYS  91  10.166  18.347   9.895
  650   3HZ   LYS  91          3HZ       LYS  91   9.843  17.727  11.372
  651    H    THR  92           H        THR  92   4.590  18.077   6.133
  652    HA   THR  92           HA       THR  92   3.084  17.559   8.546
  653    HB   THR  92           HB       THR  92   3.597  19.945   6.717
  654    HG1  THR  92           1HG      THR  92   4.861  20.449   8.531
  655   1HG2  THR  92          1HG2      THR  92   1.232  19.603   8.244
  656   2HG2  THR  92          2HG2      THR  92   2.320  20.540   9.296
  657   3HG2  THR  92          3HG2      THR  92   1.904  21.151   7.677
  658    H    ASN  93           H        ASN  93   2.269  18.557   5.151
  659    HA   ASN  93           HA       ASN  93  -0.434  18.339   5.480
  660   1HB   ASN  93          1HB       ASN  93   1.459  18.154   3.130
  661   2HB   ASN  93          2HB       ASN  93  -0.208  17.685   2.857
  662   1HD2  ASN  93          1HD2      ASN  93   1.751  20.243   4.361
  663   2HD2  ASN  93          2HD2      ASN  93   0.750  21.583   3.913
  664    H    CYS  94           H        CYS  94   1.744  15.985   3.728
  665    HA   CYS  94           HA       CYS  94  -0.194  13.931   3.848
  666   1HB   CYS  94          1HB       CYS  94   2.047  14.427   2.341
  667   2HB   CYS  94          2HB       CYS  94   2.594  13.125   3.379
  668    H    LYS  95           H        LYS  95  -0.528  14.194   6.291
  669    HA   LYS  95           HA       LYS  95   1.291  13.799   8.228
  670   1HB   LYS  95          1HB       LYS  95  -1.395  13.984   8.150
  671   2HB   LYS  95          2HB       LYS  95  -1.253  12.276   8.514
  672   1HG   LYS  95          1HG       LYS  95   0.659  13.570  10.185
  673   2HG   LYS  95          2HG       LYS  95  -0.777  14.572  10.256
  674   1HD   LYS  95          1HD       LYS  95  -1.978  12.996  11.405
  675   2HD   LYS  95          2HD       LYS  95  -1.385  11.678  10.414
  676   1HE   LYS  95          1HE       LYS  95   0.328  13.040  12.541
  677   2HE   LYS  95          2HE       LYS  95  -0.665  11.637  12.881
  678   1HZ   LYS  95          1HZ       LYS  95   1.097  11.469  10.596
  679   2HZ   LYS  95          2HZ       LYS  95   1.796  11.431  12.071
  680   3HZ   LYS  95          3HZ       LYS  95   0.674  10.315  11.670
  Start of MODEL    2
    1   1H    ILE   1           H        ILE   1 -12.956  16.418  13.264
    2    HA   ILE   1           HA       ILE   1 -13.519  17.706  10.741
    3    HB   ILE   1           HB       ILE   1 -15.306  18.504  12.238
    4   1HG1  ILE   1          1HG1      ILE   1 -14.247  21.056  12.048
    5   2HG1  ILE   1          2HG1      ILE   1 -13.340  20.172  10.837
    6   1HG2  ILE   1          1HG2      ILE   1 -13.796  18.331  14.317
    7   2HG2  ILE   1          2HG2      ILE   1 -13.211  19.947  13.852
    8   3HG2  ILE   1          3HG2      ILE   1 -14.936  19.694  14.210
    9   1HD1  ILE   1          1HD1      ILE   1 -15.773  19.193  10.235
   10   2HD1  ILE   1          2HD1      ILE   1 -16.292  20.726  10.977
   11   3HD1  ILE   1          3HD1      ILE   1 -15.200  20.742   9.571
   12    H    SER   2           H        SER   2 -11.812  19.055  10.064
   13    HA   SER   2           HA       SER   2  -9.801  19.835  11.859
   14   1HB   SER   2          1HB       SER   2  -8.959  17.622  11.865
   15   2HB   SER   2          2HB       SER   2  -9.346  17.362  10.176
   16    HG   SER   2           HG       SER   2  -7.173  18.857  11.319
   17    H    GLU   3           H        GLU   3  -7.949  20.943  10.618
   18    HA   GLU   3           HA       GLU   3  -9.052  21.935   8.110
   19   1HB   GLU   3          1HB       GLU   3  -7.980  23.259  10.431
   20   2HB   GLU   3          2HB       GLU   3  -6.911  23.599   9.085
   21   1HG   GLU   3          1HG       GLU   3  -8.408  25.205   8.486
   22   2HG   GLU   3          2HG       GLU   3  -9.422  23.894   7.916
   23    H    PHE   4           H        PHE   4  -5.839  21.380   9.739
   24    HA   PHE   4           HA       PHE   4  -4.790  20.683   7.090
   25   1HB   PHE   4          1HB       PHE   4  -3.896  22.237   9.454
   26   2HB   PHE   4          2HB       PHE   4  -2.709  21.024   9.018
   27    HD1  PHE   4           1HD      PHE   4  -4.118  24.221   8.197
   28    HD2  PHE   4           2HD      PHE   4  -1.782  21.027   6.665
   29    HE1  PHE   4           1HE      PHE   4  -3.242  25.728   6.391
   30    HE2  PHE   4           2HE      PHE   4  -0.906  22.533   4.859
   31    HZ   PHE   4           HZ       PHE   4  -1.646  24.866   4.744
   32    H    ALA   5           H        ALA   5  -4.238  18.587   6.716
   33    HA   ALA   5           HA       ALA   5  -3.086  16.978   8.747
   34   1HB   ALA   5          1HB       ALA   5  -5.917  17.066   8.710
   35   2HB   ALA   5          2HB       ALA   5  -5.463  15.525   7.943
   36   3HB   ALA   5          3HB       ALA   5  -4.879  15.911   9.580
   37    HA   PRO   6           HA       PRO   6  -1.832  14.853   5.194
   38   1HB   PRO   6          1HB       PRO   6  -1.543  12.258   6.001
   39   2HB   PRO   6          2HB       PRO   6  -0.369  13.508   6.359
   40   1HG   PRO   6          1HG       PRO   6  -2.356  12.262   8.158
   41   2HG   PRO   6          2HG       PRO   6  -0.921  13.178   8.574
   42   1HD   PRO   6          1HD       PRO   6  -3.634  14.105   8.659
   43   2HD   PRO   6          2HD       PRO   6  -2.192  15.054   8.962
   44    H    VAL   7           H        VAL   7  -2.188  12.306   4.150
   45    HA   VAL   7           HA       VAL   7  -5.027  12.548   3.452
   46    HB   VAL   7           HB       VAL   7  -3.362  12.918   1.664
   47   1HG1  VAL   7          1HG1      VAL   7  -1.496  11.646   1.899
   48   2HG1  VAL   7          2HG1      VAL   7  -2.379  10.285   2.631
   49   3HG1  VAL   7          3HG1      VAL   7  -2.407  10.518   0.867
   50   1HG2  VAL   7          1HG2      VAL   7  -5.148  10.478   1.415
   51   2HG2  VAL   7          2HG2      VAL   7  -5.549  12.166   1.017
   52   3HG2  VAL   7          3HG2      VAL   7  -4.356  11.279   0.037
   53    H    ASP   8           H        ASP   8  -2.519  10.527   4.880
   54    HA   ASP   8           HA       ASP   8  -2.493   8.444   5.557
   55   1HB   ASP   8          1HB       ASP   8  -4.875   9.783   6.650
   56   2HB   ASP   8          2HB       ASP   8  -5.078   8.043   6.628
   57    H    CYS   9           H        CYS   9  -2.467   7.344   3.447
   58    HA   CYS   9           HA       CYS   9  -4.483   6.878   1.760
   59   1HB   CYS   9          1HB       CYS   9  -2.568   4.684   2.549
   60   2HB   CYS   9          2HB       CYS   9  -3.335   4.940   0.994
   61    H    LYS  10           H        LYS  10  -3.530   4.347   4.196
   62    HA   LYS  10           HA       LYS  10  -4.772   2.673   5.021
   63   1HB   LYS  10          1HB       LYS  10  -4.916   4.399   6.719
   64   2HB   LYS  10          2HB       LYS  10  -6.298   5.130   5.928
   65   1HG   LYS  10          1HG       LYS  10  -7.760   3.589   6.780
   66   2HG   LYS  10          2HG       LYS  10  -6.685   2.245   6.451
   67   1HD   LYS  10          1HD       LYS  10  -5.413   3.716   8.523
   68   2HD   LYS  10          2HD       LYS  10  -7.111   3.695   8.957
   69   1HE   LYS  10          1HE       LYS  10  -5.832   1.118   8.024
   70   2HE   LYS  10          2HE       LYS  10  -5.488   1.681   9.648
   71   1HZ   LYS  10          1HZ       LYS  10  -7.799   0.455   8.708
   72   2HZ   LYS  10          2HZ       LYS  10  -7.439   0.895  10.239
   73   3HZ   LYS  10          3HZ       LYS  10  -8.205   1.942   9.247
   74    H    GLY  11           H        GLY  11  -7.838   4.311   4.971
   75   1HA   GLY  11          1HA       GLY  11  -9.274   2.372   3.746
   76   2HA   GLY  11          2HA       GLY  11  -9.689   4.074   3.698
   77    H    GLN  12           H        GLN  12  -7.898   5.303   2.075
   78    HA   GLN  12           HA       GLN  12  -8.747   4.829  -0.405
   79   1HB   GLN  12          1HB       GLN  12  -6.214   6.020   0.700
   80   2HB   GLN  12          2HB       GLN  12  -6.309   5.774  -1.033
   81   1HG   GLN  12          1HG       GLN  12  -7.473   7.717  -1.165
   82   2HG   GLN  12          2HG       GLN  12  -8.809   6.900  -0.378
   83   1HE2  GLN  12          1HE2      GLN  12  -8.772   9.449   0.048
   84   2HE2  GLN  12          2HE2      GLN  12  -8.190   9.897   1.616
   85    H    CYS  13           H        CYS  13  -6.395   2.939   1.415
   86    HA   CYS  13           HA       CYS  13  -5.700   1.477  -1.017
   87   1HB   CYS  13          1HB       CYS  13  -4.368   1.726   1.672
   88   2HB   CYS  13          2HB       CYS  13  -3.983   0.408   0.583
   89    H    THR  14           H        THR  14  -8.245   0.947  -0.494
   90    HA   THR  14           HA       THR  14  -8.253  -1.445   1.226
   91    HB   THR  14           HB       THR  14 -10.228   0.776   0.667
   92    HG1  THR  14           1HG      THR  14  -9.572  -0.999   2.911
   93   1HG2  THR  14          1HG2      THR  14 -11.677  -1.071   0.124
   94   2HG2  THR  14          2HG2      THR  14 -10.887  -2.133   1.315
   95   3HG2  THR  14          3HG2      THR  14 -11.926  -0.796   1.865
   96    H    THR  15           H        THR  15  -9.340  -0.038  -1.908
   97    HA   THR  15           HA       THR  15 -10.435  -2.485  -2.836
   98    HB   THR  15           HB       THR  15  -9.877   0.281  -3.820
   99    HG1  THR  15           1HG      THR  15 -11.874  -1.841  -4.192
  100   1HG2  THR  15          1HG2      THR  15  -8.793  -1.130  -5.626
  101   2HG2  THR  15          2HG2      THR  15 -10.307  -2.058  -5.752
  102   3HG2  THR  15          3HG2      THR  15 -10.285  -0.330  -6.177
  103    HA   PRO  16           HA       PRO  16  -6.217  -2.937  -4.884
  104   1HB   PRO  16          1HB       PRO  16  -4.120  -1.399  -4.044
  105   2HB   PRO  16          2HB       PRO  16  -5.094  -1.007  -5.447
  106   1HG   PRO  16          1HG       PRO  16  -5.120   0.239  -2.766
  107   2HG   PRO  16          2HG       PRO  16  -5.753   0.867  -4.275
  108   1HD   PRO  16          1HD       PRO  16  -7.265  -0.276  -2.122
  109   2HD   PRO  16          2HD       PRO  16  -7.884   0.245  -3.676
  110    H    CYS  17           H        CYS  17  -6.813  -2.666  -1.612
  111    HA   CYS  17           HA       CYS  17  -4.821  -4.764  -1.144
  112   1HB   CYS  17          1HB       CYS  17  -5.775  -2.788   0.930
  113   2HB   CYS  17          2HB       CYS  17  -4.504  -3.983   1.096
  114    H    GLU  18           H        GLU  18  -7.825  -4.567  -1.996
  115    HA   GLU  18           HA       GLU  18  -9.258  -5.485   0.249
  116   1HB   GLU  18          1HB       GLU  18  -9.834  -4.636  -2.413
  117   2HB   GLU  18          2HB       GLU  18 -10.484  -6.257  -2.270
  118   1HG   GLU  18          1HG       GLU  18 -11.458  -5.405   0.032
  119   2HG   GLU  18          2HG       GLU  18 -11.158  -3.804  -0.614
  120    HA   PRO  19           HA       PRO  19  -8.572  -9.678  -1.865
  121   1HB   PRO  19          1HB       PRO  19  -6.796  -9.892  -3.931
  122   2HB   PRO  19          2HB       PRO  19  -8.521  -9.694  -4.167
  123   1HG   PRO  19          1HG       PRO  19  -6.364  -7.703  -4.510
  124   2HG   PRO  19          2HG       PRO  19  -8.001  -7.665  -5.133
  125   1HD   PRO  19          1HD       PRO  19  -6.981  -6.184  -2.899
  126   2HD   PRO  19          2HD       PRO  19  -8.643  -6.236  -3.451
  127    H    LEU  20           H        LEU  20  -5.700  -7.682  -1.797
  128    HA   LEU  20           HA       LEU  20  -3.917  -9.681  -1.087
  129   1HB   LEU  20          1HB       LEU  20  -2.848  -7.786  -1.680
  130   2HB   LEU  20          2HB       LEU  20  -4.044  -6.732  -0.951
  131    HG   LEU  20           HG       LEU  20  -3.067  -7.496   1.317
  132   1HD1  LEU  20          1HD1      LEU  20  -0.449  -7.922   0.055
  133   2HD1  LEU  20          2HD1      LEU  20  -1.215  -8.746   1.435
  134   3HD1  LEU  20          3HD1      LEU  20  -1.618  -9.234  -0.229
  135   1HD2  LEU  20          1HD2      LEU  20  -1.275  -5.814  -0.449
  136   2HD2  LEU  20          2HD2      LEU  20  -2.820  -5.246   0.228
  137   3HD2  LEU  20          3HD2      LEU  20  -1.489  -5.711   1.315
  138    H    THR  21           H        THR  21  -5.686  -7.357   1.082
  139    HA   THR  21           HA       THR  21  -4.870  -8.442   3.476
  140    HB   THR  21           HB       THR  21  -7.358  -6.968   2.518
  141    HG1  THR  21           1HG      THR  21  -5.279  -5.873   2.720
  142   1HG2  THR  21          1HG2      THR  21  -7.051  -6.670   5.336
  143   2HG2  THR  21          2HG2      THR  21  -8.420  -7.431   4.489
  144   3HG2  THR  21          3HG2      THR  21  -7.048  -8.425   5.037
  145    H    ALA  22           H        ALA  22  -7.783  -9.349   1.522
  146    HA   ALA  22           HA       ALA  22  -8.756 -11.260   3.244
  147   1HB   ALA  22          1HB       ALA  22  -9.657 -12.267   1.038
  148   2HB   ALA  22          2HB       ALA  22 -10.099 -10.585   1.417
  149   3HB   ALA  22          3HB       ALA  22  -8.813 -10.922   0.233
  150    H    CYS  23           H        CYS  23  -6.002 -11.359   0.981
  151    HA   CYS  23           HA       CYS  23  -5.711 -14.134   0.933
  152   1HB   CYS  23          1HB       CYS  23  -4.607 -12.191  -0.470
  153   2HB   CYS  23          2HB       CYS  23  -3.345 -12.311   0.741
  154    H    LYS  24           H        LYS  24  -3.903 -11.575   2.802
  155    HA   LYS  24           HA       LYS  24  -2.449 -13.259   4.398
  156   1HB   LYS  24          1HB       LYS  24  -3.316 -10.438   4.471
  157   2HB   LYS  24          2HB       LYS  24  -2.921 -11.113   6.038
  158   1HG   LYS  24          1HG       LYS  24  -0.687 -11.281   5.549
  159   2HG   LYS  24          2HG       LYS  24  -0.984 -11.871   3.926
  160   1HD   LYS  24          1HD       LYS  24  -0.377  -9.822   3.163
  161   2HD   LYS  24          2HD       LYS  24  -1.877  -9.205   3.826
  162   1HE   LYS  24          1HE       LYS  24  -0.284  -9.306   6.094
  163   2HE   LYS  24          2HE       LYS  24   0.902  -8.930   4.859
  164   1HZ   LYS  24          1HZ       LYS  24  -1.532  -7.424   5.492
  165   2HZ   LYS  24          2HZ       LYS  24   0.016  -6.916   5.605
  166   3HZ   LYS  24          3HZ       LYS  24  -0.661  -7.153   4.138
  167    H    GLU  25           H        GLU  25  -5.781 -11.951   4.931
  168    HA   GLU  25           HA       GLU  25  -6.136 -13.037   7.424
  169   1HB   GLU  25          1HB       GLU  25  -7.730 -11.730   5.418
  170   2HB   GLU  25          2HB       GLU  25  -8.629 -13.127   5.975
  171   1HG   GLU  25          1HG       GLU  25  -7.298 -11.467   8.094
  172   2HG   GLU  25          2HG       GLU  25  -8.659 -10.732   7.269
  173    H    LYS  26           H        LYS  26  -7.551 -14.358   4.337
  174    HA   LYS  26           HA       LYS  26  -8.441 -16.722   5.219
  175   1HB   LYS  26          1HB       LYS  26  -8.206 -15.587   2.801
  176   2HB   LYS  26          2HB       LYS  26  -6.929 -16.777   2.646
  177   1HG   LYS  26          1HG       LYS  26  -8.422 -18.478   2.433
  178   2HG   LYS  26          2HG       LYS  26  -9.284 -17.992   3.879
  179   1HD   LYS  26          1HD       LYS  26 -10.725 -16.519   2.687
  180   2HD   LYS  26          2HD       LYS  26  -9.643 -16.415   1.313
  181   1HE   LYS  26          1HE       LYS  26 -10.143 -19.113   1.310
  182   2HE   LYS  26          2HE       LYS  26 -11.647 -18.532   1.996
  183   1HZ   LYS  26          1HZ       LYS  26 -10.811 -18.410  -0.649
  184   2HZ   LYS  26          2HZ       LYS  26 -12.240 -17.934  -0.019
  185   3HZ   LYS  26          3HZ       LYS  26 -11.000 -16.876  -0.120
  186    H    CYS  27           H        CYS  27  -5.014 -15.924   4.411
  187    HA   CYS  27           HA       CYS  27  -4.050 -18.508   4.839
  188   1HB   CYS  27          1HB       CYS  27  -2.611 -15.860   5.101
  189   2HB   CYS  27          2HB       CYS  27  -1.843 -17.432   5.011
  190    H    ALA  28           H        ALA  28  -4.258 -15.552   6.942
  191    HA   ALA  28           HA       ALA  28  -3.044 -16.441   9.188
  192   1HB   ALA  28          1HB       ALA  28  -4.038 -14.628  10.181
  193   2HB   ALA  28          2HB       ALA  28  -4.450 -14.244   8.492
  194   3HB   ALA  28          3HB       ALA  28  -5.652 -15.028   9.545
  195    H    GLU  29           H        GLU  29  -6.566 -16.885   8.386
  196    HA   GLU  29           HA       GLU  29  -7.176 -18.387  10.578
  197   1HB   GLU  29          1HB       GLU  29  -8.307 -18.262   7.771
  198   2HB   GLU  29          2HB       GLU  29  -8.973 -19.394   8.931
  199   1HG   GLU  29          1HG       GLU  29  -8.619 -16.706  10.093
  200   2HG   GLU  29          2HG       GLU  29  -9.654 -16.677   8.679
  201    H    SER  30           H        SER  30  -6.382 -19.624   7.243
  202    HA   SER  30           HA       SER  30  -6.356 -22.269   7.936
  203   1HB   SER  30          1HB       SER  30  -5.830 -20.732   5.644
  204   2HB   SER  30          2HB       SER  30  -4.324 -21.584   5.919
  205    HG   SER  30           HG       SER  30  -5.419 -23.587   5.833
  206    H    CYS  31           H        CYS  31  -4.155 -19.723   8.791
  207    HA   CYS  31           HA       CYS  31  -2.144 -21.715   9.549
  208   1HB   CYS  31          1HB       CYS  31  -1.862 -18.795   8.841
  209   2HB   CYS  31          2HB       CYS  31  -0.610 -19.685   9.685
  210    H    GLU  32           H        GLU  32  -4.206 -21.785  11.234
  211    HA   GLU  32           HA       GLU  32  -3.920 -19.717  13.210
  212   1HB   GLU  32          1HB       GLU  32  -5.935 -21.724  12.483
  213   2HB   GLU  32          2HB       GLU  32  -5.658 -21.694  14.213
  214   1HG   GLU  32          1HG       GLU  32  -5.861 -19.102  14.026
  215   2HG   GLU  32          2HG       GLU  32  -6.509 -19.384  12.422
  216    H    THR  33           H        THR  33  -2.610 -19.870  14.985
  217    HA   THR  33           HA       THR  33  -1.016 -20.720  16.309
  218    HB   THR  33           HB       THR  33  -1.883 -22.522  17.763
  219    HG1  THR  33           1HG      THR  33  -2.636 -23.900  16.011
  220   1HG2  THR  33          1HG2      THR  33  -4.021 -21.617  18.391
  221   2HG2  THR  33          2HG2      THR  33  -3.128 -20.228  17.727
  222   3HG2  THR  33          3HG2      THR  33  -4.352 -21.055  16.735
  223    H    SER  34           H        SER  34  -0.716 -21.336  13.451
  224    HA   SER  34           HA       SER  34   0.196 -24.025  13.365
  225   1HB   SER  34          1HB       SER  34  -0.490 -22.014  11.486
  226   2HB   SER  34          2HB       SER  34   1.214 -22.322  11.218
  227    HG   SER  34           HG       SER  34  -0.517 -23.720  10.085
  228    H    ALA  35           H        ALA  35   1.517 -23.133  15.506
  229    HA   ALA  35           HA       ALA  35   3.523 -22.910  16.410
  230   1HB   ALA  35          1HB       ALA  35   5.287 -23.099  14.141
  231   2HB   ALA  35          2HB       ALA  35   4.969 -24.306  15.411
  232   3HB   ALA  35          3HB       ALA  35   3.964 -24.273  13.942
  233    H    ASP  36           H        ASP  36   4.365 -21.569  13.154
  234    HA   ASP  36           HA       ASP  36   4.739 -19.021  14.521
  235   1HB   ASP  36          1HB       ASP  36   6.070 -19.879  11.919
  236   2HB   ASP  36          2HB       ASP  36   6.513 -18.528  12.944
  237    H    LYS  37           H        LYS  37   2.327 -18.741  14.001
  238    HA   LYS  37           HA       LYS  37   1.125 -18.881  11.611
  239   1HB   LYS  37          1HB       LYS  37   0.842 -16.636  13.632
  240   2HB   LYS  37          2HB       LYS  37  -0.313 -17.018  12.371
  241   1HG   LYS  37          1HG       LYS  37  -1.111 -18.878  13.470
  242   2HG   LYS  37          2HG       LYS  37   0.475 -19.349  14.049
  243   1HD   LYS  37          1HD       LYS  37  -0.490 -18.698  16.062
  244   2HD   LYS  37          2HD       LYS  37   0.228 -17.174  15.580
  245   1HE   LYS  37          1HE       LYS  37  -1.807 -16.174  15.286
  246   2HE   LYS  37          2HE       LYS  37  -2.456 -17.547  14.412
  247   1HZ   LYS  37          1HZ       LYS  37  -3.634 -17.411  16.398
  248   2HZ   LYS  37          2HZ       LYS  37  -2.601 -18.654  16.634
  249   3HZ   LYS  37          3HZ       LYS  37  -2.299 -17.201  17.316
  250    H    LYS  38           H        LYS  38   3.020 -16.001  12.765
  251    HA   LYS  38           HA       LYS  38   2.816 -14.407  10.613
  252   1HB   LYS  38          1HB       LYS  38   4.323 -14.433  12.885
  253   2HB   LYS  38          2HB       LYS  38   5.569 -14.655  11.674
  254   1HG   LYS  38          1HG       LYS  38   5.483 -12.367  11.527
  255   2HG   LYS  38          2HG       LYS  38   4.127 -12.678  10.461
  256   1HD   LYS  38          1HD       LYS  38   3.271 -11.099  12.015
  257   2HD   LYS  38          2HD       LYS  38   2.640 -12.630  12.589
  258   1HE   LYS  38          1HE       LYS  38   4.773 -12.732  14.098
  259   2HE   LYS  38          2HE       LYS  38   4.977 -11.035  13.711
  260   1HZ   LYS  38          1HZ       LYS  38   3.440 -11.971  15.675
  261   2HZ   LYS  38          2HZ       LYS  38   3.272 -10.492  15.003
  262   3HZ   LYS  38          3HZ       LYS  38   2.324 -11.726  14.509
  263    H    THR  39           H        THR  39   5.600 -16.719  10.973
  264    HA   THR  39           HA       THR  39   6.543 -16.530   8.420
  265    HB   THR  39           HB       THR  39   6.407 -19.120  10.034
  266    HG1  THR  39           1HG      THR  39   8.182 -16.797  10.263
  267   1HG2  THR  39          1HG2      THR  39   7.782 -19.525   8.145
  268   2HG2  THR  39          2HG2      THR  39   8.328 -17.833   8.065
  269   3HG2  THR  39          3HG2      THR  39   8.961 -18.914   9.329
  270    H    CYS  40           H        CYS  40   3.960 -18.772   9.601
  271    HA   CYS  40           HA       CYS  40   3.560 -20.144   7.289
  272   1HB   CYS  40          1HB       CYS  40   2.462 -20.414   9.584
  273   2HB   CYS  40          2HB       CYS  40   1.292 -19.224   9.050
  274    H    ARG  41           H        ARG  41   1.870 -17.102   8.377
  275    HA   ARG  41           HA       ARG  41   0.468 -16.739   6.051
  276   1HB   ARG  41          1HB       ARG  41   1.463 -14.826   8.200
  277   2HB   ARG  41          2HB       ARG  41   0.546 -14.222   6.834
  278   1HG   ARG  41          1HG       ARG  41  -1.354 -15.674   7.385
  279   2HG   ARG  41          2HG       ARG  41  -0.431 -16.486   8.634
  280   1HD   ARG  41          1HD       ARG  41  -1.991 -14.759   9.572
  281   2HD   ARG  41          2HD       ARG  41  -0.318 -14.434   9.978
  282    HE   ARG  41           HE       ARG  41  -0.879 -13.086   7.533
  283   1HH1  ARG  41          2HH2      ARG  41  -1.823 -12.945  10.920
  284   2HH1  ARG  41          1HH2      ARG  41  -2.166 -11.247  10.885
  285   1HH2  ARG  41          2HH1      ARG  41  -1.333 -10.847   7.486
  286   2HH2  ARG  41          1HH1      ARG  41  -1.886 -10.046   8.919
  287    H    ARG  42           H        ARG  42   3.623 -15.271   7.122
  288    HA   ARG  42           HA       ARG  42   4.126 -13.665   5.062
  289   1HB   ARG  42          1HB       ARG  42   6.189 -15.555   6.300
  290   2HB   ARG  42          2HB       ARG  42   6.537 -14.022   5.526
  291   1HG   ARG  42          1HG       ARG  42   4.524 -13.567   7.553
  292   2HG   ARG  42          2HG       ARG  42   5.819 -14.504   8.272
  293   1HD   ARG  42          1HD       ARG  42   6.062 -11.817   6.848
  294   2HD   ARG  42          2HD       ARG  42   6.380 -12.152   8.538
  295    HE   ARG  42           HE       ARG  42   8.125 -13.859   7.244
  296   1HH1  ARG  42          2HH2      ARG  42   7.500 -10.404   7.005
  297   2HH1  ARG  42          1HH2      ARG  42   9.121 -10.014   6.535
  298   1HH2  ARG  42          2HH1      ARG  42  10.264 -13.345   6.625
  299   2HH2  ARG  42          1HH1      ARG  42  10.704 -11.698   6.318
  300    H    ASN  43           H        ASN  43   4.674 -17.240   5.199
  301    HA   ASN  43           HA       ASN  43   5.864 -17.378   2.677
  302   1HB   ASN  43          1HB       ASN  43   4.903 -19.237   4.765
  303   2HB   ASN  43          2HB       ASN  43   4.632 -19.879   3.157
  304   1HD2  ASN  43          1HD2      ASN  43   6.862 -19.286   5.630
  305   2HD2  ASN  43          2HD2      ASN  43   8.324 -19.758   4.831
  306    H    CYS  44           H        CYS  44   2.521 -17.428   3.935
  307    HA   CYS  44           HA       CYS  44   1.325 -18.488   1.614
  308   1HB   CYS  44          1HB       CYS  44   0.416 -18.325   4.029
  309   2HB   CYS  44          2HB       CYS  44  -0.067 -16.698   3.592
  310    H    LYS  45           H        LYS  45   2.605 -15.364   2.595
  311    HA   LYS  45           HA       LYS  45   1.036 -13.714   0.964
  312   1HB   LYS  45          1HB       LYS  45   2.834 -13.277   2.908
  313   2HB   LYS  45          2HB       LYS  45   3.879 -13.007   1.528
  314   1HG   LYS  45          1HG       LYS  45   2.730 -11.113   0.840
  315   2HG   LYS  45          2HG       LYS  45   1.177 -11.722   1.376
  316   1HD   LYS  45          1HD       LYS  45   1.605  -9.993   2.923
  317   2HD   LYS  45          2HD       LYS  45   2.116 -11.420   3.803
  318   1HE   LYS  45          1HE       LYS  45   4.285 -10.298   2.140
  319   2HE   LYS  45          2HE       LYS  45   3.676  -9.140   3.306
  320   1HZ   LYS  45          1HZ       LYS  45   4.131 -10.614   5.048
  321   2HZ   LYS  45          2HZ       LYS  45   4.386 -11.885   4.054
  322   3HZ   LYS  45          3HZ       LYS  45   5.460 -10.656   4.099
  323    H    LYS  46           H        LYS  46   3.988 -15.667   0.378
  324    HA   LYS  46           HA       LYS  46   4.091 -14.665  -2.350
  325   1HB   LYS  46          1HB       LYS  46   5.938 -16.323  -0.633
  326   2HB   LYS  46          2HB       LYS  46   6.153 -16.230  -2.370
  327   1HG   LYS  46          1HG       LYS  46   5.786 -13.652  -0.839
  328   2HG   LYS  46          2HG       LYS  46   7.331 -14.471  -0.722
  329   1HD   LYS  46          1HD       LYS  46   7.667 -14.374  -3.128
  330   2HD   LYS  46          2HD       LYS  46   6.016 -13.856  -3.403
  331   1HE   LYS  46          1HE       LYS  46   6.492 -11.665  -2.929
  332   2HE   LYS  46          2HE       LYS  46   7.471 -12.079  -1.536
  333   1HZ   LYS  46          1HZ       LYS  46   8.772 -12.913  -3.860
  334   2HZ   LYS  46          2HZ       LYS  46   8.351 -11.345  -4.032
  335   3HZ   LYS  46          3HZ       LYS  46   9.262 -11.812  -2.759
  336    H    ALA  47           H        ALA  47   2.434 -17.014  -0.577
  337    HA   ALA  47           HA       ALA  47   2.621 -19.201  -2.358
  338   1HB   ALA  47          1HB       ALA  47   0.609 -19.982  -1.099
  339   2HB   ALA  47          2HB       ALA  47   1.935 -19.463  -0.031
  340   3HB   ALA  47          3HB       ALA  47   0.534 -18.398  -0.292
  341    H    ASP  48           H        ASP  48   0.054 -16.678  -1.822
  342    HA   ASP  48           HA       ASP  48  -0.404 -16.648  -4.640
  343   1HB   ASP  48          1HB       ASP  48  -1.853 -18.533  -3.463
  344   2HB   ASP  48          2HB       ASP  48  -2.812 -17.189  -2.875
  345    H    CYS  49           H        CYS  49   0.631 -14.642  -3.009
  346    HA   CYS  49           HA       CYS  49  -1.539 -12.725  -3.038
  347   1HB   CYS  49          1HB       CYS  49   0.213 -12.669  -0.623
  348   2HB   CYS  49          2HB       CYS  49  -1.401 -12.026  -0.857
  349    H    GLU  50           H        GLU  50   0.866 -13.420  -4.684
  350    HA   GLU  50           HA       GLU  50   2.847 -11.507  -3.988
  351   1HB   GLU  50          1HB       GLU  50   2.504 -13.675  -5.941
  352   2HB   GLU  50          2HB       GLU  50   3.270 -12.273  -6.663
  353   1HG   GLU  50          1HG       GLU  50   4.393 -12.769  -4.012
  354   2HG   GLU  50          2HG       GLU  50   4.480 -14.227  -4.981
  355    HA   PRO  51           HA       PRO  51   0.799  -9.286  -7.652
  356   1HB   PRO  51          1HB       PRO  51  -1.605 -10.171  -8.604
  357   2HB   PRO  51          2HB       PRO  51  -0.069 -10.607  -9.327
  358   1HG   PRO  51          1HG       PRO  51  -1.849 -12.246  -7.629
  359   2HG   PRO  51          2HG       PRO  51  -0.557 -12.769  -8.692
  360   1HD   PRO  51          1HD       PRO  51  -0.459 -12.589  -5.831
  361   2HD   PRO  51          2HD       PRO  51   0.866 -13.001  -6.902
  362    H    GLN  52           H        GLN  52  -1.569 -10.646  -5.449
  363    HA   GLN  52           HA       GLN  52  -3.214  -8.450  -5.383
  364   1HB   GLN  52          1HB       GLN  52  -2.564 -10.478  -3.200
  365   2HB   GLN  52          2HB       GLN  52  -3.898  -9.345  -3.111
  366   1HG   GLN  52          1HG       GLN  52  -4.814 -10.291  -5.259
  367   2HG   GLN  52          2HG       GLN  52  -3.504 -11.455  -5.287
  368   1HE2  GLN  52          1HE2      GLN  52  -5.301 -12.975  -5.319
  369   2HE2  GLN  52          2HE2      GLN  52  -6.002 -13.514  -3.830
  370    H    ASP  53           H        ASP  53  -0.232  -9.211  -3.502
  371    HA   ASP  53           HA       ASP  53  -0.439  -7.077  -1.756
  372   1HB   ASP  53          1HB       ASP  53   1.141  -9.107  -1.670
  373   2HB   ASP  53          2HB       ASP  53   2.142  -8.283  -2.849
  374    H    LYS  54           H        LYS  54   0.922  -7.478  -5.061
  375    HA   LYS  54           HA       LYS  54   2.332  -5.067  -5.181
  376   1HB   LYS  54          1HB       LYS  54   1.183  -6.944  -7.243
  377   2HB   LYS  54          2HB       LYS  54   1.961  -5.448  -7.720
  378   1HG   LYS  54          1HG       LYS  54   4.009  -6.118  -6.424
  379   2HG   LYS  54          2HG       LYS  54   3.231  -7.628  -5.995
  380   1HD   LYS  54          1HD       LYS  54   3.923  -8.546  -7.946
  381   2HD   LYS  54          2HD       LYS  54   2.983  -7.368  -8.838
  382   1HE   LYS  54          1HE       LYS  54   4.837  -5.802  -8.911
  383   2HE   LYS  54          2HE       LYS  54   5.753  -6.727  -7.738
  384   1HZ   LYS  54          1HZ       LYS  54   6.372  -7.060 -10.104
  385   2HZ   LYS  54          2HZ       LYS  54   6.057  -8.439  -9.286
  386   3HZ   LYS  54          3HZ       LYS  54   4.954  -7.839 -10.331
  387    H    VAL  55           H        VAL  55  -0.985  -5.920  -6.404
  388    HA   VAL  55           HA       VAL  55  -1.709  -3.474  -7.338
  389    HB   VAL  55           HB       VAL  55  -3.331  -5.564  -5.877
  390   1HG1  VAL  55          1HG1      VAL  55  -4.152  -2.963  -6.451
  391   2HG1  VAL  55          2HG1      VAL  55  -4.792  -3.929  -7.803
  392   3HG1  VAL  55          3HG1      VAL  55  -5.203  -4.363  -6.126
  393   1HG2  VAL  55          1HG2      VAL  55  -4.045  -5.932  -8.384
  394   2HG2  VAL  55          2HG2      VAL  55  -2.489  -5.141  -8.729
  395   3HG2  VAL  55          3HG2      VAL  55  -2.532  -6.635  -7.763
  396    H    CYS  56           H        CYS  56  -1.334  -4.549  -3.970
  397    HA   CYS  56           HA       CYS  56  -2.739  -2.354  -2.866
  398   1HB   CYS  56          1HB       CYS  56  -2.430  -4.500  -1.699
  399   2HB   CYS  56          2HB       CYS  56  -0.705  -4.203  -1.601
  400    H    ASP  57           H        ASP  57   0.795  -3.259  -2.954
  401    HA   ASP  57           HA       ASP  57   1.880  -1.069  -1.953
  402   1HB   ASP  57          1HB       ASP  57   3.222  -2.941  -2.767
  403   2HB   ASP  57          2HB       ASP  57   2.743  -2.634  -4.424
  404    H    ALA  58           H        ALA  58   0.821  -1.549  -5.398
  405    HA   ALA  58           HA       ALA  58   1.636   0.736  -6.565
  406   1HB   ALA  58          1HB       ALA  58   0.172   0.148  -8.218
  407   2HB   ALA  58          2HB       ALA  58   0.003  -1.328  -7.238
  408   3HB   ALA  58          3HB       ALA  58  -1.196  -0.021  -7.092
  409    H    CYS  59           H        CYS  59  -1.367   0.322  -4.569
  410    HA   CYS  59           HA       CYS  59  -2.299   2.888  -4.814
  411   1HB   CYS  59          1HB       CYS  59  -3.672   1.213  -3.847
  412   2HB   CYS  59          2HB       CYS  59  -2.518   0.885  -2.570
  413    H    ARG  60           H        ARG  60  -0.502   1.550  -1.936
  414    HA   ARG  60           HA       ARG  60  -0.002   3.860  -0.699
  415   1HB   ARG  60          1HB       ARG  60   1.935   1.506  -0.983
  416   2HB   ARG  60          2HB       ARG  60   2.029   2.725   0.272
  417   1HG   ARG  60          1HG       ARG  60  -0.458   2.057   0.807
  418   2HG   ARG  60          2HG       ARG  60  -0.124   0.623  -0.144
  419   1HD   ARG  60          1HD       ARG  60   0.439  -0.082   2.038
  420   2HD   ARG  60          2HD       ARG  60   2.001   0.359   1.377
  421    HE   ARG  60           HE       ARG  60   0.790   2.662   2.618
  422   1HH1  ARG  60          2HH2      ARG  60   2.369  -0.381   3.413
  423   2HH1  ARG  60          1HH2      ARG  60   2.950   0.174   4.947
  424   1HH2  ARG  60          2HH1      ARG  60   1.557   3.395   4.642
  425   2HH2  ARG  60          1HH1      ARG  60   2.485   2.336   5.651
  426    H    MET  61           H        MET  61   1.514   2.603  -3.652
  427    HA   MET  61           HA       MET  61   3.711   4.400  -3.537
  428   1HB   MET  61          1HB       MET  61   4.109   2.381  -4.757
  429   2HB   MET  61          2HB       MET  61   2.544   2.435  -5.545
  430   1HG   MET  61          1HG       MET  61   3.307   3.768  -7.251
  431   2HG   MET  61          2HG       MET  61   4.235   4.790  -6.172
  432   1HE   MET  61          1HE       MET  61   5.405   1.147  -8.506
  433   2HE   MET  61          2HE       MET  61   3.865   2.033  -8.392
  434   3HE   MET  61          3HE       MET  61   5.241   2.748  -9.266
  435    H    LYS  62           H        LYS  62   0.447   4.334  -4.986
  436    HA   LYS  62           HA       LYS  62   0.979   6.691  -6.561
  437   1HB   LYS  62          1HB       LYS  62  -1.229   4.714  -6.278
  438   2HB   LYS  62          2HB       LYS  62  -1.685   6.333  -6.769
  439   1HG   LYS  62          1HG       LYS  62  -1.216   5.352  -8.844
  440   2HG   LYS  62          2HG       LYS  62   0.319   6.115  -8.480
  441   1HD   LYS  62          1HD       LYS  62   1.204   3.974  -7.586
  442   2HD   LYS  62          2HD       LYS  62  -0.345   3.199  -7.851
  443   1HE   LYS  62          1HE       LYS  62   0.463   4.464 -10.326
  444   2HE   LYS  62          2HE       LYS  62   1.818   3.532  -9.723
  445   1HZ   LYS  62          1HZ       LYS  62   0.158   2.319 -11.112
  446   2HZ   LYS  62          2HZ       LYS  62   0.523   1.609  -9.687
  447   3HZ   LYS  62          3HZ       LYS  62  -0.887   2.415  -9.861
  448    H    CYS  63           H        CYS  63  -1.179   5.786  -3.780
  449    HA   CYS  63           HA       CYS  63  -2.305   8.143  -3.245
  450   1HB   CYS  63          1HB       CYS  63  -2.944   6.415  -1.861
  451   2HB   CYS  63          2HB       CYS  63  -1.298   5.957  -1.472
  452    H    HIS  64           H        HIS  64   1.058   7.097  -2.428
  453    HA   HIS  64           HA       HIS  64   1.811   9.238  -0.900
  454   1HB   HIS  64          1HB       HIS  64   3.018   7.008  -1.671
  455   2HB   HIS  64          2HB       HIS  64   3.735   8.062  -2.873
  456    HD1  HIS  64           1HD      HIS  64   6.001   7.402  -1.493
  457    HD2  HIS  64           2HD      HIS  64   3.277   9.937   0.443
  458    HE1  HIS  64           1HE      HIS  64   7.284   8.502   0.419
  459    H    LYS  65           H        LYS  65   2.486   8.857  -4.458
  460    HA   LYS  65           HA       LYS  65   3.274  11.508  -4.794
  461   1HB   LYS  65          1HB       LYS  65   4.010  10.264  -6.536
  462   2HB   LYS  65          2HB       LYS  65   2.627   9.189  -6.512
  463   1HG   LYS  65          1HG       LYS  65   1.221  11.022  -7.527
  464   2HG   LYS  65          2HG       LYS  65   2.643  12.042  -7.609
  465   1HD   LYS  65          1HD       LYS  65   3.229  11.089  -9.578
  466   2HD   LYS  65          2HD       LYS  65   3.359   9.527  -8.796
  467   1HE   LYS  65          1HE       LYS  65   1.561   8.839  -9.997
  468   2HE   LYS  65          2HE       LYS  65   0.571   9.948  -9.070
  469   1HZ   LYS  65          1HZ       LYS  65   2.100  11.060 -11.260
  470   2HZ   LYS  65          2HZ       LYS  65   0.806  10.141 -11.645
  471   3HZ   LYS  65          3HZ       LYS  65   0.616  11.469 -10.715
  472    H    ALA  66           H        ALA  66   0.102   9.889  -5.515
  473    HA   ALA  66           HA       ALA  66  -1.271  12.031  -6.454
  474   1HB   ALA  66          1HB       ALA  66  -2.733  10.319  -6.492
  475   2HB   ALA  66          2HB       ALA  66  -1.847   9.455  -5.213
  476   3HB   ALA  66          3HB       ALA  66  -3.075  10.668  -4.781
  477    H    CYS  67           H        CYS  67  -0.255  11.331  -3.106
  478    HA   CYS  67           HA       CYS  67  -1.914  13.334  -1.971
  479   1HB   CYS  67          1HB       CYS  67  -1.397  11.718  -0.437
  480   2HB   CYS  67          2HB       CYS  67   0.247  11.521  -1.012
  481    H    ARG  68           H        ARG  68   1.573  13.008  -2.913
  482    HA   ARG  68           HA       ARG  68   2.515  15.344  -1.996
  483   1HB   ARG  68          1HB       ARG  68   3.962  13.707  -3.094
  484   2HB   ARG  68          2HB       ARG  68   3.124  13.903  -4.621
  485   1HG   ARG  68          1HG       ARG  68   3.954  16.187  -4.872
  486   2HG   ARG  68          2HG       ARG  68   4.598  16.192  -3.241
  487   1HD   ARG  68          1HD       ARG  68   6.517  15.133  -3.884
  488   2HD   ARG  68          2HD       ARG  68   5.640  13.918  -4.793
  489    HE   ARG  68           HE       ARG  68   6.844  16.344  -5.860
  490   1HH1  ARG  68          2HH2      ARG  68   4.238  14.030  -6.347
  491   2HH1  ARG  68          1HH2      ARG  68   4.108  14.341  -8.046
  492   1HH2  ARG  68          2HH1      ARG  68   6.673  16.755  -8.101
  493   2HH2  ARG  68          1HH1      ARG  68   5.502  15.902  -9.050
  494    H    ALA  69           H        ALA  69   1.184  14.792  -5.348
  495    HA   ALA  69           HA       ALA  69   1.229  17.486  -6.079
  496   1HB   ALA  69          1HB       ALA  69  -0.740  15.441  -7.132
  497   2HB   ALA  69          2HB       ALA  69   0.079  16.758  -8.007
  498   3HB   ALA  69          3HB       ALA  69   0.999  15.323  -7.494
  499    H    ALA  70           H        ALA  70  -1.262  15.423  -4.493
  500    HA   ALA  70           HA       ALA  70  -3.304  17.354  -4.593
  501   1HB   ALA  70          1HB       ALA  70  -4.288  15.889  -2.773
  502   2HB   ALA  70          2HB       ALA  70  -3.828  15.027  -4.262
  503   3HB   ALA  70          3HB       ALA  70  -2.784  14.938  -2.822
  504    H    ASN  71           H        ASN  71  -2.103  16.162  -1.438
  505    HA   ASN  71           HA       ASN  71  -2.644  18.291   0.007
  506   1HB   ASN  71          1HB       ASN  71  -0.551  16.174   0.139
  507   2HB   ASN  71          2HB       ASN  71  -0.159  17.599   1.080
  508   1HD2  ASN  71          1HD2      ASN  71  -3.079  15.702   0.302
  509   2HD2  ASN  71          2HD2      ASN  71  -3.671  15.539   1.921
  510    H    CYS  72           H        CYS  72   0.730  17.695  -1.263
  511    HA   CYS  72           HA       CYS  72   1.362  20.470  -0.954
  512   1HB   CYS  72          1HB       CYS  72   3.090  18.429  -2.332
  513   2HB   CYS  72          2HB       CYS  72   3.573  19.889  -1.491
  514    H    ALA  73           H        ALA  73  -0.378  21.257  -2.451
  515    HA   ALA  73           HA       ALA  73  -0.034  20.572  -5.244
  516   1HB   ALA  73          1HB       ALA  73  -2.141  21.475  -5.528
  517   2HB   ALA  73          2HB       ALA  73  -2.238  21.029  -3.808
  518   3HB   ALA  73          3HB       ALA  73  -1.899  22.713  -4.272
  519    H    SER  74           H        SER  74   0.945  23.006  -2.903
  520    HA   SER  74           HA       SER  74   1.835  24.679  -5.116
  521   1HB   SER  74          1HB       SER  74   0.549  25.289  -2.619
  522   2HB   SER  74          2HB       SER  74   2.163  25.966  -2.550
  523    HG   SER  74           HG       SER  74   1.624  26.844  -4.800
  524    H    GLU  75           H        GLU  75   2.773  23.172  -1.967
  525    HA   GLU  75           HA       GLU  75   5.388  24.064  -1.974
  526   1HB   GLU  75          1HB       GLU  75   3.963  21.721  -0.689
  527   2HB   GLU  75          2HB       GLU  75   5.698  21.893  -0.509
  528   1HG   GLU  75          1HG       GLU  75   4.562  22.983   1.380
  529   2HG   GLU  75          2HG       GLU  75   5.383  24.192   0.413
  530    H    CYS  76           H        CYS  76   3.772  21.749  -3.985
  531    HA   CYS  76           HA       CYS  76   6.368  20.962  -5.055
  532   1HB   CYS  76          1HB       CYS  76   4.121  18.972  -4.771
  533   2HB   CYS  76          2HB       CYS  76   5.778  18.677  -5.259
  534    HA   PRO  77           HA       PRO  77   3.792  22.473  -8.366
  535   1HB   PRO  77          1HB       PRO  77   5.823  23.371  -9.959
  536   2HB   PRO  77          2HB       PRO  77   5.055  24.363  -8.735
  537   1HG   PRO  77          1HG       PRO  77   7.709  23.062  -8.669
  538   2HG   PRO  77          2HG       PRO  77   7.105  24.373  -7.677
  539   1HD   PRO  77          1HD       PRO  77   7.391  21.627  -6.901
  540   2HD   PRO  77          2HD       PRO  77   6.680  22.915  -5.950
  541    H    LYS  78           H        LYS  78   3.943  22.206 -10.911
  542    HA   LYS  78           HA       LYS  78   4.285  19.336 -11.183
  543   1HB   LYS  78          1HB       LYS  78   2.378  21.154 -12.089
  544   2HB   LYS  78          2HB       LYS  78   3.315  20.790 -13.524
  545   1HG   LYS  78          1HG       LYS  78   2.614  18.442 -11.802
  546   2HG   LYS  78          2HG       LYS  78   1.268  19.218 -12.612
  547   1HD   LYS  78          1HD       LYS  78   1.828  17.983 -14.439
  548   2HD   LYS  78          2HD       LYS  78   3.178  19.083 -14.641
  549   1HE   LYS  78          1HE       LYS  78   3.987  17.207 -12.641
  550   2HE   LYS  78          2HE       LYS  78   3.214  16.265 -13.900
  551   1HZ   LYS  78          1HZ       LYS  78   4.644  17.327 -15.503
  552   2HZ   LYS  78          2HZ       LYS  78   5.352  18.233 -14.343
  553   3HZ   LYS  78          3HZ       LYS  78   5.542  16.611 -14.343
  554    H    HIS  79           H        HIS  79   6.745  20.287 -10.767
  555    HA   HIS  79           HA       HIS  79   8.028  19.713 -13.211
  556   1HB   HIS  79          1HB       HIS  79   7.441  22.050 -13.685
  557   2HB   HIS  79          2HB       HIS  79   8.234  22.567 -12.211
  558    HD1  HIS  79           1HD      HIS  79  10.126  23.935 -13.205
  559    HD2  HIS  79           2HD      HIS  79   9.893  20.066 -14.809
  560    HE1  HIS  79           1HE      HIS  79  12.215  23.629 -14.638
  561    H    GLU  80           H        GLU  80   8.645  21.654 -10.192
  562    HA   GLU  80           HA       GLU  80  11.115  20.313  -9.828
  563   1HB   GLU  80          1HB       GLU  80   9.539  22.230  -8.057
  564   2HB   GLU  80          2HB       GLU  80  11.134  21.628  -7.650
  565   1HG   GLU  80          1HG       GLU  80  11.302  22.559 -10.349
  566   2HG   GLU  80          2HG       GLU  80  10.406  23.781  -9.469
  567    H    HIS  81           H        HIS  81  11.565  18.508  -8.598
  568    HA   HIS  81           HA       HIS  81   9.465  17.605  -6.782
  569   1HB   HIS  81          1HB       HIS  81   9.911  15.257  -7.576
  570   2HB   HIS  81          2HB       HIS  81   9.031  16.288  -8.687
  571    HD1  HIS  81           1HD      HIS  81  11.514  13.818  -8.819
  572    HD2  HIS  81           2HD      HIS  81  11.206  17.641 -10.518
  573    HE1  HIS  81           1HE      HIS  81  13.119  13.850 -10.803
  574    H    LYS  82           H        LYS  82  11.933  19.104  -6.304
  575    HA   LYS  82           HA       LYS  82  13.074  17.296  -4.387
  576   1HB   LYS  82          1HB       LYS  82  15.283  17.235  -5.167
  577   2HB   LYS  82          2HB       LYS  82  14.309  16.861  -6.574
  578   1HG   LYS  82          1HG       LYS  82  14.457  19.646  -6.679
  579   2HG   LYS  82          2HG       LYS  82  16.033  19.214  -6.049
  580   1HD   LYS  82          1HD       LYS  82  16.594  18.877  -8.239
  581   2HD   LYS  82          2HD       LYS  82  15.768  17.343  -8.054
  582   1HE   LYS  82          1HE       LYS  82  13.978  17.999  -9.339
  583   2HE   LYS  82          2HE       LYS  82  13.939  19.608  -8.648
  584   1HZ   LYS  82          1HZ       LYS  82  15.656  20.287 -10.065
  585   2HZ   LYS  82          2HZ       LYS  82  16.021  18.765 -10.533
  586   3HZ   LYS  82          3HZ       LYS  82  14.622  19.455 -11.017
  587    H    SER  83           H        SER  83  11.451  19.426  -3.889
  588    HA   SER  83           HA       SER  83  13.322  21.566  -3.251
  589   1HB   SER  83          1HB       SER  83  11.099  22.874  -2.870
  590   2HB   SER  83          2HB       SER  83  11.599  22.546  -4.517
  591    HG   SER  83           HG       SER  83   9.506  21.879  -4.542
  592    H    ASP  84           H        ASP  84  13.605  22.195  -1.084
  593    HA   ASP  84           HA       ASP  84  13.186  20.360   0.863
  594   1HB   ASP  84          1HB       ASP  84  13.297  23.394   1.212
  595   2HB   ASP  84          2HB       ASP  84  13.642  22.217   2.464
  596    H    THR  85           H        THR  85  11.224  23.271  -0.055
  597    HA   THR  85           HA       THR  85   9.342  23.105   2.002
  598    HB   THR  85           HB       THR  85   9.937  24.871   0.020
  599    HG1  THR  85           1HG      THR  85   7.256  24.382   1.104
  600   1HG2  THR  85          1HG2      THR  85   8.879  23.536  -1.801
  601   2HG2  THR  85          2HG2      THR  85   7.378  23.425  -0.850
  602   3HG2  THR  85          3HG2      THR  85   7.924  25.002  -1.472
  603    H    CYS  86           H        CYS  86   9.876  21.047  -0.754
  604    HA   CYS  86           HA       CYS  86   7.154  20.089  -0.716
  605   1HB   CYS  86          1HB       CYS  86   8.375  20.335  -2.841
  606   2HB   CYS  86          2HB       CYS  86   9.552  19.151  -2.306
  607    H    ARG  87           H        ARG  87  10.467  18.586  -0.431
  608    HA   ARG  87           HA       ARG  87   9.716  16.217   0.562
  609   1HB   ARG  87          1HB       ARG  87  12.149  17.844   1.461
  610   2HB   ARG  87          2HB       ARG  87  11.990  16.105   1.610
  611   1HG   ARG  87          1HG       ARG  87  11.575  16.133  -0.985
  612   2HG   ARG  87          2HG       ARG  87  12.236  17.755  -0.930
  613   1HD   ARG  87          1HD       ARG  87  14.133  16.387  -1.370
  614   2HD   ARG  87          2HD       ARG  87  14.254  16.723   0.346
  615    HE   ARG  87           HE       ARG  87  13.955  14.448   0.762
  616   1HH1  ARG  87          2HH2      ARG  87  12.643  15.188  -2.418
  617   2HH1  ARG  87          1HH2      ARG  87  12.279  13.536  -2.793
  618   1HH2  ARG  87          2HH1      ARG  87  13.476  12.269   0.268
  619   2HH2  ARG  87          1HH1      ARG  87  12.756  11.865  -1.255
  620    H    ALA  88           H        ALA  88   9.645  19.359   2.160
  621    HA   ALA  88           HA       ALA  88   9.538  18.288   4.818
  622   1HB   ALA  88          1HB       ALA  88   9.244  20.598   5.466
  623   2HB   ALA  88          2HB       ALA  88  10.470  20.544   4.176
  624   3HB   ALA  88          3HB       ALA  88   8.808  21.061   3.803
  625    H    CYS  89           H        CYS  89   7.188  19.938   2.585
  626    HA   CYS  89           HA       CYS  89   4.972  19.744   4.127
  627   1HB   CYS  89          1HB       CYS  89   4.756  20.956   2.162
  628   2HB   CYS  89          2HB       CYS  89   5.399  19.669   1.162
  629    H    MET  90           H        MET  90   6.031  17.347   1.589
  630    HA   MET  90           HA       MET  90   4.172  15.456   2.034
  631   1HB   MET  90          1HB       MET  90   7.122  15.342   1.276
  632   2HB   MET  90          2HB       MET  90   6.210  13.851   1.401
  633   1HG   MET  90          1HG       MET  90   4.457  15.103  -0.153
  634   2HG   MET  90          2HG       MET  90   5.808  16.153  -0.532
  635   1HE   MET  90          1HE       MET  90   5.412  11.681  -1.485
  636   2HE   MET  90          2HE       MET  90   5.063  12.385   0.112
  637   3HE   MET  90          3HE       MET  90   4.067  12.832  -1.295
  638    H    LYS  91           H        LYS  91   7.053  16.201   4.009
  639    HA   LYS  91           HA       LYS  91   7.381  13.948   5.463
  640   1HB   LYS  91          1HB       LYS  91   8.504  16.319   5.558
  641   2HB   LYS  91          2HB       LYS  91   7.354  16.617   6.846
  642   1HG   LYS  91          1HG       LYS  91   8.233  14.874   8.213
  643   2HG   LYS  91          2HG       LYS  91   9.017  14.079   6.862
  644   1HD   LYS  91          1HD       LYS  91  10.882  15.119   7.740
  645   2HD   LYS  91          2HD       LYS  91  10.333  16.434   6.720
  646   1HE   LYS  91          1HE       LYS  91  10.073  17.754   8.545
  647   2HE   LYS  91          2HE       LYS  91   8.879  16.644   9.187
  648   1HZ   LYS  91          1HZ       LYS  91  11.547  17.013   9.989
  649   2HZ   LYS  91          2HZ       LYS  91  10.355  16.184  10.736
  650   3HZ   LYS  91          3HZ       LYS  91  11.288  15.444   9.619
  651    H    THR  92           H        THR  92   5.022  16.606   6.228
  652    HA   THR  92           HA       THR  92   3.671  14.753   8.043
  653    HB   THR  92           HB       THR  92   3.661  17.769   7.585
  654    HG1  THR  92           1HG      THR  92   5.292  16.795   8.966
  655   1HG2  THR  92          1HG2      THR  92   2.194  17.387   9.873
  656   2HG2  THR  92          2HG2      THR  92   1.450  17.688   8.284
  657   3HG2  THR  92          3HG2      THR  92   1.605  16.023   8.893
  658    H    ASN  93           H        ASN  93   2.812  17.061   5.374
  659    HA   ASN  93           HA       ASN  93   0.257  16.477   5.065
  660   1HB   ASN  93          1HB       ASN  93   2.475  17.042   3.100
  661   2HB   ASN  93          2HB       ASN  93   0.941  16.532   2.425
  662   1HD2  ASN  93          1HD2      ASN  93   2.426  18.811   4.693
  663   2HD2  ASN  93          2HD2      ASN  93   1.311  20.118   4.467
  664    H    CYS  94           H        CYS  94   2.963  14.697   3.373
  665    HA   CYS  94           HA       CYS  94   1.120  12.519   2.838
  666   1HB   CYS  94          1HB       CYS  94   3.909  13.116   1.841
  667   2HB   CYS  94          2HB       CYS  94   3.049  11.633   1.478
  668    H    LYS  95           H        LYS  95   1.070  12.103   5.278
  669    HA   LYS  95           HA       LYS  95   3.200  11.489   6.832
  670   1HB   LYS  95          1HB       LYS  95   0.534  11.426   7.156
  671   2HB   LYS  95          2HB       LYS  95   0.823   9.702   7.036
  672   1HG   LYS  95          1HG       LYS  95   2.655  11.304   8.816
  673   2HG   LYS  95          2HG       LYS  95   1.021  11.020   9.380
  674   1HD   LYS  95          1HD       LYS  95   1.618   8.933  10.026
  675   2HD   LYS  95          2HD       LYS  95   1.940   8.517   8.354
  676   1HE   LYS  95          1HE       LYS  95   4.135   8.319   8.894
  677   2HE   LYS  95          2HE       LYS  95   4.184  10.055   9.128
  678   1HZ   LYS  95          1HZ       LYS  95   4.866   9.121  11.123
  679   2HZ   LYS  95          2HZ       LYS  95   3.323   9.565  11.419
  680   3HZ   LYS  95          3HZ       LYS  95   3.683   7.996  11.146
  Start of MODEL    3
    1   1H    ILE   1           H        ILE   1 -17.161  14.240   2.946
    2    HA   ILE   1           HA       ILE   1 -15.808  15.794   4.722
    3    HB   ILE   1           HB       ILE   1 -17.578  13.393   5.160
    4   1HG1  ILE   1          1HG1      ILE   1 -18.494  16.143   5.763
    5   2HG1  ILE   1          2HG1      ILE   1 -18.195  15.815   4.068
    6   1HG2  ILE   1          1HG2      ILE   1 -16.469  15.364   7.169
    7   2HG2  ILE   1          2HG2      ILE   1 -17.917  14.371   7.462
    8   3HG2  ILE   1          3HG2      ILE   1 -16.344  13.588   7.178
    9   1HD1  ILE   1          1HD1      ILE   1 -20.249  14.638   5.900
   10   2HD1  ILE   1          2HD1      ILE   1 -20.360  15.028   4.167
   11   3HD1  ILE   1          3HD1      ILE   1 -19.539  13.539   4.693
   12    H    SER   2           H        SER   2 -13.561  15.592   4.726
   13    HA   SER   2           HA       SER   2 -12.656  13.157   6.023
   14   1HB   SER   2          1HB       SER   2 -10.605  13.177   4.570
   15   2HB   SER   2          2HB       SER   2 -12.079  12.818   3.693
   16    HG   SER   2           HG       SER   2 -12.112  15.245   3.234
   17    H    GLU   3           H        GLU   3 -12.481  14.315   8.017
   18    HA   GLU   3           HA       GLU   3 -10.469  16.428   7.939
   19   1HB   GLU   3          1HB       GLU   3 -13.102  16.246   9.343
   20   2HB   GLU   3          2HB       GLU   3 -11.789  16.937  10.275
   21   1HG   GLU   3          1HG       GLU   3 -11.852  18.874   9.087
   22   2HG   GLU   3          2HG       GLU   3 -11.760  18.017   7.561
   23    H    PHE   4           H        PHE   4  -8.905  16.465   9.680
   24    HA   PHE   4           HA       PHE   4  -7.477  15.520  11.068
   25   1HB   PHE   4          1HB       PHE   4 -10.229  14.831  11.986
   26   2HB   PHE   4          2HB       PHE   4  -9.037  13.690  12.577
   27    HD1  PHE   4           1HD      PHE   4  -6.770  15.036  13.402
   28    HD2  PHE   4           2HD      PHE   4 -10.751  16.504  13.466
   29    HE1  PHE   4           1HE      PHE   4  -6.152  16.633  15.237
   30    HE2  PHE   4           2HE      PHE   4 -10.133  18.101  15.301
   31    HZ   PHE   4           HZ       PHE   4  -7.841  18.147  16.164
   32    H    ALA   5           H        ALA   5  -6.497  13.362  11.884
   33    HA   ALA   5           HA       ALA   5  -5.717  11.332  11.470
   34   1HB   ALA   5          1HB       ALA   5  -8.398  10.990  11.314
   35   2HB   ALA   5          2HB       ALA   5  -7.944  10.522   9.658
   36   3HB   ALA   5          3HB       ALA   5  -7.234   9.670  11.050
   37    HA   PRO   6           HA       PRO   6  -3.740  11.747   7.647
   38   1HB   PRO   6          1HB       PRO   6  -2.490   9.329   7.401
   39   2HB   PRO   6          2HB       PRO   6  -1.874  10.629   8.401
   40   1HG   PRO   6          1HG       PRO   6  -3.235   8.139   9.229
   41   2HG   PRO   6          2HG       PRO   6  -2.251   9.224  10.191
   42   1HD   PRO   6          1HD       PRO   6  -5.113   9.033  10.208
   43   2HD   PRO   6          2HD       PRO   6  -4.135  10.195  11.082
   44    H    VAL   7           H        VAL   7  -3.322  10.686   5.416
   45    HA   VAL   7           HA       VAL   7  -5.889  10.249   4.355
   46    HB   VAL   7           HB       VAL   7  -3.844  11.246   3.251
   47   1HG1  VAL   7          1HG1      VAL   7  -2.385   9.243   3.956
   48   2HG1  VAL   7          2HG1      VAL   7  -3.105   8.397   2.565
   49   3HG1  VAL   7          3HG1      VAL   7  -2.169   9.890   2.312
   50   1HG2  VAL   7          1HG2      VAL   7  -4.854   9.122   1.420
   51   2HG2  VAL   7          2HG2      VAL   7  -6.064  10.181   2.184
   52   3HG2  VAL   7          3HG2      VAL   7  -4.762  10.885   1.196
   53    H    ASP   8           H        ASP   8  -3.604   8.186   5.966
   54    HA   ASP   8           HA       ASP   8  -3.436   6.031   6.226
   55   1HB   ASP   8          1HB       ASP   8  -5.860   6.677   7.073
   56   2HB   ASP   8          2HB       ASP   8  -6.410   5.768   5.680
   57    H    CYS   9           H        CYS   9  -2.373   6.055   3.943
   58    HA   CYS   9           HA       CYS   9  -3.744   5.452   1.645
   59   1HB   CYS   9          1HB       CYS   9  -0.928   4.956   2.557
   60   2HB   CYS   9          2HB       CYS   9  -1.474   4.318   1.019
   61    H    LYS  10           H        LYS  10  -2.401   3.333   4.245
   62    HA   LYS  10           HA       LYS  10  -2.743   0.884   3.081
   63   1HB   LYS  10          1HB       LYS  10  -1.995   1.838   5.549
   64   2HB   LYS  10          2HB       LYS  10  -3.491   1.009   5.929
   65   1HG   LYS  10          1HG       LYS  10  -2.537  -0.959   4.485
   66   2HG   LYS  10          2HG       LYS  10  -0.995  -0.139   4.624
   67   1HD   LYS  10          1HD       LYS  10  -0.702  -1.051   6.676
   68   2HD   LYS  10          2HD       LYS  10  -2.107  -0.181   7.258
   69   1HE   LYS  10          1HE       LYS  10  -3.589  -2.034   6.461
   70   2HE   LYS  10          2HE       LYS  10  -2.187  -2.903   5.870
   71   1HZ   LYS  10          1HZ       LYS  10  -1.912  -3.693   7.888
   72   2HZ   LYS  10          2HZ       LYS  10  -1.710  -2.195   8.506
   73   3HZ   LYS  10          3HZ       LYS  10  -3.201  -2.859   8.446
   74    H    GLY  11           H        GLY  11  -5.156   2.567   5.223
   75   1HA   GLY  11          1HA       GLY  11  -7.240   0.759   4.718
   76   2HA   GLY  11          2HA       GLY  11  -7.393   2.390   5.339
   77    H    GLN  12           H        GLN  12  -6.441   3.990   3.254
   78    HA   GLN  12           HA       GLN  12  -8.625   4.203   1.655
   79   1HB   GLN  12          1HB       GLN  12  -6.896   5.967   2.015
   80   2HB   GLN  12          2HB       GLN  12  -5.771   5.071   1.013
   81   1HG   GLN  12          1HG       GLN  12  -6.640   6.046  -0.837
   82   2HG   GLN  12          2HG       GLN  12  -8.192   5.305  -0.501
   83   1HE2  GLN  12          1HE2      GLN  12  -7.837   7.805  -1.705
   84   2HE2  GLN  12          2HE2      GLN  12  -8.491   9.043  -0.685
   85    H    CYS  13           H        CYS  13  -5.702   2.204   1.244
   86    HA   CYS  13           HA       CYS  13  -6.487   1.506  -1.450
   87   1HB   CYS  13          1HB       CYS  13  -4.127   0.693   0.256
   88   2HB   CYS  13          2HB       CYS  13  -4.425   0.075  -1.357
   89    H    THR  14           H        THR  14  -8.631   0.694  -0.389
   90    HA   THR  14           HA       THR  14  -8.274  -1.931   0.864
   91    HB   THR  14           HB       THR  14 -10.485   0.153   0.717
   92    HG1  THR  14           1HG      THR  14  -9.769   0.254   2.815
   93   1HG2  THR  14          1HG2      THR  14 -11.265  -2.082   2.345
   94   2HG2  THR  14          2HG2      THR  14 -12.106  -1.444   0.912
   95   3HG2  THR  14          3HG2      THR  14 -10.885  -2.726   0.730
   96    H    THR  15           H        THR  15  -9.705  -0.296  -1.994
   97    HA   THR  15           HA       THR  15 -10.879  -2.670  -3.014
   98    HB   THR  15           HB       THR  15 -10.393   0.171  -3.848
   99    HG1  THR  15           1HG      THR  15 -12.523  -1.813  -4.218
  100   1HG2  THR  15          1HG2      THR  15  -9.614  -1.115  -5.875
  101   2HG2  THR  15          2HG2      THR  15 -11.132  -2.044  -5.832
  102   3HG2  THR  15          3HG2      THR  15 -11.169  -0.294  -6.156
  103    HA   PRO  16           HA       PRO  16  -6.865  -2.879  -5.476
  104   1HB   PRO  16          1HB       PRO  16  -4.696  -1.434  -4.654
  105   2HB   PRO  16          2HB       PRO  16  -5.783  -0.895  -5.919
  106   1HG   PRO  16          1HG       PRO  16  -5.574   0.053  -3.127
  107   2HG   PRO  16          2HG       PRO  16  -6.329   0.838  -4.500
  108   1HD   PRO  16          1HD       PRO  16  -7.661  -0.536  -2.363
  109   2HD   PRO  16          2HD       PRO  16  -8.406   0.149  -3.794
  110    H    CYS  17           H        CYS  17  -7.152  -2.937  -2.142
  111    HA   CYS  17           HA       CYS  17  -5.183  -5.106  -2.090
  112   1HB   CYS  17          1HB       CYS  17  -5.829  -3.374   0.291
  113   2HB   CYS  17          2HB       CYS  17  -4.530  -4.537   0.113
  114    H    GLU  18           H        GLU  18  -8.227  -4.819  -2.614
  115    HA   GLU  18           HA       GLU  18  -9.526  -5.778  -0.335
  116   1HB   GLU  18          1HB       GLU  18 -10.218  -4.978  -2.987
  117   2HB   GLU  18          2HB       GLU  18 -10.859  -6.596  -2.781
  118   1HG   GLU  18          1HG       GLU  18 -11.865  -5.818  -0.559
  119   2HG   GLU  18          2HG       GLU  18 -11.375  -4.189  -0.977
  120    HA   PRO  19           HA       PRO  19  -8.892  -9.996  -2.419
  121   1HB   PRO  19          1HB       PRO  19  -7.171 -10.226  -4.529
  122   2HB   PRO  19          2HB       PRO  19  -8.902 -10.040  -4.721
  123   1HG   PRO  19          1HG       PRO  19  -6.764  -8.043  -5.145
  124   2HG   PRO  19          2HG       PRO  19  -8.418  -8.020  -5.725
  125   1HD   PRO  19          1HD       PRO  19  -7.346  -6.507  -3.536
  126   2HD   PRO  19          2HD       PRO  19  -9.022  -6.573  -4.043
  127    H    LEU  20           H        LEU  20  -5.969  -8.053  -2.581
  128    HA   LEU  20           HA       LEU  20  -4.195 -10.024  -1.842
  129   1HB   LEU  20          1HB       LEU  20  -3.140  -8.151  -2.529
  130   2HB   LEU  20          2HB       LEU  20  -4.295  -7.071  -1.774
  131    HG   LEU  20           HG       LEU  20  -3.217  -7.838   0.467
  132   1HD1  LEU  20          1HD1      LEU  20  -1.475  -9.209   0.427
  133   2HD1  LEU  20          2HD1      LEU  20  -1.705  -9.405  -1.327
  134   3HD1  LEU  20          3HD1      LEU  20  -0.610  -8.145  -0.708
  135   1HD2  LEU  20          1HD2      LEU  20  -2.932  -5.638  -1.089
  136   2HD2  LEU  20          2HD2      LEU  20  -2.152  -5.856   0.495
  137   3HD2  LEU  20          3HD2      LEU  20  -1.244  -6.195  -0.998
  138    H    THR  21           H        THR  21  -5.881  -7.636   0.323
  139    HA   THR  21           HA       THR  21  -4.979  -8.655   2.716
  140    HB   THR  21           HB       THR  21  -7.590  -7.294   1.887
  141    HG1  THR  21           1HG      THR  21  -5.169  -6.472   3.324
  142   1HG2  THR  21          1HG2      THR  21  -8.302  -7.346   4.057
  143   2HG2  THR  21          2HG2      THR  21  -7.018  -8.530   4.403
  144   3HG2  THR  21          3HG2      THR  21  -6.707  -6.790   4.620
  145    H    ALA  22           H        ALA  22  -7.970  -9.601   0.902
  146    HA   ALA  22           HA       ALA  22  -8.909 -11.446   2.693
  147   1HB   ALA  22          1HB       ALA  22  -9.319 -12.460   0.057
  148   2HB   ALA  22          2HB       ALA  22 -10.443 -11.507   1.056
  149   3HB   ALA  22          3HB       ALA  22  -9.321 -10.683  -0.053
  150    H    CYS  23           H        CYS  23  -6.083 -11.583   0.571
  151    HA   CYS  23           HA       CYS  23  -5.819 -14.386   0.595
  152   1HB   CYS  23          1HB       CYS  23  -4.725 -12.510  -0.905
  153   2HB   CYS  23          2HB       CYS  23  -3.461 -12.567   0.308
  154    H    LYS  24           H        LYS  24  -3.865 -11.786   2.249
  155    HA   LYS  24           HA       LYS  24  -2.516 -13.437   3.972
  156   1HB   LYS  24          1HB       LYS  24  -3.240 -10.543   3.919
  157   2HB   LYS  24          2HB       LYS  24  -2.647 -11.191   5.435
  158   1HG   LYS  24          1HG       LYS  24  -0.527 -11.613   4.597
  159   2HG   LYS  24          2HG       LYS  24  -1.116 -12.007   2.994
  160   1HD   LYS  24          1HD       LYS  24  -0.433  -9.943   2.341
  161   2HD   LYS  24          2HD       LYS  24  -1.771  -9.290   3.265
  162   1HE   LYS  24          1HE       LYS  24  -0.116  -9.498   5.325
  163   2HE   LYS  24          2HE       LYS  24   1.131  -9.580   4.097
  164   1HZ   LYS  24          1HZ       LYS  24  -0.662  -7.383   4.719
  165   2HZ   LYS  24          2HZ       LYS  24   0.945  -7.357   4.432
  166   3HZ   LYS  24          3HZ       LYS  24  -0.104  -7.519   3.191
  167    H    GLU  25           H        GLU  25  -5.710 -11.796   4.441
  168    HA   GLU  25           HA       GLU  25  -6.142 -12.540   7.010
  169   1HB   GLU  25          1HB       GLU  25  -7.669 -11.479   4.838
  170   2HB   GLU  25          2HB       GLU  25  -8.614 -12.791   5.514
  171   1HG   GLU  25          1HG       GLU  25  -7.327 -10.946   7.496
  172   2HG   GLU  25          2HG       GLU  25  -8.619 -10.256   6.533
  173    H    LYS  26           H        LYS  26  -7.483 -14.302   4.114
  174    HA   LYS  26           HA       LYS  26  -8.500 -16.467   5.307
  175   1HB   LYS  26          1HB       LYS  26  -8.240 -15.797   2.793
  176   2HB   LYS  26          2HB       LYS  26  -6.819 -16.821   2.836
  177   1HG   LYS  26          1HG       LYS  26  -8.049 -18.759   3.044
  178   2HG   LYS  26          2HG       LYS  26  -9.234 -18.022   4.103
  179   1HD   LYS  26          1HD       LYS  26 -10.390 -16.982   2.235
  180   2HD   LYS  26          2HD       LYS  26  -9.093 -17.380   1.126
  181   1HE   LYS  26          1HE       LYS  26  -9.648 -19.891   1.945
  182   2HE   LYS  26          2HE       LYS  26 -11.210 -19.179   2.297
  183   1HZ   LYS  26          1HZ       LYS  26 -10.082 -18.522  -0.269
  184   2HZ   LYS  26          2HZ       LYS  26 -10.544 -20.077  -0.075
  185   3HZ   LYS  26          3HZ       LYS  26 -11.626 -18.872   0.133
  186    H    CYS  27           H        CYS  27  -5.006 -15.896   4.605
  187    HA   CYS  27           HA       CYS  27  -4.188 -18.408   5.553
  188   1HB   CYS  27          1HB       CYS  27  -2.801 -15.809   4.979
  189   2HB   CYS  27          2HB       CYS  27  -1.941 -17.095   5.802
  190    H    ALA  28           H        ALA  28  -4.299 -15.073   6.993
  191    HA   ALA  28           HA       ALA  28  -3.211 -15.571   9.431
  192   1HB   ALA  28          1HB       ALA  28  -5.513 -13.889   9.780
  193   2HB   ALA  28          2HB       ALA  28  -3.805 -13.415   9.623
  194   3HB   ALA  28          3HB       ALA  28  -4.822 -13.569   8.171
  195    H    GLU  29           H        GLU  29  -6.552 -16.289   8.283
  196    HA   GLU  29           HA       GLU  29  -7.515 -17.069  10.767
  197   1HB   GLU  29          1HB       GLU  29  -8.339 -17.520   7.903
  198   2HB   GLU  29          2HB       GLU  29  -9.125 -18.469   9.149
  199   1HG   GLU  29          1HG       GLU  29  -8.952 -15.418   9.107
  200   2HG   GLU  29          2HG       GLU  29 -10.364 -16.354   8.660
  201    H    SER  30           H        SER  30  -6.150 -18.992   8.006
  202    HA   SER  30           HA       SER  30  -6.432 -21.445   9.240
  203   1HB   SER  30          1HB       SER  30  -5.602 -20.566   6.776
  204   2HB   SER  30          2HB       SER  30  -4.069 -21.074   7.455
  205    HG   SER  30           HG       SER  30  -5.681 -23.057   8.091
  206    H    CYS  31           H        CYS  31  -4.026 -18.856   9.572
  207    HA   CYS  31           HA       CYS  31  -2.321 -20.616  11.145
  208   1HB   CYS  31          1HB       CYS  31  -1.931 -18.049   9.696
  209   2HB   CYS  31          2HB       CYS  31  -0.996 -18.281  11.160
  210    H    GLU  32           H        GLU  32  -4.768 -20.269  12.353
  211    HA   GLU  32           HA       GLU  32  -5.350 -18.078  13.745
  212   1HB   GLU  32          1HB       GLU  32  -5.872 -20.917  13.983
  213   2HB   GLU  32          2HB       GLU  32  -5.661 -20.248  15.589
  214   1HG   GLU  32          1HG       GLU  32  -7.267 -18.335  14.775
  215   2HG   GLU  32          2HG       GLU  32  -7.674 -19.427  13.466
  216    H    THR  33           H        THR  33  -2.683 -20.372  14.389
  217    HA   THR  33           HA       THR  33  -1.544 -18.422  16.227
  218    HB   THR  33           HB       THR  33  -1.318 -20.018  18.029
  219    HG1  THR  33           1HG      THR  33  -2.020 -22.276  17.514
  220   1HG2  THR  33          1HG2      THR  33  -3.711 -19.170  17.745
  221   2HG2  THR  33          2HG2      THR  33  -4.052 -20.638  16.797
  222   3HG2  THR  33          3HG2      THR  33  -3.600 -20.772  18.513
  223    H    SER  34           H        SER  34  -1.067 -21.758  14.872
  224    HA   SER  34           HA       SER  34   0.695 -22.707  14.020
  225   1HB   SER  34          1HB       SER  34   0.081 -20.881  12.282
  226   2HB   SER  34          2HB       SER  34   1.480 -20.004  12.868
  227    HG   SER  34           HG       SER  34   1.708 -21.574  10.952
  228    H    ALA  35           H        ALA  35   3.328 -22.272  13.582
  229    HA   ALA  35           HA       ALA  35   4.316 -21.781  16.244
  230   1HB   ALA  35          1HB       ALA  35   6.234 -22.910  15.518
  231   2HB   ALA  35          2HB       ALA  35   4.956 -23.664  14.534
  232   3HB   ALA  35          3HB       ALA  35   6.007 -22.415  13.823
  233    H    ASP  36           H        ASP  36   4.578 -20.362  12.935
  234    HA   ASP  36           HA       ASP  36   5.630 -17.985  14.246
  235   1HB   ASP  36          1HB       ASP  36   6.452 -19.028  11.495
  236   2HB   ASP  36          2HB       ASP  36   7.065 -17.578  12.264
  237    H    LYS  37           H        LYS  37   3.129 -17.629  14.112
  238    HA   LYS  37           HA       LYS  37   1.657 -17.524  11.849
  239   1HB   LYS  37          1HB       LYS  37   1.384 -16.685  14.480
  240   2HB   LYS  37          2HB       LYS  37   1.205 -15.197  13.573
  241   1HG   LYS  37          1HG       LYS  37  -0.420 -16.542  12.033
  242   2HG   LYS  37          2HG       LYS  37  -0.418 -17.756  13.297
  243   1HD   LYS  37          1HD       LYS  37  -1.896 -16.550  14.522
  244   2HD   LYS  37          2HD       LYS  37  -0.813 -15.172  14.536
  245   1HE   LYS  37          1HE       LYS  37  -1.691 -14.761  12.077
  246   2HE   LYS  37          2HE       LYS  37  -3.006 -15.823  12.540
  247   1HZ   LYS  37          1HZ       LYS  37  -2.233 -13.320  13.865
  248   2HZ   LYS  37          2HZ       LYS  37  -3.609 -13.611  13.036
  249   3HZ   LYS  37          3HZ       LYS  37  -3.348 -14.350  14.468
  250    H    LYS  38           H        LYS  38   3.774 -14.863  13.126
  251    HA   LYS  38           HA       LYS  38   3.334 -13.001  11.210
  252   1HB   LYS  38          1HB       LYS  38   5.372 -13.592  13.173
  253   2HB   LYS  38          2HB       LYS  38   6.114 -12.947  11.722
  254   1HG   LYS  38          1HG       LYS  38   5.543 -11.042  13.073
  255   2HG   LYS  38          2HG       LYS  38   4.374 -11.073  11.768
  256   1HD   LYS  38          1HD       LYS  38   3.426 -12.698  14.007
  257   2HD   LYS  38          2HD       LYS  38   3.836 -11.087  14.562
  258   1HE   LYS  38          1HE       LYS  38   2.387 -10.079  12.820
  259   2HE   LYS  38          2HE       LYS  38   2.035 -11.664  12.160
  260   1HZ   LYS  38          1HZ       LYS  38   0.629 -10.434  14.086
  261   2HZ   LYS  38          2HZ       LYS  38   0.556 -12.029  13.747
  262   3HZ   LYS  38          3HZ       LYS  38   1.522 -11.494  14.950
  263    H    THR  39           H        THR  39   6.164 -15.278  11.050
  264    HA   THR  39           HA       THR  39   6.833 -14.797   8.445
  265    HB   THR  39           HB       THR  39   6.937 -17.488   9.903
  266    HG1  THR  39           1HG      THR  39   8.267 -16.339  11.245
  267   1HG2  THR  39          1HG2      THR  39   7.817 -17.048   7.391
  268   2HG2  THR  39          2HG2      THR  39   9.164 -16.274   8.261
  269   3HG2  THR  39          3HG2      THR  39   8.787 -17.990   8.549
  270    H    CYS  40           H        CYS  40   4.398 -17.169   9.669
  271    HA   CYS  40           HA       CYS  40   3.807 -18.358   7.287
  272   1HB   CYS  40          1HB       CYS  40   2.792 -19.366   9.065
  273   2HB   CYS  40          2HB       CYS  40   2.311 -17.854   9.808
  274    H    ARG  41           H        ARG  41   1.995 -15.590   8.826
  275    HA   ARG  41           HA       ARG  41   0.349 -14.998   6.827
  276   1HB   ARG  41          1HB       ARG  41   1.846 -13.210   8.777
  277   2HB   ARG  41          2HB       ARG  41   0.743 -12.496   7.617
  278   1HG   ARG  41          1HG       ARG  41  -1.033 -14.165   8.456
  279   2HG   ARG  41          2HG       ARG  41   0.077 -14.572   9.750
  280   1HD   ARG  41          1HD       ARG  41  -0.984 -12.865  10.865
  281   2HD   ARG  41          2HD       ARG  41   0.115 -11.841   9.963
  282    HE   ARG  41           HE       ARG  41  -2.242 -12.406   8.387
  283   1HH1  ARG  41          2HH2      ARG  41  -1.116 -10.461  11.095
  284   2HH1  ARG  41          1HH2      ARG  41  -2.300  -9.219  10.860
  285   1HH2  ARG  41          2HH1      ARG  41  -3.804 -10.768   8.077
  286   2HH2  ARG  41          1HH1      ARG  41  -3.840  -9.394   9.132
  287    H    ARG  42           H        ARG  42   3.822 -14.066   7.118
  288    HA   ARG  42           HA       ARG  42   3.824 -12.375   4.913
  289   1HB   ARG  42          1HB       ARG  42   5.914 -13.822   6.542
  290   2HB   ARG  42          2HB       ARG  42   6.418 -13.139   5.009
  291   1HG   ARG  42          1HG       ARG  42   6.363 -11.013   5.824
  292   2HG   ARG  42          2HG       ARG  42   4.763 -11.233   6.503
  293   1HD   ARG  42          1HD       ARG  42   5.573 -11.734   8.599
  294   2HD   ARG  42          2HD       ARG  42   6.892 -12.702   7.971
  295    HE   ARG  42           HE       ARG  42   7.215  -9.830   7.468
  296   1HH1  ARG  42          2HH2      ARG  42   7.792 -12.448   9.747
  297   2HH1  ARG  42          1HH2      ARG  42   9.096 -11.635  10.547
  298   1HH2  ARG  42          2HH1      ARG  42   8.935  -8.757   8.522
  299   2HH2  ARG  42          1HH1      ARG  42   9.751  -9.522   9.845
  300    H    ASN  43           H        ASN  43   4.971 -15.809   5.332
  301    HA   ASN  43           HA       ASN  43   5.821 -16.311   2.850
  302   1HB   ASN  43          1HB       ASN  43   4.654 -17.899   5.062
  303   2HB   ASN  43          2HB       ASN  43   4.393 -18.652   3.501
  304   1HD2  ASN  43          1HD2      ASN  43   6.636 -17.826   5.955
  305   2HD2  ASN  43          2HD2      ASN  43   8.063 -18.539   5.279
  306    H    CYS  44           H        CYS  44   2.430 -16.315   4.107
  307    HA   CYS  44           HA       CYS  44   1.087 -17.422   2.042
  308   1HB   CYS  44          1HB       CYS  44   0.098 -16.651   4.166
  309   2HB   CYS  44          2HB       CYS  44   0.236 -14.989   3.627
  310    H    LYS  45           H        LYS  45   2.626 -14.200   2.293
  311    HA   LYS  45           HA       LYS  45   1.436 -12.972   0.117
  312   1HB   LYS  45          1HB       LYS  45   3.107 -12.138   1.986
  313   2HB   LYS  45          2HB       LYS  45   4.324 -12.500   0.780
  314   1HG   LYS  45          1HG       LYS  45   3.433 -10.932  -0.780
  315   2HG   LYS  45          2HG       LYS  45   1.876 -10.874   0.022
  316   1HD   LYS  45          1HD       LYS  45   2.578  -9.070   1.199
  317   2HD   LYS  45          2HD       LYS  45   3.773 -10.076   1.992
  318   1HE   LYS  45          1HE       LYS  45   4.438  -9.124  -0.782
  319   2HE   LYS  45          2HE       LYS  45   4.441  -7.915   0.487
  320   1HZ   LYS  45          1HZ       LYS  45   6.418  -9.698  -0.049
  321   2HZ   LYS  45          2HZ       LYS  45   6.314  -8.739   1.269
  322   3HZ   LYS  45          3HZ       LYS  45   5.745 -10.268   1.325
  323    H    LYS  46           H        LYS  46   4.219 -15.247   0.319
  324    HA   LYS  46           HA       LYS  46   4.557 -15.092  -2.555
  325   1HB   LYS  46          1HB       LYS  46   6.091 -16.256  -0.261
  326   2HB   LYS  46          2HB       LYS  46   6.330 -16.943  -1.855
  327   1HG   LYS  46          1HG       LYS  46   6.310 -13.997  -1.927
  328   2HG   LYS  46          2HG       LYS  46   7.542 -14.611  -0.842
  329   1HD   LYS  46          1HD       LYS  46   8.569 -15.930  -2.591
  330   2HD   LYS  46          2HD       LYS  46   7.200 -15.710  -3.663
  331   1HE   LYS  46          1HE       LYS  46   7.827 -13.552  -4.265
  332   2HE   LYS  46          2HE       LYS  46   8.539 -13.202  -2.703
  333   1HZ   LYS  46          1HZ       LYS  46   9.720 -15.029  -4.678
  334   2HZ   LYS  46          2HZ       LYS  46  10.174 -13.475  -4.466
  335   3HZ   LYS  46          3HZ       LYS  46  10.399 -14.562  -3.268
  336    H    ALA  47           H        ALA  47   2.940 -17.017  -0.097
  337    HA   ALA  47           HA       ALA  47   2.792 -19.482  -1.229
  338   1HB   ALA  47          1HB       ALA  47   0.613 -17.872   0.160
  339   2HB   ALA  47          2HB       ALA  47   0.582 -19.635  -0.083
  340   3HB   ALA  47          3HB       ALA  47   1.835 -18.900   0.945
  341    H    ASP  48           H        ASP  48   0.415 -16.784  -1.805
  342    HA   ASP  48           HA       ASP  48   0.401 -17.310  -4.562
  343   1HB   ASP  48          1HB       ASP  48  -1.797 -18.438  -2.823
  344   2HB   ASP  48          2HB       ASP  48  -2.236 -17.789  -4.391
  345    H    CYS  49           H        CYS  49   0.894 -14.999  -3.066
  346    HA   CYS  49           HA       CYS  49  -1.431 -13.393  -3.750
  347   1HB   CYS  49          1HB       CYS  49  -0.046 -12.734  -1.191
  348   2HB   CYS  49          2HB       CYS  49  -1.675 -12.361  -1.717
  349    H    GLU  50           H        GLU  50   0.988 -13.859  -5.208
  350    HA   GLU  50           HA       GLU  50   2.841 -11.815  -4.525
  351   1HB   GLU  50          1HB       GLU  50   2.659 -14.042  -6.449
  352   2HB   GLU  50          2HB       GLU  50   3.409 -12.619  -7.145
  353   1HG   GLU  50          1HG       GLU  50   4.595 -12.753  -4.617
  354   2HG   GLU  50          2HG       GLU  50   4.425 -14.444  -5.046
  355    HA   PRO  51           HA       PRO  51   0.728  -9.846  -8.299
  356   1HB   PRO  51          1HB       PRO  51  -1.638 -10.872  -9.203
  357   2HB   PRO  51          2HB       PRO  51  -0.086 -11.275  -9.910
  358   1HG   PRO  51          1HG       PRO  51  -1.795 -12.909  -8.137
  359   2HG   PRO  51          2HG       PRO  51  -0.484 -13.425  -9.179
  360   1HD   PRO  51          1HD       PRO  51  -0.390 -13.114  -6.329
  361   2HD   PRO  51          2HD       PRO  51   0.950 -13.518  -7.384
  362    H    GLN  52           H        GLN  52  -1.847 -11.235  -6.315
  363    HA   GLN  52           HA       GLN  52  -3.474  -9.097  -6.261
  364   1HB   GLN  52          1HB       GLN  52  -2.789 -11.008  -3.986
  365   2HB   GLN  52          2HB       GLN  52  -4.164  -9.921  -3.960
  366   1HG   GLN  52          1HG       GLN  52  -5.018 -10.981  -6.076
  367   2HG   GLN  52          2HG       GLN  52  -3.661 -12.090  -6.054
  368   1HE2  GLN  52          1HE2      GLN  52  -4.763 -13.946  -5.788
  369   2HE2  GLN  52          2HE2      GLN  52  -5.675 -14.373  -4.379
  370    H    ASP  53           H        ASP  53  -0.506  -9.650  -4.287
  371    HA   ASP  53           HA       ASP  53  -0.841  -7.452  -2.643
  372   1HB   ASP  53          1HB       ASP  53   0.820  -9.417  -2.445
  373   2HB   ASP  53          2HB       ASP  53   1.818  -8.583  -3.619
  374    H    LYS  54           H        LYS  54   0.703  -7.953  -5.864
  375    HA   LYS  54           HA       LYS  54   1.957  -5.463  -6.051
  376   1HB   LYS  54          1HB       LYS  54   1.032  -7.492  -8.089
  377   2HB   LYS  54          2HB       LYS  54   1.815  -5.997  -8.563
  378   1HG   LYS  54          1HG       LYS  54   3.798  -6.550  -7.197
  379   2HG   LYS  54          2HG       LYS  54   3.008  -7.985  -6.573
  380   1HD   LYS  54          1HD       LYS  54   2.765  -8.624  -9.147
  381   2HD   LYS  54          2HD       LYS  54   4.064  -7.468  -9.363
  382   1HE   LYS  54          1HE       LYS  54   4.787  -9.113  -7.123
  383   2HE   LYS  54          2HE       LYS  54   4.213 -10.193  -8.378
  384   1HZ   LYS  54          1HZ       LYS  54   6.486  -8.406  -8.415
  385   2HZ   LYS  54          2HZ       LYS  54   6.341  -9.916  -9.018
  386   3HZ   LYS  54          3HZ       LYS  54   5.711  -8.648  -9.832
  387    H    VAL  55           H        VAL  55  -1.195  -6.601  -7.465
  388    HA   VAL  55           HA       VAL  55  -2.026  -4.276  -8.566
  389    HB   VAL  55           HB       VAL  55  -3.602  -6.369  -7.059
  390   1HG1  VAL  55          1HG1      VAL  55  -5.597  -5.515  -7.857
  391   2HG1  VAL  55          2HG1      VAL  55  -4.694  -4.020  -7.511
  392   3HG1  VAL  55          3HG1      VAL  55  -4.813  -4.621  -9.182
  393   1HG2  VAL  55          1HG2      VAL  55  -3.412  -6.095 -10.054
  394   2HG2  VAL  55          2HG2      VAL  55  -2.136  -6.932  -9.138
  395   3HG2  VAL  55          3HG2      VAL  55  -3.813  -7.523  -9.071
  396    H    CYS  56           H        CYS  56  -1.674  -5.062  -5.137
  397    HA   CYS  56           HA       CYS  56  -3.264  -2.820  -4.311
  398   1HB   CYS  56          1HB       CYS  56  -3.386  -4.625  -2.844
  399   2HB   CYS  56          2HB       CYS  56  -1.661  -4.929  -2.899
  400    H    ASP  57           H        ASP  57   0.224  -3.842  -3.997
  401    HA   ASP  57           HA       ASP  57   1.306  -1.687  -2.950
  402   1HB   ASP  57          1HB       ASP  57   2.184  -3.634  -5.033
  403   2HB   ASP  57          2HB       ASP  57   3.134  -2.164  -4.971
  404    H    ALA  58           H        ALA  58  -0.106  -2.004  -6.201
  405    HA   ALA  58           HA       ALA  58   1.066   0.192  -7.445
  406   1HB   ALA  58          1HB       ALA  58  -0.260  -0.492  -9.137
  407   2HB   ALA  58          2HB       ALA  58  -0.802  -1.793  -8.050
  408   3HB   ALA  58          3HB       ALA  58  -1.736  -0.282  -8.166
  409    H    CYS  59           H        CYS  59  -2.104  -0.077  -5.679
  410    HA   CYS  59           HA       CYS  59  -2.836   2.544  -5.889
  411   1HB   CYS  59          1HB       CYS  59  -4.389   0.963  -5.068
  412   2HB   CYS  59          2HB       CYS  59  -3.343   0.491  -3.743
  413    H    ARG  60           H        ARG  60  -1.157   0.962  -3.063
  414    HA   ARG  60           HA       ARG  60  -0.669   3.164  -1.623
  415   1HB   ARG  60          1HB       ARG  60   1.056   0.684  -2.058
  416   2HB   ARG  60          2HB       ARG  60   1.471   1.893  -0.858
  417   1HG   ARG  60          1HG       ARG  60  -1.134   1.530  -0.180
  418   2HG   ARG  60          2HG       ARG  60  -0.829  -0.042  -0.892
  419   1HD   ARG  60          1HD       ARG  60  -0.100  -0.532   1.245
  420   2HD   ARG  60          2HD       ARG  60   1.404   0.131   0.639
  421    HE   ARG  60           HE       ARG  60  -0.432   2.129   1.786
  422   1HH1  ARG  60          2HH2      ARG  60   2.252  -0.065   2.392
  423   2HH1  ARG  60          1HH2      ARG  60   2.791   0.779   3.805
  424   1HH2  ARG  60          2HH1      ARG  60   0.278   3.244   3.650
  425   2HH2  ARG  60          1HH1      ARG  60   1.660   2.674   4.526
  426    H    MET  61           H        MET  61   1.375   1.798  -4.292
  427    HA   MET  61           HA       MET  61   3.479   3.501  -4.119
  428   1HB   MET  61          1HB       MET  61   2.135   1.878  -6.250
  429   2HB   MET  61          2HB       MET  61   3.169   3.152  -6.864
  430   1HG   MET  61          1HG       MET  61   4.564   1.836  -4.695
  431   2HG   MET  61          2HG       MET  61   3.950   0.600  -5.776
  432   1HE   MET  61          1HE       MET  61   4.935   2.139  -9.189
  433   2HE   MET  61          2HE       MET  61   5.192   0.464  -8.642
  434   3HE   MET  61          3HE       MET  61   3.683   1.313  -8.230
  435    H    LYS  62           H        LYS  62   0.242   4.057  -5.549
  436    HA   LYS  62           HA       LYS  62   1.065   6.614  -6.615
  437   1HB   LYS  62          1HB       LYS  62  -1.309   4.834  -6.826
  438   2HB   LYS  62          2HB       LYS  62  -1.613   6.554  -6.970
  439   1HG   LYS  62          1HG       LYS  62  -1.153   5.809  -9.199
  440   2HG   LYS  62          2HG       LYS  62   0.300   6.642  -8.684
  441   1HD   LYS  62          1HD       LYS  62   0.464   3.848  -7.887
  442   2HD   LYS  62          2HD       LYS  62   0.063   3.939  -9.590
  443   1HE   LYS  62          1HE       LYS  62   2.155   5.883  -8.833
  444   2HE   LYS  62          2HE       LYS  62   2.625   4.233  -8.477
  445   1HZ   LYS  62          1HZ       LYS  62   1.767   5.305 -11.068
  446   2HZ   LYS  62          2HZ       LYS  62   3.222   4.671 -10.682
  447   3HZ   LYS  62          3HZ       LYS  62   1.910   3.703 -10.783
  448    H    CYS  63           H        CYS  63  -1.260   5.360  -4.121
  449    HA   CYS  63           HA       CYS  63  -2.208   7.676  -3.162
  450   1HB   CYS  63          1HB       CYS  63  -2.823   5.412  -2.383
  451   2HB   CYS  63          2HB       CYS  63  -1.325   5.323  -1.478
  452    H    HIS  64           H        HIS  64   0.902   6.046  -2.217
  453    HA   HIS  64           HA       HIS  64   1.785   7.758  -0.332
  454   1HB   HIS  64          1HB       HIS  64   2.823   5.617  -1.441
  455   2HB   HIS  64          2HB       HIS  64   3.684   6.769  -2.442
  456    HD1  HIS  64           1HD      HIS  64   5.991   7.039  -1.546
  457    HD2  HIS  64           2HD      HIS  64   3.144   6.742   1.521
  458    HE1  HIS  64           1HE      HIS  64   7.271   7.300   0.646
  459    H    LYS  65           H        LYS  65   2.792   8.048  -3.817
  460    HA   LYS  65           HA       LYS  65   3.844  10.584  -3.565
  461   1HB   LYS  65          1HB       LYS  65   2.729   9.030  -5.899
  462   2HB   LYS  65          2HB       LYS  65   3.352  10.654  -6.105
  463   1HG   LYS  65          1HG       LYS  65   5.546  10.025  -5.696
  464   2HG   LYS  65          2HG       LYS  65   5.094   8.791  -4.535
  465   1HD   LYS  65          1HD       LYS  65   5.520   7.279  -6.181
  466   2HD   LYS  65          2HD       LYS  65   4.008   7.794  -6.902
  467   1HE   LYS  65          1HE       LYS  65   5.465   9.719  -7.985
  468   2HE   LYS  65          2HE       LYS  65   6.826   8.688  -7.590
  469   1HZ   LYS  65          1HZ       LYS  65   6.233   7.220  -9.141
  470   2HZ   LYS  65          2HZ       LYS  65   4.629   7.355  -8.866
  471   3HZ   LYS  65          3HZ       LYS  65   5.394   8.458  -9.798
  472    H    ALA  66           H        ALA  66   0.495   9.546  -4.459
  473    HA   ALA  66           HA       ALA  66  -0.614  11.926  -5.089
  474   1HB   ALA  66          1HB       ALA  66  -1.472   9.330  -4.199
  475   2HB   ALA  66          2HB       ALA  66  -2.449  10.567  -3.373
  476   3HB   ALA  66          3HB       ALA  66  -2.373  10.535  -5.151
  477    H    CYS  67           H        CYS  67  -0.438  10.557  -1.721
  478    HA   CYS  67           HA       CYS  67  -1.437  12.780  -0.456
  479   1HB   CYS  67          1HB       CYS  67  -1.072  10.521   0.536
  480   2HB   CYS  67          2HB       CYS  67   0.642  10.871   0.631
  481    H    ARG  68           H        ARG  68   1.942  11.885  -1.391
  482    HA   ARG  68           HA       ARG  68   3.347  13.775  -0.157
  483   1HB   ARG  68          1HB       ARG  68   4.001  11.951  -1.977
  484   2HB   ARG  68          2HB       ARG  68   3.860  13.281  -3.109
  485   1HG   ARG  68          1HG       ARG  68   5.384  14.510  -1.223
  486   2HG   ARG  68          2HG       ARG  68   5.870  12.854  -0.916
  487   1HD   ARG  68          1HD       ARG  68   5.859  14.018  -3.733
  488   2HD   ARG  68          2HD       ARG  68   7.243  14.190  -2.673
  489    HE   ARG  68           HE       ARG  68   6.603  11.456  -2.604
  490   1HH1  ARG  68          2HH2      ARG  68   7.524  13.794  -5.068
  491   2HH1  ARG  68          1HH2      ARG  68   8.289  12.616  -6.081
  492   1HH2  ARG  68          2HH1      ARG  68   7.613   9.902  -3.941
  493   2HH2  ARG  68          1HH1      ARG  68   8.340  10.388  -5.436
  494    H    ALA  69           H        ALA  69   1.126  14.181  -2.916
  495    HA   ALA  69           HA       ALA  69   1.901  16.995  -3.134
  496   1HB   ALA  69          1HB       ALA  69   0.105  15.307  -4.920
  497   2HB   ALA  69          2HB       ALA  69   0.731  16.937  -5.265
  498   3HB   ALA  69          3HB       ALA  69   1.848  15.553  -5.185
  499    H    ALA  70           H        ALA  70  -0.692  14.748  -2.186
  500    HA   ALA  70           HA       ALA  70  -2.785  16.599  -2.116
  501   1HB   ALA  70          1HB       ALA  70  -2.516  13.911  -1.766
  502   2HB   ALA  70          2HB       ALA  70  -2.724  14.433  -0.077
  503   3HB   ALA  70          3HB       ALA  70  -3.965  14.829  -1.291
  504    H    ASN  71           H        ASN  71  -1.152  15.183   0.799
  505    HA   ASN  71           HA       ASN  71  -1.909  17.428   2.320
  506   1HB   ASN  71          1HB       ASN  71  -0.568  14.820   2.750
  507   2HB   ASN  71          2HB       ASN  71   0.104  16.083   3.762
  508   1HD2  ASN  71          1HD2      ASN  71  -2.383  13.868   3.327
  509   2HD2  ASN  71          2HD2      ASN  71  -3.476  14.388   4.565
  510    H    CYS  72           H        CYS  72   1.353  15.960   1.566
  511    HA   CYS  72           HA       CYS  72   2.678  18.392   2.221
  512   1HB   CYS  72          1HB       CYS  72   3.743  15.887   0.898
  513   2HB   CYS  72          2HB       CYS  72   4.711  17.207   1.524
  514    H    ALA  73           H        ALA  73   4.251  19.401   0.539
  515    HA   ALA  73           HA       ALA  73   3.697  19.037  -2.209
  516   1HB   ALA  73          1HB       ALA  73   2.357  20.881  -2.713
  517   2HB   ALA  73          2HB       ALA  73   1.634  20.312  -1.189
  518   3HB   ALA  73          3HB       ALA  73   2.740  21.707  -1.183
  519    H    SER  74           H        SER  74   4.483  21.778   0.056
  520    HA   SER  74           HA       SER  74   6.617  22.602  -1.562
  521   1HB   SER  74          1HB       SER  74   5.237  23.513   0.801
  522   2HB   SER  74          2HB       SER  74   6.956  23.539   1.140
  523    HG   SER  74           HG       SER  74   5.691  25.424  -0.098
  524    H    GLU  75           H        GLU  75   6.288  20.528   1.352
  525    HA   GLU  75           HA       GLU  75   8.972  20.392   1.984
  526   1HB   GLU  75          1HB       GLU  75   6.623  18.528   2.450
  527   2HB   GLU  75          2HB       GLU  75   8.227  18.104   3.012
  528   1HG   GLU  75          1HG       GLU  75   6.900  19.272   4.776
  529   2HG   GLU  75          2HG       GLU  75   8.361  20.150   4.367
  530    H    CYS  76           H        CYS  76   7.109  18.952  -0.623
  531    HA   CYS  76           HA       CYS  76   9.539  17.585  -1.479
  532   1HB   CYS  76          1HB       CYS  76   6.931  16.233  -1.996
  533   2HB   CYS  76          2HB       CYS  76   8.546  15.561  -1.896
  534    HA   PRO  77           HA       PRO  77   7.759  20.218  -4.693
  535   1HB   PRO  77          1HB       PRO  77  10.093  21.385  -5.504
  536   2HB   PRO  77          2HB       PRO  77   9.042  22.088  -4.291
  537   1HG   PRO  77          1HG       PRO  77  11.626  20.700  -3.925
  538   2HG   PRO  77          2HG       PRO  77  10.783  21.762  -2.814
  539   1HD   PRO  77          1HD       PRO  77  10.925  18.900  -2.679
  540   2HD   PRO  77          2HD       PRO  77   9.988  19.953  -1.638
  541    H    LYS  78           H        LYS  78   8.983  20.675  -7.086
  542    HA   LYS  78           HA       LYS  78   8.550  18.304  -8.387
  543   1HB   LYS  78          1HB       LYS  78   8.913  20.809  -9.188
  544   2HB   LYS  78          2HB       LYS  78  10.547  20.250  -9.483
  545   1HG   LYS  78          1HG       LYS  78   8.899  18.184 -10.500
  546   2HG   LYS  78          2HG       LYS  78   8.089  19.663 -10.975
  547   1HD   LYS  78          1HD       LYS  78   9.845  20.365 -12.338
  548   2HD   LYS  78          2HD       LYS  78  11.068  19.579 -11.359
  549   1HE   LYS  78          1HE       LYS  78  10.958  18.308 -13.394
  550   2HE   LYS  78          2HE       LYS  78  10.148  17.330 -12.186
  551   1HZ   LYS  78          1HZ       LYS  78   8.827  19.083 -14.141
  552   2HZ   LYS  78          2HZ       LYS  78   8.850  17.450 -14.167
  553   3HZ   LYS  78          3HZ       LYS  78   8.049  18.236 -12.981
  554    H    HIS  79           H        HIS  79   9.541  16.372  -8.239
  555    HA   HIS  79           HA       HIS  79  11.228  14.924  -8.388
  556   1HB   HIS  79          1HB       HIS  79  12.532  17.067  -9.323
  557   2HB   HIS  79          2HB       HIS  79  13.389  16.899  -7.804
  558    HD1  HIS  79           1HD      HIS  79  15.567  16.212  -9.098
  559    HD2  HIS  79           2HD      HIS  79  12.333  13.588  -9.602
  560    HE1  HIS  79           1HE      HIS  79  16.523  14.092 -10.147
  561    H    GLU  80           H        GLU  80  13.245  14.240  -6.791
  562    HA   GLU  80           HA       GLU  80  13.825  13.653  -4.783
  563   1HB   GLU  80          1HB       GLU  80  12.789  16.411  -4.287
  564   2HB   GLU  80          2HB       GLU  80  12.941  15.395  -2.867
  565   1HG   GLU  80          1HG       GLU  80  15.049  16.555  -3.140
  566   2HG   GLU  80          2HG       GLU  80  15.328  14.876  -3.558
  567    H    HIS  81           H        HIS  81  13.018  12.062  -3.434
  568    HA   HIS  81           HA       HIS  81  10.145  12.178  -2.893
  569   1HB   HIS  81          1HB       HIS  81  10.019   9.746  -3.251
  570   2HB   HIS  81          2HB       HIS  81  10.430  10.626  -4.709
  571    HD1  HIS  81           1HD      HIS  81  11.348   7.660  -2.988
  572    HD2  HIS  81           2HD      HIS  81  13.518  10.658  -4.963
  573    HE1  HIS  81           1HE      HIS  81  13.620   6.644  -3.553
  574    H    LYS  82           H        LYS  82  13.319  10.634  -2.056
  575    HA   LYS  82           HA       LYS  82  12.335  10.274   0.664
  576   1HB   LYS  82          1HB       LYS  82  13.956   8.735  -1.055
  577   2HB   LYS  82          2HB       LYS  82  15.033   9.334   0.190
  578   1HG   LYS  82          1HG       LYS  82  14.240   7.623   1.470
  579   2HG   LYS  82          2HG       LYS  82  12.813   8.616   1.689
  580   1HD   LYS  82          1HD       LYS  82  11.522   7.250   0.394
  581   2HD   LYS  82          2HD       LYS  82  12.739   7.144  -0.863
  582   1HE   LYS  82          1HE       LYS  82  13.721   5.237   0.042
  583   2HE   LYS  82          2HE       LYS  82  13.341   5.687   1.692
  584   1HZ   LYS  82          1HZ       LYS  82  11.383   4.743  -0.286
  585   2HZ   LYS  82          2HZ       LYS  82  12.005   3.850   0.932
  586   3HZ   LYS  82          3HZ       LYS  82  11.051   5.133   1.265
  587    H    SER  83           H        SER  83  12.304  12.802   0.626
  588    HA   SER  83           HA       SER  83  14.966  13.844   1.048
  589   1HB   SER  83          1HB       SER  83  13.868  15.435  -0.206
  590   2HB   SER  83          2HB       SER  83  12.287  14.982   0.396
  591    HG   SER  83           HG       SER  83  14.159  16.250   2.164
  592    H    ASP  84           H        ASP  84  15.640  14.787   3.057
  593    HA   ASP  84           HA       ASP  84  14.962  13.543   5.308
  594   1HB   ASP  84          1HB       ASP  84  16.605  15.669   4.618
  595   2HB   ASP  84          2HB       ASP  84  15.473  16.451   5.704
  596    H    THR  85           H        THR  85  13.844  16.914   4.442
  597    HA   THR  85           HA       THR  85  11.916  17.080   6.460
  598    HB   THR  85           HB       THR  85  13.010  18.945   5.069
  599    HG1  THR  85           1HG      THR  85  10.082  18.738   5.074
  600   1HG2  THR  85          1HG2      THR  85  11.879  19.582   2.986
  601   2HG2  THR  85          2HG2      THR  85  12.476  17.916   2.796
  602   3HG2  THR  85          3HG2      THR  85  10.753  18.210   3.133
  603    H    CYS  86           H        CYS  86  11.556  16.206   2.962
  604    HA   CYS  86           HA       CYS  86   8.880  15.894   2.881
  605   1HB   CYS  86          1HB       CYS  86  10.492  15.620   0.998
  606   2HB   CYS  86          2HB       CYS  86  10.876  14.018   1.597
  607    H    ARG  87           H        ARG  87  11.245  13.198   3.555
  608    HA   ARG  87           HA       ARG  87   9.613  11.250   4.194
  609   1HB   ARG  87          1HB       ARG  87  12.169  12.129   5.603
  610   2HB   ARG  87          2HB       ARG  87  11.365  10.637   6.047
  611   1HG   ARG  87          1HG       ARG  87  11.409  10.201   3.404
  612   2HG   ARG  87          2HG       ARG  87  12.724  11.358   3.446
  613   1HD   ARG  87          1HD       ARG  87  13.643   9.093   3.679
  614   2HD   ARG  87          2HD       ARG  87  13.887   9.963   5.180
  615    HE   ARG  87           HE       ARG  87  11.397   8.660   5.439
  616   1HH1  ARG  87          2HH2      ARG  87  14.761   7.737   4.977
  617   2HH1  ARG  87          1HH2      ARG  87  14.587   6.214   5.784
  618   1HH2  ARG  87          2HH1      ARG  87  11.167   6.651   6.503
  619   2HH2  ARG  87          1HH1      ARG  87  12.529   5.592   6.658
  620    H    ALA  88           H        ALA  88  10.505  13.994   6.377
  621    HA   ALA  88           HA       ALA  88   9.081  13.041   8.610
  622   1HB   ALA  88          1HB       ALA  88   9.314  15.953   8.405
  623   2HB   ALA  88          2HB       ALA  88  10.060  14.831   9.569
  624   3HB   ALA  88          3HB       ALA  88  10.837  15.128   7.996
  625    H    CYS  89           H        CYS  89   8.293  15.604   6.150
  626    HA   CYS  89           HA       CYS  89   5.832  16.278   7.011
  627   1HB   CYS  89          1HB       CYS  89   7.050  17.280   5.100
  628   2HB   CYS  89          2HB       CYS  89   6.633  15.889   4.119
  629    H    MET  90           H        MET  90   6.835  13.395   5.085
  630    HA   MET  90           HA       MET  90   4.236  12.483   4.629
  631   1HB   MET  90          1HB       MET  90   6.971  11.102   4.715
  632   2HB   MET  90          2HB       MET  90   5.518  10.266   4.203
  633   1HG   MET  90          1HG       MET  90   5.238  12.330   2.550
  634   2HG   MET  90          2HG       MET  90   6.948  12.572   2.848
  635   1HE   MET  90          1HE       MET  90   4.949   9.173   0.547
  636   2HE   MET  90          2HE       MET  90   4.349   9.699   2.138
  637   3HE   MET  90          3HE       MET  90   4.371  10.841   0.773
  638    H    LYS  91           H        LYS  91   6.788  11.219   6.903
  639    HA   LYS  91           HA       LYS  91   5.258   9.388   8.210
  640   1HB   LYS  91          1HB       LYS  91   7.506   9.316   8.722
  641   2HB   LYS  91          2HB       LYS  91   7.635  11.048   8.955
  642   1HG   LYS  91          1HG       LYS  91   6.479  10.935  11.093
  643   2HG   LYS  91          2HG       LYS  91   6.012   9.267  10.825
  644   1HD   LYS  91          1HD       LYS  91   8.584   8.781  10.678
  645   2HD   LYS  91          2HD       LYS  91   8.788  10.364  11.402
  646   1HE   LYS  91          1HE       LYS  91   7.389   9.690  13.340
  647   2HE   LYS  91          2HE       LYS  91   7.087   8.128  12.606
  648   1HZ   LYS  91          1HZ       LYS  91   9.716   8.174  12.562
  649   2HZ   LYS  91          2HZ       LYS  91   9.472   9.104  13.882
  650   3HZ   LYS  91          3HZ       LYS  91   8.864   7.590  13.827
  651    H    THR  92           H        THR  92   5.147  12.921   8.403
  652    HA   THR  92           HA       THR  92   3.738  13.068  10.853
  653    HB   THR  92           HB       THR  92   3.782  15.016   8.490
  654    HG1  THR  92           1HG      THR  92   5.507  14.733  10.843
  655   1HG2  THR  92          1HG2      THR  92   3.578  15.412  11.523
  656   2HG2  THR  92          2HG2      THR  92   3.694  16.717  10.319
  657   3HG2  THR  92          3HG2      THR  92   2.254  15.672  10.363
  658    H    ASN  93           H        ASN  93   2.605  13.260   7.410
  659    HA   ASN  93           HA       ASN  93  -0.010  12.532   8.475
  660   1HB   ASN  93          1HB       ASN  93   0.504  13.879   5.783
  661   2HB   ASN  93          2HB       ASN  93  -1.021  13.758   6.638
  662   1HD2  ASN  93          1HD2      ASN  93   2.064  15.339   6.418
  663   2HD2  ASN  93          2HD2      ASN  93   1.753  16.661   7.493
  664    H    CYS  94           H        CYS  94   1.829  12.520   5.316
  665    HA   CYS  94           HA       CYS  94   0.536  10.179   4.421
  666   1HB   CYS  94          1HB       CYS  94   3.142  11.201   3.323
  667   2HB   CYS  94          2HB       CYS  94   1.853  10.353   2.491
  668    H    LYS  95           H        LYS  95   1.015   9.002   6.582
  669    HA   LYS  95           HA       LYS  95   3.419   8.308   7.544
  670   1HB   LYS  95          1HB       LYS  95   0.751   7.298   7.668
  671   2HB   LYS  95          2HB       LYS  95   1.827   5.929   7.481
  672   1HG   LYS  95          1HG       LYS  95   3.246   6.831   9.369
  673   2HG   LYS  95          2HG       LYS  95   2.090   8.130   9.584
  674   1HD   LYS  95          1HD       LYS  95   0.451   6.727  10.474
  675   2HD   LYS  95          2HD       LYS  95   0.992   5.330   9.565
  676   1HE   LYS  95          1HE       LYS  95   1.859   4.672  11.591
  677   2HE   LYS  95          2HE       LYS  95   3.196   5.708  11.133
  678   1HZ   LYS  95          1HZ       LYS  95   2.432   7.386  12.478
  679   2HZ   LYS  95          2HZ       LYS  95   0.897   6.831  12.536
  680   3HZ   LYS  95          3HZ       LYS  95   2.074   6.065  13.370
  Start of MODEL    4
    1   1H    ILE   1           H        ILE   1 -13.018  20.793  17.729
    2    HA   ILE   1           HA       ILE   1 -13.119  18.563  17.324
    3    HB   ILE   1           HB       ILE   1 -15.283  19.496  16.835
    4   1HG1  ILE   1          1HG1      ILE   1 -15.235  17.594  14.609
    5   2HG1  ILE   1          2HG1      ILE   1 -14.357  17.011  16.009
    6   1HG2  ILE   1          1HG2      ILE   1 -15.998  20.151  14.629
    7   2HG2  ILE   1          2HG2      ILE   1 -14.551  21.087  15.077
    8   3HG2  ILE   1          3HG2      ILE   1 -14.412  19.723  13.942
    9   1HD1  ILE   1          1HD1      ILE   1 -16.725  16.358  16.169
   10   2HD1  ILE   1          2HD1      ILE   1 -16.335  17.523  17.457
   11   3HD1  ILE   1          3HD1      ILE   1 -17.225  18.059  16.012
   12    H    SER   2           H        SER   2 -12.549  20.288  14.181
   13    HA   SER   2           HA       SER   2 -10.208  18.974  13.662
   14   1HB   SER   2          1HB       SER   2 -12.640  17.459  12.849
   15   2HB   SER   2          2HB       SER   2 -11.430  17.627  11.593
   16    HG   SER   2           HG       SER   2  -9.839  16.768  13.129
   17    H    GLU   3           H        GLU   3  -9.457  19.402  11.345
   18    HA   GLU   3           HA       GLU   3 -11.146  21.060   9.773
   19   1HB   GLU   3          1HB       GLU   3  -8.930  22.241  11.438
   20   2HB   GLU   3          2HB       GLU   3  -9.188  22.890   9.831
   21   1HG   GLU   3          1HG       GLU   3 -11.783  22.791  10.752
   22   2HG   GLU   3          2HG       GLU   3 -10.924  23.076  12.252
   23    H    PHE   4           H        PHE   4 -10.772  20.190   7.782
   24    HA   PHE   4           HA       PHE   4  -9.697  19.516   5.976
   25   1HB   PHE   4          1HB       PHE   4  -7.025  20.228   7.261
   26   2HB   PHE   4          2HB       PHE   4  -7.492  20.411   5.582
   27    HD1  PHE   4           1HD      PHE   4  -9.658  22.064   5.337
   28    HD2  PHE   4           2HD      PHE   4  -6.751  22.188   8.426
   29    HE1  PHE   4           1HE      PHE   4 -10.200  24.480   5.750
   30    HE2  PHE   4           2HE      PHE   4  -7.293  24.603   8.839
   31    HZ   PHE   4           HZ       PHE   4  -9.010  25.721   7.496
   32    H    ALA   5           H        ALA   5  -7.393  18.911   8.732
   33    HA   ALA   5           HA       ALA   5  -6.473  17.048   9.491
   34   1HB   ALA   5          1HB       ALA   5  -8.596  15.440   8.044
   35   2HB   ALA   5          2HB       ALA   5  -7.777  15.072   9.581
   36   3HB   ALA   5          3HB       ALA   5  -8.972  16.389   9.502
   37    HA   PRO   6           HA       PRO   6  -3.942  15.625   6.287
   38   1HB   PRO   6          1HB       PRO   6  -2.668  13.514   7.463
   39   2HB   PRO   6          2HB       PRO   6  -2.212  15.183   7.740
   40   1HG   PRO   6          1HG       PRO   6  -3.681  13.343   9.527
   41   2HG   PRO   6          2HG       PRO   6  -2.856  14.836   9.927
   42   1HD   PRO   6          1HD       PRO   6  -5.687  14.457   9.664
   43   2HD   PRO   6          2HD       PRO   6  -4.854  15.973   9.950
   44    H    VAL   7           H        VAL   7  -3.572  14.116   4.590
   45    HA   VAL   7           HA       VAL   7  -5.912  12.439   4.304
   46    HB   VAL   7           HB       VAL   7  -3.631  13.190   2.469
   47   1HG1  VAL   7          1HG1      VAL   7  -4.934  12.117   0.664
   48   2HG1  VAL   7          2HG1      VAL   7  -4.401  10.947   1.895
   49   3HG1  VAL   7          3HG1      VAL   7  -6.090  11.508   1.874
   50   1HG2  VAL   7          1HG2      VAL   7  -6.547  13.921   2.166
   51   2HG2  VAL   7          2HG2      VAL   7  -5.434  14.903   3.148
   52   3HG2  VAL   7          3HG2      VAL   7  -5.119  14.670   1.412
   53    H    ASP   8           H        ASP   8  -5.894  10.173   4.129
   54    HA   ASP   8           HA       ASP   8  -3.318   8.915   4.539
   55   1HB   ASP   8          1HB       ASP   8  -4.643   9.270   6.750
   56   2HB   ASP   8          2HB       ASP   8  -5.785   8.095   6.127
   57    H    CYS   9           H        CYS   9  -3.163   7.265   3.009
   58    HA   CYS   9           HA       CYS   9  -5.063   6.680   1.185
   59   1HB   CYS   9          1HB       CYS   9  -3.126   4.594   2.174
   60   2HB   CYS   9          2HB       CYS   9  -3.782   4.791   0.561
   61    H    LYS  10           H        LYS  10  -4.143   4.311   3.790
   62    HA   LYS  10           HA       LYS  10  -5.360   2.616   4.615
   63   1HB   LYS  10          1HB       LYS  10  -5.651   4.447   6.209
   64   2HB   LYS  10          2HB       LYS  10  -7.063   5.017   5.343
   65   1HG   LYS  10          1HG       LYS  10  -8.076   3.721   7.003
   66   2HG   LYS  10          2HG       LYS  10  -7.959   2.547   5.707
   67   1HD   LYS  10          1HD       LYS  10  -6.431   1.267   6.835
   68   2HD   LYS  10          2HD       LYS  10  -5.512   2.660   7.367
   69   1HE   LYS  10          1HE       LYS  10  -8.207   2.324   8.632
   70   2HE   LYS  10          2HE       LYS  10  -7.016   1.109   9.049
   71   1HZ   LYS  10          1HZ       LYS  10  -7.175   3.738   9.941
   72   2HZ   LYS  10          2HZ       LYS  10  -6.123   2.576  10.400
   73   3HZ   LYS  10          3HZ       LYS  10  -5.757   3.562   9.151
   74    H    GLY  11           H        GLY  11  -8.478   4.130   4.351
   75   1HA   GLY  11          1HA       GLY  11  -9.763   2.079   3.124
   76   2HA   GLY  11          2HA       GLY  11 -10.262   3.756   3.021
   77    H    GLN  12           H        GLN  12  -8.454   5.039   1.451
   78    HA   GLN  12           HA       GLN  12  -9.174   4.482  -1.053
   79   1HB   GLN  12          1HB       GLN  12  -6.557   5.653  -0.031
   80   2HB   GLN  12          2HB       GLN  12  -6.980   5.649  -1.731
   81   1HG   GLN  12          1HG       GLN  12  -8.462   7.364  -1.481
   82   2HG   GLN  12          2HG       GLN  12  -9.202   6.632  -0.072
   83   1HE2  GLN  12          1HE2      GLN  12  -8.580   7.188   1.953
   84   2HE2  GLN  12          2HE2      GLN  12  -7.474   8.469   2.328
   85    H    CYS  13           H        CYS  13  -6.819   2.734   0.902
   86    HA   CYS  13           HA       CYS  13  -5.957   1.260  -1.467
   87   1HB   CYS  13          1HB       CYS  13  -4.753   1.645   1.262
   88   2HB   CYS  13          2HB       CYS  13  -4.279   0.293   0.253
   89    H    THR  14           H        THR  14  -8.547   0.707  -0.923
   90    HA   THR  14           HA       THR  14  -8.488  -1.707   0.765
   91    HB   THR  14           HB       THR  14 -10.588   0.403   0.142
   92    HG1  THR  14           1HG      THR  14  -9.198   0.484   2.066
   93   1HG2  THR  14          1HG2      THR  14 -11.847  -1.444   1.783
   94   2HG2  THR  14          2HG2      THR  14 -12.159  -1.285   0.037
   95   3HG2  THR  14          3HG2      THR  14 -11.009  -2.509   0.628
   96    H    THR  15           H        THR  15  -9.358  -0.320  -2.414
   97    HA   THR  15           HA       THR  15 -10.500  -2.760  -3.361
   98    HB   THR  15           HB       THR  15  -9.922   0.006  -4.316
   99    HG1  THR  15           1HG      THR  15 -11.875  -2.096  -4.935
  100   1HG2  THR  15          1HG2      THR  15 -10.336  -0.692  -6.710
  101   2HG2  THR  15          2HG2      THR  15  -8.741  -1.214  -6.117
  102   3HG2  THR  15          3HG2      THR  15 -10.077  -2.385  -6.226
  103    HA   PRO  16           HA       PRO  16  -6.218  -3.229  -5.268
  104   1HB   PRO  16          1HB       PRO  16  -4.146  -1.693  -4.365
  105   2HB   PRO  16          2HB       PRO  16  -5.073  -1.304  -5.800
  106   1HG   PRO  16          1HG       PRO  16  -5.183  -0.048  -3.126
  107   2HG   PRO  16          2HG       PRO  16  -5.765   0.576  -4.657
  108   1HD   PRO  16          1HD       PRO  16  -7.349  -0.555  -2.550
  109   2HD   PRO  16          2HD       PRO  16  -7.916  -0.038  -4.126
  110    H    CYS  17           H        CYS  17  -6.799  -2.820  -1.968
  111    HA   CYS  17           HA       CYS  17  -4.855  -4.949  -1.440
  112   1HB   CYS  17          1HB       CYS  17  -5.924  -3.013   0.612
  113   2HB   CYS  17          2HB       CYS  17  -4.602  -4.149   0.786
  114    H    GLU  18           H        GLU  18  -7.908  -4.646  -2.320
  115    HA   GLU  18           HA       GLU  18  -9.399  -5.599  -0.172
  116   1HB   GLU  18          1HB       GLU  18  -9.892  -4.757  -2.801
  117   2HB   GLU  18          2HB       GLU  18 -10.375  -6.442  -2.819
  118   1HG   GLU  18          1HG       GLU  18 -11.496  -5.658  -0.441
  119   2HG   GLU  18          2HG       GLU  18 -11.561  -4.142  -1.317
  120    HA   PRO  19           HA       PRO  19  -8.539  -9.856  -2.085
  121   1HB   PRO  19          1HB       PRO  19  -6.649 -10.117  -4.042
  122   2HB   PRO  19          2HB       PRO  19  -8.361  -9.957  -4.379
  123   1HG   PRO  19          1HG       PRO  19  -6.217  -7.945  -4.679
  124   2HG   PRO  19          2HG       PRO  19  -7.818  -7.957  -5.391
  125   1HD   PRO  19          1HD       PRO  19  -6.943  -6.377  -3.163
  126   2HD   PRO  19          2HD       PRO  19  -8.571  -6.477  -3.802
  127    H    LEU  20           H        LEU  20  -5.657  -7.856  -2.017
  128    HA   LEU  20           HA       LEU  20  -3.898  -9.772  -1.123
  129   1HB   LEU  20          1HB       LEU  20  -2.842  -7.865  -1.701
  130   2HB   LEU  20          2HB       LEU  20  -4.097  -6.825  -1.057
  131    HG   LEU  20           HG       LEU  20  -3.236  -7.465   1.269
  132   1HD1  LEU  20          1HD1      LEU  20  -1.830  -9.387   0.092
  133   2HD1  LEU  20          2HD1      LEU  20  -0.609  -8.094   0.005
  134   3HD1  LEU  20          3HD1      LEU  20  -1.277  -8.584   1.581
  135   1HD2  LEU  20          1HD2      LEU  20  -1.393  -5.885  -0.545
  136   2HD2  LEU  20          2HD2      LEU  20  -2.887  -5.271   0.203
  137   3HD2  LEU  20          3HD2      LEU  20  -1.514  -5.757   1.226
  138    H    THR  21           H        THR  21  -5.945  -7.512   0.853
  139    HA   THR  21           HA       THR  21  -5.199  -8.490   3.332
  140    HB   THR  21           HB       THR  21  -7.657  -7.116   2.180
  141    HG1  THR  21           1HG      THR  21  -5.459  -6.597   4.055
  142   1HG2  THR  21          1HG2      THR  21  -7.850  -6.670   4.876
  143   2HG2  THR  21          2HG2      THR  21  -8.810  -7.910   4.034
  144   3HG2  THR  21          3HG2      THR  21  -7.316  -8.368   4.886
  145    H    ALA  22           H        ALA  22  -8.166  -9.420   1.452
  146    HA   ALA  22           HA       ALA  22  -9.003 -11.407   3.131
  147   1HB   ALA  22          1HB       ALA  22  -9.976 -12.384   0.950
  148   2HB   ALA  22          2HB       ALA  22 -10.420 -10.710   1.362
  149   3HB   ALA  22          3HB       ALA  22  -9.175 -11.023   0.128
  150    H    CYS  23           H        CYS  23  -6.276 -11.360   0.862
  151    HA   CYS  23           HA       CYS  23  -5.938 -14.128   0.671
  152   1HB   CYS  23          1HB       CYS  23  -4.883 -12.113  -0.653
  153   2HB   CYS  23          2HB       CYS  23  -3.618 -12.238   0.553
  154    H    LYS  24           H        LYS  24  -4.110 -11.641   2.617
  155    HA   LYS  24           HA       LYS  24  -2.705 -13.450   4.158
  156   1HB   LYS  24          1HB       LYS  24  -3.367 -10.569   4.260
  157   2HB   LYS  24          2HB       LYS  24  -2.962 -11.286   5.807
  158   1HG   LYS  24          1HG       LYS  24  -0.762 -11.442   5.256
  159   2HG   LYS  24          2HG       LYS  24  -1.129 -12.253   3.747
  160   1HD   LYS  24          1HD       LYS  24  -0.319 -10.337   2.786
  161   2HD   LYS  24          2HD       LYS  24  -1.921  -9.705   3.111
  162   1HE   LYS  24          1HE       LYS  24  -0.029  -9.530   5.412
  163   2HE   LYS  24          2HE       LYS  24   0.421  -8.561   4.023
  164   1HZ   LYS  24          1HZ       LYS  24  -2.244  -8.152   4.305
  165   2HZ   LYS  24          2HZ       LYS  24  -1.699  -8.171   5.845
  166   3HZ   LYS  24          3HZ       LYS  24  -1.060  -7.126   4.765
  167    H    GLU  25           H        GLU  25  -5.924 -11.905   4.735
  168    HA   GLU  25           HA       GLU  25  -6.345 -12.884   7.240
  169   1HB   GLU  25          1HB       GLU  25  -7.870 -11.602   5.189
  170   2HB   GLU  25          2HB       GLU  25  -8.819 -12.973   5.729
  171   1HG   GLU  25          1HG       GLU  25  -7.525 -11.353   7.892
  172   2HG   GLU  25          2HG       GLU  25  -8.801 -10.549   7.000
  173    H    LYS  26           H        LYS  26  -7.687 -14.337   4.178
  174    HA   LYS  26           HA       LYS  26  -8.717 -16.608   5.140
  175   1HB   LYS  26          1HB       LYS  26  -8.424 -15.681   2.704
  176   2HB   LYS  26          2HB       LYS  26  -7.026 -16.736   2.657
  177   1HG   LYS  26          1HG       LYS  26  -8.306 -18.623   2.537
  178   2HG   LYS  26          2HG       LYS  26  -9.378 -18.084   3.814
  179   1HD   LYS  26          1HD       LYS  26 -10.475 -16.514   2.125
  180   2HD   LYS  26          2HD       LYS  26  -9.497 -17.260   0.876
  181   1HE   LYS  26          1HE       LYS  26 -10.538 -19.512   2.018
  182   2HE   LYS  26          2HE       LYS  26 -11.828 -18.387   2.393
  183   1HZ   LYS  26          1HZ       LYS  26 -11.759 -19.612   0.136
  184   2HZ   LYS  26          2HZ       LYS  26 -12.271 -18.063   0.205
  185   3HZ   LYS  26          3HZ       LYS  26 -10.757 -18.400  -0.306
  186    H    CYS  27           H        CYS  27  -5.218 -15.962   4.551
  187    HA   CYS  27           HA       CYS  27  -4.419 -18.571   5.242
  188   1HB   CYS  27          1HB       CYS  27  -3.071 -15.957   4.774
  189   2HB   CYS  27          2HB       CYS  27  -2.185 -17.168   5.679
  190    H    ALA  28           H        ALA  28  -4.368 -15.371   6.982
  191    HA   ALA  28           HA       ALA  28  -3.336 -16.111   9.360
  192   1HB   ALA  28          1HB       ALA  28  -5.512 -14.428   9.991
  193   2HB   ALA  28          2HB       ALA  28  -3.845 -13.935   9.609
  194   3HB   ALA  28          3HB       ALA  28  -5.066 -14.019   8.317
  195    H    GLU  29           H        GLU  29  -6.708 -16.638   8.187
  196    HA   GLU  29           HA       GLU  29  -7.664 -17.640  10.588
  197   1HB   GLU  29          1HB       GLU  29  -8.517 -17.797   7.702
  198   2HB   GLU  29          2HB       GLU  29  -9.310 -18.851   8.855
  199   1HG   GLU  29          1HG       GLU  29  -9.081 -15.815   9.123
  200   2HG   GLU  29          2HG       GLU  29 -10.511 -16.671   8.580
  201    H    SER  30           H        SER  30  -6.340 -19.313   7.652
  202    HA   SER  30           HA       SER  30  -6.667 -21.869   8.653
  203   1HB   SER  30          1HB       SER  30  -5.828 -20.767   6.275
  204   2HB   SER  30          2HB       SER  30  -4.312 -21.396   6.889
  205    HG   SER  30           HG       SER  30  -5.093 -23.477   6.855
  206    H    CYS  31           H        CYS  31  -4.379 -19.328   9.409
  207    HA   CYS  31           HA       CYS  31  -2.826 -21.270  10.959
  208   1HB   CYS  31          1HB       CYS  31  -1.935 -19.046   9.199
  209   2HB   CYS  31          2HB       CYS  31  -1.065 -19.261  10.705
  210    H    GLU  32           H        GLU  32  -4.778 -20.690  12.452
  211    HA   GLU  32           HA       GLU  32  -4.491 -18.054  13.599
  212   1HB   GLU  32          1HB       GLU  32  -6.539 -18.893  14.975
  213   2HB   GLU  32          2HB       GLU  32  -6.768 -18.551  13.271
  214   1HG   GLU  32          1HG       GLU  32  -6.702 -20.886  12.680
  215   2HG   GLU  32          2HG       GLU  32  -6.044 -21.345  14.238
  216    H    THR  33           H        THR  33  -3.689 -21.431  14.173
  217    HA   THR  33           HA       THR  33  -2.419 -20.638  16.685
  218    HB   THR  33           HB       THR  33  -3.328 -22.905  17.604
  219    HG1  THR  33           1HG      THR  33  -4.363 -23.871  15.878
  220   1HG2  THR  33          1HG2      THR  33  -5.388 -20.737  16.935
  221   2HG2  THR  33          2HG2      THR  33  -5.534 -21.961  18.220
  222   3HG2  THR  33          3HG2      THR  33  -4.295 -20.688  18.339
  223    H    SER  34           H        SER  34  -1.307 -20.924  14.054
  224    HA   SER  34           HA       SER  34  -0.130 -23.534  14.038
  225   1HB   SER  34          1HB       SER  34  -0.629 -21.498  12.117
  226   2HB   SER  34          2HB       SER  34   1.116 -21.626  12.217
  227    HG   SER  34           HG       SER  34   1.052 -23.763  11.579
  228    H    ALA  35           H        ALA  35   2.242 -23.880  14.124
  229    HA   ALA  35           HA       ALA  35   3.436 -22.659  16.294
  230   1HB   ALA  35          1HB       ALA  35   4.197 -24.799  15.603
  231   2HB   ALA  35          2HB       ALA  35   4.491 -24.248  13.936
  232   3HB   ALA  35          3HB       ALA  35   5.552 -23.698  15.256
  233    H    ASP  36           H        ASP  36   4.485 -22.290  12.829
  234    HA   ASP  36           HA       ASP  36   5.630 -19.756  13.588
  235   1HB   ASP  36          1HB       ASP  36   5.695 -20.958  10.803
  236   2HB   ASP  36          2HB       ASP  36   6.859 -19.877  11.543
  237    H    LYS  37           H        LYS  37   3.476 -18.667  13.839
  238    HA   LYS  37           HA       LYS  37   1.620 -18.602  11.726
  239   1HB   LYS  37          1HB       LYS  37   1.274 -18.113  14.222
  240   2HB   LYS  37          2HB       LYS  37   1.919 -16.517  13.893
  241   1HG   LYS  37          1HG       LYS  37   0.151 -16.450  11.942
  242   2HG   LYS  37          2HG       LYS  37  -0.604 -17.790  12.780
  243   1HD   LYS  37          1HD       LYS  37   0.089 -15.172  14.181
  244   2HD   LYS  37          2HD       LYS  37  -1.452 -15.432  13.389
  245   1HE   LYS  37          1HE       LYS  37  -1.332 -17.712  14.898
  246   2HE   LYS  37          2HE       LYS  37  -0.385 -16.644  15.914
  247   1HZ   LYS  37          1HZ       LYS  37  -2.812 -16.616  16.312
  248   2HZ   LYS  37          2HZ       LYS  37  -2.170 -15.141  16.029
  249   3HZ   LYS  37          3HZ       LYS  37  -3.019 -15.899  14.859
  250    H    LYS  38           H        LYS  38   3.999 -16.112  12.898
  251    HA   LYS  38           HA       LYS  38   3.601 -14.244  10.974
  252   1HB   LYS  38          1HB       LYS  38   5.133 -14.209  13.021
  253   2HB   LYS  38          2HB       LYS  38   6.341 -14.987  12.017
  254   1HG   LYS  38          1HG       LYS  38   6.576 -13.120  10.600
  255   2HG   LYS  38          2HG       LYS  38   4.968 -12.518  10.947
  256   1HD   LYS  38          1HD       LYS  38   6.263 -12.493  13.456
  257   2HD   LYS  38          2HD       LYS  38   7.501 -11.964  12.334
  258   1HE   LYS  38          1HE       LYS  38   6.375 -10.011  11.781
  259   2HE   LYS  38          2HE       LYS  38   4.792 -10.745  11.945
  260   1HZ   LYS  38          1HZ       LYS  38   4.822  -9.538  13.816
  261   2HZ   LYS  38          2HZ       LYS  38   5.594 -10.836  14.437
  262   3HZ   LYS  38          3HZ       LYS  38   6.449  -9.528  13.962
  263    H    THR  39           H        THR  39   5.931 -17.027  10.789
  264    HA   THR  39           HA       THR  39   6.742 -16.516   8.169
  265    HB   THR  39           HB       THR  39   6.546 -19.198   9.635
  266    HG1  THR  39           1HG      THR  39   8.442 -16.956   9.615
  267   1HG2  THR  39          1HG2      THR  39   7.363 -19.347   7.269
  268   2HG2  THR  39          2HG2      THR  39   8.555 -18.070   7.613
  269   3HG2  THR  39          3HG2      THR  39   8.682 -19.649   8.426
  270    H    CYS  40           H        CYS  40   4.235 -18.859   9.355
  271    HA   CYS  40           HA       CYS  40   3.431 -19.870   7.014
  272   1HB   CYS  40          1HB       CYS  40   2.468 -20.614   9.059
  273   2HB   CYS  40          2HB       CYS  40   1.774 -19.041   9.395
  274    H    ARG  41           H        ARG  41   2.176 -16.805   8.533
  275    HA   ARG  41           HA       ARG  41   0.563 -16.115   6.422
  276   1HB   ARG  41          1HB       ARG  41   1.989 -14.436   8.536
  277   2HB   ARG  41          2HB       ARG  41   0.871 -13.721   7.391
  278   1HG   ARG  41          1HG       ARG  41  -0.899 -15.363   8.162
  279   2HG   ARG  41          2HG       ARG  41   0.223 -15.957   9.371
  280   1HD   ARG  41          1HD       ARG  41  -0.932 -13.138   9.167
  281   2HD   ARG  41          2HD       ARG  41  -1.228 -14.310  10.435
  282    HE   ARG  41           HE       ARG  41   1.566 -13.938  10.377
  283   1HH1  ARG  41          2HH2      ARG  41  -1.285 -11.960  10.963
  284   2HH1  ARG  41          1HH2      ARG  41  -0.465 -10.869  12.030
  285   1HH2  ARG  41          2HH1      ARG  41   2.647 -12.499  11.784
  286   2HH2  ARG  41          1HH1      ARG  41   1.786 -11.177  12.500
  287    H    ARG  42           H        ARG  42   3.922 -14.977   7.257
  288    HA   ARG  42           HA       ARG  42   4.315 -13.275   5.228
  289   1HB   ARG  42          1HB       ARG  42   5.971 -14.836   7.045
  290   2HB   ARG  42          2HB       ARG  42   6.751 -14.777   5.476
  291   1HG   ARG  42          1HG       ARG  42   7.305 -12.586   5.733
  292   2HG   ARG  42          2HG       ARG  42   5.664 -12.149   6.167
  293   1HD   ARG  42          1HD       ARG  42   6.175 -12.074   8.387
  294   2HD   ARG  42          2HD       ARG  42   6.934 -13.653   8.340
  295    HE   ARG  42           HE       ARG  42   8.317 -11.170   8.401
  296   1HH1  ARG  42          2HH2      ARG  42   8.417 -14.208   6.628
  297   2HH1  ARG  42          1HH2      ARG  42  10.115 -14.109   6.301
  298   1HH2  ARG  42          2HH1      ARG  42  10.558 -11.039   7.970
  299   2HH2  ARG  42          1HH1      ARG  42  11.341 -12.294   7.070
  300    H    ASN  43           H        ASN  43   4.540 -16.870   5.183
  301    HA   ASN  43           HA       ASN  43   5.657 -17.067   2.651
  302   1HB   ASN  43          1HB       ASN  43   4.439 -18.844   4.656
  303   2HB   ASN  43          2HB       ASN  43   3.994 -19.345   3.037
  304   1HD2  ASN  43          1HD2      ASN  43   6.699 -18.515   5.143
  305   2HD2  ASN  43          2HD2      ASN  43   7.912 -19.465   4.353
  306    H    CYS  44           H        CYS  44   2.308 -16.771   3.913
  307    HA   CYS  44           HA       CYS  44   0.861 -17.556   1.737
  308   1HB   CYS  44          1HB       CYS  44   0.000 -16.906   3.997
  309   2HB   CYS  44          2HB       CYS  44   0.193 -15.225   3.543
  310    H    LYS  45           H        LYS  45   2.835 -14.656   2.299
  311    HA   LYS  45           HA       LYS  45   1.741 -13.012   0.330
  312   1HB   LYS  45          1HB       LYS  45   3.593 -12.704   2.267
  313   2HB   LYS  45          2HB       LYS  45   4.661 -12.865   0.888
  314   1HG   LYS  45          1HG       LYS  45   3.750 -10.963  -0.211
  315   2HG   LYS  45          2HG       LYS  45   2.267 -11.011   0.721
  316   1HD   LYS  45          1HD       LYS  45   3.172  -9.490   2.136
  317   2HD   LYS  45          2HD       LYS  45   4.306 -10.718   2.662
  318   1HE   LYS  45          1HE       LYS  45   4.992  -9.380   0.077
  319   2HE   LYS  45          2HE       LYS  45   5.046  -8.344   1.489
  320   1HZ   LYS  45          1HZ       LYS  45   7.018  -9.939   0.760
  321   2HZ   LYS  45          2HZ       LYS  45   6.789  -9.449   2.301
  322   3HZ   LYS  45          3HZ       LYS  45   6.264 -10.921   1.825
  323    H    LYS  46           H        LYS  46   4.070 -15.719   0.210
  324    HA   LYS  46           HA       LYS  46   4.469 -15.222  -2.634
  325   1HB   LYS  46          1HB       LYS  46   5.900 -16.795  -0.523
  326   2HB   LYS  46          2HB       LYS  46   6.044 -17.311  -2.191
  327   1HG   LYS  46          1HG       LYS  46   6.492 -14.409  -1.383
  328   2HG   LYS  46          2HG       LYS  46   7.785 -15.590  -1.303
  329   1HD   LYS  46          1HD       LYS  46   6.379 -15.749  -3.875
  330   2HD   LYS  46          2HD       LYS  46   6.963 -14.123  -3.581
  331   1HE   LYS  46          1HE       LYS  46   8.885 -16.336  -2.950
  332   2HE   LYS  46          2HE       LYS  46   8.512 -16.110  -4.647
  333   1HZ   LYS  46          1HZ       LYS  46  10.131 -14.540  -3.012
  334   2HZ   LYS  46          2HZ       LYS  46   9.876 -14.404  -4.619
  335   3HZ   LYS  46          3HZ       LYS  46   8.911 -13.607  -3.569
  336    H    ALA  47           H        ALA  47   2.518 -17.045  -0.426
  337    HA   ALA  47           HA       ALA  47   2.132 -19.414  -1.760
  338   1HB   ALA  47          1HB       ALA  47   1.215 -19.024   0.433
  339   2HB   ALA  47          2HB       ALA  47   0.236 -17.659  -0.156
  340   3HB   ALA  47          3HB       ALA  47  -0.152 -19.319  -0.668
  341    H    ASP  48           H        ASP  48   0.120 -16.396  -2.077
  342    HA   ASP  48           HA       ASP  48   0.081 -16.610  -4.863
  343   1HB   ASP  48          1HB       ASP  48  -2.201 -17.795  -3.296
  344   2HB   ASP  48          2HB       ASP  48  -2.616 -16.856  -4.716
  345    H    CYS  49           H        CYS  49   0.585 -14.669  -2.706
  346    HA   CYS  49           HA       CYS  49  -1.604 -12.792  -3.234
  347   1HB   CYS  49          1HB       CYS  49   0.120 -12.634  -0.777
  348   2HB   CYS  49          2HB       CYS  49  -1.431 -11.879  -1.089
  349    H    GLU  50           H        GLU  50   1.346 -13.662  -4.260
  350    HA   GLU  50           HA       GLU  50   3.024 -11.550  -3.807
  351   1HB   GLU  50          1HB       GLU  50   2.805 -13.770  -5.730
  352   2HB   GLU  50          2HB       GLU  50   3.590 -12.367  -6.428
  353   1HG   GLU  50          1HG       GLU  50   4.711 -12.584  -3.838
  354   2HG   GLU  50          2HG       GLU  50   4.596 -14.239  -4.403
  355    HA   PRO  51           HA       PRO  51   1.039  -9.503  -7.605
  356   1HB   PRO  51          1HB       PRO  51  -1.306 -10.488  -8.605
  357   2HB   PRO  51          2HB       PRO  51   0.265 -10.899  -9.265
  358   1HG   PRO  51          1HG       PRO  51  -1.522 -12.539  -7.575
  359   2HG   PRO  51          2HG       PRO  51  -0.182 -13.056  -8.578
  360   1HD   PRO  51          1HD       PRO  51  -0.183 -12.786  -5.723
  361   2HD   PRO  51          2HD       PRO  51   1.188 -13.190  -6.737
  362    H    GLN  52           H        GLN  52  -1.344 -10.862  -5.420
  363    HA   GLN  52           HA       GLN  52  -3.050  -8.704  -5.481
  364   1HB   GLN  52          1HB       GLN  52  -2.450 -10.633  -3.196
  365   2HB   GLN  52          2HB       GLN  52  -3.841  -9.569  -3.255
  366   1HG   GLN  52          1HG       GLN  52  -4.633 -10.664  -5.334
  367   2HG   GLN  52          2HG       GLN  52  -3.202 -11.676  -5.374
  368   1HE2  GLN  52          1HE2      GLN  52  -3.865 -13.657  -4.993
  369   2HE2  GLN  52          2HE2      GLN  52  -4.833 -14.192  -3.659
  370    H    ASP  53           H        ASP  53  -0.148  -9.373  -3.442
  371    HA   ASP  53           HA       ASP  53  -0.464  -7.194  -1.770
  372   1HB   ASP  53          1HB       ASP  53   1.148  -9.216  -1.595
  373   2HB   ASP  53          2HB       ASP  53   2.201  -8.350  -2.696
  374    H    LYS  54           H        LYS  54   1.018  -7.656  -5.009
  375    HA   LYS  54           HA       LYS  54   2.413  -5.230  -5.124
  376   1HB   LYS  54          1HB       LYS  54   1.400  -7.194  -7.173
  377   2HB   LYS  54          2HB       LYS  54   2.149  -5.690  -7.671
  378   1HG   LYS  54          1HG       LYS  54   4.159  -6.256  -6.252
  379   2HG   LYS  54          2HG       LYS  54   3.413  -7.788  -5.845
  380   1HD   LYS  54          1HD       LYS  54   4.183  -8.709  -7.766
  381   2HD   LYS  54          2HD       LYS  54   3.317  -7.515  -8.713
  382   1HE   LYS  54          1HE       LYS  54   5.374  -5.944  -7.961
  383   2HE   LYS  54          2HE       LYS  54   6.187  -7.486  -7.786
  384   1HZ   LYS  54          1HZ       LYS  54   6.483  -6.720  -9.983
  385   2HZ   LYS  54          2HZ       LYS  54   5.457  -7.988 -10.069
  386   3HZ   LYS  54          3HZ       LYS  54   4.886  -6.464 -10.211
  387    H    VAL  55           H        VAL  55  -0.831  -6.170  -6.468
  388    HA   VAL  55           HA       VAL  55  -1.553  -3.772  -7.512
  389    HB   VAL  55           HB       VAL  55  -3.213  -5.817  -6.028
  390   1HG1  VAL  55          1HG1      VAL  55  -4.179  -3.398  -6.429
  391   2HG1  VAL  55          2HG1      VAL  55  -4.362  -3.976  -8.103
  392   3HG1  VAL  55          3HG1      VAL  55  -5.168  -4.838  -6.771
  393   1HG2  VAL  55          1HG2      VAL  55  -2.286  -5.513  -8.876
  394   2HG2  VAL  55          2HG2      VAL  55  -2.271  -6.950  -7.825
  395   3HG2  VAL  55          3HG2      VAL  55  -3.805  -6.365  -8.511
  396    H    CYS  56           H        CYS  56  -1.242  -4.697  -4.102
  397    HA   CYS  56           HA       CYS  56  -2.741  -2.503  -3.121
  398   1HB   CYS  56          1HB       CYS  56  -2.367  -4.620  -1.882
  399   2HB   CYS  56          2HB       CYS  56  -0.674  -4.201  -1.709
  400    H    ASP  57           H        ASP  57   0.817  -3.310  -3.110
  401    HA   ASP  57           HA       ASP  57   1.838  -1.076  -2.157
  402   1HB   ASP  57          1HB       ASP  57   2.746  -3.207  -3.793
  403   2HB   ASP  57          2HB       ASP  57   3.249  -1.758  -4.641
  404    H    ALA  58           H        ALA  58   0.876  -1.640  -5.624
  405    HA   ALA  58           HA       ALA  58   1.613   0.660  -6.798
  406   1HB   ALA  58          1HB       ALA  58   0.211  -1.436  -7.597
  407   2HB   ALA  58          2HB       ALA  58  -1.177  -0.370  -7.273
  408   3HB   ALA  58          3HB       ALA  58   0.066   0.120  -8.449
  409    H    CYS  59           H        CYS  59  -1.371   0.154  -4.803
  410    HA   CYS  59           HA       CYS  59  -2.401   2.690  -5.114
  411   1HB   CYS  59          1HB       CYS  59  -3.702   0.910  -4.168
  412   2HB   CYS  59          2HB       CYS  59  -2.604   0.744  -2.812
  413    H    ARG  60           H        ARG  60  -0.546   1.390  -2.253
  414    HA   ARG  60           HA       ARG  60  -0.175   3.737  -0.994
  415   1HB   ARG  60          1HB       ARG  60   1.718   1.346  -1.212
  416   2HB   ARG  60          2HB       ARG  60   1.953   2.641  -0.056
  417   1HG   ARG  60          1HG       ARG  60  -0.530   2.153   0.665
  418   2HG   ARG  60          2HG       ARG  60  -0.326   0.639  -0.193
  419   1HD   ARG  60          1HD       ARG  60   2.017   0.955   1.419
  420   2HD   ARG  60          2HD       ARG  60   0.662   1.385   2.443
  421    HE   ARG  60           HE       ARG  60  -0.174  -0.947   1.164
  422   1HH1  ARG  60          2HH2      ARG  60   2.586  -0.054   3.156
  423   2HH1  ARG  60          1HH2      ARG  60   2.796  -1.646   3.805
  424   1HH2  ARG  60          2HH1      ARG  60   0.102  -3.048   2.020
  425   2HH2  ARG  60          1HH1      ARG  60   1.374  -3.361   3.154
  426    H    MET  61           H        MET  61   1.378   2.536  -3.933
  427    HA   MET  61           HA       MET  61   3.570   4.338  -3.778
  428   1HB   MET  61          1HB       MET  61   3.975   2.336  -5.028
  429   2HB   MET  61          2HB       MET  61   2.418   2.407  -5.828
  430   1HG   MET  61          1HG       MET  61   3.200   3.761  -7.506
  431   2HG   MET  61          2HG       MET  61   4.106   4.774  -6.399
  432   1HE   MET  61          1HE       MET  61   5.528   0.980  -8.530
  433   2HE   MET  61          2HE       MET  61   3.921   1.160  -7.784
  434   3HE   MET  61          3HE       MET  61   4.381   2.183  -9.166
  435    H    LYS  62           H        LYS  62   0.314   4.280  -5.248
  436    HA   LYS  62           HA       LYS  62   0.840   6.660  -6.786
  437   1HB   LYS  62          1HB       LYS  62  -1.785   5.217  -6.326
  438   2HB   LYS  62          2HB       LYS  62  -1.431   6.396  -7.573
  439   1HG   LYS  62          1HG       LYS  62   0.562   4.272  -7.654
  440   2HG   LYS  62          2HG       LYS  62  -1.041   3.567  -7.687
  441   1HD   LYS  62          1HD       LYS  62  -1.615   4.595  -9.714
  442   2HD   LYS  62          2HD       LYS  62  -0.534   5.951  -9.460
  443   1HE   LYS  62          1HE       LYS  62   1.287   4.853 -10.361
  444   2HE   LYS  62          2HE       LYS  62   0.827   3.305  -9.682
  445   1HZ   LYS  62          1HZ       LYS  62  -0.333   2.797 -11.496
  446   2HZ   LYS  62          2HZ       LYS  62  -0.955   4.294 -11.693
  447   3HZ   LYS  62          3HZ       LYS  62   0.548   3.956 -12.235
  448    H    CYS  63           H        CYS  63  -1.449   5.756  -4.105
  449    HA   CYS  63           HA       CYS  63  -2.457   8.168  -3.545
  450   1HB   CYS  63          1HB       CYS  63  -3.255   6.340  -2.325
  451   2HB   CYS  63          2HB       CYS  63  -1.663   5.902  -1.738
  452    H    HIS  64           H        HIS  64   0.837   6.941  -2.887
  453    HA   HIS  64           HA       HIS  64   1.620   8.939  -1.109
  454   1HB   HIS  64          1HB       HIS  64   2.860   6.892  -1.318
  455   2HB   HIS  64          2HB       HIS  64   3.178   7.181  -3.017
  456    HD1  HIS  64           1HD      HIS  64   4.441   9.822  -3.252
  457    HD2  HIS  64           2HD      HIS  64   5.112   7.408   0.113
  458    HE1  HIS  64           1HE      HIS  64   6.624  10.636  -2.212
  459    H    LYS  65           H        LYS  65   2.483   8.613  -4.631
  460    HA   LYS  65           HA       LYS  65   3.472  11.200  -4.849
  461   1HB   LYS  65          1HB       LYS  65   3.969  10.551  -6.934
  462   2HB   LYS  65          2HB       LYS  65   3.390   8.974  -6.436
  463   1HG   LYS  65          1HG       LYS  65   1.011   9.918  -7.127
  464   2HG   LYS  65          2HG       LYS  65   1.934  11.105  -8.028
  465   1HD   LYS  65          1HD       LYS  65   3.078   9.342  -9.298
  466   2HD   LYS  65          2HD       LYS  65   2.355   8.093  -8.304
  467   1HE   LYS  65          1HE       LYS  65   0.624   8.009  -9.768
  468   2HE   LYS  65          2HE       LYS  65   0.155   9.613  -9.240
  469   1HZ   LYS  65          1HZ       LYS  65   2.047   9.014 -11.408
  470   2HZ   LYS  65          2HZ       LYS  65   0.522   9.569 -11.588
  471   3HZ   LYS  65          3HZ       LYS  65   1.660  10.517 -10.899
  472    H    ALA  66           H        ALA  66   0.163   9.884  -5.025
  473    HA   ALA  66           HA       ALA  66  -1.011  12.157  -6.194
  474   1HB   ALA  66          1HB       ALA  66  -1.776   9.576  -5.286
  475   2HB   ALA  66          2HB       ALA  66  -2.800  10.744  -4.416
  476   3HB   ALA  66          3HB       ALA  66  -2.759  10.748  -6.195
  477    H    CYS  67           H        CYS  67  -0.757  11.039  -2.744
  478    HA   CYS  67           HA       CYS  67  -1.980  13.288  -1.672
  479   1HB   CYS  67          1HB       CYS  67  -1.485  11.047  -0.571
  480   2HB   CYS  67          2HB       CYS  67   0.141  11.639  -0.298
  481    H    ARG  68           H        ARG  68   1.423  12.500  -2.550
  482    HA   ARG  68           HA       ARG  68   2.669  14.581  -1.329
  483   1HB   ARG  68          1HB       ARG  68   3.708  12.630  -2.631
  484   2HB   ARG  68          2HB       ARG  68   3.360  13.507  -4.108
  485   1HG   ARG  68          1HG       ARG  68   4.675  15.321  -2.279
  486   2HG   ARG  68          2HG       ARG  68   5.602  13.834  -2.327
  487   1HD   ARG  68          1HD       ARG  68   6.528  14.972  -4.150
  488   2HD   ARG  68          2HD       ARG  68   5.285  14.038  -4.959
  489    HE   ARG  68           HE       ARG  68   4.409  16.690  -4.016
  490   1HH1  ARG  68          2HH2      ARG  68   5.725  14.819  -6.690
  491   2HH1  ARG  68          1HH2      ARG  68   5.231  15.959  -7.897
  492   1HH2  ARG  68          2HH1      ARG  68   3.758  18.194  -5.608
  493   2HH2  ARG  68          1HH1      ARG  68   4.105  17.892  -7.278
  494    H    ALA  69           H        ALA  69   0.646  14.512  -4.249
  495    HA   ALA  69           HA       ALA  69   1.369  17.285  -4.843
  496   1HB   ALA  69          1HB       ALA  69   0.994  15.047  -6.457
  497   2HB   ALA  69          2HB       ALA  69  -0.534  15.943  -6.632
  498   3HB   ALA  69          3HB       ALA  69   1.013  16.740  -7.005
  499    H    ALA  70           H        ALA  70  -0.985  15.291  -3.262
  500    HA   ALA  70           HA       ALA  70  -3.193  17.070  -3.695
  501   1HB   ALA  70          1HB       ALA  70  -3.126  14.482  -3.206
  502   2HB   ALA  70          2HB       ALA  70  -3.042  15.001  -1.506
  503   3HB   ALA  70          3HB       ALA  70  -4.427  15.481  -2.516
  504    H    ASN  71           H        ASN  71  -1.537  15.992  -0.641
  505    HA   ASN  71           HA       ASN  71  -2.388  18.365   0.641
  506   1HB   ASN  71          1HB       ASN  71  -1.285  15.796   1.391
  507   2HB   ASN  71          2HB       ASN  71  -0.269  17.033   2.106
  508   1HD2  ASN  71          1HD2      ASN  71  -3.357  15.504   2.052
  509   2HD2  ASN  71          2HD2      ASN  71  -4.074  16.298   3.415
  510    H    CYS  72           H        CYS  72   0.931  16.878   0.326
  511    HA   CYS  72           HA       CYS  72   2.246  19.308   0.746
  512   1HB   CYS  72          1HB       CYS  72   3.225  16.722  -0.479
  513   2HB   CYS  72          2HB       CYS  72   4.259  18.073  -0.058
  514    H    ALA  73           H        ALA  73   3.794  20.295  -0.966
  515    HA   ALA  73           HA       ALA  73   3.337  19.881  -3.693
  516   1HB   ALA  73          1HB       ALA  73   1.129  21.029  -2.685
  517   2HB   ALA  73          2HB       ALA  73   2.110  22.498  -2.908
  518   3HB   ALA  73          3HB       ALA  73   1.758  21.443  -4.298
  519    H    SER  74           H        SER  74   4.112  22.193  -1.041
  520    HA   SER  74           HA       SER  74   6.080  23.440  -2.725
  521   1HB   SER  74          1HB       SER  74   4.542  24.638  -1.012
  522   2HB   SER  74          2HB       SER  74   5.593  23.983   0.228
  523    HG   SER  74           HG       SER  74   6.009  26.240  -0.886
  524    H    GLU  75           H        GLU  75   5.795  21.083  -0.078
  525    HA   GLU  75           HA       GLU  75   8.569  21.167   0.535
  526   1HB   GLU  75          1HB       GLU  75   6.373  19.196   1.307
  527   2HB   GLU  75          2HB       GLU  75   8.003  19.146   1.947
  528   1HG   GLU  75          1HG       GLU  75   6.639  21.804   2.114
  529   2HG   GLU  75          2HG       GLU  75   5.950  20.540   3.113
  530    H    CYS  76           H        CYS  76   6.961  20.140  -2.168
  531    HA   CYS  76           HA       CYS  76   9.089  18.276  -2.784
  532   1HB   CYS  76          1HB       CYS  76   6.344  17.410  -3.567
  533   2HB   CYS  76          2HB       CYS  76   7.802  16.463  -3.344
  534    HA   PRO  77           HA       PRO  77   8.453  20.993  -6.226
  535   1HB   PRO  77          1HB       PRO  77  10.919  20.666  -7.357
  536   2HB   PRO  77          2HB       PRO  77  10.584  21.857  -6.116
  537   1HG   PRO  77          1HG       PRO  77  12.022  19.286  -5.876
  538   2HG   PRO  77          2HG       PRO  77  12.042  20.660  -4.789
  539   1HD   PRO  77          1HD       PRO  77  10.622  18.196  -4.413
  540   2HD   PRO  77          2HD       PRO  77  10.551  19.614  -3.386
  541    H    LYS  78           H        LYS  78   9.487  20.611  -8.751
  542    HA   LYS  78           HA       LYS  78   7.886  18.298  -9.479
  543   1HB   LYS  78          1HB       LYS  78   8.268  20.875 -10.564
  544   2HB   LYS  78          2HB       LYS  78   9.005  19.769 -11.706
  545   1HG   LYS  78          1HG       LYS  78   6.786  18.348 -11.334
  546   2HG   LYS  78          2HG       LYS  78   6.132  19.867 -10.753
  547   1HD   LYS  78          1HD       LYS  78   5.617  20.013 -13.030
  548   2HD   LYS  78          2HD       LYS  78   7.147  20.866 -12.986
  549   1HE   LYS  78          1HE       LYS  78   7.924  19.399 -14.535
  550   2HE   LYS  78          2HE       LYS  78   7.891  18.161 -13.295
  551   1HZ   LYS  78          1HZ       LYS  78   6.579  17.723 -15.359
  552   2HZ   LYS  78          2HZ       LYS  78   5.772  17.504 -13.956
  553   3HZ   LYS  78          3HZ       LYS  78   5.505  18.843 -14.851
  554    H    HIS  79           H        HIS  79   8.697  16.430 -10.387
  555    HA   HIS  79           HA       HIS  79  10.161  14.909 -10.981
  556   1HB   HIS  79          1HB       HIS  79  11.431  17.394 -11.982
  557   2HB   HIS  79          2HB       HIS  79  12.497  16.012 -11.824
  558    HD1  HIS  79           1HD      HIS  79  10.004  17.495 -14.053
  559    HD2  HIS  79           2HD      HIS  79  11.519  13.650 -13.335
  560    HE1  HIS  79           1HE      HIS  79   9.367  16.085 -16.083
  561    H    GLU  80           H        GLU  80  10.224  14.213  -8.746
  562    HA   GLU  80           HA       GLU  80  12.880  14.355  -7.729
  563   1HB   GLU  80          1HB       GLU  80  10.798  16.077  -6.622
  564   2HB   GLU  80          2HB       GLU  80  11.363  14.947  -5.407
  565   1HG   GLU  80          1HG       GLU  80  13.071  16.872  -7.048
  566   2HG   GLU  80          2HG       GLU  80  12.760  16.954  -5.325
  567    H    HIS  81           H        HIS  81  12.721  13.131  -5.332
  568    HA   HIS  81           HA       HIS  81  10.731  11.033  -5.517
  569   1HB   HIS  81          1HB       HIS  81  13.696  10.413  -5.426
  570   2HB   HIS  81          2HB       HIS  81  12.388   9.248  -5.372
  571    HD1  HIS  81           1HD      HIS  81  11.952   8.158  -7.567
  572    HD2  HIS  81           2HD      HIS  81  13.447  12.050  -8.024
  573    HE1  HIS  81           1HE      HIS  81  12.175   8.547 -10.079
  574    H    LYS  82           H        LYS  82   9.773  11.673  -3.587
  575    HA   LYS  82           HA       LYS  82   9.625  12.250  -1.432
  576   1HB   LYS  82          1HB       LYS  82  10.561  10.440   0.077
  577   2HB   LYS  82          2HB       LYS  82   9.478   9.912  -1.195
  578   1HG   LYS  82          1HG       LYS  82  11.404   9.257  -2.611
  579   2HG   LYS  82          2HG       LYS  82  12.525   9.873  -1.414
  580   1HD   LYS  82          1HD       LYS  82  12.466   7.896  -0.310
  581   2HD   LYS  82          2HD       LYS  82  10.741   8.072  -0.054
  582   1HE   LYS  82          1HE       LYS  82  10.619   6.167  -1.335
  583   2HE   LYS  82          2HE       LYS  82  10.715   7.296  -2.672
  584   1HZ   LYS  82          1HZ       LYS  82  12.339   5.448  -2.718
  585   2HZ   LYS  82          2HZ       LYS  82  13.015   6.930  -2.841
  586   3HZ   LYS  82          3HZ       LYS  82  13.094   6.111  -1.430
  587    H    SER  83           H        SER  83  10.791  14.303  -1.745
  588    HA   SER  83           HA       SER  83  13.552  14.402  -1.289
  589   1HB   SER  83          1HB       SER  83  13.314  16.605  -1.829
  590   2HB   SER  83          2HB       SER  83  11.685  16.143  -2.280
  591    HG   SER  83           HG       SER  83  11.872  18.026  -0.793
  592    H    ASP  84           H        ASP  84  14.590  15.596   0.601
  593    HA   ASP  84           HA       ASP  84  14.045  14.356   2.941
  594   1HB   ASP  84          1HB       ASP  84  16.126  15.639   2.391
  595   2HB   ASP  84          2HB       ASP  84  15.238  17.142   2.546
  596    H    THR  85           H        THR  85  13.309  17.829   2.073
  597    HA   THR  85           HA       THR  85  11.694  18.275   4.347
  598    HB   THR  85           HB       THR  85  12.971  19.831   2.502
  599    HG1  THR  85           1HG      THR  85  12.015  21.354   3.850
  600   1HG2  THR  85          1HG2      THR  85   9.991  20.084   1.856
  601   2HG2  THR  85          2HG2      THR  85  11.329  21.025   1.153
  602   3HG2  THR  85          3HG2      THR  85  11.156  19.296   0.764
  603    H    CYS  86           H        CYS  86  11.132  16.570   1.379
  604    HA   CYS  86           HA       CYS  86   8.335  17.056   1.302
  605   1HB   CYS  86          1HB       CYS  86   9.675  16.448  -0.682
  606   2HB   CYS  86          2HB       CYS  86   9.965  14.861   0.004
  607    H    ARG  87           H        ARG  87  10.359  14.115   2.059
  608    HA   ARG  87           HA       ARG  87   8.418  12.521   2.970
  609   1HB   ARG  87          1HB       ARG  87  11.236  12.856   4.114
  610   2HB   ARG  87          2HB       ARG  87  10.210  11.474   4.442
  611   1HG   ARG  87          1HG       ARG  87  10.060  11.112   1.903
  612   2HG   ARG  87          2HG       ARG  87  11.293  12.345   1.726
  613   1HD   ARG  87          1HD       ARG  87  12.347  10.117   1.740
  614   2HD   ARG  87          2HD       ARG  87  12.846  11.011   3.162
  615    HE   ARG  87           HE       ARG  87  11.043   8.668   3.100
  616   1HH1  ARG  87          2HH2      ARG  87  12.394  11.308   4.995
  617   2HH1  ARG  87          1HH2      ARG  87  12.029  10.570   6.519
  618   1HH2  ARG  87          2HH1      ARG  87  10.561   7.695   5.110
  619   2HH2  ARG  87          1HH1      ARG  87  10.979   8.501   6.585
  620    H    ALA  88           H        ALA  88  10.063  15.206   4.707
  621    HA   ALA  88           HA       ALA  88   8.979  14.635   7.243
  622   1HB   ALA  88          1HB       ALA  88  10.720  16.552   5.997
  623   2HB   ALA  88          2HB       ALA  88   9.491  17.431   6.938
  624   3HB   ALA  88          3HB       ALA  88  10.508  16.204   7.730
  625    H    CYS  89           H        CYS  89   7.852  16.458   4.377
  626    HA   CYS  89           HA       CYS  89   5.707  17.698   5.734
  627   1HB   CYS  89          1HB       CYS  89   6.509  18.739   3.771
  628   2HB   CYS  89          2HB       CYS  89   6.369  17.271   2.826
  629    H    MET  90           H        MET  90   5.929  14.953   3.344
  630    HA   MET  90           HA       MET  90   3.292  14.212   3.531
  631   1HB   MET  90          1HB       MET  90   5.870  12.700   2.889
  632   2HB   MET  90          2HB       MET  90   4.314  11.900   2.790
  633   1HG   MET  90          1HG       MET  90   4.667  14.554   1.379
  634   2HG   MET  90          2HG       MET  90   5.364  13.119   0.653
  635   1HE   MET  90          1HE       MET  90   4.157  10.951   1.006
  636   2HE   MET  90          2HE       MET  90   2.473  10.837   1.571
  637   3HE   MET  90          3HE       MET  90   2.832  10.795  -0.172
  638    H    LYS  91           H        LYS  91   5.960  13.726   5.768
  639    HA   LYS  91           HA       LYS  91   5.074  11.420   7.053
  640   1HB   LYS  91          1HB       LYS  91   7.286  12.123   7.447
  641   2HB   LYS  91          2HB       LYS  91   6.801  13.751   7.873
  642   1HG   LYS  91          1HG       LYS  91   5.758  12.967   9.952
  643   2HG   LYS  91          2HG       LYS  91   6.010  11.292   9.501
  644   1HD   LYS  91          1HD       LYS  91   8.535  11.820   9.433
  645   2HD   LYS  91          2HD       LYS  91   8.148  13.359  10.176
  646   1HE   LYS  91          1HE       LYS  91   6.897  11.971  11.996
  647   2HE   LYS  91          2HE       LYS  91   7.721  10.574  11.331
  648   1HZ   LYS  91          1HZ       LYS  91   9.076  12.999  12.292
  649   2HZ   LYS  91          2HZ       LYS  91   8.938  11.608  13.137
  650   3HZ   LYS  91          3HZ       LYS  91   9.807  11.641  11.755
  651    H    THR  92           H        THR  92   4.271  14.903   7.522
  652    HA   THR  92           HA       THR  92   2.325  14.123   9.564
  653    HB   THR  92           HB       THR  92   3.642  16.727   8.675
  654    HG1  THR  92           1HG      THR  92   4.227  16.529  10.989
  655   1HG2  THR  92          1HG2      THR  92   2.315  17.611  10.765
  656   2HG2  THR  92          2HG2      THR  92   1.456  17.536   9.208
  657   3HG2  THR  92          3HG2      THR  92   1.195  16.268  10.431
  658    H    ASN  93           H        ASN  93   2.522  15.973   6.456
  659    HA   ASN  93           HA       ASN  93  -0.074  16.602   6.209
  660   1HB   ASN  93          1HB       ASN  93   2.129  15.927   4.276
  661   2HB   ASN  93          2HB       ASN  93   0.511  15.957   3.605
  662   1HD2  ASN  93          1HD2      ASN  93   2.724  17.806   5.677
  663   2HD2  ASN  93          2HD2      ASN  93   2.234  19.389   5.173
  664    H    CYS  94           H        CYS  94   1.579  13.580   5.005
  665    HA   CYS  94           HA       CYS  94  -1.063  12.315   4.930
  666   1HB   CYS  94          1HB       CYS  94   0.811  12.561   2.890
  667   2HB   CYS  94          2HB       CYS  94   1.048  10.926   3.475
  668    H    LYS  95           H        LYS  95  -0.989  11.707   7.186
  669    HA   LYS  95           HA       LYS  95   1.058  10.732   8.616
  670   1HB   LYS  95          1HB       LYS  95  -1.865  10.427   8.645
  671   2HB   LYS  95          2HB       LYS  95  -1.021   9.101   9.420
  672   1HG   LYS  95          1HG       LYS  95   0.402  11.203  10.444
  673   2HG   LYS  95          2HG       LYS  95  -1.144  11.991  10.200
  674   1HD   LYS  95          1HD       LYS  95  -2.273  10.167  11.498
  675   2HD   LYS  95          2HD       LYS  95  -0.722   9.392  11.752
  676   1HE   LYS  95          1HE       LYS  95  -0.713  10.623  13.693
  677   2HE   LYS  95          2HE       LYS  95  -0.112  11.899  12.653
  678   1HZ   LYS  95          1HZ       LYS  95  -2.238  12.192  14.120
  679   2HZ   LYS  95          2HZ       LYS  95  -2.093  12.940  12.675
  680   3HZ   LYS  95          3HZ       LYS  95  -2.981  11.576  12.803
  Start of MODEL    5
    1   1H    ILE   1           H        ILE   1 -21.477  15.955   9.723
    2    HA   ILE   1           HA       ILE   1 -21.506  15.752   6.813
    3    HB   ILE   1           HB       ILE   1 -23.258  17.569   8.463
    4   1HG1  ILE   1          1HG1      ILE   1 -24.116  15.794   6.186
    5   2HG1  ILE   1          2HG1      ILE   1 -23.924  15.140   7.800
    6   1HG2  ILE   1          1HG2      ILE   1 -22.274  17.833   5.647
    7   2HG2  ILE   1          2HG2      ILE   1 -23.937  18.331   6.040
    8   3HG2  ILE   1          3HG2      ILE   1 -22.560  19.081   6.884
    9   1HD1  ILE   1          1HD1      ILE   1 -25.440  17.023   8.643
   10   2HD1  ILE   1          2HD1      ILE   1 -25.769  17.405   6.936
   11   3HD1  ILE   1          3HD1      ILE   1 -26.229  15.818   7.598
   12    H    SER   2           H        SER   2 -19.200  15.960   6.981
   13    HA   SER   2           HA       SER   2 -18.345  18.577   6.826
   14   1HB   SER   2          1HB       SER   2 -18.254  17.397   9.541
   15   2HB   SER   2          2HB       SER   2 -16.704  18.014   9.004
   16    HG   SER   2           HG       SER   2 -17.508  19.893   9.675
   17    H    GLU   3           H        GLU   3 -17.181  15.379   8.132
   18    HA   GLU   3           HA       GLU   3 -15.508  14.103   7.586
   19   1HB   GLU   3          1HB       GLU   3 -16.968  14.526   5.255
   20   2HB   GLU   3          2HB       GLU   3 -15.330  14.853   4.728
   21   1HG   GLU   3          1HG       GLU   3 -14.611  12.672   5.106
   22   2HG   GLU   3          2HG       GLU   3 -15.716  12.419   6.442
   23    H    PHE   4           H        PHE   4 -14.075  15.547   8.873
   24    HA   PHE   4           HA       PHE   4 -12.163  16.928   7.122
   25   1HB   PHE   4          1HB       PHE   4 -13.781  17.820   9.331
   26   2HB   PHE   4          2HB       PHE   4 -12.155  17.688   9.972
   27    HD1  PHE   4           1HD      PHE   4 -10.281  18.812   8.499
   28    HD2  PHE   4           2HD      PHE   4 -14.406  19.781   8.274
   29    HE1  PHE   4           1HE      PHE   4  -9.703  21.038   7.494
   30    HE2  PHE   4           2HE      PHE   4 -13.828  22.007   7.270
   31    HZ   PHE   4           HZ       PHE   4 -11.484  22.609   6.891
   32    H    ALA   5           H        ALA   5 -10.699  15.199   6.876
   33    HA   ALA   5           HA       ALA   5  -9.049  14.729   9.181
   34   1HB   ALA   5          1HB       ALA   5  -9.583  12.117   8.151
   35   2HB   ALA   5          2HB       ALA   5  -9.906  12.745   9.785
   36   3HB   ALA   5          3HB       ALA   5 -11.148  12.880   8.517
   37    HA   PRO   6           HA       PRO   6  -6.170  14.431   5.968
   38   1HB   PRO   6          1HB       PRO   6  -4.101  13.116   7.175
   39   2HB   PRO   6          2HB       PRO   6  -4.410  14.826   7.398
   40   1HG   PRO   6          1HG       PRO   6  -4.928  12.590   9.261
   41   2HG   PRO   6          2HG       PRO   6  -4.827  14.306   9.606
   42   1HD   PRO   6          1HD       PRO   6  -7.218  12.734   9.408
   43   2HD   PRO   6          2HD       PRO   6  -7.120  14.468   9.637
   44    H    VAL   7           H        VAL   7  -5.312  13.213   4.254
   45    HA   VAL   7           HA       VAL   7  -6.778  11.046   3.546
   46    HB   VAL   7           HB       VAL   7  -3.918  11.764   2.890
   47   1HG1  VAL   7          1HG1      VAL   7  -5.756   9.790   1.493
   48   2HG1  VAL   7          2HG1      VAL   7  -4.178  10.345   0.884
   49   3HG1  VAL   7          3HG1      VAL   7  -4.269   9.400   2.390
   50   1HG2  VAL   7          1HG2      VAL   7  -5.915  12.133   0.804
   51   2HG2  VAL   7          2HG2      VAL   7  -6.323  13.047   2.276
   52   3HG2  VAL   7          3HG2      VAL   7  -4.748  13.292   1.484
   53    H    ASP   8           H        ASP   8  -6.132   8.706   3.336
   54    HA   ASP   8           HA       ASP   8  -4.581   7.920   5.676
   55   1HB   ASP   8          1HB       ASP   8  -6.149   5.831   5.612
   56   2HB   ASP   8          2HB       ASP   8  -6.774   7.318   6.296
   57    H    CYS   9           H        CYS   9  -5.910   7.043   2.416
   58    HA   CYS   9           HA       CYS   9  -5.029   5.957   0.719
   59   1HB   CYS   9          1HB       CYS   9  -2.429   5.851   2.261
   60   2HB   CYS   9          2HB       CYS   9  -2.640   5.496   0.558
   61    H    LYS  10           H        LYS  10  -3.394   4.552   3.663
   62    HA   LYS  10           HA       LYS  10  -3.399   1.953   2.999
   63   1HB   LYS  10          1HB       LYS  10  -2.402   2.795   5.036
   64   2HB   LYS  10          2HB       LYS  10  -3.972   3.201   5.700
   65   1HG   LYS  10          1HG       LYS  10  -3.892   0.395   4.840
   66   2HG   LYS  10          2HG       LYS  10  -2.599   0.740   5.971
   67   1HD   LYS  10          1HD       LYS  10  -4.045   1.130   7.729
   68   2HD   LYS  10          2HD       LYS  10  -5.248   1.898   6.712
   69   1HE   LYS  10          1HE       LYS  10  -6.011  -0.286   5.868
   70   2HE   LYS  10          2HE       LYS  10  -4.713  -1.110   6.708
   71   1HZ   LYS  10          1HZ       LYS  10  -6.300  -1.312   8.251
   72   2HZ   LYS  10          2HZ       LYS  10  -5.825   0.183   8.708
   73   3HZ   LYS  10          3HZ       LYS  10  -7.147  -0.002   7.767
   74    H    GLY  11           H        GLY  11  -6.146   3.582   4.740
   75   1HA   GLY  11          1HA       GLY  11  -7.877   1.356   4.505
   76   2HA   GLY  11          2HA       GLY  11  -8.314   3.001   4.923
   77    H    GLN  12           H        GLN  12  -7.864   4.580   2.805
   78    HA   GLN  12           HA       GLN  12  -9.911   4.187   1.144
   79   1HB   GLN  12          1HB       GLN  12  -7.272   5.618   0.782
   80   2HB   GLN  12          2HB       GLN  12  -8.415   5.579  -0.545
   81   1HG   GLN  12          1HG       GLN  12  -9.528   6.305   2.146
   82   2HG   GLN  12          2HG       GLN  12  -8.464   7.482   1.403
   83   1HE2  GLN  12          1HE2      GLN  12  -9.505   8.976   0.351
   84   2HE2  GLN  12          2HE2      GLN  12 -10.941   8.794  -0.601
   85    H    CYS  13           H        CYS  13  -6.649   2.749   0.907
   86    HA   CYS  13           HA       CYS  13  -7.126   1.714  -1.713
   87   1HB   CYS  13          1HB       CYS  13  -4.939   1.238   0.316
   88   2HB   CYS  13          2HB       CYS  13  -4.993   0.444  -1.245
   89    H    THR  14           H        THR  14  -9.336   0.848  -0.729
   90    HA   THR  14           HA       THR  14  -8.916  -1.702   0.649
   91    HB   THR  14           HB       THR  14 -11.292   0.160   0.192
   92    HG1  THR  14           1HG      THR  14 -10.905   0.432   2.409
   93   1HG2  THR  14          1HG2      THR  14 -12.520  -1.481   1.709
   94   2HG2  THR  14          2HG2      THR  14 -12.236  -2.104   0.066
   95   3HG2  THR  14          3HG2      THR  14 -11.208  -2.647   1.413
   96    H    THR  15           H        THR  15 -10.190  -0.271  -2.382
   97    HA   THR  15           HA       THR  15 -11.173  -2.737  -3.382
   98    HB   THR  15           HB       THR  15 -10.781   0.087  -4.268
   99    HG1  THR  15           1HG      THR  15 -12.677  -2.075  -4.855
  100   1HG2  THR  15          1HG2      THR  15 -11.177  -2.153  -6.314
  101   2HG2  THR  15          2HG2      THR  15 -11.099  -0.404  -6.635
  102   3HG2  THR  15          3HG2      THR  15  -9.638  -1.280  -6.119
  103    HA   PRO  16           HA       PRO  16  -6.960  -2.889  -5.488
  104   1HB   PRO  16          1HB       PRO  16  -4.928  -1.305  -4.575
  105   2HB   PRO  16          2HB       PRO  16  -5.927  -0.884  -5.952
  106   1HG   PRO  16          1HG       PRO  16  -5.992   0.217  -3.209
  107   2HG   PRO  16          2HG       PRO  16  -6.662   0.894  -4.680
  108   1HD   PRO  16          1HD       PRO  16  -8.108  -0.427  -2.584
  109   2HD   PRO  16          2HD       PRO  16  -8.759   0.147  -4.107
  110    H    CYS  17           H        CYS  17  -7.426  -2.685  -2.150
  111    HA   CYS  17           HA       CYS  17  -5.394  -4.773  -1.825
  112   1HB   CYS  17          1HB       CYS  17  -6.370  -2.940   0.364
  113   2HB   CYS  17          2HB       CYS  17  -5.029  -4.065   0.420
  114    H    GLU  18           H        GLU  18  -8.393  -4.702  -2.635
  115    HA   GLU  18           HA       GLU  18  -9.780  -5.710  -0.402
  116   1HB   GLU  18          1HB       GLU  18 -10.398  -4.854  -3.047
  117   2HB   GLU  18          2HB       GLU  18 -10.954  -6.512  -2.943
  118   1HG   GLU  18          1HG       GLU  18 -11.883  -5.632  -0.550
  119   2HG   GLU  18          2HG       GLU  18 -11.869  -4.099  -1.399
  120    HA   PRO  19           HA       PRO  19  -8.967  -9.867  -2.524
  121   1HB   PRO  19          1HB       PRO  19  -7.346 -10.013  -4.719
  122   2HB   PRO  19          2HB       PRO  19  -9.092  -9.904  -4.823
  123   1HG   PRO  19          1HG       PRO  19  -7.071  -7.811  -5.344
  124   2HG   PRO  19          2HG       PRO  19  -8.751  -7.862  -5.839
  125   1HD   PRO  19          1HD       PRO  19  -7.639  -6.308  -3.700
  126   2HD   PRO  19          2HD       PRO  19  -9.334  -6.449  -4.121
  127    H    LEU  20           H        LEU  20  -6.381  -7.609  -2.301
  128    HA   LEU  20           HA       LEU  20  -4.390  -9.571  -1.811
  129   1HB   LEU  20          1HB       LEU  20  -3.541  -7.603  -2.616
  130   2HB   LEU  20          2HB       LEU  20  -4.614  -6.603  -1.658
  131    HG   LEU  20           HG       LEU  20  -2.071  -6.691  -1.111
  132   1HD1  LEU  20          1HD1      LEU  20  -2.600  -5.662   0.809
  133   2HD1  LEU  20          2HD1      LEU  20  -4.283  -5.911   0.286
  134   3HD1  LEU  20          3HD1      LEU  20  -3.525  -7.052   1.423
  135   1HD2  LEU  20          1HD2      LEU  20  -1.196  -8.432   0.078
  136   2HD2  LEU  20          2HD2      LEU  20  -2.773  -8.930   0.736
  137   3HD2  LEU  20          3HD2      LEU  20  -2.347  -9.321  -0.948
  138    H    THR  21           H        THR  21  -6.137  -7.227   0.353
  139    HA   THR  21           HA       THR  21  -5.130  -8.197   2.738
  140    HB   THR  21           HB       THR  21  -7.787  -6.883   1.976
  141    HG1  THR  21           1HG      THR  21  -6.501  -5.061   2.362
  142   1HG2  THR  21          1HG2      THR  21  -8.425  -7.142   4.158
  143   2HG2  THR  21          2HG2      THR  21  -6.895  -7.962   4.552
  144   3HG2  THR  21          3HG2      THR  21  -6.995  -6.186   4.617
  145    H    ALA  22           H        ALA  22  -8.123  -9.220   0.977
  146    HA   ALA  22           HA       ALA  22  -9.041 -11.033   2.804
  147   1HB   ALA  22          1HB       ALA  22  -9.722 -12.246   0.501
  148   2HB   ALA  22          2HB       ALA  22 -10.489 -10.734   1.044
  149   3HB   ALA  22          3HB       ALA  22  -9.183 -10.686  -0.165
  150    H    CYS  23           H        CYS  23  -6.501 -11.451   0.267
  151    HA   CYS  23           HA       CYS  23  -6.112 -14.153   0.586
  152   1HB   CYS  23          1HB       CYS  23  -5.098 -12.365  -1.067
  153   2HB   CYS  23          2HB       CYS  23  -3.778 -12.348   0.086
  154    H    LYS  24           H        LYS  24  -4.304 -11.382   2.119
  155    HA   LYS  24           HA       LYS  24  -2.730 -12.883   3.798
  156   1HB   LYS  24          1HB       LYS  24  -3.358 -10.138   3.373
  157   2HB   LYS  24          2HB       LYS  24  -3.486 -10.436   5.095
  158   1HG   LYS  24          1HG       LYS  24  -1.231 -11.271   5.232
  159   2HG   LYS  24          2HG       LYS  24  -1.105 -11.449   3.493
  160   1HD   LYS  24          1HD       LYS  24  -0.167  -9.384   3.430
  161   2HD   LYS  24          2HD       LYS  24  -1.738  -8.726   3.839
  162   1HE   LYS  24          1HE       LYS  24  -1.168  -8.352   6.049
  163   2HE   LYS  24          2HE       LYS  24  -0.185  -9.799   6.155
  164   1HZ   LYS  24          1HZ       LYS  24   1.292  -8.035   6.204
  165   2HZ   LYS  24          2HZ       LYS  24   1.404  -8.566   4.664
  166   3HZ   LYS  24          3HZ       LYS  24   0.554  -7.214   5.002
  167    H    GLU  25           H        GLU  25  -6.038 -11.527   4.381
  168    HA   GLU  25           HA       GLU  25  -6.290 -12.324   6.969
  169   1HB   GLU  25          1HB       GLU  25  -7.987 -11.334   4.887
  170   2HB   GLU  25          2HB       GLU  25  -8.811 -12.711   5.593
  171   1HG   GLU  25          1HG       GLU  25  -7.543 -10.807   7.531
  172   2HG   GLU  25          2HG       GLU  25  -8.921 -10.190   6.643
  173    H    LYS  26           H        LYS  26  -7.711 -14.112   4.129
  174    HA   LYS  26           HA       LYS  26  -8.488 -16.365   5.340
  175   1HB   LYS  26          1HB       LYS  26  -8.457 -15.618   2.826
  176   2HB   LYS  26          2HB       LYS  26  -6.990 -16.573   2.741
  177   1HG   LYS  26          1HG       LYS  26  -9.143 -17.981   4.186
  178   2HG   LYS  26          2HG       LYS  26  -9.620 -17.549   2.556
  179   1HD   LYS  26          1HD       LYS  26  -7.236 -18.511   1.891
  180   2HD   LYS  26          2HD       LYS  26  -7.323 -19.313   3.447
  181   1HE   LYS  26          1HE       LYS  26  -9.270 -20.561   2.837
  182   2HE   LYS  26          2HE       LYS  26  -9.648 -19.495   1.499
  183   1HZ   LYS  26          1HZ       LYS  26  -7.077 -20.610   1.208
  184   2HZ   LYS  26          2HZ       LYS  26  -8.196 -21.788   1.379
  185   3HZ   LYS  26          3HZ       LYS  26  -8.352 -20.681   0.190
  186    H    CYS  27           H        CYS  27  -5.112 -15.450   4.527
  187    HA   CYS  27           HA       CYS  27  -4.014 -17.938   5.218
  188   1HB   CYS  27          1HB       CYS  27  -2.691 -15.218   5.220
  189   2HB   CYS  27          2HB       CYS  27  -1.872 -16.767   5.236
  190    H    ALA  28           H        ALA  28  -3.841 -14.728   6.944
  191    HA   ALA  28           HA       ALA  28  -2.829 -15.507   9.300
  192   1HB   ALA  28          1HB       ALA  28  -5.055 -13.719   9.791
  193   2HB   ALA  28          2HB       ALA  28  -3.311 -13.364   9.769
  194   3HB   ALA  28          3HB       ALA  28  -4.253 -13.288   8.261
  195    H    GLU  29           H        GLU  29  -6.329 -15.682   8.360
  196    HA   GLU  29           HA       GLU  29  -7.285 -16.645  10.710
  197   1HB   GLU  29          1HB       GLU  29  -8.115 -16.904   7.831
  198   2HB   GLU  29          2HB       GLU  29  -8.935 -17.917   9.002
  199   1HG   GLU  29          1HG       GLU  29  -8.670 -14.878   9.192
  200   2HG   GLU  29          2HG       GLU  29 -10.104 -15.730   8.654
  201    H    SER  30           H        SER  30  -6.156 -18.587   7.846
  202    HA   SER  30           HA       SER  30  -6.484 -21.029   9.116
  203   1HB   SER  30          1HB       SER  30  -5.589 -20.060   6.584
  204   2HB   SER  30          2HB       SER  30  -4.313 -21.102   7.182
  205    HG   SER  30           HG       SER  30  -5.615 -22.854   7.089
  206    H    CYS  31           H        CYS  31  -3.952 -18.564   9.243
  207    HA   CYS  31           HA       CYS  31  -2.236 -20.429  10.700
  208   1HB   CYS  31          1HB       CYS  31  -1.561 -17.752   9.462
  209   2HB   CYS  31          2HB       CYS  31  -0.444 -18.780  10.338
  210    H    GLU  32           H        GLU  32  -4.388 -19.832  12.191
  211    HA   GLU  32           HA       GLU  32  -4.057 -17.346  13.541
  212   1HB   GLU  32          1HB       GLU  32  -6.077 -19.429  13.340
  213   2HB   GLU  32          2HB       GLU  32  -5.789 -19.055  15.028
  214   1HG   GLU  32          1HG       GLU  32  -6.218 -16.865  12.955
  215   2HG   GLU  32          2HG       GLU  32  -7.563 -17.630  13.777
  216    H    THR  33           H        THR  33  -3.710 -20.861  14.392
  217    HA   THR  33           HA       THR  33  -1.909 -20.010  16.564
  218    HB   THR  33           HB       THR  33  -2.855 -21.774  17.930
  219    HG1  THR  33           1HG      THR  33  -4.287 -22.404  15.443
  220   1HG2  THR  33          1HG2      THR  33  -4.419 -19.797  17.694
  221   2HG2  THR  33          2HG2      THR  33  -5.187 -20.617  16.314
  222   3HG2  THR  33          3HG2      THR  33  -5.287 -21.331  17.941
  223    H    SER  34           H        SER  34  -0.581 -20.142  14.339
  224    HA   SER  34           HA       SER  34   0.279 -22.900  14.040
  225   1HB   SER  34          1HB       SER  34  -0.197 -20.828  12.179
  226   2HB   SER  34          2HB       SER  34   1.549 -20.966  12.239
  227    HG   SER  34           HG       SER  34   1.481 -22.960  11.371
  228    H    ALA  35           H        ALA  35   2.615 -23.396  14.077
  229    HA   ALA  35           HA       ALA  35   3.963 -22.466  16.225
  230   1HB   ALA  35          1HB       ALA  35   4.459 -24.131  13.949
  231   2HB   ALA  35          2HB       ALA  35   5.876 -23.078  14.174
  232   3HB   ALA  35          3HB       ALA  35   5.314 -24.110  15.511
  233    H    ASP  36           H        ASP  36   4.794 -21.475  12.823
  234    HA   ASP  36           HA       ASP  36   5.711 -18.971  13.993
  235   1HB   ASP  36          1HB       ASP  36   6.474 -20.440  11.432
  236   2HB   ASP  36          2HB       ASP  36   6.959 -18.783  11.735
  237    H    LYS  37           H        LYS  37   3.768 -17.722  13.861
  238    HA   LYS  37           HA       LYS  37   1.946 -17.885  11.757
  239   1HB   LYS  37          1HB       LYS  37   2.311 -16.371  14.184
  240   2HB   LYS  37          2HB       LYS  37   1.822 -15.290  12.894
  241   1HG   LYS  37          1HG       LYS  37   0.065 -17.236  12.354
  242   2HG   LYS  37          2HG       LYS  37   0.356 -17.680  14.024
  243   1HD   LYS  37          1HD       LYS  37  -0.082 -14.768  13.623
  244   2HD   LYS  37          2HD       LYS  37  -1.459 -15.755  13.175
  245   1HE   LYS  37          1HE       LYS  37  -1.998 -15.902  15.373
  246   2HE   LYS  37          2HE       LYS  37  -0.556 -16.867  15.619
  247   1HZ   LYS  37          1HZ       LYS  37  -0.804 -13.958  15.870
  248   2HZ   LYS  37          2HZ       LYS  37  -0.403 -15.033  17.033
  249   3HZ   LYS  37          3HZ       LYS  37   0.644 -14.710  15.822
  250    H    LYS  38           H        LYS  38   4.638 -15.534  12.391
  251    HA   LYS  38           HA       LYS  38   4.307 -13.930  10.221
  252   1HB   LYS  38          1HB       LYS  38   6.386 -14.538  12.123
  253   2HB   LYS  38          2HB       LYS  38   7.098 -14.316  10.538
  254   1HG   LYS  38          1HG       LYS  38   6.519 -12.086  10.431
  255   2HG   LYS  38          2HG       LYS  38   4.982 -12.333  11.236
  256   1HD   LYS  38          1HD       LYS  38   7.503 -12.694  12.856
  257   2HD   LYS  38          2HD       LYS  38   7.013 -11.061  12.450
  258   1HE   LYS  38          1HE       LYS  38   5.223 -11.105  13.884
  259   2HE   LYS  38          2HE       LYS  38   4.767 -12.733  13.423
  260   1HZ   LYS  38          1HZ       LYS  38   5.745 -13.467  15.234
  261   2HZ   LYS  38          2HZ       LYS  38   7.185 -12.832  14.798
  262   3HZ   LYS  38          3HZ       LYS  38   6.136 -11.946  15.682
  263    H    THR  39           H        THR  39   6.367 -16.925  10.349
  264    HA   THR  39           HA       THR  39   6.967 -16.925   7.623
  265    HB   THR  39           HB       THR  39   6.746 -19.264   9.591
  266    HG1  THR  39           1HG      THR  39   8.151 -17.708  10.477
  267   1HG2  THR  39          1HG2      THR  39   8.956 -19.018   7.588
  268   2HG2  THR  39          2HG2      THR  39   8.092 -20.472   8.143
  269   3HG2  THR  39          3HG2      THR  39   7.360 -19.417   6.910
  270    H    CYS  40           H        CYS  40   4.389 -18.741   9.415
  271    HA   CYS  40           HA       CYS  40   3.309 -20.113   7.384
  272   1HB   CYS  40          1HB       CYS  40   2.596 -19.941   9.843
  273   2HB   CYS  40          2HB       CYS  40   1.569 -18.614   9.337
  274    H    ARG  41           H        ARG  41   2.223 -16.776   8.384
  275    HA   ARG  41           HA       ARG  41   0.603 -16.354   6.242
  276   1HB   ARG  41          1HB       ARG  41   2.255 -14.392   7.903
  277   2HB   ARG  41          2HB       ARG  41   1.063 -13.859   6.735
  278   1HG   ARG  41          1HG       ARG  41  -0.379 -15.745   8.174
  279   2HG   ARG  41          2HG       ARG  41   0.667 -15.084   9.415
  280   1HD   ARG  41          1HD       ARG  41  -0.329 -12.880   7.830
  281   2HD   ARG  41          2HD       ARG  41  -1.692 -13.896   8.255
  282    HE   ARG  41           HE       ARG  41  -1.485 -13.149  10.451
  283   1HH1  ARG  41          2HH2      ARG  41   1.634 -12.802   8.859
  284   2HH1  ARG  41          1HH2      ARG  41   2.388 -12.042  10.221
  285   1HH2  ARG  41          2HH1      ARG  41  -0.490 -12.147  12.248
  286   2HH2  ARG  41          1HH1      ARG  41   1.172 -11.668  12.162
  287    H    ARG  42           H        ARG  42   4.110 -15.531   6.673
  288    HA   ARG  42           HA       ARG  42   4.527 -14.154   4.404
  289   1HB   ARG  42          1HB       ARG  42   6.128 -15.611   6.328
  290   2HB   ARG  42          2HB       ARG  42   6.765 -15.952   4.732
  291   1HG   ARG  42          1HG       ARG  42   7.914 -13.985   5.137
  292   2HG   ARG  42          2HG       ARG  42   6.468 -13.291   4.431
  293   1HD   ARG  42          1HD       ARG  42   5.518 -12.839   6.644
  294   2HD   ARG  42          2HD       ARG  42   6.798 -13.737   7.435
  295    HE   ARG  42           HE       ARG  42   6.978 -11.013   6.359
  296   1HH1  ARG  42          2HH2      ARG  42   8.797 -13.856   7.354
  297   2HH1  ARG  42          1HH2      ARG  42  10.261 -12.976   7.643
  298   1HH2  ARG  42          2HH1      ARG  42   8.909  -9.851   6.739
  299   2HH2  ARG  42          1HH1      ARG  42  10.325 -10.683   7.291
  300    H    ASN  43           H        ASN  43   4.738 -17.759   4.846
  301    HA   ASN  43           HA       ASN  43   5.428 -18.352   2.262
  302   1HB   ASN  43          1HB       ASN  43   4.388 -19.771   4.621
  303   2HB   ASN  43          2HB       ASN  43   3.732 -20.459   3.149
  304   1HD2  ASN  43          1HD2      ASN  43   5.211 -22.119   4.439
  305   2HD2  ASN  43          2HD2      ASN  43   6.800 -22.326   3.781
  306    H    CYS  44           H        CYS  44   2.195 -18.055   3.887
  307    HA   CYS  44           HA       CYS  44   0.666 -18.825   1.694
  308   1HB   CYS  44          1HB       CYS  44  -0.013 -18.581   4.145
  309   2HB   CYS  44          2HB       CYS  44  -0.213 -16.871   3.817
  310    H    LYS  45           H        LYS  45   2.396 -15.867   2.553
  311    HA   LYS  45           HA       LYS  45   0.920 -14.107   0.909
  312   1HB   LYS  45          1HB       LYS  45   2.946 -13.911   2.821
  313   2HB   LYS  45          2HB       LYS  45   3.710 -13.371   1.339
  314   1HG   LYS  45          1HG       LYS  45   1.284 -12.091   1.131
  315   2HG   LYS  45          2HG       LYS  45   1.461 -12.139   2.874
  316   1HD   LYS  45          1HD       LYS  45   3.987 -11.377   1.590
  317   2HD   LYS  45          2HD       LYS  45   2.689 -10.313   1.089
  318   1HE   LYS  45          1HE       LYS  45   3.621  -9.343   3.090
  319   2HE   LYS  45          2HE       LYS  45   2.075 -10.027   3.553
  320   1HZ   LYS  45          1HZ       LYS  45   4.187 -11.905   3.766
  321   2HZ   LYS  45          2HZ       LYS  45   4.451 -10.587   4.693
  322   3HZ   LYS  45          3HZ       LYS  45   3.082 -11.457   4.882
  323    H    LYS  46           H        LYS  46   3.658 -16.344   0.403
  324    HA   LYS  46           HA       LYS  46   3.969 -15.354  -2.314
  325   1HB   LYS  46          1HB       LYS  46   5.538 -17.317  -0.626
  326   2HB   LYS  46          2HB       LYS  46   5.863 -17.047  -2.326
  327   1HG   LYS  46          1HG       LYS  46   5.641 -14.596  -0.606
  328   2HG   LYS  46          2HG       LYS  46   7.048 -15.606  -0.343
  329   1HD   LYS  46          1HD       LYS  46   6.773 -15.405  -3.173
  330   2HD   LYS  46          2HD       LYS  46   6.480 -13.790  -2.558
  331   1HE   LYS  46          1HE       LYS  46   8.879 -15.468  -1.696
  332   2HE   LYS  46          2HE       LYS  46   8.934 -14.373  -3.063
  333   1HZ   LYS  46          1HZ       LYS  46   9.657 -13.430  -0.906
  334   2HZ   LYS  46          2HZ       LYS  46   8.495 -12.563  -1.657
  335   3HZ   LYS  46          3HZ       LYS  46   8.112 -13.509  -0.383
  336    H    ALA  47           H        ALA  47   1.983 -17.488  -0.612
  337    HA   ALA  47           HA       ALA  47   1.968 -19.707  -2.338
  338   1HB   ALA  47          1HB       ALA  47  -0.190 -18.562  -0.518
  339   2HB   ALA  47          2HB       ALA  47  -0.184 -20.199  -1.217
  340   3HB   ALA  47          3HB       ALA  47   1.070 -19.727  -0.044
  341    H    ASP  48           H        ASP  48  -0.338 -16.903  -2.056
  342    HA   ASP  48           HA       ASP  48  -0.482 -16.774  -4.889
  343   1HB   ASP  48          1HB       ASP  48  -2.159 -18.624  -3.980
  344   2HB   ASP  48          2HB       ASP  48  -3.120 -17.249  -3.472
  345    H    CYS  49           H        CYS  49   0.455 -14.848  -3.189
  346    HA   CYS  49           HA       CYS  49  -1.604 -12.836  -3.353
  347   1HB   CYS  49          1HB       CYS  49  -0.184 -12.946  -0.734
  348   2HB   CYS  49          2HB       CYS  49  -1.728 -12.228  -1.148
  349    H    GLU  50           H        GLU  50   0.984 -13.632  -4.674
  350    HA   GLU  50           HA       GLU  50   2.929 -11.829  -3.659
  351   1HB   GLU  50          1HB       GLU  50   2.761 -13.924  -5.725
  352   2HB   GLU  50          2HB       GLU  50   3.721 -12.554  -6.247
  353   1HG   GLU  50          1HG       GLU  50   4.152 -13.747  -3.489
  354   2HG   GLU  50          2HG       GLU  50   4.877 -14.502  -4.895
  355    HA   PRO  51           HA       PRO  51   1.518  -9.447  -7.518
  356   1HB   PRO  51          1HB       PRO  51  -0.776 -10.190  -8.804
  357   2HB   PRO  51          2HB       PRO  51   0.820 -10.694  -9.324
  358   1HG   PRO  51          1HG       PRO  51  -1.253 -12.264  -7.918
  359   2HG   PRO  51          2HG       PRO  51   0.142 -12.838  -8.810
  360   1HD   PRO  51          1HD       PRO  51  -0.139 -12.708  -5.958
  361   2HD   PRO  51          2HD       PRO  51   1.297 -13.171  -6.850
  362    H    GLN  52           H        GLN  52  -0.864 -10.645  -5.329
  363    HA   GLN  52           HA       GLN  52  -2.493  -8.357  -5.539
  364   1HB   GLN  52          1HB       GLN  52  -2.345 -10.302  -3.200
  365   2HB   GLN  52          2HB       GLN  52  -3.706  -9.295  -3.654
  366   1HG   GLN  52          1HG       GLN  52  -3.825 -10.539  -5.862
  367   2HG   GLN  52          2HG       GLN  52  -2.551 -11.599  -5.294
  368   1HE2  GLN  52          1HE2      GLN  52  -4.524 -13.008  -5.898
  369   2HE2  GLN  52          2HE2      GLN  52  -5.552 -13.484  -4.587
  370    H    ASP  53           H        ASP  53  -0.089  -9.517  -3.071
  371    HA   ASP  53           HA       ASP  53  -0.290  -7.414  -1.367
  372   1HB   ASP  53          1HB       ASP  53   1.118  -9.595  -1.223
  373   2HB   ASP  53          2HB       ASP  53   2.354  -8.730  -2.113
  374    H    LYS  54           H        LYS  54   1.332  -7.722  -4.530
  375    HA   LYS  54           HA       LYS  54   2.976  -5.435  -4.280
  376   1HB   LYS  54          1HB       LYS  54   2.079  -7.191  -6.555
  377   2HB   LYS  54          2HB       LYS  54   2.953  -5.707  -6.875
  378   1HG   LYS  54          1HG       LYS  54   4.729  -6.506  -5.207
  379   2HG   LYS  54          2HG       LYS  54   3.895  -8.047  -5.158
  380   1HD   LYS  54          1HD       LYS  54   4.969  -8.693  -7.043
  381   2HD   LYS  54          2HD       LYS  54   4.212  -7.384  -7.928
  382   1HE   LYS  54          1HE       LYS  54   6.032  -5.833  -7.235
  383   2HE   LYS  54          2HE       LYS  54   6.776  -7.106  -6.287
  384   1HZ   LYS  54          1HZ       LYS  54   7.082  -6.611  -8.986
  385   2HZ   LYS  54          2HZ       LYS  54   7.767  -7.803  -8.104
  386   3HZ   LYS  54          3HZ       LYS  54   6.342  -8.062  -8.859
  387    H    VAL  55           H        VAL  55  -0.119  -6.023  -6.099
  388    HA   VAL  55           HA       VAL  55  -0.589  -3.567  -7.057
  389    HB   VAL  55           HB       VAL  55  -2.540  -5.456  -5.726
  390   1HG1  VAL  55          1HG1      VAL  55  -4.326  -4.339  -6.760
  391   2HG1  VAL  55          2HG1      VAL  55  -3.314  -3.024  -6.118
  392   3HG1  VAL  55          3HG1      VAL  55  -3.252  -3.430  -7.850
  393   1HG2  VAL  55          1HG2      VAL  55  -2.129  -6.792  -7.463
  394   2HG2  VAL  55          2HG2      VAL  55  -2.747  -5.522  -8.547
  395   3HG2  VAL  55          3HG2      VAL  55  -1.010  -5.599  -8.166
  396    H    CYS  56           H        CYS  56  -1.735  -4.641  -3.773
  397    HA   CYS  56           HA       CYS  56  -2.728  -2.344  -2.857
  398   1HB   CYS  56          1HB       CYS  56  -2.492  -4.581  -1.676
  399   2HB   CYS  56          2HB       CYS  56  -0.899  -4.055  -1.171
  400    H    ASP  57           H        ASP  57   0.774  -3.326  -2.786
  401    HA   ASP  57           HA       ASP  57   1.806  -1.172  -1.558
  402   1HB   ASP  57          1HB       ASP  57   2.839  -3.343  -2.821
  403   2HB   ASP  57          2HB       ASP  57   3.226  -2.135  -4.029
  404    H    ALA  58           H        ALA  58   1.298  -1.636  -5.141
  405    HA   ALA  58           HA       ALA  58   2.204   0.735  -6.080
  406   1HB   ALA  58          1HB       ALA  58   0.991   0.234  -8.012
  407   2HB   ALA  58          2HB       ALA  58   1.098  -1.358  -7.225
  408   3HB   ALA  58          3HB       ALA  58  -0.398  -0.402  -7.099
  409    H    CYS  59           H        CYS  59  -1.142   0.052  -4.841
  410    HA   CYS  59           HA       CYS  59  -2.173   2.555  -5.215
  411   1HB   CYS  59          1HB       CYS  59  -3.365   0.456  -4.483
  412   2HB   CYS  59          2HB       CYS  59  -2.789   0.768  -2.858
  413    H    ARG  60           H        ARG  60  -0.744   1.196  -2.145
  414    HA   ARG  60           HA       ARG  60  -0.766   3.504  -0.733
  415   1HB   ARG  60          1HB       ARG  60   1.222   1.184  -0.689
  416   2HB   ARG  60          2HB       ARG  60   1.234   2.452   0.521
  417   1HG   ARG  60          1HG       ARG  60  -1.431   1.781   0.552
  418   2HG   ARG  60          2HG       ARG  60  -0.731   0.237   0.111
  419   1HD   ARG  60          1HD       ARG  60   0.950   0.716   2.104
  420   2HD   ARG  60          2HD       ARG  60  -0.261   1.870   2.624
  421    HE   ARG  60           HE       ARG  60  -1.683   0.097   3.214
  422   1HH1  ARG  60          2HH2      ARG  60   0.933  -1.117   1.197
  423   2HH1  ARG  60          1HH2      ARG  60   0.531  -2.781   1.456
  424   1HH2  ARG  60          2HH1      ARG  60  -2.214  -2.099   3.556
  425   2HH2  ARG  60          1HH1      ARG  60  -1.271  -3.344   2.807
  426    H    MET  61           H        MET  61   1.381   2.482  -3.357
  427    HA   MET  61           HA       MET  61   3.383   4.409  -2.737
  428   1HB   MET  61          1HB       MET  61   4.166   2.458  -3.885
  429   2HB   MET  61          2HB       MET  61   2.807   2.447  -4.991
  430   1HG   MET  61          1HG       MET  61   3.834   3.873  -6.463
  431   2HG   MET  61          2HG       MET  61   4.413   4.926  -5.188
  432   1HE   MET  61          1HE       MET  61   4.644   1.580  -6.830
  433   2HE   MET  61          2HE       MET  61   5.774   2.440  -7.903
  434   3HE   MET  61          3HE       MET  61   6.370   1.147  -6.836
  435    H    LYS  62           H        LYS  62   0.508   4.166  -4.843
  436    HA   LYS  62           HA       LYS  62   1.155   6.500  -6.347
  437   1HB   LYS  62          1HB       LYS  62  -1.468   5.005  -6.055
  438   2HB   LYS  62          2HB       LYS  62  -1.109   6.225  -7.260
  439   1HG   LYS  62          1HG       LYS  62   0.915   4.055  -7.132
  440   2HG   LYS  62          2HG       LYS  62  -0.687   3.493  -7.568
  441   1HD   LYS  62          1HD       LYS  62  -0.743   4.728  -9.554
  442   2HD   LYS  62          2HD       LYS  62   0.321   5.977  -8.940
  443   1HE   LYS  62          1HE       LYS  62   1.864   4.926 -10.291
  444   2HE   LYS  62          2HE       LYS  62   2.069   3.896  -8.887
  445   1HZ   LYS  62          1HZ       LYS  62   0.118   2.621  -9.978
  446   2HZ   LYS  62          2HZ       LYS  62   0.629   3.350 -11.347
  447   3HZ   LYS  62          3HZ       LYS  62   1.645   2.388 -10.506
  448    H    CYS  63           H        CYS  63  -1.459   5.791  -3.916
  449    HA   CYS  63           HA       CYS  63  -2.412   8.277  -3.595
  450   1HB   CYS  63          1HB       CYS  63  -3.242   6.222  -2.484
  451   2HB   CYS  63          2HB       CYS  63  -1.908   6.312  -1.351
  452    H    HIS  64           H        HIS  64   0.617   6.858  -2.265
  453    HA   HIS  64           HA       HIS  64   1.283   8.838  -0.487
  454   1HB   HIS  64          1HB       HIS  64   2.690   7.078  -0.283
  455   2HB   HIS  64          2HB       HIS  64   2.701   6.733  -2.001
  456    HD1  HIS  64           1HD      HIS  64   5.261   6.554  -2.192
  457    HD2  HIS  64           2HD      HIS  64   3.942  10.235  -0.671
  458    HE1  HIS  64           1HE      HIS  64   7.295   8.095  -2.183
  459    H    LYS  65           H        LYS  65   2.178   8.573  -3.999
  460    HA   LYS  65           HA       LYS  65   3.373  11.151  -3.998
  461   1HB   LYS  65          1HB       LYS  65   4.325   9.856  -5.613
  462   2HB   LYS  65          2HB       LYS  65   2.848   8.978  -5.957
  463   1HG   LYS  65          1HG       LYS  65   1.920  11.014  -7.101
  464   2HG   LYS  65          2HG       LYS  65   3.419  11.864  -6.784
  465   1HD   LYS  65          1HD       LYS  65   3.990   9.288  -8.030
  466   2HD   LYS  65          2HD       LYS  65   2.825  10.169  -8.998
  467   1HE   LYS  65          1HE       LYS  65   5.302  11.579  -7.953
  468   2HE   LYS  65          2HE       LYS  65   5.404  10.579  -9.388
  469   1HZ   LYS  65          1HZ       LYS  65   4.905  12.853  -9.931
  470   2HZ   LYS  65          2HZ       LYS  65   3.651  11.900 -10.363
  471   3HZ   LYS  65          3HZ       LYS  65   3.547  12.829  -9.024
  472    H    ALA  66           H        ALA  66   0.216   9.780  -5.110
  473    HA   ALA  66           HA       ALA  66  -0.819  12.027  -6.284
  474   1HB   ALA  66          1HB       ALA  66  -2.412  10.465  -6.557
  475   2HB   ALA  66          2HB       ALA  66  -1.750   9.490  -5.222
  476   3HB   ALA  66          3HB       ALA  66  -2.933  10.777  -4.884
  477    H    CYS  67           H        CYS  67  -1.282  10.990  -2.825
  478    HA   CYS  67           HA       CYS  67  -2.646  13.142  -1.942
  479   1HB   CYS  67          1HB       CYS  67  -1.968  11.050  -0.684
  480   2HB   CYS  67          2HB       CYS  67  -0.434  11.832  -0.357
  481    H    ARG  68           H        ARG  68   0.949  12.748  -2.252
  482    HA   ARG  68           HA       ARG  68   1.647  15.163  -1.196
  483   1HB   ARG  68          1HB       ARG  68   3.218  13.287  -1.810
  484   2HB   ARG  68          2HB       ARG  68   3.005  13.680  -3.504
  485   1HG   ARG  68          1HG       ARG  68   3.873  16.010  -3.032
  486   2HG   ARG  68          2HG       ARG  68   4.170  15.533  -1.372
  487   1HD   ARG  68          1HD       ARG  68   6.268  15.063  -2.241
  488   2HD   ARG  68          2HD       ARG  68   5.509  13.517  -2.560
  489    HE   ARG  68           HE       ARG  68   4.909  15.066  -4.810
  490   1HH1  ARG  68          2HH2      ARG  68   7.853  14.032  -3.183
  491   2HH1  ARG  68          1HH2      ARG  68   8.805  14.035  -4.629
  492   1HH2  ARG  68          2HH1      ARG  68   6.165  15.071  -6.718
  493   2HH2  ARG  68          1HH1      ARG  68   7.839  14.630  -6.654
  494    H    ALA  69           H        ALA  69   0.879  14.252  -4.621
  495    HA   ALA  69           HA       ALA  69   1.243  16.949  -5.533
  496   1HB   ALA  69          1HB       ALA  69   1.396  14.473  -6.692
  497   2HB   ALA  69          2HB       ALA  69  -0.222  14.996  -7.219
  498   3HB   ALA  69          3HB       ALA  69   1.203  15.993  -7.597
  499    H    ALA  70           H        ALA  70  -0.988  15.677  -3.511
  500    HA   ALA  70           HA       ALA  70  -3.305  16.856  -4.833
  501   1HB   ALA  70          1HB       ALA  70  -3.675  15.720  -2.151
  502   2HB   ALA  70          2HB       ALA  70  -4.491  15.319  -3.681
  503   3HB   ALA  70          3HB       ALA  70  -2.925  14.571  -3.285
  504    H    ASN  71           H        ASN  71  -1.319  17.086  -1.815
  505    HA   ASN  71           HA       ASN  71  -2.452  19.756  -1.510
  506   1HB   ASN  71          1HB       ASN  71  -1.804  17.600   0.521
  507   2HB   ASN  71          2HB       ASN  71  -1.646  19.275   1.013
  508   1HD2  ASN  71          1HD2      ASN  71  -3.850  16.952  -0.497
  509   2HD2  ASN  71          2HD2      ASN  71  -5.334  17.642   0.070
  510    H    CYS  72           H        CYS  72   0.283  17.739  -0.169
  511    HA   CYS  72           HA       CYS  72   2.037  19.929  -0.050
  512   1HB   CYS  72          1HB       CYS  72   2.801  17.008  -0.064
  513   2HB   CYS  72          2HB       CYS  72   3.712  18.349   0.601
  514    H    ALA  73           H        ALA  73   1.454  20.600  -2.407
  515    HA   ALA  73           HA       ALA  73   2.935  19.024  -4.371
  516   1HB   ALA  73          1HB       ALA  73   0.989  21.349  -4.664
  517   2HB   ALA  73          2HB       ALA  73   1.724  20.438  -6.005
  518   3HB   ALA  73          3HB       ALA  73   0.604  19.625  -4.886
  519    H    SER  74           H        SER  74   3.248  21.732  -2.265
  520    HA   SER  74           HA       SER  74   5.282  22.866  -4.012
  521   1HB   SER  74          1HB       SER  74   3.461  24.403  -3.236
  522   2HB   SER  74          2HB       SER  74   3.917  24.092  -1.573
  523    HG   SER  74           HG       SER  74   5.406  25.607  -1.763
  524    H    GLU  75           H        GLU  75   4.551  21.871  -0.604
  525    HA   GLU  75           HA       GLU  75   6.992  22.365   0.483
  526   1HB   GLU  75          1HB       GLU  75   5.084  20.063   1.089
  527   2HB   GLU  75          2HB       GLU  75   6.390  20.572   2.141
  528   1HG   GLU  75          1HG       GLU  75   4.191  22.474   1.215
  529   2HG   GLU  75          2HG       GLU  75   4.059  21.523   2.681
  530    H    CYS  76           H        CYS  76   6.011  19.835  -1.778
  531    HA   CYS  76           HA       CYS  76   8.647  18.600  -1.442
  532   1HB   CYS  76          1HB       CYS  76   6.290  17.302  -2.798
  533   2HB   CYS  76          2HB       CYS  76   7.771  16.556  -2.231
  534    HA   PRO  77           HA       PRO  77   8.976  20.652  -5.389
  535   1HB   PRO  77          1HB       PRO  77  11.695  20.923  -5.376
  536   2HB   PRO  77          2HB       PRO  77  10.609  22.121  -4.700
  537   1HG   PRO  77          1HG       PRO  77  12.312  20.158  -3.291
  538   2HG   PRO  77          2HG       PRO  77  11.565  21.613  -2.663
  539   1HD   PRO  77          1HD       PRO  77  10.684  18.915  -2.246
  540   2HD   PRO  77          2HD       PRO  77   9.874  20.376  -1.716
  541    H    LYS  78           H        LYS  78  10.769  20.278  -7.297
  542    HA   LYS  78           HA       LYS  78  10.389  17.436  -7.791
  543   1HB   LYS  78          1HB       LYS  78   9.859  19.531  -9.370
  544   2HB   LYS  78          2HB       LYS  78  11.528  19.284  -9.841
  545   1HG   LYS  78          1HG       LYS  78   9.797  16.832  -9.666
  546   2HG   LYS  78          2HG       LYS  78   9.466  17.938 -10.985
  547   1HD   LYS  78          1HD       LYS  78  11.420  17.432 -12.079
  548   2HD   LYS  78          2HD       LYS  78  12.359  17.393 -10.599
  549   1HE   LYS  78          1HE       LYS  78  12.303  15.127 -10.615
  550   2HE   LYS  78          2HE       LYS  78  10.556  15.162 -10.487
  551   1HZ   LYS  78          1HZ       LYS  78  12.195  14.982 -12.880
  552   2HZ   LYS  78          2HZ       LYS  78  10.880  14.109 -12.461
  553   3HZ   LYS  78          3HZ       LYS  78  10.706  15.642 -12.996
  554    H    HIS  79           H        HIS  79  12.028  15.955  -7.822
  555    HA   HIS  79           HA       HIS  79  14.074  15.126  -7.815
  556   1HB   HIS  79          1HB       HIS  79  14.473  17.437  -9.247
  557   2HB   HIS  79          2HB       HIS  79  15.611  17.640  -7.930
  558    HD1  HIS  79           1HD      HIS  79  14.916  15.515 -10.955
  559    HD2  HIS  79           2HD      HIS  79  17.779  15.808  -7.903
  560    HE1  HIS  79           1HE      HIS  79  16.880  14.054 -11.675
  561    H    GLU  80           H        GLU  80  12.941  15.083  -5.498
  562    HA   GLU  80           HA       GLU  80  15.059  15.814  -3.704
  563   1HB   GLU  80          1HB       GLU  80  12.490  17.249  -3.803
  564   2HB   GLU  80          2HB       GLU  80  12.802  16.568  -2.219
  565   1HG   GLU  80          1HG       GLU  80  13.938  18.582  -1.991
  566   2HG   GLU  80          2HG       GLU  80  15.244  17.588  -2.603
  567    H    HIS  81           H        HIS  81  15.510  13.856  -2.791
  568    HA   HIS  81           HA       HIS  81  13.929  11.662  -2.843
  569   1HB   HIS  81          1HB       HIS  81  15.489  10.663  -1.478
  570   2HB   HIS  81          2HB       HIS  81  16.401  12.007  -2.136
  571    HD1  HIS  81           1HD      HIS  81  14.857  10.747   1.060
  572    HD2  HIS  81           2HD      HIS  81  17.118  14.017  -0.277
  573    HE1  HIS  81           1HE      HIS  81  15.671  11.957   3.154
  574    H    LYS  82           H        LYS  82  13.960  14.320  -0.425
  575    HA   LYS  82           HA       LYS  82  11.358  14.245   0.226
  576   1HB   LYS  82          1HB       LYS  82  12.682  11.890   1.331
  577   2HB   LYS  82          2HB       LYS  82  11.947  12.871   2.583
  578   1HG   LYS  82          1HG       LYS  82   9.777  12.650   1.684
  579   2HG   LYS  82          2HG       LYS  82  10.364  12.318   0.067
  580   1HD   LYS  82          1HD       LYS  82  11.432  10.165   1.330
  581   2HD   LYS  82          2HD       LYS  82  10.080  10.453   2.407
  582   1HE   LYS  82          1HE       LYS  82   8.490   9.919   0.797
  583   2HE   LYS  82          2HE       LYS  82   9.462  10.529  -0.528
  584   1HZ   LYS  82          1HZ       LYS  82   9.657   8.309  -0.822
  585   2HZ   LYS  82          2HZ       LYS  82  10.959   8.535   0.138
  586   3HZ   LYS  82          3HZ       LYS  82   9.575   7.938   0.766
  587    H    SER  83           H        SER  83  11.555  16.408   0.631
  588    HA   SER  83           HA       SER  83  13.719  17.361   2.193
  589   1HB   SER  83          1HB       SER  83  13.198  19.236   1.054
  590   2HB   SER  83          2HB       SER  83  11.777  18.450   0.395
  591    HG   SER  83           HG       SER  83  11.908  20.451   2.239
  592    H    ASP  84           H        ASP  84  13.660  18.179   4.348
  593    HA   ASP  84           HA       ASP  84  12.228  16.885   6.170
  594   1HB   ASP  84          1HB       ASP  84  14.090  18.823   6.290
  595   2HB   ASP  84          2HB       ASP  84  12.700  19.830   6.646
  596    H    THR  85           H        THR  85  11.449  20.181   4.811
  597    HA   THR  85           HA       THR  85   9.053  20.572   6.147
  598    HB   THR  85           HB       THR  85  10.649  21.991   4.427
  599    HG1  THR  85           1HG      THR  85   8.996  23.525   4.851
  600   1HG2  THR  85          1HG2      THR  85   9.277  22.571   2.450
  601   2HG2  THR  85          2HG2      THR  85   9.676  20.837   2.400
  602   3HG2  THR  85          3HG2      THR  85   8.057  21.363   2.919
  603    H    CYS  86           H        CYS  86   9.714  18.840   3.060
  604    HA   CYS  86           HA       CYS  86   7.062  18.465   2.358
  605   1HB   CYS  86          1HB       CYS  86   8.762  18.071   0.755
  606   2HB   CYS  86          2HB       CYS  86   9.565  16.890   1.770
  607    H    ARG  87           H        ARG  87   9.330  15.988   3.778
  608    HA   ARG  87           HA       ARG  87   7.630  14.082   4.382
  609   1HB   ARG  87          1HB       ARG  87   9.829  15.151   6.223
  610   2HB   ARG  87          2HB       ARG  87   9.087  13.573   6.405
  611   1HG   ARG  87          1HG       ARG  87   9.768  13.173   3.912
  612   2HG   ARG  87          2HG       ARG  87  10.800  14.577   4.100
  613   1HD   ARG  87          1HD       ARG  87  12.089  12.530   4.574
  614   2HD   ARG  87          2HD       ARG  87  11.948  13.488   6.034
  615    HE   ARG  87           HE       ARG  87   9.739  11.691   5.979
  616   1HH1  ARG  87          2HH2      ARG  87  13.244  11.581   6.275
  617   2HH1  ARG  87          1HH2      ARG  87  13.247  10.121   7.207
  618   1HH2  ARG  87          2HH1      ARG  87   9.743   9.765   7.209
  619   2HH2  ARG  87          1HH1      ARG  87  11.242   9.081   7.741
  620    H    ALA  88           H        ALA  88   8.036  17.166   6.185
  621    HA   ALA  88           HA       ALA  88   6.391  16.452   8.362
  622   1HB   ALA  88          1HB       ALA  88   8.001  18.650   7.497
  623   2HB   ALA  88          2HB       ALA  88   6.380  19.283   7.869
  624   3HB   ALA  88          3HB       ALA  88   7.284  18.373   9.102
  625    H    CYS  89           H        CYS  89   5.804  18.467   5.392
  626    HA   CYS  89           HA       CYS  89   3.210  19.085   5.811
  627   1HB   CYS  89          1HB       CYS  89   4.596  19.868   3.928
  628   2HB   CYS  89          2HB       CYS  89   4.453  18.295   3.168
  629    H    MET  90           H        MET  90   4.657  15.997   4.664
  630    HA   MET  90           HA       MET  90   2.200  14.811   4.017
  631   1HB   MET  90          1HB       MET  90   4.951  13.656   4.734
  632   2HB   MET  90          2HB       MET  90   3.637  12.678   4.113
  633   1HG   MET  90          1HG       MET  90   3.612  14.566   2.187
  634   2HG   MET  90          2HG       MET  90   5.275  14.779   2.696
  635   1HE   MET  90          1HE       MET  90   2.709  11.957   2.364
  636   2HE   MET  90          2HE       MET  90   2.808  12.465   0.661
  637   3HE   MET  90          3HE       MET  90   3.417  10.865   1.149
  638    H    LYS  91           H        LYS  91   4.487  14.144   6.777
  639    HA   LYS  91           HA       LYS  91   2.752  12.511   8.178
  640   1HB   LYS  91          1HB       LYS  91   4.972  12.404   8.838
  641   2HB   LYS  91          2HB       LYS  91   5.169  14.144   8.879
  642   1HG   LYS  91          1HG       LYS  91   3.883  14.339  10.924
  643   2HG   LYS  91          2HG       LYS  91   3.307  12.689  10.803
  644   1HD   LYS  91          1HD       LYS  91   5.865  12.041  10.892
  645   2HD   LYS  91          2HD       LYS  91   6.093  13.663  11.512
  646   1HE   LYS  91          1HE       LYS  91   4.320  13.145  13.283
  647   2HE   LYS  91          2HE       LYS  91   4.329  11.484  12.723
  648   1HZ   LYS  91          1HZ       LYS  91   5.830  11.898  14.584
  649   2HZ   LYS  91          2HZ       LYS  91   6.624  11.325  13.276
  650   3HZ   LYS  91          3HZ       LYS  91   6.721  12.909  13.661
  651    H    THR  92           H        THR  92   2.650  15.941   7.607
  652    HA   THR  92           HA       THR  92   1.216  16.635   9.971
  653    HB   THR  92           HB       THR  92   1.666  17.971   7.254
  654    HG1  THR  92           1HG      THR  92   3.443  17.531   8.883
  655   1HG2  THR  92          1HG2      THR  92   0.982  19.534   9.727
  656   2HG2  THR  92          2HG2      THR  92   0.614  19.898   8.024
  657   3HG2  THR  92          3HG2      THR  92  -0.374  18.715   8.915
  658    H    ASN  93           H        ASN  93   0.197  16.191   6.515
  659    HA   ASN  93           HA       ASN  93  -2.395  15.452   7.616
  660   1HB   ASN  93          1HB       ASN  93  -3.280  16.500   5.352
  661   2HB   ASN  93          2HB       ASN  93  -2.915  17.568   6.693
  662   1HD2  ASN  93          1HD2      ASN  93  -1.024  18.793   6.703
  663   2HD2  ASN  93          2HD2      ASN  93  -0.123  19.137   5.264
  664    H    CYS  94           H        CYS  94  -0.364  15.599   4.586
  665    HA   CYS  94           HA       CYS  94  -1.627  13.360   3.427
  666   1HB   CYS  94          1HB       CYS  94   0.490  15.246   2.737
  667   2HB   CYS  94          2HB       CYS  94   0.849  13.619   2.194
  668    H    LYS  95           H        LYS  95  -1.425  12.029   5.531
  669    HA   LYS  95           HA       LYS  95   0.837  11.203   6.711
  670   1HB   LYS  95          1HB       LYS  95  -1.571  10.551   7.195
  671   2HB   LYS  95          2HB       LYS  95  -1.406   9.312   5.967
  672   1HG   LYS  95          1HG       LYS  95   0.866   8.824   7.416
  673   2HG   LYS  95          2HG       LYS  95  -0.154   9.477   8.683
  674   1HD   LYS  95          1HD       LYS  95  -1.965   7.825   7.977
  675   2HD   LYS  95          2HD       LYS  95  -0.812   7.112   6.867
  676   1HE   LYS  95          1HE       LYS  95   0.740   6.665   8.804
  677   2HE   LYS  95          2HE       LYS  95  -0.464   7.320   9.897
  678   1HZ   LYS  95          1HZ       LYS  95  -1.504   5.398   9.858
  679   2HZ   LYS  95          2HZ       LYS  95  -1.644   5.408   8.231
  680   3HZ   LYS  95          3HZ       LYS  95  -0.320   4.759   8.933
  Start of MODEL    6
    1   1H    ILE   1           H        ILE   1 -21.152  18.280   7.523
    2    HA   ILE   1           HA       ILE   1 -20.282  17.458   9.490
    3    HB   ILE   1           HB       ILE   1 -20.241  14.744   8.166
    4   1HG1  ILE   1          1HG1      ILE   1 -22.535  15.554   8.513
    5   2HG1  ILE   1          2HG1      ILE   1 -22.154  14.187   9.542
    6   1HG2  ILE   1          1HG2      ILE   1 -19.407  15.747  10.872
    7   2HG2  ILE   1          2HG2      ILE   1 -19.999  14.081  10.667
    8   3HG2  ILE   1          3HG2      ILE   1 -18.570  14.636   9.762
    9   1HD1  ILE   1          1HD1      ILE   1 -22.250  17.126  10.347
   10   2HD1  ILE   1          2HD1      ILE   1 -23.303  15.808  10.917
   11   3HD1  ILE   1          3HD1      ILE   1 -21.590  15.850  11.399
   12    H    SER   2           H        SER   2 -18.678  18.976   8.800
   13    HA   SER   2           HA       SER   2 -16.738  18.222   6.917
   14   1HB   SER   2          1HB       SER   2 -17.538  20.590   8.068
   15   2HB   SER   2          2HB       SER   2 -16.029  20.316   8.917
   16    HG   SER   2           HG       SER   2 -16.199  21.440   6.598
   17    H    GLU   3           H        GLU   3 -15.895  16.164   7.632
   18    HA   GLU   3           HA       GLU   3 -14.952  15.772  10.218
   19   1HB   GLU   3          1HB       GLU   3 -13.855  13.754   9.261
   20   2HB   GLU   3          2HB       GLU   3 -15.521  13.904   8.740
   21   1HG   GLU   3          1HG       GLU   3 -14.146  15.337   6.775
   22   2HG   GLU   3          2HG       GLU   3 -13.030  14.037   7.142
   23    H    PHE   4           H        PHE   4 -13.491  17.128   7.261
   24    HA   PHE   4           HA       PHE   4 -11.429  17.841   6.810
   25   1HB   PHE   4          1HB       PHE   4 -12.689  19.242   8.897
   26   2HB   PHE   4          2HB       PHE   4 -11.116  18.908   9.595
   27    HD1  PHE   4           1HD      PHE   4  -9.363  20.360   9.166
   28    HD2  PHE   4           2HD      PHE   4 -12.654  20.285   6.488
   29    HE1  PHE   4           1HE      PHE   4  -8.396  22.315   7.924
   30    HE2  PHE   4           2HE      PHE   4 -11.687  22.241   5.246
   31    HZ   PHE   4           HZ       PHE   4  -9.570  23.232   5.979
   32    H    ALA   5           H        ALA   5 -10.122  15.981   6.617
   33    HA   ALA   5           HA       ALA   5  -8.188  15.699   8.731
   34   1HB   ALA   5          1HB       ALA   5  -8.999  13.026   8.093
   35   2HB   ALA   5          2HB       ALA   5  -9.036  13.846   9.672
   36   3HB   ALA   5          3HB       ALA   5 -10.446  13.936   8.589
   37    HA   PRO   6           HA       PRO   6  -5.758  14.785   5.273
   38   1HB   PRO   6          1HB       PRO   6  -3.707  13.328   6.339
   39   2HB   PRO   6          2HB       PRO   6  -3.803  15.074   6.454
   40   1HG   PRO   6          1HG       PRO   6  -4.321  13.048   8.543
   41   2HG   PRO   6          2HG       PRO   6  -3.997  14.760   8.731
   42   1HD   PRO   6          1HD       PRO   6  -6.547  13.463   8.940
   43   2HD   PRO   6          2HD       PRO   6  -6.239  15.187   9.011
   44    H    VAL   7           H        VAL   7  -4.723  13.115   3.835
   45    HA   VAL   7           HA       VAL   7  -6.657  11.163   3.343
   46    HB   VAL   7           HB       VAL   7  -3.777  11.116   2.445
   47   1HG1  VAL   7          1HG1      VAL   7  -5.812   9.357   1.932
   48   2HG1  VAL   7          2HG1      VAL   7  -5.956  10.481   0.559
   49   3HG1  VAL   7          3HG1      VAL   7  -4.416   9.641   0.865
   50   1HG2  VAL   7          1HG2      VAL   7  -4.254  13.300   1.891
   51   2HG2  VAL   7          2HG2      VAL   7  -4.866  12.461   0.446
   52   3HG2  VAL   7          3HG2      VAL   7  -5.998  12.993   1.713
   53    H    ASP   8           H        ASP   8  -6.636   8.871   3.639
   54    HA   ASP   8           HA       ASP   8  -5.008   8.128   5.927
   55   1HB   ASP   8          1HB       ASP   8  -7.735   7.836   5.416
   56   2HB   ASP   8          2HB       ASP   8  -7.115   6.249   5.006
   57    H    CYS   9           H        CYS   9  -6.017   7.269   2.583
   58    HA   CYS   9           HA       CYS   9  -5.061   6.030   1.038
   59   1HB   CYS   9          1HB       CYS   9  -2.772   5.620   2.973
   60   2HB   CYS   9          2HB       CYS   9  -2.768   5.181   1.277
   61    H    LYS  10           H        LYS  10  -4.219   4.507   4.245
   62    HA   LYS  10           HA       LYS  10  -4.416   1.913   3.644
   63   1HB   LYS  10          1HB       LYS  10  -4.537   3.507   5.992
   64   2HB   LYS  10          2HB       LYS  10  -5.832   2.333   6.114
   65   1HG   LYS  10          1HG       LYS  10  -4.372   0.497   6.065
   66   2HG   LYS  10          2HG       LYS  10  -3.143   1.357   5.160
   67   1HD   LYS  10          1HD       LYS  10  -2.622   2.744   7.173
   68   2HD   LYS  10          2HD       LYS  10  -3.862   1.901   8.080
   69   1HE   LYS  10          1HE       LYS  10  -2.201  -0.123   6.915
   70   2HE   LYS  10          2HE       LYS  10  -1.117   1.090   7.567
   71   1HZ   LYS  10          1HZ       LYS  10  -1.549  -0.228   9.361
   72   2HZ   LYS  10          2HZ       LYS  10  -2.664   0.942   9.590
   73   3HZ   LYS  10          3HZ       LYS  10  -3.111  -0.501   8.969
   74    H    GLY  11           H        GLY  11  -7.316   3.493   5.133
   75   1HA   GLY  11          1HA       GLY  11  -9.176   1.643   4.419
   76   2HA   GLY  11          2HA       GLY  11  -9.503   3.355   4.601
   77    H    GLN  12           H        GLN  12  -8.293   4.614   2.506
   78    HA   GLN  12           HA       GLN  12 -10.001   4.166   0.436
   79   1HB   GLN  12          1HB       GLN  12  -7.356   5.593   0.704
   80   2HB   GLN  12          2HB       GLN  12  -8.055   5.424  -0.894
   81   1HG   GLN  12          1HG       GLN  12 -10.000   6.300   1.177
   82   2HG   GLN  12          2HG       GLN  12  -8.686   7.430   0.920
   83   1HE2  GLN  12          1HE2      GLN  12 -10.075   8.938   0.022
   84   2HE2  GLN  12          2HE2      GLN  12 -10.709   8.804  -1.585
   85    H    CYS  13           H        CYS  13  -7.126   2.405   1.338
   86    HA   CYS  13           HA       CYS  13  -6.905   1.252  -1.324
   87   1HB   CYS  13          1HB       CYS  13  -5.147   1.106   1.125
   88   2HB   CYS  13          2HB       CYS  13  -4.906   0.080  -0.274
   89    H    THR  14           H        THR  14  -9.287   0.491  -0.593
   90    HA   THR  14           HA       THR  14  -9.006  -2.031   0.901
   91    HB   THR  14           HB       THR  14 -11.277  -0.030   0.516
   92    HG1  THR  14           1HG      THR  14 -10.211   0.392   2.431
   93   1HG2  THR  14          1HG2      THR  14 -12.860  -1.551   1.276
   94   2HG2  THR  14          2HG2      THR  14 -11.803  -2.718   0.446
   95   3HG2  THR  14          3HG2      THR  14 -11.659  -2.481   2.204
   96    H    THR  15           H        THR  15 -10.377  -0.490  -2.050
   97    HA   THR  15           HA       THR  15 -11.396  -2.930  -3.078
   98    HB   THR  15           HB       THR  15 -11.072  -0.076  -3.884
   99    HG1  THR  15           1HG      THR  15 -12.936  -2.299  -4.343
  100   1HG2  THR  15          1HG2      THR  15 -11.464  -2.273  -5.981
  101   2HG2  THR  15          2HG2      THR  15 -11.528  -0.516  -6.259
  102   3HG2  THR  15          3HG2      THR  15  -9.984  -1.295  -5.837
  103    HA   PRO  16           HA       PRO  16  -7.299  -2.996  -5.403
  104   1HB   PRO  16          1HB       PRO  16  -5.238  -1.402  -4.579
  105   2HB   PRO  16          2HB       PRO  16  -6.318  -0.970  -5.889
  106   1HG   PRO  16          1HG       PRO  16  -6.240   0.083  -3.128
  107   2HG   PRO  16          2HG       PRO  16  -7.000   0.777  -4.547
  108   1HD   PRO  16          1HD       PRO  16  -8.311  -0.597  -2.397
  109   2HD   PRO  16          2HD       PRO  16  -9.053  -0.005  -3.871
  110    H    CYS  17           H        CYS  17  -7.715  -3.002  -2.097
  111    HA   CYS  17           HA       CYS  17  -5.600  -5.021  -1.905
  112   1HB   CYS  17          1HB       CYS  17  -6.464  -3.160   0.316
  113   2HB   CYS  17          2HB       CYS  17  -5.205  -4.377   0.393
  114    H    GLU  18           H        GLU  18  -8.628  -4.965  -2.565
  115    HA   GLU  18           HA       GLU  18  -9.928  -5.990  -0.301
  116   1HB   GLU  18          1HB       GLU  18 -10.587  -5.287  -3.025
  117   2HB   GLU  18          2HB       GLU  18 -11.228  -6.885  -2.700
  118   1HG   GLU  18          1HG       GLU  18 -11.967  -5.666  -0.383
  119   2HG   GLU  18          2HG       GLU  18 -11.932  -4.257  -1.425
  120    HA   PRO  19           HA       PRO  19  -9.090 -10.166  -2.375
  121   1HB   PRO  19          1HB       PRO  19  -7.520 -10.319  -4.607
  122   2HB   PRO  19          2HB       PRO  19  -9.270 -10.243  -4.669
  123   1HG   PRO  19          1HG       PRO  19  -7.301  -8.123  -5.273
  124   2HG   PRO  19          2HG       PRO  19  -8.992  -8.212  -5.726
  125   1HD   PRO  19          1HD       PRO  19  -7.856  -6.604  -3.640
  126   2HD   PRO  19          2HD       PRO  19  -9.558  -6.782  -4.018
  127    H    LEU  20           H        LEU  20  -6.467  -7.898  -2.416
  128    HA   LEU  20           HA       LEU  20  -4.464  -9.809  -1.886
  129   1HB   LEU  20          1HB       LEU  20  -3.619  -7.879  -2.740
  130   2HB   LEU  20          2HB       LEU  20  -4.729  -6.851  -1.855
  131    HG   LEU  20           HG       LEU  20  -2.294  -6.683  -1.213
  132   1HD1  LEU  20          1HD1      LEU  20  -4.488  -6.232   0.242
  133   2HD1  LEU  20          2HD1      LEU  20  -3.747  -7.495   1.254
  134   3HD1  LEU  20          3HD1      LEU  20  -2.843  -6.007   0.884
  135   1HD2  LEU  20          1HD2      LEU  20  -2.041  -9.258  -1.311
  136   2HD2  LEU  20          2HD2      LEU  20  -1.179  -8.351  -0.045
  137   3HD2  LEU  20          3HD2      LEU  20  -2.679  -9.224   0.350
  138    H    THR  21           H        THR  21  -6.234  -7.476   0.268
  139    HA   THR  21           HA       THR  21  -5.114  -8.328   2.649
  140    HB   THR  21           HB       THR  21  -7.892  -7.215   1.989
  141    HG1  THR  21           1HG      THR  21  -6.246  -5.753   1.396
  142   1HG2  THR  21          1HG2      THR  21  -6.408  -7.688   4.583
  143   2HG2  THR  21          2HG2      THR  21  -7.327  -6.175   4.401
  144   3HG2  THR  21          3HG2      THR  21  -8.159  -7.743   4.266
  145    H    ALA  22           H        ALA  22  -8.149  -9.506   1.055
  146    HA   ALA  22           HA       ALA  22  -8.886 -11.327   2.951
  147   1HB   ALA  22          1HB       ALA  22 -10.277 -12.208   1.291
  148   2HB   ALA  22          2HB       ALA  22  -9.946 -10.573   0.671
  149   3HB   ALA  22          3HB       ALA  22  -9.066 -11.971   0.008
  150    H    CYS  23           H        CYS  23  -6.532 -11.735   0.229
  151    HA   CYS  23           HA       CYS  23  -6.000 -14.391   0.566
  152   1HB   CYS  23          1HB       CYS  23  -5.134 -12.593  -1.145
  153   2HB   CYS  23          2HB       CYS  23  -3.769 -12.490  -0.050
  154    H    LYS  24           H        LYS  24  -4.309 -11.532   2.061
  155    HA   LYS  24           HA       LYS  24  -2.621 -13.041   3.685
  156   1HB   LYS  24          1HB       LYS  24  -3.345 -10.244   3.302
  157   2HB   LYS  24          2HB       LYS  24  -3.059 -10.607   4.992
  158   1HG   LYS  24          1HG       LYS  24  -0.829 -11.304   4.611
  159   2HG   LYS  24          2HG       LYS  24  -1.118 -11.655   2.918
  160   1HD   LYS  24          1HD       LYS  24  -0.040  -9.638   2.626
  161   2HD   LYS  24          2HD       LYS  24  -1.656  -9.001   2.859
  162   1HE   LYS  24          1HE       LYS  24  -1.185  -8.726   5.310
  163   2HE   LYS  24          2HE       LYS  24   0.437  -9.342   5.061
  164   1HZ   LYS  24          1HZ       LYS  24  -0.090  -6.809   4.968
  165   2HZ   LYS  24          2HZ       LYS  24   1.062  -7.460   4.012
  166   3HZ   LYS  24          3HZ       LYS  24  -0.416  -7.129   3.400
  167    H    GLU  25           H        GLU  25  -5.801 -11.450   4.416
  168    HA   GLU  25           HA       GLU  25  -5.968 -12.200   7.018
  169   1HB   GLU  25          1HB       GLU  25  -7.701 -11.114   5.024
  170   2HB   GLU  25          2HB       GLU  25  -8.580 -12.432   5.773
  171   1HG   GLU  25          1HG       GLU  25  -7.099 -10.624   7.647
  172   2HG   GLU  25          2HG       GLU  25  -8.464  -9.905   6.817
  173    H    LYS  26           H        LYS  26  -7.594 -13.942   4.259
  174    HA   LYS  26           HA       LYS  26  -8.503 -16.108   5.534
  175   1HB   LYS  26          1HB       LYS  26  -8.313 -15.379   2.955
  176   2HB   LYS  26          2HB       LYS  26  -7.090 -16.633   2.962
  177   1HG   LYS  26          1HG       LYS  26  -9.461 -17.511   4.440
  178   2HG   LYS  26          2HG       LYS  26  -9.905 -16.986   2.828
  179   1HD   LYS  26          1HD       LYS  26  -7.840 -18.439   2.048
  180   2HD   LYS  26          2HD       LYS  26  -7.975 -19.187   3.628
  181   1HE   LYS  26          1HE       LYS  26 -10.377 -19.737   3.155
  182   2HE   LYS  26          2HE       LYS  26 -10.229 -19.004   1.570
  183   1HZ   LYS  26          1HZ       LYS  26  -9.179 -20.783   0.809
  184   2HZ   LYS  26          2HZ       LYS  26  -8.198 -20.924   2.107
  185   3HZ   LYS  26          3HZ       LYS  26  -9.699 -21.566   2.144
  186    H    CYS  27           H        CYS  27  -5.090 -15.563   4.487
  187    HA   CYS  27           HA       CYS  27  -4.203 -18.079   5.359
  188   1HB   CYS  27          1HB       CYS  27  -2.817 -15.488   4.708
  189   2HB   CYS  27          2HB       CYS  27  -1.927 -16.859   5.340
  190    H    ALA  28           H        ALA  28  -4.179 -14.743   6.794
  191    HA   ALA  28           HA       ALA  28  -2.859 -15.308   9.133
  192   1HB   ALA  28          1HB       ALA  28  -3.959 -13.114   8.015
  193   2HB   ALA  28          2HB       ALA  28  -5.205 -13.458   9.239
  194   3HB   ALA  28          3HB       ALA  28  -3.516 -13.194   9.737
  195    H    GLU  29           H        GLU  29  -6.302 -15.835   8.232
  196    HA   GLU  29           HA       GLU  29  -7.095 -16.544  10.819
  197   1HB   GLU  29          1HB       GLU  29  -8.249 -16.848   8.048
  198   2HB   GLU  29          2HB       GLU  29  -8.991 -17.736   9.363
  199   1HG   GLU  29          1HG       GLU  29  -8.441 -14.742   9.530
  200   2HG   GLU  29          2HG       GLU  29  -9.937 -15.383   8.880
  201    H    SER  30           H        SER  30  -6.376 -18.550   7.868
  202    HA   SER  30           HA       SER  30  -6.703 -20.980   9.075
  203   1HB   SER  30          1HB       SER  30  -5.877 -20.018   6.569
  204   2HB   SER  30          2HB       SER  30  -4.502 -20.955   7.120
  205    HG   SER  30           HG       SER  30  -5.707 -22.540   6.239
  206    H    CYS  31           H        CYS  31  -4.163 -18.592   9.434
  207    HA   CYS  31           HA       CYS  31  -2.613 -20.558  10.958
  208   1HB   CYS  31          1HB       CYS  31  -1.745 -18.497   8.998
  209   2HB   CYS  31          2HB       CYS  31  -0.750 -18.702  10.426
  210    H    GLU  32           H        GLU  32  -4.403 -19.734  12.562
  211    HA   GLU  32           HA       GLU  32  -3.898 -17.066  13.501
  212   1HB   GLU  32          1HB       GLU  32  -6.072 -18.998  13.656
  213   2HB   GLU  32          2HB       GLU  32  -5.680 -18.418  15.263
  214   1HG   GLU  32          1HG       GLU  32  -5.629 -16.037  13.976
  215   2HG   GLU  32          2HG       GLU  32  -6.709 -16.884  12.886
  216    H    THR  33           H        THR  33  -3.692 -20.476  14.719
  217    HA   THR  33           HA       THR  33  -1.794 -19.490  16.746
  218    HB   THR  33           HB       THR  33  -4.056 -20.182  17.663
  219    HG1  THR  33           1HG      THR  33  -2.251 -20.509  19.030
  220   1HG2  THR  33          1HG2      THR  33  -3.620 -23.023  17.583
  221   2HG2  THR  33          2HG2      THR  33  -5.019 -22.125  16.948
  222   3HG2  THR  33          3HG2      THR  33  -3.617 -22.446  15.899
  223    H    SER  34           H        SER  34  -0.808 -20.032  14.256
  224    HA   SER  34           HA       SER  34   0.023 -22.792  14.319
  225   1HB   SER  34          1HB       SER  34  -0.570 -21.058  12.249
  226   2HB   SER  34          2HB       SER  34   1.180 -20.981  12.265
  227    HG   SER  34           HG       SER  34   0.342 -22.696  10.884
  228    H    ALA  35           H        ALA  35   2.304 -23.415  14.372
  229    HA   ALA  35           HA       ALA  35   3.812 -22.220  16.290
  230   1HB   ALA  35          1HB       ALA  35   5.581 -23.367  14.354
  231   2HB   ALA  35          2HB       ALA  35   4.973 -24.092  15.861
  232   3HB   ALA  35          3HB       ALA  35   4.073 -24.312  14.341
  233    H    ASP  36           H        ASP  36   4.505 -21.951  12.726
  234    HA   ASP  36           HA       ASP  36   5.873 -19.476  13.344
  235   1HB   ASP  36          1HB       ASP  36   5.758 -20.790  10.612
  236   2HB   ASP  36          2HB       ASP  36   7.001 -19.736  11.255
  237    H    LYS  37           H        LYS  37   3.725 -18.344  13.661
  238    HA   LYS  37           HA       LYS  37   1.810 -18.256  11.611
  239   1HB   LYS  37          1HB       LYS  37   1.276 -17.743  13.928
  240   2HB   LYS  37          2HB       LYS  37   2.371 -16.376  13.922
  241   1HG   LYS  37          1HG       LYS  37   0.985 -15.398  11.996
  242   2HG   LYS  37          2HG       LYS  37  -0.173 -16.685  12.265
  243   1HD   LYS  37          1HD       LYS  37   0.350 -15.569  14.838
  244   2HD   LYS  37          2HD       LYS  37   0.185 -14.202  13.754
  245   1HE   LYS  37          1HE       LYS  37  -1.827 -16.496  13.829
  246   2HE   LYS  37          2HE       LYS  37  -1.993 -15.059  14.819
  247   1HZ   LYS  37          1HZ       LYS  37  -1.675 -14.919  11.908
  248   2HZ   LYS  37          2HZ       LYS  37  -3.137 -15.019  12.627
  249   3HZ   LYS  37          3HZ       LYS  37  -2.171 -13.734  12.917
  250    H    LYS  38           H        LYS  38   4.164 -15.690  12.668
  251    HA   LYS  38           HA       LYS  38   3.798 -13.924  10.679
  252   1HB   LYS  38          1HB       LYS  38   5.539 -14.155  12.721
  253   2HB   LYS  38          2HB       LYS  38   6.633 -14.489  11.394
  254   1HG   LYS  38          1HG       LYS  38   6.775 -12.162  11.466
  255   2HG   LYS  38          2HG       LYS  38   5.496 -12.357  10.283
  256   1HD   LYS  38          1HD       LYS  38   3.848 -12.241  12.299
  257   2HD   LYS  38          2HD       LYS  38   5.213 -11.665  13.234
  258   1HE   LYS  38          1HE       LYS  38   5.546  -9.862  11.423
  259   2HE   LYS  38          2HE       LYS  38   4.005 -10.361  10.755
  260   1HZ   LYS  38          1HZ       LYS  38   3.990  -9.871  13.580
  261   2HZ   LYS  38          2HZ       LYS  38   4.272  -8.550  12.662
  262   3HZ   LYS  38          3HZ       LYS  38   2.911  -9.425  12.439
  263    H    THR  39           H        THR  39   6.135 -16.706  10.525
  264    HA   THR  39           HA       THR  39   6.907 -16.318   7.897
  265    HB   THR  39           HB       THR  39   6.581 -18.955   9.422
  266    HG1  THR  39           1HG      THR  39   8.794 -18.267  10.115
  267   1HG2  THR  39          1HG2      THR  39   7.353 -19.040   6.963
  268   2HG2  THR  39          2HG2      THR  39   8.748 -18.054   7.462
  269   3HG2  THR  39          3HG2      THR  39   8.518 -19.681   8.146
  270    H    CYS  40           H        CYS  40   4.291 -18.519   9.120
  271    HA   CYS  40           HA       CYS  40   3.448 -19.433   6.708
  272   1HB   CYS  40          1HB       CYS  40   2.583 -20.347   8.729
  273   2HB   CYS  40          2HB       CYS  40   1.891 -18.813   9.217
  274    H    ARG  41           H        ARG  41   1.940 -16.662   8.542
  275    HA   ARG  41           HA       ARG  41   0.301 -15.779   6.629
  276   1HB   ARG  41          1HB       ARG  41   1.881 -14.365   8.790
  277   2HB   ARG  41          2HB       ARG  41   0.948 -13.389   7.672
  278   1HG   ARG  41          1HG       ARG  41  -1.047 -14.972   8.220
  279   2HG   ARG  41          2HG       ARG  41  -0.075 -15.550   9.558
  280   1HD   ARG  41          1HD       ARG  41  -1.553 -13.748  10.344
  281   2HD   ARG  41          2HD       ARG  41   0.112 -13.210  10.435
  282    HE   ARG  41           HE       ARG  41  -0.791 -12.434   7.883
  283   1HH1  ARG  41          2HH2      ARG  41  -1.669 -11.774  11.226
  284   2HH1  ARG  41          1HH2      ARG  41  -2.275 -10.187  10.887
  285   1HH2  ARG  41          2HH1      ARG  41  -1.590 -10.341   7.436
  286   2HH2  ARG  41          1HH1      ARG  41  -2.230  -9.366   8.717
  287    H    ARG  42           H        ARG  42   3.840 -15.300   6.882
  288    HA   ARG  42           HA       ARG  42   3.956 -13.323   4.900
  289   1HB   ARG  42          1HB       ARG  42   5.805 -14.795   6.619
  290   2HB   ARG  42          2HB       ARG  42   6.454 -14.715   4.993
  291   1HG   ARG  42          1HG       ARG  42   7.188 -12.634   5.569
  292   2HG   ARG  42          2HG       ARG  42   5.528 -12.124   5.335
  293   1HD   ARG  42          1HD       ARG  42   5.098 -11.979   7.612
  294   2HD   ARG  42          2HD       ARG  42   6.146 -13.325   8.010
  295    HE   ARG  42           HE       ARG  42   6.889 -10.545   8.012
  296   1HH1  ARG  42          2HH2      ARG  42   8.166 -13.720   7.194
  297   2HH1  ARG  42          1HH2      ARG  42   9.817 -13.265   7.458
  298   1HH2  ARG  42          2HH1      ARG  42   9.066  -9.944   8.361
  299   2HH2  ARG  42          1HH1      ARG  42  10.332 -11.103   8.126
  300    H    ASN  43           H        ASN  43   4.590 -16.897   4.965
  301    HA   ASN  43           HA       ASN  43   5.451 -17.206   2.416
  302   1HB   ASN  43          1HB       ASN  43   4.817 -18.895   4.501
  303   2HB   ASN  43          2HB       ASN  43   3.509 -19.272   3.398
  304   1HD2  ASN  43          1HD2      ASN  43   6.733 -19.781   4.207
  305   2HD2  ASN  43          2HD2      ASN  43   7.263 -20.660   2.812
  306    H    CYS  44           H        CYS  44   2.165 -16.687   3.722
  307    HA   CYS  44           HA       CYS  44   0.522 -17.587   1.820
  308   1HB   CYS  44          1HB       CYS  44  -0.167 -16.390   3.855
  309   2HB   CYS  44          2HB       CYS  44   0.346 -14.872   3.144
  310    H    LYS  45           H        LYS  45   2.596 -14.634   1.714
  311    HA   LYS  45           HA       LYS  45   1.630 -13.589  -0.668
  312   1HB   LYS  45          1HB       LYS  45   3.451 -12.829   1.209
  313   2HB   LYS  45          2HB       LYS  45   4.521 -13.269  -0.106
  314   1HG   LYS  45          1HG       LYS  45   3.576 -11.670  -1.590
  315   2HG   LYS  45          2HG       LYS  45   2.090 -11.545  -0.669
  316   1HD   LYS  45          1HD       LYS  45   2.935  -9.818   0.530
  317   2HD   LYS  45          2HD       LYS  45   4.270 -10.813   1.077
  318   1HE   LYS  45          1HE       LYS  45   4.309  -9.584  -1.702
  319   2HE   LYS  45          2HE       LYS  45   4.792  -8.639  -0.308
  320   1HZ   LYS  45          1HZ       LYS  45   5.974 -11.224  -0.355
  321   2HZ   LYS  45          2HZ       LYS  45   6.373 -10.331  -1.662
  322   3HZ   LYS  45          3HZ       LYS  45   6.678  -9.763  -0.162
  323    H    LYS  46           H        LYS  46   4.407 -15.848  -0.066
  324    HA   LYS  46           HA       LYS  46   4.865 -16.189  -2.851
  325   1HB   LYS  46          1HB       LYS  46   5.906 -17.487  -0.337
  326   2HB   LYS  46          2HB       LYS  46   6.302 -18.138  -1.915
  327   1HG   LYS  46          1HG       LYS  46   6.839 -15.288  -0.958
  328   2HG   LYS  46          2HG       LYS  46   8.041 -16.542  -1.192
  329   1HD   LYS  46          1HD       LYS  46   7.096 -16.624  -3.668
  330   2HD   LYS  46          2HD       LYS  46   6.444 -15.042  -3.289
  331   1HE   LYS  46          1HE       LYS  46   9.363 -15.649  -2.720
  332   2HE   LYS  46          2HE       LYS  46   8.858 -15.231  -4.346
  333   1HZ   LYS  46          1HZ       LYS  46   9.319 -13.214  -3.417
  334   2HZ   LYS  46          2HZ       LYS  46   7.708 -13.288  -3.161
  335   3HZ   LYS  46          3HZ       LYS  46   8.745 -13.599  -1.938
  336    H    ALA  47           H        ALA  47   2.386 -17.211  -0.785
  337    HA   ALA  47           HA       ALA  47   2.061 -19.843  -1.865
  338   1HB   ALA  47          1HB       ALA  47   1.337 -18.847   0.447
  339   2HB   ALA  47          2HB       ALA  47  -0.078 -18.247  -0.451
  340   3HB   ALA  47          3HB       ALA  47   0.256 -19.994  -0.380
  341    H    ASP  48           H        ASP  48   0.120 -16.769  -2.076
  342    HA   ASP  48           HA       ASP  48  -0.103 -16.946  -4.838
  343   1HB   ASP  48          1HB       ASP  48  -1.697 -18.845  -3.816
  344   2HB   ASP  48          2HB       ASP  48  -2.772 -17.492  -3.526
  345    H    CYS  49           H        CYS  49   0.621 -14.883  -3.151
  346    HA   CYS  49           HA       CYS  49  -1.570 -13.034  -3.522
  347   1HB   CYS  49          1HB       CYS  49  -0.218 -12.889  -0.868
  348   2HB   CYS  49          2HB       CYS  49  -1.798 -12.312  -1.359
  349    H    GLU  50           H        GLU  50   1.087 -13.690  -4.754
  350    HA   GLU  50           HA       GLU  50   2.893 -11.726  -3.794
  351   1HB   GLU  50          1HB       GLU  50   2.869 -13.871  -5.826
  352   2HB   GLU  50          2HB       GLU  50   3.770 -12.460  -6.341
  353   1HG   GLU  50          1HG       GLU  50   4.210 -13.526  -3.543
  354   2HG   GLU  50          2HG       GLU  50   4.940 -14.373  -4.892
  355    HA   PRO  51           HA       PRO  51   1.341  -9.555  -7.725
  356   1HB   PRO  51          1HB       PRO  51  -0.915 -10.468  -8.969
  357   2HB   PRO  51          2HB       PRO  51   0.704 -10.898  -9.484
  358   1HG   PRO  51          1HG       PRO  51  -1.269 -12.535  -8.013
  359   2HG   PRO  51          2HG       PRO  51   0.152 -13.058  -8.896
  360   1HD   PRO  51          1HD       PRO  51  -0.119 -12.851  -6.048
  361   2HD   PRO  51          2HD       PRO  51   1.335 -13.262  -6.935
  362    H    GLN  52           H        GLN  52  -1.002 -10.832  -5.524
  363    HA   GLN  52           HA       GLN  52  -2.744  -8.643  -5.782
  364   1HB   GLN  52          1HB       GLN  52  -2.438 -10.578  -3.444
  365   2HB   GLN  52          2HB       GLN  52  -3.832  -9.566  -3.768
  366   1HG   GLN  52          1HG       GLN  52  -4.077 -10.743  -6.015
  367   2HG   GLN  52          2HG       GLN  52  -2.793 -11.833  -5.530
  368   1HE2  GLN  52          1HE2      GLN  52  -4.455 -13.452  -5.864
  369   2HE2  GLN  52          2HE2      GLN  52  -5.550 -13.852  -4.583
  370    H    ASP  53           H        ASP  53  -0.235  -9.565  -3.323
  371    HA   ASP  53           HA       ASP  53  -0.564  -7.414  -1.684
  372   1HB   ASP  53          1HB       ASP  53   0.957  -9.513  -1.461
  373   2HB   ASP  53          2HB       ASP  53   2.148  -8.614  -2.380
  374    H    LYS  54           H        LYS  54   1.231  -7.809  -4.771
  375    HA   LYS  54           HA       LYS  54   2.717  -5.441  -4.644
  376   1HB   LYS  54          1HB       LYS  54   1.843  -7.290  -6.854
  377   2HB   LYS  54          2HB       LYS  54   2.661  -5.787  -7.232
  378   1HG   LYS  54          1HG       LYS  54   4.519  -6.452  -5.640
  379   2HG   LYS  54          2HG       LYS  54   3.718  -7.993  -5.402
  380   1HD   LYS  54          1HD       LYS  54   4.672  -8.810  -7.287
  381   2HD   LYS  54          2HD       LYS  54   3.903  -7.558  -8.242
  382   1HE   LYS  54          1HE       LYS  54   6.257  -6.624  -6.671
  383   2HE   LYS  54          2HE       LYS  54   6.637  -7.818  -7.897
  384   1HZ   LYS  54          1HZ       LYS  54   5.873  -5.121  -8.225
  385   2HZ   LYS  54          2HZ       LYS  54   6.547  -6.142  -9.307
  386   3HZ   LYS  54          3HZ       LYS  54   4.926  -6.107  -9.118
  387    H    VAL  55           H        VAL  55  -0.402  -6.177  -6.363
  388    HA   VAL  55           HA       VAL  55  -0.916  -3.692  -7.333
  389    HB   VAL  55           HB       VAL  55  -2.656  -5.912  -6.304
  390   1HG1  VAL  55          1HG1      VAL  55  -4.645  -4.799  -7.126
  391   2HG1  VAL  55          2HG1      VAL  55  -3.860  -3.769  -5.905
  392   3HG1  VAL  55          3HG1      VAL  55  -3.689  -3.386  -7.635
  393   1HG2  VAL  55          1HG2      VAL  55  -1.599  -6.444  -8.354
  394   2HG2  VAL  55          2HG2      VAL  55  -3.258  -5.963  -8.785
  395   3HG2  VAL  55          3HG2      VAL  55  -1.910  -4.827  -9.029
  396    H    CYS  56           H        CYS  56  -1.574  -4.960  -4.013
  397    HA   CYS  56           HA       CYS  56  -2.905  -2.713  -3.090
  398   1HB   CYS  56          1HB       CYS  56  -2.842  -4.914  -1.967
  399   2HB   CYS  56          2HB       CYS  56  -1.169  -4.634  -1.526
  400    H    ASP  57           H        ASP  57   0.594  -3.692  -2.844
  401    HA   ASP  57           HA       ASP  57   1.548  -1.586  -1.493
  402   1HB   ASP  57          1HB       ASP  57   2.615  -3.689  -2.982
  403   2HB   ASP  57          2HB       ASP  57   3.212  -2.289  -3.850
  404    H    ALA  58           H        ALA  58   0.757  -1.855  -5.007
  405    HA   ALA  58           HA       ALA  58   1.867   0.501  -5.909
  406   1HB   ALA  58          1HB       ALA  58   0.770  -0.023  -7.843
  407   2HB   ALA  58          2HB       ALA  58   0.469  -1.560  -6.997
  408   3HB   ALA  58          3HB       ALA  58  -0.781  -0.294  -7.014
  409    H    CYS  59           H        CYS  59  -1.380  -0.127  -4.437
  410    HA   CYS  59           HA       CYS  59  -2.402   2.404  -4.754
  411   1HB   CYS  59          1HB       CYS  59  -3.655   0.395  -4.016
  412   2HB   CYS  59          2HB       CYS  59  -2.885   0.509  -2.446
  413    H    ARG  60           H        ARG  60  -0.625   0.956  -1.922
  414    HA   ARG  60           HA       ARG  60  -0.560   3.275  -0.451
  415   1HB   ARG  60          1HB       ARG  60   1.499   1.010  -0.494
  416   2HB   ARG  60          2HB       ARG  60   1.295   2.164   0.809
  417   1HG   ARG  60          1HG       ARG  60  -1.072   1.362   1.120
  418   2HG   ARG  60          2HG       ARG  60  -0.821   0.177  -0.147
  419   1HD   ARG  60          1HD       ARG  60   0.406  -1.212   1.213
  420   2HD   ARG  60          2HD       ARG  60   1.277   0.116   1.955
  421    HE   ARG  60           HE       ARG  60  -1.532   0.017   2.765
  422   1HH1  ARG  60          2HH2      ARG  60   1.688  -1.238   3.427
  423   2HH1  ARG  60          1HH2      ARG  60   1.332  -1.641   5.074
  424   1HH2  ARG  60          2HH1      ARG  60  -2.002  -0.513   4.937
  425   2HH2  ARG  60          1HH1      ARG  60  -0.782  -1.226   5.938
  426    H    MET  61           H        MET  61   1.191   2.324  -3.318
  427    HA   MET  61           HA       MET  61   3.375   4.113  -2.795
  428   1HB   MET  61          1HB       MET  61   3.993   2.133  -4.002
  429   2HB   MET  61          2HB       MET  61   2.565   2.193  -5.016
  430   1HG   MET  61          1HG       MET  61   3.564   3.573  -6.546
  431   2HG   MET  61          2HG       MET  61   4.241   4.610  -5.306
  432   1HE   MET  61          1HE       MET  61   5.761   1.564  -7.873
  433   2HE   MET  61          2HE       MET  61   5.553   0.512  -6.452
  434   3HE   MET  61          3HE       MET  61   4.178   1.461  -7.066
  435    H    LYS  62           H        LYS  62   0.362   3.964  -4.718
  436    HA   LYS  62           HA       LYS  62   0.975   6.300  -6.233
  437   1HB   LYS  62          1HB       LYS  62  -1.156   4.297  -6.075
  438   2HB   LYS  62          2HB       LYS  62  -1.773   5.914  -6.349
  439   1HG   LYS  62          1HG       LYS  62  -1.317   5.332  -8.546
  440   2HG   LYS  62          2HG       LYS  62   0.237   6.023  -8.124
  441   1HD   LYS  62          1HD       LYS  62   0.897   3.605  -7.375
  442   2HD   LYS  62          2HD       LYS  62  -0.525   3.081  -8.256
  443   1HE   LYS  62          1HE       LYS  62   0.907   4.916  -9.955
  444   2HE   LYS  62          2HE       LYS  62   2.078   3.787  -9.304
  445   1HZ   LYS  62          1HZ       LYS  62  -0.315   2.499 -10.105
  446   2HZ   LYS  62          2HZ       LYS  62   0.383   3.303 -11.344
  447   3HZ   LYS  62          3HZ       LYS  62   1.229   2.171 -10.525
  448    H    CYS  63           H        CYS  63  -1.266   5.562  -3.470
  449    HA   CYS  63           HA       CYS  63  -2.338   7.985  -3.076
  450   1HB   CYS  63          1HB       CYS  63  -2.618   5.798  -1.757
  451   2HB   CYS  63          2HB       CYS  63  -1.295   6.366  -0.758
  452    H    HIS  64           H        HIS  64   0.791   6.807  -1.622
  453    HA   HIS  64           HA       HIS  64   1.595   8.972  -0.299
  454   1HB   HIS  64          1HB       HIS  64   2.752   6.658  -0.981
  455   2HB   HIS  64          2HB       HIS  64   3.633   7.705  -2.076
  456    HD1  HIS  64           1HD      HIS  64   5.880   7.969  -0.992
  457    HD2  HIS  64           2HD      HIS  64   2.730   8.491   1.728
  458    HE1  HIS  64           1HE      HIS  64   6.948   8.697   1.207
  459    H    LYS  65           H        LYS  65   2.312   8.448  -3.829
  460    HA   LYS  65           HA       LYS  65   3.338  11.022  -4.205
  461   1HB   LYS  65          1HB       LYS  65   4.015   9.665  -5.890
  462   2HB   LYS  65          2HB       LYS  65   2.540   8.720  -5.888
  463   1HG   LYS  65          1HG       LYS  65   1.327  10.563  -7.034
  464   2HG   LYS  65          2HG       LYS  65   2.766  11.563  -6.985
  465   1HD   LYS  65          1HD       LYS  65   3.455  10.647  -8.938
  466   2HD   LYS  65          2HD       LYS  65   3.577   9.085  -8.152
  467   1HE   LYS  65          1HE       LYS  65   0.784   9.822  -8.807
  468   2HE   LYS  65          2HE       LYS  65   1.812   9.737 -10.223
  469   1HZ   LYS  65          1HZ       LYS  65   2.387   7.541  -9.707
  470   2HZ   LYS  65          2HZ       LYS  65   1.749   7.611  -8.205
  471   3HZ   LYS  65          3HZ       LYS  65   0.768   7.617  -9.510
  472    H    ALA  66           H        ALA  66   0.045   9.623  -4.769
  473    HA   ALA  66           HA       ALA  66  -1.169  11.789  -5.883
  474   1HB   ALA  66          1HB       ALA  66  -1.911   9.348  -4.532
  475   2HB   ALA  66          2HB       ALA  66  -2.994  10.662  -4.014
  476   3HB   ALA  66          3HB       ALA  66  -2.824  10.279  -5.744
  477    H    CYS  67           H        CYS  67  -0.452  11.155  -2.404
  478    HA   CYS  67           HA       CYS  67  -1.807  13.449  -1.497
  479   1HB   CYS  67          1HB       CYS  67  -1.455  11.665   0.025
  480   2HB   CYS  67          2HB       CYS  67   0.274  11.649  -0.263
  481    H    ARG  68           H        ARG  68   1.456  12.705  -2.737
  482    HA   ARG  68           HA       ARG  68   2.699  14.995  -1.793
  483   1HB   ARG  68          1HB       ARG  68   3.771  12.875  -2.798
  484   2HB   ARG  68          2HB       ARG  68   3.369  13.512  -4.380
  485   1HG   ARG  68          1HG       ARG  68   4.731  15.494  -2.650
  486   2HG   ARG  68          2HG       ARG  68   5.702  14.066  -2.947
  487   1HD   ARG  68          1HD       ARG  68   4.403  14.921  -5.423
  488   2HD   ARG  68          2HD       ARG  68   5.282  16.261  -4.714
  489    HE   ARG  68           HE       ARG  68   7.079  14.163  -4.515
  490   1HH1  ARG  68          2HH2      ARG  68   5.235  15.544  -7.175
  491   2HH1  ARG  68          1HH2      ARG  68   6.409  15.121  -8.376
  492   1HH2  ARG  68          2HH1      ARG  68   8.628  13.606  -6.099
  493   2HH2  ARG  68          1HH1      ARG  68   8.352  14.012  -7.760
  494    H    ALA  69           H        ALA  69   0.573  14.331  -4.556
  495    HA   ALA  69           HA       ALA  69   1.189  16.924  -5.740
  496   1HB   ALA  69          1HB       ALA  69  -0.424  14.507  -6.629
  497   2HB   ALA  69          2HB       ALA  69  -0.393  16.041  -7.531
  498   3HB   ALA  69          3HB       ALA  69   1.107  15.111  -7.306
  499    H    ALA  70           H        ALA  70  -1.383  15.077  -4.054
  500    HA   ALA  70           HA       ALA  70  -3.385  17.036  -4.425
  501   1HB   ALA  70          1HB       ALA  70  -2.962  14.614  -2.682
  502   2HB   ALA  70          2HB       ALA  70  -4.314  15.718  -2.334
  503   3HB   ALA  70          3HB       ALA  70  -4.205  14.916  -3.920
  504    H    ASN  71           H        ASN  71  -2.372  16.065  -1.134
  505    HA   ASN  71           HA       ASN  71  -2.836  18.507  -0.051
  506   1HB   ASN  71          1HB       ASN  71  -1.250  16.078   0.729
  507   2HB   ASN  71          2HB       ASN  71  -0.872  17.540   1.620
  508   1HD2  ASN  71          1HD2      ASN  71  -2.714  14.855   1.614
  509   2HD2  ASN  71          2HD2      ASN  71  -4.062  15.349   2.583
  510    H    CYS  72           H        CYS  72   0.460  17.018  -0.573
  511    HA   CYS  72           HA       CYS  72   1.718  19.559  -0.381
  512   1HB   CYS  72          1HB       CYS  72   2.883  16.924  -1.299
  513   2HB   CYS  72          2HB       CYS  72   3.779  18.350  -0.818
  514    H    ALA  73           H        ALA  73   3.177  20.385  -2.208
  515    HA   ALA  73           HA       ALA  73   2.877  19.518  -4.833
  516   1HB   ALA  73          1HB       ALA  73   0.491  20.455  -4.150
  517   2HB   ALA  73          2HB       ALA  73   1.266  22.030  -4.449
  518   3HB   ALA  73          3HB       ALA  73   1.186  20.817  -5.749
  519    H    SER  74           H        SER  74   3.260  22.273  -2.551
  520    HA   SER  74           HA       SER  74   5.325  23.292  -4.330
  521   1HB   SER  74          1HB       SER  74   3.331  24.539  -2.565
  522   2HB   SER  74          2HB       SER  74   4.942  25.157  -2.258
  523    HG   SER  74           HG       SER  74   3.337  25.355  -4.602
  524    H    GLU  75           H        GLU  75   4.778  21.471  -1.475
  525    HA   GLU  75           HA       GLU  75   7.133  22.386  -0.130
  526   1HB   GLU  75          1HB       GLU  75   5.305  20.020   0.478
  527   2HB   GLU  75          2HB       GLU  75   6.546  20.647   1.545
  528   1HG   GLU  75          1HG       GLU  75   4.296  22.416   0.505
  529   2HG   GLU  75          2HG       GLU  75   4.103  21.441   1.948
  530    H    CYS  76           H        CYS  76   6.256  20.043  -2.559
  531    HA   CYS  76           HA       CYS  76   8.886  18.793  -2.219
  532   1HB   CYS  76          1HB       CYS  76   6.542  17.411  -3.505
  533   2HB   CYS  76          2HB       CYS  76   8.056  16.719  -2.957
  534    HA   PRO  77           HA       PRO  77   8.982  20.861  -6.180
  535   1HB   PRO  77          1HB       PRO  77  11.673  21.335  -6.221
  536   2HB   PRO  77          2HB       PRO  77  10.513  22.457  -5.538
  537   1HG   PRO  77          1HG       PRO  77  12.383  20.644  -4.140
  538   2HG   PRO  77          2HG       PRO  77  11.540  22.047  -3.514
  539   1HD   PRO  77          1HD       PRO  77  10.873  19.296  -3.051
  540   2HD   PRO  77          2HD       PRO  77   9.965  20.698  -2.522
  541    H    LYS  78           H        LYS  78  10.776  20.599  -8.112
  542    HA   LYS  78           HA       LYS  78  10.505  17.773  -8.656
  543   1HB   LYS  78          1HB       LYS  78   9.857  19.452 -10.339
  544   2HB   LYS  78          2HB       LYS  78  11.500  20.060 -10.382
  545   1HG   LYS  78          1HG       LYS  78  11.526  18.567 -12.187
  546   2HG   LYS  78          2HG       LYS  78  12.157  17.554 -10.904
  547   1HD   LYS  78          1HD       LYS  78   9.779  16.732 -10.482
  548   2HD   LYS  78          2HD       LYS  78   9.271  17.629 -11.899
  549   1HE   LYS  78          1HE       LYS  78  11.506  16.164 -12.800
  550   2HE   LYS  78          2HE       LYS  78  10.679  15.047 -11.733
  551   1HZ   LYS  78          1HZ       LYS  78   9.481  16.484 -13.998
  552   2HZ   LYS  78          2HZ       LYS  78   9.785  14.882 -13.910
  553   3HZ   LYS  78          3HZ       LYS  78   8.637  15.548 -12.959
  554    H    HIS  79           H        HIS  79  12.154  16.281  -8.732
  555    HA   HIS  79           HA       HIS  79  14.108  15.388  -8.287
  556   1HB   HIS  79          1HB       HIS  79  14.692  17.718  -9.940
  557   2HB   HIS  79          2HB       HIS  79  16.049  17.299  -8.915
  558    HD1  HIS  79           1HD      HIS  79  14.075  16.098 -11.860
  559    HD2  HIS  79           2HD      HIS  79  17.215  14.738  -9.434
  560    HE1  HIS  79           1HE      HIS  79  15.110  14.109 -13.078
  561    H    GLU  80           H        GLU  80  14.283  15.042  -6.111
  562    HA   GLU  80           HA       GLU  80  16.077  16.319  -4.602
  563   1HB   GLU  80          1HB       GLU  80  13.740  17.999  -4.854
  564   2HB   GLU  80          2HB       GLU  80  13.853  17.461  -3.190
  565   1HG   GLU  80          1HG       GLU  80  16.510  18.094  -3.827
  566   2HG   GLU  80          2HG       GLU  80  15.598  19.322  -4.681
  567    H    HIS  81           H        HIS  81  12.910  14.736  -4.833
  568    HA   HIS  81           HA       HIS  81  12.183  12.888  -3.864
  569   1HB   HIS  81          1HB       HIS  81  14.581  12.803  -2.032
  570   2HB   HIS  81          2HB       HIS  81  13.545  11.479  -2.529
  571    HD1  HIS  81           1HD      HIS  81  13.924  10.471  -4.924
  572    HD2  HIS  81           2HD      HIS  81  16.612  13.510  -3.861
  573    HE1  HIS  81           1HE      HIS  81  15.820  10.376  -6.629
  574    H    LYS  82           H        LYS  82  12.742  12.327  -0.879
  575    HA   LYS  82           HA       LYS  82  10.593  13.896   0.082
  576   1HB   LYS  82          1HB       LYS  82  12.246  11.651   0.996
  577   2HB   LYS  82          2HB       LYS  82  11.800  12.742   2.293
  578   1HG   LYS  82          1HG       LYS  82   9.859  11.517   2.316
  579   2HG   LYS  82          2HG       LYS  82   9.396  12.584   1.005
  580   1HD   LYS  82          1HD       LYS  82  10.979  10.462  -0.132
  581   2HD   LYS  82          2HD       LYS  82   9.801   9.722   0.934
  582   1HE   LYS  82          1HE       LYS  82   7.947  10.777  -0.225
  583   2HE   LYS  82          2HE       LYS  82   9.019  11.839  -1.116
  584   1HZ   LYS  82          1HZ       LYS  82   8.989   8.911  -1.369
  585   2HZ   LYS  82          2HZ       LYS  82   8.289   9.950  -2.418
  586   3HZ   LYS  82          3HZ       LYS  82   9.913   9.938  -2.241
  587    H    SER  83           H        SER  83  11.240  16.096  -0.268
  588    HA   SER  83           HA       SER  83  13.639  17.069   0.780
  589   1HB   SER  83          1HB       SER  83  13.021  18.925  -0.359
  590   2HB   SER  83          2HB       SER  83  11.601  18.032  -0.869
  591    HG   SER  83           HG       SER  83  11.588  20.258   0.522
  592    H    ASP  84           H        ASP  84  13.772  18.779   2.563
  593    HA   ASP  84           HA       ASP  84  12.954  17.750   4.928
  594   1HB   ASP  84          1HB       ASP  84  13.254  20.744   4.492
  595   2HB   ASP  84          2HB       ASP  84  13.680  19.820   5.919
  596    H    THR  85           H        THR  85  11.639  20.749   3.304
  597    HA   THR  85           HA       THR  85   9.399  20.955   4.994
  598    HB   THR  85           HB       THR  85  10.658  22.634   3.323
  599    HG1  THR  85           1HG      THR  85   7.778  22.360   3.823
  600   1HG2  THR  85          1HG2      THR  85   8.219  21.734   1.707
  601   2HG2  THR  85          2HG2      THR  85   9.364  23.030   1.285
  602   3HG2  THR  85          3HG2      THR  85   9.893  21.331   1.255
  603    H    CYS  86           H        CYS  86  10.112  18.825   2.341
  604    HA   CYS  86           HA       CYS  86   7.411  18.437   1.563
  605   1HB   CYS  86          1HB       CYS  86   9.243  18.021   0.024
  606   2HB   CYS  86          2HB       CYS  86   9.897  16.784   1.078
  607    H    ARG  87           H        ARG  87   9.848  16.320   3.265
  608    HA   ARG  87           HA       ARG  87   8.192  14.359   4.019
  609   1HB   ARG  87          1HB       ARG  87  10.492  15.606   5.604
  610   2HB   ARG  87          2HB       ARG  87   9.764  14.067   6.020
  611   1HG   ARG  87          1HG       ARG  87  10.272  13.364   3.558
  612   2HG   ARG  87          2HG       ARG  87  11.304  14.779   3.494
  613   1HD   ARG  87          1HD       ARG  87  12.734  12.950   4.134
  614   2HD   ARG  87          2HD       ARG  87  12.490  13.896   5.589
  615    HE   ARG  87           HE       ARG  87  10.453  11.867   5.406
  616   1HH1  ARG  87          2HH2      ARG  87  13.876  12.268   6.113
  617   2HH1  ARG  87          1HH2      ARG  87  13.961  10.868   7.129
  618   1HH2  ARG  87          2HH1      ARG  87  10.564  10.020   6.746
  619   2HH2  ARG  87          1HH1      ARG  87  12.065   9.581   7.492
  620    H    ALA  88           H        ALA  88   8.607  17.598   5.505
  621    HA   ALA  88           HA       ALA  88   7.131  17.051   7.846
  622   1HB   ALA  88          1HB       ALA  88   8.783  18.926   7.466
  623   2HB   ALA  88          2HB       ALA  88   7.557  19.718   6.446
  624   3HB   ALA  88          3HB       ALA  88   7.233  19.441   8.174
  625    H    CYS  89           H        CYS  89   6.305  18.348   4.581
  626    HA   CYS  89           HA       CYS  89   3.659  18.978   5.214
  627   1HB   CYS  89          1HB       CYS  89   4.639  19.954   3.292
  628   2HB   CYS  89          2HB       CYS  89   5.073  18.397   2.616
  629    H    MET  90           H        MET  90   5.175  16.109   3.560
  630    HA   MET  90           HA       MET  90   2.789  14.695   3.367
  631   1HB   MET  90          1HB       MET  90   5.712  13.763   3.481
  632   2HB   MET  90          2HB       MET  90   4.384  12.730   2.989
  633   1HG   MET  90          1HG       MET  90   3.837  14.425   1.160
  634   2HG   MET  90          2HG       MET  90   5.293  15.295   1.600
  635   1HE   MET  90          1HE       MET  90   4.759  11.273   1.526
  636   2HE   MET  90          2HE       MET  90   3.697  12.101   0.361
  637   3HE   MET  90          3HE       MET  90   5.040  11.088  -0.222
  638    H    LYS  91           H        LYS  91   5.100  15.150   6.002
  639    HA   LYS  91           HA       LYS  91   4.589  12.861   7.480
  640   1HB   LYS  91          1HB       LYS  91   6.427  14.103   8.163
  641   2HB   LYS  91          2HB       LYS  91   5.566  15.628   8.108
  642   1HG   LYS  91          1HG       LYS  91   4.301  15.088  10.116
  643   2HG   LYS  91          2HG       LYS  91   4.855  13.425  10.094
  644   1HD   LYS  91          1HD       LYS  91   6.750  13.959  11.226
  645   2HD   LYS  91          2HD       LYS  91   7.153  15.221  10.079
  646   1HE   LYS  91          1HE       LYS  91   6.385  16.869  11.458
  647   2HE   LYS  91          2HE       LYS  91   4.893  16.012  11.791
  648   1HZ   LYS  91          1HZ       LYS  91   5.898  15.922  13.796
  649   2HZ   LYS  91          2HZ       LYS  91   6.499  14.534  13.180
  650   3HZ   LYS  91          3HZ       LYS  91   7.419  15.883  13.203
  651    H    THR  92           H        THR  92   3.019  16.132   7.682
  652    HA   THR  92           HA       THR  92   1.002  15.096   9.454
  653    HB   THR  92           HB       THR  92   1.525  17.769   8.063
  654    HG1  THR  92           1HG      THR  92   2.583  18.041  10.000
  655   1HG2  THR  92          1HG2      THR  92  -0.968  16.887   9.102
  656   2HG2  THR  92          2HG2      THR  92  -0.221  17.824  10.418
  657   3HG2  THR  92          3HG2      THR  92  -0.476  18.574   8.824
  658    H    ASN  93           H        ASN  93   0.947  16.493   6.102
  659    HA   ASN  93           HA       ASN  93  -1.679  15.934   5.638
  660   1HB   ASN  93          1HB       ASN  93   0.731  16.035   3.762
  661   2HB   ASN  93          2HB       ASN  93  -0.900  15.840   3.151
  662   1HD2  ASN  93          1HD2      ASN  93   1.360  17.935   4.772
  663   2HD2  ASN  93          2HD2      ASN  93   0.482  19.421   4.621
  664    H    CYS  94           H        CYS  94   1.149  14.099   4.231
  665    HA   CYS  94           HA       CYS  94  -0.490  11.824   3.749
  666   1HB   CYS  94          1HB       CYS  94   2.517  11.860   3.621
  667   2HB   CYS  94          2HB       CYS  94   1.393  10.860   2.723
  668    H    LYS  95           H        LYS  95  -1.174  11.762   6.151
  669    HA   LYS  95           HA       LYS  95   0.399  11.328   8.276
  670   1HB   LYS  95          1HB       LYS  95  -2.279  11.092   7.722
  671   2HB   LYS  95          2HB       LYS  95  -1.861   9.437   8.116
  672   1HG   LYS  95          1HG       LYS  95  -0.504  10.814  10.098
  673   2HG   LYS  95          2HG       LYS  95  -1.900  11.847   9.865
  674   1HD   LYS  95          1HD       LYS  95  -2.853  10.381  11.371
  675   2HD   LYS  95          2HD       LYS  95  -3.192   9.470   9.913
  676   1HE   LYS  95          1HE       LYS  95  -1.384   7.962  10.275
  677   2HE   LYS  95          2HE       LYS  95  -0.561   9.058  11.367
  678   1HZ   LYS  95          1HZ       LYS  95  -2.018   7.070  12.212
  679   2HZ   LYS  95          2HZ       LYS  95  -1.875   8.453  13.069
  680   3HZ   LYS  95          3HZ       LYS  95  -3.201   8.193  12.152
  Start of MODEL    7
    1   1H    ILE   1           H        ILE   1 -18.983   8.311   8.092
    2    HA   ILE   1           HA       ILE   1 -18.061  10.064   9.130
    3    HB   ILE   1           HB       ILE   1 -17.014   8.495  10.714
    4   1HG1  ILE   1          1HG1      ILE   1 -14.918  10.555  10.195
    5   2HG1  ILE   1          2HG1      ILE   1 -16.560  11.120  10.429
    6   1HG2  ILE   1          1HG2      ILE   1 -14.436   8.655   9.197
    7   2HG2  ILE   1          2HG2      ILE   1 -14.979   7.473  10.412
    8   3HG2  ILE   1          3HG2      ILE   1 -15.635   7.415   8.759
    9   1HD1  ILE   1          1HD1      ILE   1 -14.704   9.817  12.371
   10   2HD1  ILE   1          2HD1      ILE   1 -15.970  11.037  12.649
   11   3HD1  ILE   1          3HD1      ILE   1 -16.410   9.320  12.479
   12    H    SER   2           H        SER   2 -18.338  10.523   6.706
   13    HA   SER   2           HA       SER   2 -15.687  11.021   5.593
   14   1HB   SER   2          1HB       SER   2 -17.847   9.584   4.469
   15   2HB   SER   2          2HB       SER   2 -17.867  11.126   3.638
   16    HG   SER   2           HG       SER   2 -15.334  10.581   3.597
   17    H    GLU   3           H        GLU   3 -15.284  13.155   6.177
   18    HA   GLU   3           HA       GLU   3 -16.507  15.181   4.838
   19   1HB   GLU   3          1HB       GLU   3 -18.093  14.346   7.106
   20   2HB   GLU   3          2HB       GLU   3 -17.461  15.947   7.435
   21   1HG   GLU   3          1HG       GLU   3 -18.562  16.920   5.603
   22   2HG   GLU   3          2HG       GLU   3 -18.606  15.422   4.693
   23    H    PHE   4           H        PHE   4 -14.789  16.554   4.722
   24    HA   PHE   4           HA       PHE   4 -12.796  17.412   5.241
   25   1HB   PHE   4          1HB       PHE   4 -14.281  18.011   7.864
   26   2HB   PHE   4          2HB       PHE   4 -13.037  19.007   7.136
   27    HD1  PHE   4           1HD      PHE   4 -16.557  18.069   7.048
   28    HD2  PHE   4           2HD      PHE   4 -13.537  20.391   5.179
   29    HE1  PHE   4           1HE      PHE   4 -18.319  19.393   5.847
   30    HE2  PHE   4           2HE      PHE   4 -15.298  21.714   3.977
   31    HZ   PHE   4           HZ       PHE   4 -17.668  21.200   4.325
   32    H    ALA   5           H        ALA   5 -11.502  15.480   5.436
   33    HA   ALA   5           HA       ALA   5 -10.446  15.166   8.096
   34   1HB   ALA   5          1HB       ALA   5 -12.493  13.423   7.225
   35   2HB   ALA   5          2HB       ALA   5 -10.975  12.512   7.041
   36   3HB   ALA   5          3HB       ALA   5 -11.411  13.205   8.621
   37    HA   PRO   6           HA       PRO   6  -6.904  14.302   5.769
   38   1HB   PRO   6          1HB       PRO   6  -5.464  12.596   7.343
   39   2HB   PRO   6          2HB       PRO   6  -5.538  14.324   7.621
   40   1HG   PRO   6          1HG       PRO   6  -6.881  12.149   9.106
   41   2HG   PRO   6          2HG       PRO   6  -6.595  13.805   9.604
   42   1HD   PRO   6          1HD       PRO   6  -9.074  12.693   8.686
   43   2HD   PRO   6          2HD       PRO   6  -8.759  14.373   9.074
   44    H    VAL   7           H        VAL   7  -5.580  12.828   4.472
   45    HA   VAL   7           HA       VAL   7  -7.311  10.883   3.343
   46    HB   VAL   7           HB       VAL   7  -4.397  11.570   2.930
   47   1HG1  VAL   7          1HG1      VAL   7  -4.856  10.328   0.684
   48   2HG1  VAL   7          2HG1      VAL   7  -4.470   9.381   2.141
   49   3HG1  VAL   7          3HG1      VAL   7  -6.158   9.523   1.594
   50   1HG2  VAL   7          1HG2      VAL   7  -5.282  13.349   1.895
   51   2HG2  VAL   7          2HG2      VAL   7  -5.835  12.211   0.642
   52   3HG2  VAL   7          3HG2      VAL   7  -6.928  12.676   1.968
   53    H    ASP   8           H        ASP   8  -6.867   8.553   3.174
   54    HA   ASP   8           HA       ASP   8  -5.524   7.632   5.592
   55   1HB   ASP   8          1HB       ASP   8  -8.070   7.249   5.271
   56   2HB   ASP   8          2HB       ASP   8  -7.640   6.127   3.996
   57    H    CYS   9           H        CYS   9  -6.210   7.099   2.088
   58    HA   CYS   9           HA       CYS   9  -5.070   6.112   0.492
   59   1HB   CYS   9          1HB       CYS   9  -2.934   6.490   2.517
   60   2HB   CYS   9          2HB       CYS   9  -2.611   5.314   1.259
   61    H    LYS  10           H        LYS  10  -3.704   4.394   3.395
   62    HA   LYS  10           HA       LYS  10  -3.741   1.880   2.481
   63   1HB   LYS  10          1HB       LYS  10  -3.037   2.861   4.772
   64   2HB   LYS  10          2HB       LYS  10  -4.670   2.491   5.286
   65   1HG   LYS  10          1HG       LYS  10  -3.803   0.159   3.926
   66   2HG   LYS  10          2HG       LYS  10  -2.410   0.674   4.857
   67   1HD   LYS  10          1HD       LYS  10  -4.528   1.006   6.664
   68   2HD   LYS  10          2HD       LYS  10  -4.981  -0.445   5.792
   69   1HE   LYS  10          1HE       LYS  10  -3.573  -1.551   7.205
   70   2HE   LYS  10          2HE       LYS  10  -2.269  -0.880   6.245
   71   1HZ   LYS  10          1HZ       LYS  10  -2.247  -0.454   8.712
   72   2HZ   LYS  10          2HZ       LYS  10  -1.982   0.837   7.748
   73   3HZ   LYS  10          3HZ       LYS  10  -3.439   0.633   8.458
   74    H    GLY  11           H        GLY  11  -6.567   3.604   3.955
   75   1HA   GLY  11          1HA       GLY  11  -8.355   1.424   3.627
   76   2HA   GLY  11          2HA       GLY  11  -8.762   3.095   3.962
   77    H    GLN  12           H        GLN  12  -7.929   4.559   1.821
   78    HA   GLN  12           HA       GLN  12  -9.859   4.169  -0.027
   79   1HB   GLN  12          1HB       GLN  12  -7.264   5.669   0.032
   80   2HB   GLN  12          2HB       GLN  12  -8.021   5.480  -1.537
   81   1HG   GLN  12          1HG       GLN  12  -9.957   6.238   0.564
   82   2HG   GLN  12          2HG       GLN  12  -8.672   7.416   0.382
   83   1HE2  GLN  12          1HE2      GLN  12  -8.221   8.268  -1.735
   84   2HE2  GLN  12          2HE2      GLN  12  -9.485   8.430  -2.908
   85    H    CYS  13           H        CYS  13  -6.778   2.503   0.304
   86    HA   CYS  13           HA       CYS  13  -6.910   1.487  -2.400
   87   1HB   CYS  13          1HB       CYS  13  -4.926   1.103  -0.156
   88   2HB   CYS  13          2HB       CYS  13  -4.832   0.238  -1.677
   89    H    THR  14           H        THR  14  -9.227   0.705  -1.453
   90    HA   THR  14           HA       THR  14  -8.912  -1.827  -0.026
   91    HB   THR  14           HB       THR  14 -11.173   0.119  -0.611
   92    HG1  THR  14           1HG      THR  14 -10.121   0.423   1.377
   93   1HG2  THR  14          1HG2      THR  14 -12.650  -1.638  -0.710
   94   2HG2  THR  14          2HG2      THR  14 -11.386  -2.817  -0.287
   95   3HG2  THR  14          3HG2      THR  14 -12.231  -1.919   0.997
   96    H    THR  15           H        THR  15  -9.817  -0.466  -3.196
   97    HA   THR  15           HA       THR  15 -10.838  -2.924  -4.202
   98    HB   THR  15           HB       THR  15 -10.223  -0.152  -5.149
   99    HG1  THR  15           1HG      THR  15 -12.386  -0.715  -4.747
  100   1HG2  THR  15          1HG2      THR  15 -10.551  -2.493  -7.098
  101   2HG2  THR  15          2HG2      THR  15 -10.466  -0.766  -7.522
  102   3HG2  THR  15          3HG2      THR  15  -9.031  -1.595  -6.871
  103    HA   PRO  16           HA       PRO  16  -6.462  -3.312  -5.908
  104   1HB   PRO  16          1HB       PRO  16  -4.458  -1.768  -4.875
  105   2HB   PRO  16          2HB       PRO  16  -5.314  -1.366  -6.350
  106   1HG   PRO  16          1HG       PRO  16  -5.577  -0.155  -3.666
  107   2HG   PRO  16          2HG       PRO  16  -6.087   0.487  -5.214
  108   1HD   PRO  16          1HD       PRO  16  -7.765  -0.696  -3.211
  109   2HD   PRO  16          2HD       PRO  16  -8.255  -0.160  -4.805
  110    H    CYS  17           H        CYS  17  -7.033  -2.795  -2.572
  111    HA   CYS  17           HA       CYS  17  -5.193  -5.005  -2.017
  112   1HB   CYS  17          1HB       CYS  17  -6.246  -3.066   0.035
  113   2HB   CYS  17          2HB       CYS  17  -4.909  -4.190   0.183
  114    H    GLU  18           H        GLU  18  -8.030  -5.023  -3.112
  115    HA   GLU  18           HA       GLU  18  -9.654  -5.802  -0.919
  116   1HB   GLU  18          1HB       GLU  18 -10.082  -4.982  -3.573
  117   2HB   GLU  18          2HB       GLU  18 -10.585  -6.661  -3.573
  118   1HG   GLU  18          1HG       GLU  18 -11.726  -5.799  -1.217
  119   2HG   GLU  18          2HG       GLU  18 -11.784  -4.321  -2.157
  120    HA   PRO  19           HA       PRO  19  -8.744 -10.065  -2.800
  121   1HB   PRO  19          1HB       PRO  19  -6.786 -10.331  -4.687
  122   2HB   PRO  19          2HB       PRO  19  -8.484 -10.169  -5.085
  123   1HG   PRO  19          1HG       PRO  19  -6.328  -8.159  -5.311
  124   2HG   PRO  19          2HG       PRO  19  -7.903  -8.171  -6.080
  125   1HD   PRO  19          1HD       PRO  19  -7.107  -6.589  -3.823
  126   2HD   PRO  19          2HD       PRO  19  -8.712  -6.688  -4.520
  127    H    LEU  20           H        LEU  20  -5.961  -7.987  -2.478
  128    HA   LEU  20           HA       LEU  20  -4.219  -9.954  -1.541
  129   1HB   LEU  20          1HB       LEU  20  -3.103  -8.088  -2.140
  130   2HB   LEU  20          2HB       LEU  20  -4.362  -7.003  -1.584
  131    HG   LEU  20           HG       LEU  20  -3.590  -7.651   0.804
  132   1HD1  LEU  20          1HD1      LEU  20  -2.053  -9.486  -0.404
  133   2HD1  LEU  20          2HD1      LEU  20  -0.893  -8.136  -0.344
  134   3HD1  LEU  20          3HD1      LEU  20  -1.636  -8.739   1.157
  135   1HD2  LEU  20          1HD2      LEU  20  -3.154  -5.502  -0.691
  136   2HD2  LEU  20          2HD2      LEU  20  -2.385  -5.718   0.899
  137   3HD2  LEU  20          3HD2      LEU  20  -1.472  -6.075  -0.586
  138    H    THR  21           H        THR  21  -6.054  -7.461   0.374
  139    HA   THR  21           HA       THR  21  -5.504  -8.366   2.868
  140    HB   THR  21           HB       THR  21  -8.026  -7.175   1.622
  141    HG1  THR  21           1HG      THR  21  -5.865  -6.050   1.789
  142   1HG2  THR  21          1HG2      THR  21  -7.734  -6.547   4.422
  143   2HG2  THR  21          2HG2      THR  21  -9.106  -7.355   3.625
  144   3HG2  THR  21          3HG2      THR  21  -7.755  -8.320   4.267
  145    H    ALA  22           H        ALA  22  -8.259  -9.534   0.817
  146    HA   ALA  22           HA       ALA  22  -9.235 -11.389   2.580
  147   1HB   ALA  22          1HB       ALA  22 -10.568 -11.096   0.721
  148   2HB   ALA  22          2HB       ALA  22  -9.185 -11.051  -0.399
  149   3HB   ALA  22          3HB       ALA  22  -9.751 -12.607   0.254
  150    H    CYS  23           H        CYS  23  -6.358 -11.525   0.461
  151    HA   CYS  23           HA       CYS  23  -5.940 -14.286   0.738
  152   1HB   CYS  23          1HB       CYS  23  -4.932 -12.481  -0.905
  153   2HB   CYS  23          2HB       CYS  23  -3.672 -12.384   0.309
  154    H    LYS  24           H        LYS  24  -4.409 -11.378   2.313
  155    HA   LYS  24           HA       LYS  24  -2.816 -12.741   4.092
  156   1HB   LYS  24          1HB       LYS  24  -3.925 -10.013   3.837
  157   2HB   LYS  24          2HB       LYS  24  -3.474 -10.471   5.467
  158   1HG   LYS  24          1HG       LYS  24  -1.204 -10.850   4.878
  159   2HG   LYS  24          2HG       LYS  24  -1.574 -11.049   3.177
  160   1HD   LYS  24          1HD       LYS  24  -0.739  -8.889   3.101
  161   2HD   LYS  24          2HD       LYS  24  -2.422  -8.510   3.409
  162   1HE   LYS  24          1HE       LYS  24  -1.745  -7.397   5.270
  163   2HE   LYS  24          2HE       LYS  24  -1.357  -8.951   5.982
  164   1HZ   LYS  24          1HZ       LYS  24   0.722  -8.263   5.965
  165   2HZ   LYS  24          2HZ       LYS  24   0.734  -8.384   4.336
  166   3HZ   LYS  24          3HZ       LYS  24   0.392  -6.954   5.046
  167    H    GLU  25           H        GLU  25  -6.253 -11.670   4.445
  168    HA   GLU  25           HA       GLU  25  -6.566 -12.460   7.046
  169   1HB   GLU  25          1HB       GLU  25  -8.232 -11.600   4.860
  170   2HB   GLU  25          2HB       GLU  25  -9.006 -12.985   5.605
  171   1HG   GLU  25          1HG       GLU  25  -7.879 -10.896   7.454
  172   2HG   GLU  25          2HG       GLU  25  -9.314 -10.461   6.547
  173    H    LYS  26           H        LYS  26  -7.779 -14.308   4.150
  174    HA   LYS  26           HA       LYS  26  -8.456 -16.611   5.332
  175   1HB   LYS  26          1HB       LYS  26  -8.263 -15.780   2.782
  176   2HB   LYS  26          2HB       LYS  26  -6.895 -16.875   2.806
  177   1HG   LYS  26          1HG       LYS  26  -8.227 -18.729   2.917
  178   2HG   LYS  26          2HG       LYS  26  -9.262 -18.025   4.144
  179   1HD   LYS  26          1HD       LYS  26 -10.707 -17.049   2.576
  180   2HD   LYS  26          2HD       LYS  26  -9.467 -16.923   1.345
  181   1HE   LYS  26          1HE       LYS  26  -9.601 -19.661   1.642
  182   2HE   LYS  26          2HE       LYS  26 -11.257 -19.220   2.005
  183   1HZ   LYS  26          1HZ       LYS  26  -9.784 -18.883  -0.463
  184   2HZ   LYS  26          2HZ       LYS  26 -11.335 -19.340  -0.232
  185   3HZ   LYS  26          3HZ       LYS  26 -10.922 -17.765  -0.112
  186    H    CYS  27           H        CYS  27  -5.120 -15.502   4.587
  187    HA   CYS  27           HA       CYS  27  -3.893 -17.923   5.290
  188   1HB   CYS  27          1HB       CYS  27  -2.774 -15.112   5.287
  189   2HB   CYS  27          2HB       CYS  27  -1.826 -16.581   5.419
  190    H    ALA  28           H        ALA  28  -4.143 -14.735   7.045
  191    HA   ALA  28           HA       ALA  28  -3.057 -15.363   9.409
  192   1HB   ALA  28          1HB       ALA  28  -5.213 -13.567   8.461
  193   2HB   ALA  28          2HB       ALA  28  -5.255 -13.918  10.206
  194   3HB   ALA  28          3HB       ALA  28  -3.792 -13.215   9.474
  195    H    GLU  29           H        GLU  29  -6.538 -15.969   8.541
  196    HA   GLU  29           HA       GLU  29  -7.265 -17.176  10.852
  197   1HB   GLU  29          1HB       GLU  29  -8.155 -17.457   7.984
  198   2HB   GLU  29          2HB       GLU  29  -8.826 -18.553   9.176
  199   1HG   GLU  29          1HG       GLU  29  -8.772 -15.583   9.768
  200   2HG   GLU  29          2HG       GLU  29  -9.999 -16.215   8.688
  201    H    SER  30           H        SER  30  -5.901 -18.762   7.880
  202    HA   SER  30           HA       SER  30  -5.913 -21.312   8.967
  203   1HB   SER  30          1HB       SER  30  -5.102 -20.039   6.535
  204   2HB   SER  30          2HB       SER  30  -3.730 -20.979   7.087
  205    HG   SER  30           HG       SER  30  -4.777 -22.820   6.686
  206    H    CYS  31           H        CYS  31  -3.686 -18.561   9.252
  207    HA   CYS  31           HA       CYS  31  -1.700 -20.257  10.527
  208   1HB   CYS  31          1HB       CYS  31  -1.592 -17.324   9.792
  209   2HB   CYS  31          2HB       CYS  31  -0.281 -18.246  10.500
  210    H    GLU  32           H        GLU  32  -4.075 -20.227  11.949
  211    HA   GLU  32           HA       GLU  32  -4.154 -18.051  13.753
  212   1HB   GLU  32          1HB       GLU  32  -5.769 -20.372  13.107
  213   2HB   GLU  32          2HB       GLU  32  -5.546 -20.298  14.843
  214   1HG   GLU  32          1HG       GLU  32  -6.457 -17.927  13.147
  215   2HG   GLU  32          2HG       GLU  32  -7.556 -19.002  13.987
  216    H    THR  33           H        THR  33  -3.018 -21.484  13.887
  217    HA   THR  33           HA       THR  33  -1.706 -20.833  16.442
  218    HB   THR  33           HB       THR  33  -2.018 -23.138  17.024
  219    HG1  THR  33           1HG      THR  33  -2.758 -23.429  14.198
  220   1HG2  THR  33          1HG2      THR  33  -4.253 -21.840  16.765
  221   2HG2  THR  33          2HG2      THR  33  -4.418 -22.662  15.195
  222   3HG2  THR  33          3HG2      THR  33  -4.364 -23.615  16.697
  223    H    SER  34           H        SER  34  -0.596 -19.890  13.994
  224    HA   SER  34           HA       SER  34   1.352 -21.781  13.172
  225   1HB   SER  34          1HB       SER  34   2.186 -19.973  11.744
  226   2HB   SER  34          2HB       SER  34   0.438 -20.044  11.644
  227    HG   SER  34           HG       SER  34   0.992 -18.376  13.679
  228    H    ALA  35           H        ALA  35   3.628 -21.747  13.631
  229    HA   ALA  35           HA       ALA  35   4.288 -20.924  16.235
  230   1HB   ALA  35          1HB       ALA  35   5.845 -22.483  15.804
  231   2HB   ALA  35          2HB       ALA  35   5.407 -22.474  14.079
  232   3HB   ALA  35          3HB       ALA  35   6.645 -21.350  14.689
  233    H    ASP  36           H        ASP  36   4.794 -19.515  12.967
  234    HA   ASP  36           HA       ASP  36   5.592 -17.080  14.337
  235   1HB   ASP  36          1HB       ASP  36   7.027 -18.591  12.177
  236   2HB   ASP  36          2HB       ASP  36   6.981 -16.849  11.995
  237    H    LYS  37           H        LYS  37   3.340 -16.386  13.941
  238    HA   LYS  37           HA       LYS  37   1.872 -16.588  11.707
  239   1HB   LYS  37          1HB       LYS  37   2.146 -14.420  13.765
  240   2HB   LYS  37          2HB       LYS  37   1.098 -14.159  12.386
  241   1HG   LYS  37          1HG       LYS  37   0.059 -16.477  12.936
  242   2HG   LYS  37          2HG       LYS  37   0.917 -16.382  14.461
  243   1HD   LYS  37          1HD       LYS  37  -1.025 -15.350  15.151
  244   2HD   LYS  37          2HD       LYS  37  -0.233 -13.927  14.505
  245   1HE   LYS  37          1HE       LYS  37  -1.475 -14.018  12.454
  246   2HE   LYS  37          2HE       LYS  37  -1.970 -15.677  12.725
  247   1HZ   LYS  37          1HZ       LYS  37  -2.754 -13.594  14.612
  248   2HZ   LYS  37          2HZ       LYS  37  -3.599 -13.813  13.232
  249   3HZ   LYS  37          3HZ       LYS  37  -3.475 -15.029  14.315
  250    H    LYS  38           H        LYS  38   4.330 -13.986  12.326
  251    HA   LYS  38           HA       LYS  38   4.097 -12.604  10.012
  252   1HB   LYS  38          1HB       LYS  38   5.915 -12.760  12.142
  253   2HB   LYS  38          2HB       LYS  38   6.895 -12.986  10.707
  254   1HG   LYS  38          1HG       LYS  38   6.837 -10.725  10.467
  255   2HG   LYS  38          2HG       LYS  38   5.179 -10.923   9.935
  256   1HD   LYS  38          1HD       LYS  38   4.288 -10.218  11.961
  257   2HD   LYS  38          2HD       LYS  38   5.607 -10.884  12.902
  258   1HE   LYS  38          1HE       LYS  38   7.098  -9.028  11.917
  259   2HE   LYS  38          2HE       LYS  38   5.639  -8.310  11.264
  260   1HZ   LYS  38          1HZ       LYS  38   5.949  -7.325  13.319
  261   2HZ   LYS  38          2HZ       LYS  38   4.787  -8.434  13.616
  262   3HZ   LYS  38          3HZ       LYS  38   6.327  -8.722  14.077
  263    H    THR  39           H        THR  39   6.377 -15.398  10.503
  264    HA   THR  39           HA       THR  39   7.158 -15.599   7.855
  265    HB   THR  39           HB       THR  39   6.829 -17.891   9.853
  266    HG1  THR  39           1HG      THR  39   8.826 -15.765   9.504
  267   1HG2  THR  39          1HG2      THR  39   8.503 -18.953   8.660
  268   2HG2  THR  39          2HG2      THR  39   7.931 -17.928   7.321
  269   3HG2  THR  39          3HG2      THR  39   9.335 -17.423   8.292
  270    H    CYS  40           H        CYS  40   4.620 -17.596   9.518
  271    HA   CYS  40           HA       CYS  40   3.765 -18.998   7.394
  272   1HB   CYS  40          1HB       CYS  40   2.958 -19.102   9.783
  273   2HB   CYS  40          2HB       CYS  40   1.891 -17.761   9.415
  274    H    ARG  41           H        ARG  41   2.184 -15.904   8.503
  275    HA   ARG  41           HA       ARG  41   0.566 -15.483   6.453
  276   1HB   ARG  41          1HB       ARG  41   2.187 -13.618   8.187
  277   2HB   ARG  41          2HB       ARG  41   1.321 -12.910   6.838
  278   1HG   ARG  41          1HG       ARG  41  -0.522 -14.704   8.064
  279   2HG   ARG  41          2HG       ARG  41   0.275 -13.876   9.388
  280   1HD   ARG  41          1HD       ARG  41  -0.253 -11.854   7.453
  281   2HD   ARG  41          2HD       ARG  41  -1.701 -12.841   7.496
  282    HE   ARG  41           HE       ARG  41  -2.165 -11.971   9.607
  283   1HH1  ARG  41          2HH2      ARG  41   1.290 -11.668   9.009
  284   2HH1  ARG  41          1HH2      ARG  41   1.599 -10.810  10.481
  285   1HH2  ARG  41          2HH1      ARG  41  -1.757 -10.838  11.550
  286   2HH2  ARG  41          1HH1      ARG  41  -0.145 -10.335  11.936
  287    H    ARG  42           H        ARG  42   3.999 -14.263   6.610
  288    HA   ARG  42           HA       ARG  42   4.094 -13.130   4.162
  289   1HB   ARG  42          1HB       ARG  42   6.158 -14.493   5.910
  290   2HB   ARG  42          2HB       ARG  42   6.640 -13.966   4.309
  291   1HG   ARG  42          1HG       ARG  42   6.537 -11.735   4.861
  292   2HG   ARG  42          2HG       ARG  42   5.092 -11.933   5.832
  293   1HD   ARG  42          1HD       ARG  42   6.309 -12.023   7.751
  294   2HD   ARG  42          2HD       ARG  42   7.311 -13.315   7.120
  295    HE   ARG  42           HE       ARG  42   8.062 -10.555   7.317
  296   1HH1  ARG  42          2HH2      ARG  42   8.332 -13.284   5.111
  297   2HH1  ARG  42          1HH2      ARG  42   9.803 -12.720   4.391
  298   1HH2  ARG  42          2HH1      ARG  42  10.003  -9.811   6.367
  299   2HH2  ARG  42          1HH1      ARG  42  10.760 -10.732   5.110
  300    H    ASN  43           H        ASN  43   4.997 -16.543   5.055
  301    HA   ASN  43           HA       ASN  43   5.731 -17.391   2.586
  302   1HB   ASN  43          1HB       ASN  43   4.125 -19.043   4.604
  303   2HB   ASN  43          2HB       ASN  43   5.242 -19.668   3.407
  304   1HD2  ASN  43          1HD2      ASN  43   5.357 -20.128   6.188
  305   2HD2  ASN  43          2HD2      ASN  43   6.829 -19.466   6.815
  306    H    CYS  44           H        CYS  44   2.459 -17.310   4.154
  307    HA   CYS  44           HA       CYS  44   1.093 -18.571   2.077
  308   1HB   CYS  44          1HB       CYS  44   0.319 -18.170   4.455
  309   2HB   CYS  44          2HB       CYS  44  -0.054 -16.525   3.979
  310    H    LYS  45           H        LYS  45   2.221 -15.240   2.662
  311    HA   LYS  45           HA       LYS  45   0.592 -13.958   0.779
  312   1HB   LYS  45          1HB       LYS  45   2.473 -13.214   2.673
  313   2HB   LYS  45          2HB       LYS  45   3.260 -12.801   1.163
  314   1HG   LYS  45          1HG       LYS  45   1.677 -11.196   0.603
  315   2HG   LYS  45          2HG       LYS  45   0.362 -12.062   1.373
  316   1HD   LYS  45          1HD       LYS  45   0.844 -10.023   2.650
  317   2HD   LYS  45          2HD       LYS  45   1.255 -11.422   3.622
  318   1HE   LYS  45          1HE       LYS  45   3.659 -11.018   2.379
  319   2HE   LYS  45          2HE       LYS  45   3.058  -9.372   2.383
  320   1HZ   LYS  45          1HZ       LYS  45   4.152  -9.653   4.392
  321   2HZ   LYS  45          2HZ       LYS  45   2.575  -9.773   4.800
  322   3HZ   LYS  45          3HZ       LYS  45   3.495 -11.118   4.690
  323    H    LYS  46           H        LYS  46   3.290 -16.148   0.473
  324    HA   LYS  46           HA       LYS  46   3.858 -15.242  -2.228
  325   1HB   LYS  46          1HB       LYS  46   5.756 -15.752  -0.815
  326   2HB   LYS  46          2HB       LYS  46   5.127 -17.347  -0.455
  327   1HG   LYS  46          1HG       LYS  46   6.633 -17.849  -2.174
  328   2HG   LYS  46          2HG       LYS  46   5.146 -17.669  -3.084
  329   1HD   LYS  46          1HD       LYS  46   6.637 -16.333  -4.320
  330   2HD   LYS  46          2HD       LYS  46   5.840 -15.144  -3.309
  331   1HE   LYS  46          1HE       LYS  46   7.730 -15.274  -1.669
  332   2HE   LYS  46          2HE       LYS  46   8.527 -16.462  -2.682
  333   1HZ   LYS  46          1HZ       LYS  46   7.851 -13.723  -3.507
  334   2HZ   LYS  46          2HZ       LYS  46   9.341 -14.250  -3.095
  335   3HZ   LYS  46          3HZ       LYS  46   8.612 -14.829  -4.437
  336    H    ALA  47           H        ALA  47   1.959 -17.604  -0.461
  337    HA   ALA  47           HA       ALA  47   1.774 -19.675  -2.229
  338   1HB   ALA  47          1HB       ALA  47   0.738 -19.542   0.030
  339   2HB   ALA  47          2HB       ALA  47  -0.473 -18.407  -0.611
  340   3HB   ALA  47          3HB       ALA  47  -0.417 -20.081  -1.211
  341    H    ASP  48           H        ASP  48  -0.425 -16.773  -2.123
  342    HA   ASP  48           HA       ASP  48  -0.361 -16.629  -4.951
  343   1HB   ASP  48          1HB       ASP  48  -2.114 -18.476  -4.238
  344   2HB   ASP  48          2HB       ASP  48  -3.101 -17.117  -3.737
  345    H    CYS  49           H        CYS  49   0.441 -14.752  -3.101
  346    HA   CYS  49           HA       CYS  49  -1.695 -12.778  -3.275
  347   1HB   CYS  49          1HB       CYS  49  -0.008 -12.769  -0.816
  348   2HB   CYS  49          2HB       CYS  49  -1.618 -12.129  -1.078
  349    H    GLU  50           H        GLU  50   0.925 -13.598  -4.696
  350    HA   GLU  50           HA       GLU  50   2.754 -11.550  -3.968
  351   1HB   GLU  50          1HB       GLU  50   2.689 -13.878  -5.767
  352   2HB   GLU  50          2HB       GLU  50   3.499 -12.508  -6.501
  353   1HG   GLU  50          1HG       GLU  50   4.542 -12.448  -3.931
  354   2HG   GLU  50          2HG       GLU  50   4.325 -14.170  -4.177
  355    HA   PRO  51           HA       PRO  51   1.034  -9.729  -8.003
  356   1HB   PRO  51          1HB       PRO  51  -1.222 -10.793  -9.118
  357   2HB   PRO  51          2HB       PRO  51   0.396 -11.219  -9.638
  358   1HG   PRO  51          1HG       PRO  51  -1.498 -12.789  -7.998
  359   2HG   PRO  51          2HG       PRO  51  -0.083 -13.341  -8.873
  360   1HD   PRO  51          1HD       PRO  51  -0.297 -12.923  -6.043
  361   2HD   PRO  51          2HD       PRO  51   1.148 -13.363  -6.931
  362    H    GLN  52           H        GLN  52  -1.075 -10.813  -5.529
  363    HA   GLN  52           HA       GLN  52  -2.932  -8.713  -5.949
  364   1HB   GLN  52          1HB       GLN  52  -2.528 -10.478  -3.494
  365   2HB   GLN  52          2HB       GLN  52  -3.946  -9.508  -3.842
  366   1HG   GLN  52          1HG       GLN  52  -4.520 -10.856  -5.769
  367   2HG   GLN  52          2HG       GLN  52  -2.961 -11.656  -5.765
  368   1HE2  GLN  52          1HE2      GLN  52  -4.737 -13.411  -5.850
  369   2HE2  GLN  52          2HE2      GLN  52  -5.157 -14.147  -4.339
  370    H    ASP  53           H        ASP  53  -0.300  -9.410  -3.551
  371    HA   ASP  53           HA       ASP  53  -0.641  -7.137  -2.056
  372   1HB   ASP  53          1HB       ASP  53   0.893  -9.218  -1.697
  373   2HB   ASP  53          2HB       ASP  53   2.070  -8.374  -2.684
  374    H    LYS  54           H        LYS  54   1.080  -7.783  -5.138
  375    HA   LYS  54           HA       LYS  54   2.582  -5.422  -5.232
  376   1HB   LYS  54          1HB       LYS  54   1.657  -7.443  -7.260
  377   2HB   LYS  54          2HB       LYS  54   2.457  -5.976  -7.785
  378   1HG   LYS  54          1HG       LYS  54   4.349  -6.508  -6.162
  379   2HG   LYS  54          2HG       LYS  54   3.569  -8.042  -5.830
  380   1HD   LYS  54          1HD       LYS  54   3.603  -8.259  -8.506
  381   2HD   LYS  54          2HD       LYS  54   4.914  -7.105  -8.366
  382   1HE   LYS  54          1HE       LYS  54   5.476  -9.006  -6.359
  383   2HE   LYS  54          2HE       LYS  54   4.876  -9.971  -7.693
  384   1HZ   LYS  54          1HZ       LYS  54   6.457  -8.680  -9.105
  385   2HZ   LYS  54          2HZ       LYS  54   7.120  -8.088  -7.735
  386   3HZ   LYS  54          3HZ       LYS  54   7.153  -9.694  -8.030
  387    H    VAL  55           H        VAL  55  -0.567  -6.275  -6.840
  388    HA   VAL  55           HA       VAL  55  -1.082  -3.847  -7.965
  389    HB   VAL  55           HB       VAL  55  -2.943  -5.874  -6.717
  390   1HG1  VAL  55          1HG1      VAL  55  -3.775  -3.860  -8.804
  391   2HG1  VAL  55          2HG1      VAL  55  -4.789  -4.857  -7.733
  392   3HG1  VAL  55          3HG1      VAL  55  -3.875  -3.482  -7.068
  393   1HG2  VAL  55          1HG2      VAL  55  -2.983  -5.753  -9.596
  394   2HG2  VAL  55          2HG2      VAL  55  -1.308  -5.952  -9.027
  395   3HG2  VAL  55          3HG2      VAL  55  -2.560  -7.115  -8.530
  396    H    CYS  56           H        CYS  56  -1.502  -4.894  -4.556
  397    HA   CYS  56           HA       CYS  56  -2.883  -2.552  -3.793
  398   1HB   CYS  56          1HB       CYS  56  -3.171  -4.520  -2.492
  399   2HB   CYS  56          2HB       CYS  56  -1.446  -4.704  -2.243
  400    H    ASP  57           H        ASP  57   0.512  -3.761  -3.237
  401    HA   ASP  57           HA       ASP  57   1.595  -1.728  -1.966
  402   1HB   ASP  57          1HB       ASP  57   2.524  -3.736  -3.869
  403   2HB   ASP  57          2HB       ASP  57   3.448  -2.262  -4.074
  404    H    ALA  58           H        ALA  58   0.928  -1.914  -5.524
  405    HA   ALA  58           HA       ALA  58   2.134   0.448  -6.300
  406   1HB   ALA  58          1HB       ALA  58   1.448  -0.498  -8.220
  407   2HB   ALA  58          2HB       ALA  58   0.278  -1.524  -7.355
  408   3HB   ALA  58          3HB       ALA  58  -0.187   0.114  -7.872
  409    H    CYS  59           H        CYS  59  -1.390  -0.098  -5.558
  410    HA   CYS  59           HA       CYS  59  -2.233   2.454  -5.722
  411   1HB   CYS  59          1HB       CYS  59  -3.660   0.489  -5.304
  412   2HB   CYS  59          2HB       CYS  59  -3.092   0.426  -3.648
  413    H    ARG  60           H        ARG  60  -1.010   0.796  -2.714
  414    HA   ARG  60           HA       ARG  60  -1.077   2.989  -1.107
  415   1HB   ARG  60          1HB       ARG  60   0.847   0.612  -1.119
  416   2HB   ARG  60          2HB       ARG  60   0.771   1.765   0.198
  417   1HG   ARG  60          1HG       ARG  60  -1.917   1.095  -0.171
  418   2HG   ARG  60          2HG       ARG  60  -1.101  -0.421  -0.497
  419   1HD   ARG  60          1HD       ARG  60   0.201  -0.067   1.697
  420   2HD   ARG  60          2HD       ARG  60  -0.874   1.276   2.031
  421    HE   ARG  60           HE       ARG  60  -2.657  -0.238   2.403
  422   1HH1  ARG  60          2HH2      ARG  60   0.152  -1.927   1.122
  423   2HH1  ARG  60          1HH2      ARG  60  -0.478  -3.502   1.469
  424   1HH2  ARG  60          2HH1      ARG  60  -3.489  -2.316   2.861
  425   2HH2  ARG  60          1HH1      ARG  60  -2.563  -3.725   2.465
  426    H    MET  61           H        MET  61   1.426   1.890  -3.442
  427    HA   MET  61           HA       MET  61   3.388   3.698  -2.615
  428   1HB   MET  61          1HB       MET  61   4.137   1.860  -3.941
  429   2HB   MET  61          2HB       MET  61   2.821   2.024  -5.087
  430   1HG   MET  61          1HG       MET  61   3.952   3.564  -6.364
  431   2HG   MET  61          2HG       MET  61   4.572   4.419  -4.966
  432   1HE   MET  61          1HE       MET  61   4.766   1.054  -6.895
  433   2HE   MET  61          2HE       MET  61   5.524   2.302  -7.913
  434   3HE   MET  61          3HE       MET  61   6.508   0.975  -7.251
  435    H    LYS  62           H        LYS  62   1.054   3.760  -5.404
  436    HA   LYS  62           HA       LYS  62   1.830   6.287  -6.311
  437   1HB   LYS  62          1HB       LYS  62  -0.263   4.315  -6.866
  438   2HB   LYS  62          2HB       LYS  62  -0.821   5.963  -7.072
  439   1HG   LYS  62          1HG       LYS  62   0.112   5.315  -9.190
  440   2HG   LYS  62          2HG       LYS  62   1.277   6.407  -8.468
  441   1HD   LYS  62          1HD       LYS  62   2.550   4.396  -7.596
  442   2HD   LYS  62          2HD       LYS  62   1.425   3.356  -8.446
  443   1HE   LYS  62          1HE       LYS  62   2.148   5.064 -10.481
  444   2HE   LYS  62          2HE       LYS  62   3.622   5.065  -9.534
  445   1HZ   LYS  62          1HZ       LYS  62   2.238   2.664 -10.511
  446   2HZ   LYS  62          2HZ       LYS  62   3.613   3.292 -11.130
  447   3HZ   LYS  62          3HZ       LYS  62   3.608   2.662  -9.623
  448    H    CYS  63           H        CYS  63  -0.870   5.237  -4.130
  449    HA   CYS  63           HA       CYS  63  -2.015   7.668  -3.721
  450   1HB   CYS  63          1HB       CYS  63  -2.655   5.326  -2.853
  451   2HB   CYS  63          2HB       CYS  63  -1.633   5.696  -1.478
  452    H    HIS  64           H        HIS  64   0.882   6.180  -2.150
  453    HA   HIS  64           HA       HIS  64   1.349   7.966  -0.172
  454   1HB   HIS  64          1HB       HIS  64   2.687   5.854  -1.305
  455   2HB   HIS  64          2HB       HIS  64   3.760   7.186  -1.684
  456    HD1  HIS  64           1HD      HIS  64   5.491   7.564   0.063
  457    HD2  HIS  64           2HD      HIS  64   1.941   6.031   1.687
  458    HE1  HIS  64           1HE      HIS  64   5.914   7.278   2.563
  459    H    LYS  65           H        LYS  65   2.342   8.249  -3.647
  460    HA   LYS  65           HA       LYS  65   3.401  10.873  -3.200
  461   1HB   LYS  65          1HB       LYS  65   4.587   9.847  -4.859
  462   2HB   LYS  65          2HB       LYS  65   3.209   8.949  -5.462
  463   1HG   LYS  65          1HG       LYS  65   2.257  11.070  -6.414
  464   2HG   LYS  65          2HG       LYS  65   3.658  11.949  -5.834
  465   1HD   LYS  65          1HD       LYS  65   4.761  11.408  -7.736
  466   2HD   LYS  65          2HD       LYS  65   4.696   9.718  -7.276
  467   1HE   LYS  65          1HE       LYS  65   3.481   9.480  -9.208
  468   2HE   LYS  65          2HE       LYS  65   2.142  10.039  -8.225
  469   1HZ   LYS  65          1HZ       LYS  65   2.086  11.933  -9.337
  470   2HZ   LYS  65          2HZ       LYS  65   3.697  12.179  -9.246
  471   3HZ   LYS  65          3HZ       LYS  65   3.080  11.250 -10.439
  472    H    ALA  66           H        ALA  66   0.516   9.453  -4.875
  473    HA   ALA  66           HA       ALA  66  -0.613  11.738  -5.820
  474   1HB   ALA  66          1HB       ALA  66  -2.005  10.080  -6.437
  475   2HB   ALA  66          2HB       ALA  66  -1.441   9.031  -5.115
  476   3HB   ALA  66          3HB       ALA  66  -2.748  10.204  -4.825
  477    H    CYS  67           H        CYS  67  -0.428  10.553  -2.457
  478    HA   CYS  67           HA       CYS  67  -2.294  12.491  -1.508
  479   1HB   CYS  67          1HB       CYS  67  -1.583  10.147  -0.530
  480   2HB   CYS  67          2HB       CYS  67  -0.345  11.088   0.278
  481    H    ARG  68           H        ARG  68   1.256  12.094  -1.857
  482    HA   ARG  68           HA       ARG  68   2.023  14.184  -0.253
  483   1HB   ARG  68          1HB       ARG  68   3.610  12.521  -1.163
  484   2HB   ARG  68          2HB       ARG  68   3.307  13.073  -2.798
  485   1HG   ARG  68          1HG       ARG  68   4.046  15.446  -1.744
  486   2HG   ARG  68          2HG       ARG  68   4.877  14.410  -0.601
  487   1HD   ARG  68          1HD       ARG  68   6.534  14.077  -2.116
  488   2HD   ARG  68          2HD       ARG  68   5.389  13.311  -3.198
  489    HE   ARG  68           HE       ARG  68   6.296  16.124  -3.301
  490   1HH1  ARG  68          2HH2      ARG  68   4.032  13.704  -4.485
  491   2HH1  ARG  68          1HH2      ARG  68   3.625  14.599  -5.911
  492   1HH2  ARG  68          2HH1      ARG  68   5.759  17.304  -5.182
  493   2HH2  ARG  68          1HH1      ARG  68   4.614  16.660  -6.311
  494    H    ALA  69           H        ALA  69   1.205  14.063  -3.780
  495    HA   ALA  69           HA       ALA  69   1.725  16.839  -4.168
  496   1HB   ALA  69          1HB       ALA  69   0.631  14.535  -5.754
  497   2HB   ALA  69          2HB       ALA  69   0.310  16.188  -6.330
  498   3HB   ALA  69          3HB       ALA  69   1.987  15.629  -6.121
  499    H    ALA  70           H        ALA  70  -0.733  15.095  -2.578
  500    HA   ALA  70           HA       ALA  70  -2.963  16.659  -3.374
  501   1HB   ALA  70          1HB       ALA  70  -4.140  15.366  -1.821
  502   2HB   ALA  70          2HB       ALA  70  -2.794  14.287  -2.259
  503   3HB   ALA  70          3HB       ALA  70  -2.737  15.208  -0.737
  504    H    ASN  71           H        ASN  71  -1.222  16.494  -0.182
  505    HA   ASN  71           HA       ASN  71  -2.057  19.236   0.227
  506   1HB   ASN  71          1HB       ASN  71  -0.879  17.141   2.126
  507   2HB   ASN  71          2HB       ASN  71  -1.262  18.779   2.617
  508   1HD2  ASN  71          1HD2      ASN  71  -2.505  15.694   1.590
  509   2HD2  ASN  71          2HD2      ASN  71  -4.163  15.929   2.033
  510    H    CYS  72           H        CYS  72   0.833  17.120   0.956
  511    HA   CYS  72           HA       CYS  72   2.635  19.162   1.306
  512   1HB   CYS  72          1HB       CYS  72   3.108  16.355   0.284
  513   2HB   CYS  72          2HB       CYS  72   4.372  17.450   0.805
  514    H    ALA  73           H        ALA  73   4.679  19.356  -0.314
  515    HA   ALA  73           HA       ALA  73   4.411  18.987  -3.019
  516   1HB   ALA  73          1HB       ALA  73   3.085  20.615  -3.835
  517   2HB   ALA  73          2HB       ALA  73   2.531  20.879  -2.164
  518   3HB   ALA  73          3HB       ALA  73   3.867  21.853  -2.824
  519    H    SER  74           H        SER  74   5.289  21.513  -0.567
  520    HA   SER  74           HA       SER  74   7.817  21.810  -1.941
  521   1HB   SER  74          1HB       SER  74   6.095  23.543  -0.397
  522   2HB   SER  74          2HB       SER  74   7.657  23.475   0.395
  523    HG   SER  74           HG       SER  74   7.711  23.771  -2.425
  524    H    GLU  75           H        GLU  75   6.362  20.825   1.201
  525    HA   GLU  75           HA       GLU  75   8.612  20.594   2.696
  526   1HB   GLU  75          1HB       GLU  75   6.013  19.041   2.637
  527   2HB   GLU  75          2HB       GLU  75   7.270  18.593   3.773
  528   1HG   GLU  75          1HG       GLU  75   6.171  20.151   5.084
  529   2HG   GLU  75          2HG       GLU  75   7.278  21.239   4.270
  530    H    CYS  76           H        CYS  76   7.679  18.766  -0.125
  531    HA   CYS  76           HA       CYS  76   9.908  16.942   0.406
  532   1HB   CYS  76          1HB       CYS  76   7.602  16.086  -1.298
  533   2HB   CYS  76          2HB       CYS  76   8.784  15.112  -0.448
  534    HA   PRO  77           HA       PRO  77  10.947  19.124  -3.331
  535   1HB   PRO  77          1HB       PRO  77  13.653  18.793  -3.148
  536   2HB   PRO  77          2HB       PRO  77  12.802  20.143  -2.424
  537   1HG   PRO  77          1HG       PRO  77  13.941  17.751  -1.111
  538   2HG   PRO  77          2HG       PRO  77  13.478  19.282  -0.394
  539   1HD   PRO  77          1HD       PRO  77  12.015  16.817  -0.274
  540   2HD   PRO  77          2HD       PRO  77  11.498  18.373   0.343
  541    H    LYS  78           H        LYS  78  12.825  18.492  -5.127
  542    HA   LYS  78           HA       LYS  78  11.683  16.355  -6.432
  543   1HB   LYS  78          1HB       LYS  78  13.325  18.261  -7.199
  544   2HB   LYS  78          2HB       LYS  78  14.569  17.077  -6.853
  545   1HG   LYS  78          1HG       LYS  78  12.879  15.487  -8.265
  546   2HG   LYS  78          2HG       LYS  78  12.431  17.029  -8.966
  547   1HD   LYS  78          1HD       LYS  78  14.323  17.072 -10.215
  548   2HD   LYS  78          2HD       LYS  78  15.321  16.912  -8.784
  549   1HE   LYS  78          1HE       LYS  78  15.907  14.879  -9.650
  550   2HE   LYS  78          2HE       LYS  78  14.359  14.332  -9.038
  551   1HZ   LYS  78          1HZ       LYS  78  14.903  13.996 -11.484
  552   2HZ   LYS  78          2HZ       LYS  78  13.408  14.529 -11.102
  553   3HZ   LYS  78          3HZ       LYS  78  14.525  15.574 -11.673
  554    H    HIS  79           H        HIS  79  14.531  16.463  -4.217
  555    HA   HIS  79           HA       HIS  79  14.747  13.580  -4.440
  556   1HB   HIS  79          1HB       HIS  79  16.606  15.612  -4.173
  557   2HB   HIS  79          2HB       HIS  79  16.521  14.959  -2.549
  558    HD1  HIS  79           1HD      HIS  79  19.136  14.374  -3.483
  559    HD2  HIS  79           2HD      HIS  79  15.933  12.016  -4.816
  560    HE1  HIS  79           1HE      HIS  79  20.157  12.197  -4.335
  561    H    GLU  80           H        GLU  80  15.489  12.706  -1.982
  562    HA   GLU  80           HA       GLU  80  14.750  12.077  -0.041
  563   1HB   GLU  80          1HB       GLU  80  14.242  14.952  -0.043
  564   2HB   GLU  80          2HB       GLU  80  13.052  14.125   0.941
  565   1HG   GLU  80          1HG       GLU  80  15.084  14.765   2.253
  566   2HG   GLU  80          2HG       GLU  80  14.806  13.035   2.265
  567    H    HIS  81           H        HIS  81  13.191  10.563   0.409
  568    HA   HIS  81           HA       HIS  81  10.638  10.930  -0.968
  569   1HB   HIS  81          1HB       HIS  81  10.494   8.383  -0.494
  570   2HB   HIS  81          2HB       HIS  81  11.505   8.968  -1.801
  571    HD1  HIS  81           1HD      HIS  81  11.598   6.754   1.044
  572    HD2  HIS  81           2HD      HIS  81  14.377   9.246  -0.869
  573    HE1  HIS  81           1HE      HIS  81  13.905   5.935   1.762
  574    H    LYS  82           H        LYS  82  12.236  10.221   2.157
  575    HA   LYS  82           HA       LYS  82   9.670  10.799   3.443
  576   1HB   LYS  82          1HB       LYS  82  10.174   9.041   5.132
  577   2HB   LYS  82          2HB       LYS  82   9.828   8.413   3.533
  578   1HG   LYS  82          1HG       LYS  82  11.933   7.552   3.279
  579   2HG   LYS  82          2HG       LYS  82  12.702   8.986   3.928
  580   1HD   LYS  82          1HD       LYS  82  12.951   8.029   5.973
  581   2HD   LYS  82          2HD       LYS  82  11.253   7.600   6.048
  582   1HE   LYS  82          1HE       LYS  82  11.710   5.581   4.625
  583   2HE   LYS  82          2HE       LYS  82  13.409   6.006   4.579
  584   1HZ   LYS  82          1HZ       LYS  82  12.465   4.408   6.375
  585   2HZ   LYS  82          2HZ       LYS  82  13.678   5.440   6.737
  586   3HZ   LYS  82          3HZ       LYS  82  12.146   5.793   7.179
  587    H    SER  83           H        SER  83  11.084  12.926   3.147
  588    HA   SER  83           HA       SER  83  13.305  13.199   4.806
  589   1HB   SER  83          1HB       SER  83  13.096  14.808   3.087
  590   2HB   SER  83          2HB       SER  83  11.406  15.114   3.436
  591    HG   SER  83           HG       SER  83  13.235  16.701   4.174
  592    H    ASP  84           H        ASP  84  13.487  14.367   6.869
  593    HA   ASP  84           HA       ASP  84  11.827  13.532   8.790
  594   1HB   ASP  84          1HB       ASP  84  13.899  14.536   9.425
  595   2HB   ASP  84          2HB       ASP  84  13.554  16.015   8.549
  596    H    THR  85           H        THR  85  11.718  16.664   6.954
  597    HA   THR  85           HA       THR  85   9.406  17.622   8.320
  598    HB   THR  85           HB       THR  85  11.261  18.986   7.181
  599    HG1  THR  85           1HG      THR  85   8.514  19.287   6.194
  600   1HG2  THR  85          1HG2      THR  85  11.177  17.605   4.995
  601   2HG2  THR  85          2HG2      THR  85   9.615  18.395   4.674
  602   3HG2  THR  85          3HG2      THR  85  11.099  19.371   4.794
  603    H    CYS  86           H        CYS  86   9.985  16.057   5.115
  604    HA   CYS  86           HA       CYS  86   7.412  16.238   4.185
  605   1HB   CYS  86          1HB       CYS  86   9.443  15.470   2.935
  606   2HB   CYS  86          2HB       CYS  86   9.301  13.919   3.739
  607    H    ARG  87           H        ARG  87   8.968  13.363   5.807
  608    HA   ARG  87           HA       ARG  87   6.918  11.757   6.075
  609   1HB   ARG  87          1HB       ARG  87   8.982  12.489   8.204
  610   2HB   ARG  87          2HB       ARG  87   7.896  11.126   8.389
  611   1HG   ARG  87          1HG       ARG  87   8.785  10.472   5.958
  612   2HG   ARG  87          2HG       ARG  87  10.131  11.510   6.386
  613   1HD   ARG  87          1HD       ARG  87  10.810   9.341   7.113
  614   2HD   ARG  87          2HD       ARG  87  10.300  10.145   8.585
  615    HE   ARG  87           HE       ARG  87   8.163   8.644   7.228
  616   1HH1  ARG  87          2HH2      ARG  87  10.730   8.535   9.632
  617   2HH1  ARG  87          1HH2      ARG  87  10.058   7.181  10.475
  618   1HH2  ARG  87          2HH1      ARG  87   7.275   6.856   8.341
  619   2HH2  ARG  87          1HH1      ARG  87   8.079   6.219   9.736
  620    H    ALA  88           H        ALA  88   7.426  14.795   7.901
  621    HA   ALA  88           HA       ALA  88   5.282  14.318   9.725
  622   1HB   ALA  88          1HB       ALA  88   5.870  16.412  10.617
  623   2HB   ALA  88          2HB       ALA  88   7.411  15.805   9.966
  624   3HB   ALA  88          3HB       ALA  88   6.475  17.016   9.056
  625    H    CYS  89           H        CYS  89   5.751  16.748   7.052
  626    HA   CYS  89           HA       CYS  89   3.253  17.730   6.953
  627   1HB   CYS  89          1HB       CYS  89   4.915  18.678   5.579
  628   2HB   CYS  89          2HB       CYS  89   5.222  17.167   4.746
  629    H    MET  90           H        MET  90   4.504  14.789   5.214
  630    HA   MET  90           HA       MET  90   2.236  14.082   3.926
  631   1HB   MET  90          1HB       MET  90   4.439  12.435   5.262
  632   2HB   MET  90          2HB       MET  90   3.185  11.659   4.315
  633   1HG   MET  90          1HG       MET  90   4.783  13.971   3.154
  634   2HG   MET  90          2HG       MET  90   5.426  12.342   3.122
  635   1HE   MET  90          1HE       MET  90   3.321  10.281   1.025
  636   2HE   MET  90          2HE       MET  90   3.996  10.414   2.667
  637   3HE   MET  90          3HE       MET  90   2.249  10.630   2.402
  638    H    LYS  91           H        LYS  91   3.033  13.714   7.383
  639    HA   LYS  91           HA       LYS  91   0.728  12.034   7.840
  640   1HB   LYS  91          1HB       LYS  91   2.254  11.324   9.335
  641   2HB   LYS  91          2HB       LYS  91   3.150  12.829   9.305
  642   1HG   LYS  91          1HG       LYS  91   0.426  12.809  10.613
  643   2HG   LYS  91          2HG       LYS  91   1.767  12.080  11.474
  644   1HD   LYS  91          1HD       LYS  91   2.418  14.725  10.291
  645   2HD   LYS  91          2HD       LYS  91   1.136  14.790  11.483
  646   1HE   LYS  91          1HE       LYS  91   2.620  13.510  13.089
  647   2HE   LYS  91          2HE       LYS  91   3.909  13.575  11.903
  648   1HZ   LYS  91          1HZ       LYS  91   2.615  15.869  13.200
  649   2HZ   LYS  91          2HZ       LYS  91   4.158  15.369  13.394
  650   3HZ   LYS  91          3HZ       LYS  91   3.681  16.011  11.971
  651    H    THR  92           H        THR  92   1.842  15.401   8.537
  652    HA   THR  92           HA       THR  92  -0.190  16.318  10.069
  653    HB   THR  92           HB       THR  92   1.423  17.550   7.795
  654    HG1  THR  92           1HG      THR  92   2.255  18.580   9.865
  655   1HG2  THR  92          1HG2      THR  92  -0.237  19.197   7.806
  656   2HG2  THR  92          2HG2      THR  92  -0.819  18.737   9.425
  657   3HG2  THR  92          3HG2      THR  92   0.665  19.706   9.254
  658    H    ASN  93           H        ASN  93  -0.387  15.289   6.699
  659    HA   ASN  93           HA       ASN  93  -3.185  16.109   6.784
  660   1HB   ASN  93          1HB       ASN  93  -2.763  15.831   4.110
  661   2HB   ASN  93          2HB       ASN  93  -2.504  17.351   4.942
  662   1HD2  ASN  93          1HD2      ASN  93  -0.484  18.141   5.262
  663   2HD2  ASN  93          2HD2      ASN  93   0.958  17.459   4.585
  664    H    CYS  94           H        CYS  94  -0.810  13.869   5.146
  665    HA   CYS  94           HA       CYS  94  -2.905  11.876   4.926
  666   1HB   CYS  94          1HB       CYS  94  -1.076  12.602   3.135
  667   2HB   CYS  94          2HB       CYS  94  -0.121  11.391   3.968
  668    H    LYS  95           H        LYS  95  -0.535   9.823   4.955
  669    HA   LYS  95           HA       LYS  95  -0.251   9.729   7.878
  670   1HB   LYS  95          1HB       LYS  95  -1.835   8.055   7.325
  671   2HB   LYS  95          2HB       LYS  95  -0.930   7.532   5.919
  672   1HG   LYS  95          1HG       LYS  95   0.476   6.210   7.155
  673   2HG   LYS  95          2HG       LYS  95   0.651   7.407   8.422
  674   1HD   LYS  95          1HD       LYS  95  -1.817   6.771   9.068
  675   2HD   LYS  95          2HD       LYS  95  -1.558   5.350   8.077
  676   1HE   LYS  95          1HE       LYS  95  -0.353   4.347   9.720
  677   2HE   LYS  95          2HE       LYS  95   0.740   5.713   9.819
  678   1HZ   LYS  95          1HZ       LYS  95  -0.297   5.569  11.875
  679   2HZ   LYS  95          2HZ       LYS  95  -1.069   6.808  11.142
  680   3HZ   LYS  95          3HZ       LYS  95  -1.788   5.345  11.247
  Start of MODEL    8
    1   1H    ILE   1           H        ILE   1 -17.395  12.716   0.323
    2    HA   ILE   1           HA       ILE   1 -17.407  14.850   1.088
    3    HB   ILE   1           HB       ILE   1 -17.892  15.332   3.514
    4   1HG1  ILE   1          1HG1      ILE   1 -19.211  12.683   3.786
    5   2HG1  ILE   1          2HG1      ILE   1 -17.466  12.694   3.949
    6   1HG2  ILE   1          1HG2      ILE   1 -19.856  14.179   1.562
    7   2HG2  ILE   1          2HG2      ILE   1 -20.401  14.671   3.183
    8   3HG2  ILE   1          3HG2      ILE   1 -19.635  15.860   2.103
    9   1HD1  ILE   1          1HD1      ILE   1 -19.112  13.204   6.029
   10   2HD1  ILE   1          2HD1      ILE   1 -17.504  13.954   5.890
   11   3HD1  ILE   1          3HD1      ILE   1 -18.954  14.860   5.397
   12    H    SER   2           H        SER   2 -15.550  16.006   1.561
   13    HA   SER   2           HA       SER   2 -13.588  14.653   3.204
   14   1HB   SER   2          1HB       SER   2 -13.287  14.220   0.633
   15   2HB   SER   2          2HB       SER   2 -12.751  15.887   0.562
   16    HG   SER   2           HG       SER   2 -10.849  15.242   1.277
   17    H    GLU   3           H        GLU   3 -12.954  16.112   4.746
   18    HA   GLU   3           HA       GLU   3 -12.228  18.734   3.967
   19   1HB   GLU   3          1HB       GLU   3 -14.931  18.278   4.963
   20   2HB   GLU   3          2HB       GLU   3 -14.049  19.311   6.070
   21   1HG   GLU   3          1HG       GLU   3 -13.817  21.028   4.520
   22   2HG   GLU   3          2HG       GLU   3 -13.738  19.935   3.152
   23    H    PHE   4           H        PHE   4 -10.886  19.739   5.558
   24    HA   PHE   4           HA       PHE   4  -9.380  19.697   7.174
   25   1HB   PHE   4          1HB       PHE   4 -12.054  19.165   8.265
   26   2HB   PHE   4          2HB       PHE   4 -10.866  18.346   9.259
   27    HD1  PHE   4           1HD      PHE   4  -9.021  19.692  10.314
   28    HD2  PHE   4           2HD      PHE   4 -12.332  21.513   8.383
   29    HE1  PHE   4           1HE      PHE   4  -8.526  21.848  11.499
   30    HE2  PHE   4           2HE      PHE   4 -11.836  23.670   9.568
   31    HZ   PHE   4           HZ       PHE   4  -9.939  23.811  11.112
   32    H    ALA   5           H        ALA   5  -8.435  18.182   9.130
   33    HA   ALA   5           HA       ALA   5  -7.267  16.361   9.591
   34   1HB   ALA   5          1HB       ALA   5  -8.400  14.288   9.567
   35   2HB   ALA   5          2HB       ALA   5  -9.708  15.491   9.665
   36   3HB   ALA   5          3HB       ALA   5  -9.331  14.711   8.110
   37    HA   PRO   6           HA       PRO   6  -4.855  15.439   6.124
   38   1HB   PRO   6          1HB       PRO   6  -3.449  13.241   6.938
   39   2HB   PRO   6          2HB       PRO   6  -3.040  14.875   7.424
   40   1HG   PRO   6          1HG       PRO   6  -4.353  12.746   9.000
   41   2HG   PRO   6          2HG       PRO   6  -3.562  14.203   9.567
   42   1HD   PRO   6          1HD       PRO   6  -6.387  13.746   9.379
   43   2HD   PRO   6          2HD       PRO   6  -5.596  15.241   9.836
   44    H    VAL   7           H        VAL   7  -4.044  13.580   4.586
   45    HA   VAL   7           HA       VAL   7  -6.533  12.320   3.786
   46    HB   VAL   7           HB       VAL   7  -4.752  13.648   2.358
   47   1HG1  VAL   7          1HG1      VAL   7  -3.066  12.364   1.329
   48   2HG1  VAL   7          2HG1      VAL   7  -2.956  11.948   3.057
   49   3HG1  VAL   7          3HG1      VAL   7  -3.748  10.829   1.920
   50   1HG2  VAL   7          1HG2      VAL   7  -5.421  11.771   0.479
   51   2HG2  VAL   7          2HG2      VAL   7  -6.635  11.461   1.742
   52   3HG2  VAL   7          3HG2      VAL   7  -6.486  13.086   1.032
   53    H    ASP   8           H        ASP   8  -6.699  10.025   3.359
   54    HA   ASP   8           HA       ASP   8  -4.902   8.549   5.100
   55   1HB   ASP   8          1HB       ASP   8  -7.773   8.378   4.382
   56   2HB   ASP   8          2HB       ASP   8  -6.968   6.821   4.347
   57    H    CYS   9           H        CYS   9  -4.714   6.076   4.249
   58    HA   CYS   9           HA       CYS   9  -4.644   5.979   1.353
   59   1HB   CYS   9          1HB       CYS   9  -2.207   5.716   3.108
   60   2HB   CYS   9          2HB       CYS   9  -2.296   4.953   1.532
   61    H    LYS  10           H        LYS  10  -3.918   4.375   4.528
   62    HA   LYS  10           HA       LYS  10  -3.974   1.768   3.764
   63   1HB   LYS  10          1HB       LYS  10  -4.023   3.223   6.170
   64   2HB   LYS  10          2HB       LYS  10  -5.397   2.140   6.267
   65   1HG   LYS  10          1HG       LYS  10  -4.080   0.227   6.238
   66   2HG   LYS  10          2HG       LYS  10  -2.859   0.945   5.207
   67   1HD   LYS  10          1HD       LYS  10  -1.582   1.330   7.037
   68   2HD   LYS  10          2HD       LYS  10  -2.790   2.460   7.615
   69   1HE   LYS  10          1HE       LYS  10  -3.868   0.828   8.964
   70   2HE   LYS  10          2HE       LYS  10  -3.201  -0.513   8.053
   71   1HZ   LYS  10          1HZ       LYS  10  -1.913  -0.456   9.923
   72   2HZ   LYS  10          2HZ       LYS  10  -0.982   0.405   8.895
   73   3HZ   LYS  10          3HZ       LYS  10  -1.876   1.174  10.024
   74    H    GLY  11           H        GLY  11  -6.869   3.580   5.023
   75   1HA   GLY  11          1HA       GLY  11  -8.742   1.635   4.345
   76   2HA   GLY  11          2HA       GLY  11  -9.059   3.343   4.581
   77    H    GLN  12           H        GLN  12  -8.040   4.754   2.596
   78    HA   GLN  12           HA       GLN  12  -9.637   4.444   0.501
   79   1HB   GLN  12          1HB       GLN  12  -6.920   5.673   0.840
   80   2HB   GLN  12          2HB       GLN  12  -7.526   5.530  -0.798
   81   1HG   GLN  12          1HG       GLN  12  -9.237   6.717   1.422
   82   2HG   GLN  12          2HG       GLN  12  -8.098   7.702   0.526
   83   1HE2  GLN  12          1HE2      GLN  12  -8.537   8.360  -1.494
   84   2HE2  GLN  12          2HE2      GLN  12  -9.998   8.025  -2.362
   85    H    CYS  13           H        CYS  13  -6.643   2.638   1.156
   86    HA   CYS  13           HA       CYS  13  -6.704   1.454  -1.483
   87   1HB   CYS  13          1HB       CYS  13  -4.810   1.218   0.853
   88   2HB   CYS  13          2HB       CYS  13  -4.700   0.176  -0.552
   89    H    THR  14           H        THR  14  -9.038   0.708  -0.765
   90    HA   THR  14           HA       THR  14  -8.812  -1.782   0.790
   91    HB   THR  14           HB       THR  14 -11.045   0.246   0.332
   92    HG1  THR  14           1HG      THR  14 -10.493   0.589   2.462
   93   1HG2  THR  14          1HG2      THR  14 -12.662  -1.275   0.912
   94   2HG2  THR  14          2HG2      THR  14 -11.487  -2.531   0.450
   95   3HG2  THR  14          3HG2      THR  14 -11.615  -2.013   2.148
   96    H    THR  15           H        THR  15 -10.240  -0.300  -2.176
   97    HA   THR  15           HA       THR  15 -11.243  -2.751  -3.159
   98    HB   THR  15           HB       THR  15 -10.884   0.079  -4.039
   99    HG1  THR  15           1HG      THR  15 -12.897  -0.855  -3.281
  100   1HG2  THR  15          1HG2      THR  15 -11.499  -0.525  -6.404
  101   2HG2  THR  15          2HG2      THR  15  -9.846  -1.045  -5.998
  102   3HG2  THR  15          3HG2      THR  15 -11.171  -2.233  -6.030
  103    HA   PRO  16           HA       PRO  16  -7.142  -2.909  -5.475
  104   1HB   PRO  16          1HB       PRO  16  -5.063  -1.331  -4.667
  105   2HB   PRO  16          2HB       PRO  16  -6.132  -0.906  -5.990
  106   1HG   PRO  16          1HG       PRO  16  -6.051   0.192  -3.246
  107   2HG   PRO  16          2HG       PRO  16  -6.795   0.872  -4.679
  108   1HD   PRO  16          1HD       PRO  16  -8.133  -0.448  -2.512
  109   2HD   PRO  16          2HD       PRO  16  -8.861   0.129  -3.998
  110    H    CYS  17           H        CYS  17  -7.620  -2.915  -2.195
  111    HA   CYS  17           HA       CYS  17  -5.504  -4.925  -1.949
  112   1HB   CYS  17          1HB       CYS  17  -6.387  -2.968   0.182
  113   2HB   CYS  17          2HB       CYS  17  -5.236  -4.271   0.404
  114    H    GLU  18           H        GLU  18  -8.541  -4.827  -2.639
  115    HA   GLU  18           HA       GLU  18  -9.857  -5.866  -0.390
  116   1HB   GLU  18          1HB       GLU  18 -10.502  -5.124  -3.110
  117   2HB   GLU  18          2HB       GLU  18 -11.171  -6.713  -2.795
  118   1HG   GLU  18          1HG       GLU  18 -11.829  -5.418  -0.452
  119   2HG   GLU  18          2HG       GLU  18 -11.885  -4.081  -1.583
  120    HA   PRO  19           HA       PRO  19  -9.062 -10.021  -2.524
  121   1HB   PRO  19          1HB       PRO  19  -7.486 -10.158  -4.752
  122   2HB   PRO  19          2HB       PRO  19  -9.234 -10.062  -4.819
  123   1HG   PRO  19          1HG       PRO  19  -7.238  -7.956  -5.384
  124   2HG   PRO  19          2HG       PRO  19  -8.928  -8.019  -5.845
  125   1HD   PRO  19          1HD       PRO  19  -7.782  -6.455  -3.731
  126   2HD   PRO  19          2HD       PRO  19  -9.485  -6.608  -4.117
  127    H    LEU  20           H        LEU  20  -6.448  -7.764  -2.443
  128    HA   LEU  20           HA       LEU  20  -4.455  -9.712  -1.959
  129   1HB   LEU  20          1HB       LEU  20  -3.649  -7.739  -2.812
  130   2HB   LEU  20          2HB       LEU  20  -4.676  -6.741  -1.802
  131    HG   LEU  20           HG       LEU  20  -2.099  -6.863  -1.379
  132   1HD1  LEU  20          1HD1      LEU  20  -2.474  -5.886   0.632
  133   2HD1  LEU  20          2HD1      LEU  20  -4.154  -5.909   0.044
  134   3HD1  LEU  20          3HD1      LEU  20  -3.590  -7.162   1.176
  135   1HD2  LEU  20          1HD2      LEU  20  -1.211  -8.604  -0.203
  136   2HD2  LEU  20          2HD2      LEU  20  -2.767  -9.053   0.536
  137   3HD2  LEU  20          3HD2      LEU  20  -2.428  -9.485  -1.158
  138    H    THR  21           H        THR  21  -6.148  -7.352   0.230
  139    HA   THR  21           HA       THR  21  -5.075  -8.306   2.595
  140    HB   THR  21           HB       THR  21  -7.763  -7.004   1.918
  141    HG1  THR  21           1HG      THR  21  -6.435  -5.214   2.008
  142   1HG2  THR  21          1HG2      THR  21  -8.270  -6.984   4.146
  143   2HG2  THR  21          2HG2      THR  21  -6.921  -8.111   4.423
  144   3HG2  THR  21          3HG2      THR  21  -6.650  -6.355   4.531
  145    H    ALA  22           H        ALA  22  -8.144  -9.307   0.951
  146    HA   ALA  22           HA       ALA  22  -8.999 -11.114   2.814
  147   1HB   ALA  22          1HB       ALA  22  -9.247 -10.801  -0.159
  148   2HB   ALA  22          2HB       ALA  22  -9.817 -12.320   0.573
  149   3HB   ALA  22          3HB       ALA  22 -10.504 -10.765   1.100
  150    H    CYS  23           H        CYS  23  -6.500 -11.495   0.247
  151    HA   CYS  23           HA       CYS  23  -6.142 -14.225   0.528
  152   1HB   CYS  23          1HB       CYS  23  -5.190 -12.449  -1.174
  153   2HB   CYS  23          2HB       CYS  23  -3.824 -12.432  -0.077
  154    H    LYS  24           H        LYS  24  -4.313 -11.438   2.003
  155    HA   LYS  24           HA       LYS  24  -2.691 -12.986   3.635
  156   1HB   LYS  24          1HB       LYS  24  -3.374 -10.170   3.291
  157   2HB   LYS  24          2HB       LYS  24  -3.074 -10.566   4.972
  158   1HG   LYS  24          1HG       LYS  24  -0.904 -11.627   4.347
  159   2HG   LYS  24          2HG       LYS  24  -1.206 -11.269   2.658
  160   1HD   LYS  24          1HD       LYS  24  -0.413  -9.158   2.900
  161   2HD   LYS  24          2HD       LYS  24  -1.538  -8.834   4.204
  162   1HE   LYS  24          1HE       LYS  24   0.875 -10.539   4.819
  163   2HE   LYS  24          2HE       LYS  24   1.123  -8.818   4.602
  164   1HZ   LYS  24          1HZ       LYS  24   0.631  -9.007   6.813
  165   2HZ   LYS  24          2HZ       LYS  24  -0.839  -8.629   6.210
  166   3HZ   LYS  24          3HZ       LYS  24  -0.493 -10.174   6.611
  167    H    GLU  25           H        GLU  25  -5.935 -11.509   4.239
  168    HA   GLU  25           HA       GLU  25  -6.121 -12.187   6.880
  169   1HB   GLU  25          1HB       GLU  25  -7.843 -11.186   4.820
  170   2HB   GLU  25          2HB       GLU  25  -8.705 -12.490   5.611
  171   1HG   GLU  25          1HG       GLU  25  -7.269 -10.582   7.424
  172   2HG   GLU  25          2HG       GLU  25  -8.647  -9.928   6.561
  173    H    LYS  26           H        LYS  26  -7.705 -13.991   4.138
  174    HA   LYS  26           HA       LYS  26  -8.561 -16.163   5.438
  175   1HB   LYS  26          1HB       LYS  26  -8.399 -15.453   2.851
  176   2HB   LYS  26          2HB       LYS  26  -7.154 -16.685   2.863
  177   1HG   LYS  26          1HG       LYS  26  -8.691 -18.354   2.988
  178   2HG   LYS  26          2HG       LYS  26  -9.478 -17.612   4.367
  179   1HD   LYS  26          1HD       LYS  26 -11.083 -16.572   3.075
  180   2HD   LYS  26          2HD       LYS  26  -9.969 -16.239   1.764
  181   1HE   LYS  26          1HE       LYS  26 -10.416 -19.130   2.085
  182   2HE   LYS  26          2HE       LYS  26 -11.923 -18.274   1.829
  183   1HZ   LYS  26          1HZ       LYS  26 -11.379 -18.044  -0.275
  184   2HZ   LYS  26          2HZ       LYS  26 -10.000 -17.252   0.094
  185   3HZ   LYS  26          3HZ       LYS  26  -9.995 -18.879  -0.044
  186    H    CYS  27           H        CYS  27  -5.165 -15.400   4.585
  187    HA   CYS  27           HA       CYS  27  -4.176 -17.933   5.326
  188   1HB   CYS  27          1HB       CYS  27  -2.760 -15.267   5.115
  189   2HB   CYS  27          2HB       CYS  27  -1.971 -16.822   5.294
  190    H    ALA  28           H        ALA  28  -4.043 -14.651   6.912
  191    HA   ALA  28           HA       ALA  28  -2.900 -15.266   9.258
  192   1HB   ALA  28          1HB       ALA  28  -4.368 -13.447  10.219
  193   2HB   ALA  28          2HB       ALA  28  -3.562 -13.015   8.692
  194   3HB   ALA  28          3HB       ALA  28  -5.284 -13.464   8.693
  195    H    GLU  29           H        GLU  29  -6.413 -15.693   8.456
  196    HA   GLU  29           HA       GLU  29  -7.201 -16.634  10.886
  197   1HB   GLU  29          1HB       GLU  29  -8.166 -16.995   8.060
  198   2HB   GLU  29          2HB       GLU  29  -8.872 -18.022   9.293
  199   1HG   GLU  29          1HG       GLU  29  -8.762 -14.970   9.390
  200   2HG   GLU  29          2HG       GLU  29 -10.177 -15.919   8.982
  201    H    SER  30           H        SER  30  -6.130 -18.579   8.003
  202    HA   SER  30           HA       SER  30  -6.285 -21.014   9.289
  203   1HB   SER  30          1HB       SER  30  -5.466 -20.011   6.747
  204   2HB   SER  30          2HB       SER  30  -4.130 -20.981   7.335
  205    HG   SER  30           HG       SER  30  -6.632 -21.781   6.429
  206    H    CYS  31           H        CYS  31  -3.806 -18.462   9.280
  207    HA   CYS  31           HA       CYS  31  -1.997 -20.224  10.738
  208   1HB   CYS  31          1HB       CYS  31  -1.542 -17.513   9.477
  209   2HB   CYS  31          2HB       CYS  31  -0.343 -18.389  10.407
  210    H    GLU  32           H        GLU  32  -4.155 -19.793  12.276
  211    HA   GLU  32           HA       GLU  32  -3.994 -17.318  13.659
  212   1HB   GLU  32          1HB       GLU  32  -5.817 -19.573  13.492
  213   2HB   GLU  32          2HB       GLU  32  -5.505 -19.204  15.177
  214   1HG   GLU  32          1HG       GLU  32  -6.176 -17.001  13.189
  215   2HG   GLU  32          2HG       GLU  32  -7.442 -17.928  13.969
  216    H    THR  33           H        THR  33  -3.622 -20.775  14.753
  217    HA   THR  33           HA       THR  33  -1.827 -19.787  16.857
  218    HB   THR  33           HB       THR  33  -3.968 -21.134  17.374
  219    HG1  THR  33           1HG      THR  33  -1.394 -22.397  17.979
  220   1HG2  THR  33          1HG2      THR  33  -4.244 -23.160  16.358
  221   2HG2  THR  33          2HG2      THR  33  -2.698 -22.958  15.500
  222   3HG2  THR  33          3HG2      THR  33  -2.728 -23.709  17.114
  223    H    SER  34           H        SER  34  -0.579 -19.606  14.485
  224    HA   SER  34           HA       SER  34   0.829 -22.114  14.149
  225   1HB   SER  34          1HB       SER  34  -0.029 -20.090  12.360
  226   2HB   SER  34          2HB       SER  34   1.716 -19.937  12.409
  227    HG   SER  34           HG       SER  34   1.924 -21.771  11.319
  228    H    ALA  35           H        ALA  35   3.090 -22.311  14.524
  229    HA   ALA  35           HA       ALA  35   4.219 -21.013  16.588
  230   1HB   ALA  35          1HB       ALA  35   4.967 -22.987  14.878
  231   2HB   ALA  35          2HB       ALA  35   6.072 -21.693  14.356
  232   3HB   ALA  35          3HB       ALA  35   6.074 -22.235  16.052
  233    H    ASP  36           H        ASP  36   5.216 -20.272  13.170
  234    HA   ASP  36           HA       ASP  36   5.760 -17.579  14.114
  235   1HB   ASP  36          1HB       ASP  36   6.696 -19.096  11.633
  236   2HB   ASP  36          2HB       ASP  36   7.088 -17.417  11.946
  237    H    LYS  37           H        LYS  37   3.637 -16.643  13.876
  238    HA   LYS  37           HA       LYS  37   1.930 -17.146  11.742
  239   1HB   LYS  37          1HB       LYS  37   1.949 -15.585  14.102
  240   2HB   LYS  37          2HB       LYS  37   1.592 -14.477  12.792
  241   1HG   LYS  37          1HG       LYS  37  -0.040 -16.477  12.017
  242   2HG   LYS  37          2HG       LYS  37   0.036 -16.889  13.719
  243   1HD   LYS  37          1HD       LYS  37  -0.343 -14.028  13.499
  244   2HD   LYS  37          2HD       LYS  37  -1.514 -14.815  12.460
  245   1HE   LYS  37          1HE       LYS  37  -2.627 -15.821  14.229
  246   2HE   LYS  37          2HE       LYS  37  -1.165 -16.044  15.169
  247   1HZ   LYS  37          1HZ       LYS  37  -2.228 -13.362  14.710
  248   2HZ   LYS  37          2HZ       LYS  37  -2.823 -14.297  15.909
  249   3HZ   LYS  37          3HZ       LYS  37  -1.245 -13.879  15.907
  250    H    LYS  38           H        LYS  38   4.383 -14.532  12.253
  251    HA   LYS  38           HA       LYS  38   3.916 -13.069  10.002
  252   1HB   LYS  38          1HB       LYS  38   5.955 -13.310  11.976
  253   2HB   LYS  38          2HB       LYS  38   6.750 -13.276  10.415
  254   1HG   LYS  38          1HG       LYS  38   6.494 -10.978  11.118
  255   2HG   LYS  38          2HG       LYS  38   5.352 -11.238   9.815
  256   1HD   LYS  38          1HD       LYS  38   4.043 -10.123  11.434
  257   2HD   LYS  38          2HD       LYS  38   3.623 -11.805  11.692
  258   1HE   LYS  38          1HE       LYS  38   5.528 -11.841  13.465
  259   2HE   LYS  38          2HE       LYS  38   5.532 -10.093  13.338
  260   1HZ   LYS  38          1HZ       LYS  38   4.075 -10.835  15.075
  261   2HZ   LYS  38          2HZ       LYS  38   3.194 -10.109  13.907
  262   3HZ   LYS  38          3HZ       LYS  38   3.197 -11.737  14.034
  263    H    THR  39           H        THR  39   6.338 -15.773  10.268
  264    HA   THR  39           HA       THR  39   6.907 -15.885   7.553
  265    HB   THR  39           HB       THR  39   6.919 -18.137   9.631
  266    HG1  THR  39           1HG      THR  39   8.244 -16.563  10.507
  267   1HG2  THR  39          1HG2      THR  39   9.195 -17.858   7.785
  268   2HG2  THR  39          2HG2      THR  39   8.229 -19.305   8.159
  269   3HG2  THR  39          3HG2      THR  39   7.678 -18.166   6.908
  270    H    CYS  40           H        CYS  40   4.512 -17.842   9.446
  271    HA   CYS  40           HA       CYS  40   3.588 -19.432   7.498
  272   1HB   CYS  40          1HB       CYS  40   2.848 -19.191   9.943
  273   2HB   CYS  40          2HB       CYS  40   1.695 -18.007   9.360
  274    H    ARG  41           H        ARG  41   2.265 -16.124   8.281
  275    HA   ARG  41           HA       ARG  41   0.564 -15.980   6.163
  276   1HB   ARG  41          1HB       ARG  41   2.060 -13.889   7.780
  277   2HB   ARG  41          2HB       ARG  41   1.053 -13.381   6.439
  278   1HG   ARG  41          1HG       ARG  41  -0.843 -14.777   7.498
  279   2HG   ARG  41          2HG       ARG  41   0.180 -14.938   8.911
  280   1HD   ARG  41          1HD       ARG  41   0.017 -12.139   7.998
  281   2HD   ARG  41          2HD       ARG  41  -1.567 -12.799   8.355
  282    HE   ARG  41           HE       ARG  41  -0.058 -13.621  10.522
  283   1HH1  ARG  41          2HH2      ARG  41  -0.625 -10.497   9.005
  284   2HH1  ARG  41          1HH2      ARG  41  -0.418  -9.603  10.475
  285   1HH2  ARG  41          2HH1      ARG  41   0.215 -12.442  12.460
  286   2HH2  ARG  41          1HH1      ARG  41   0.063 -10.717  12.453
  287    H    ARG  42           H        ARG  42   3.963 -14.702   6.433
  288    HA   ARG  42           HA       ARG  42   4.234 -13.551   4.053
  289   1HB   ARG  42          1HB       ARG  42   6.047 -14.966   5.931
  290   2HB   ARG  42          2HB       ARG  42   6.666 -14.917   4.292
  291   1HG   ARG  42          1HG       ARG  42   7.464 -12.865   4.978
  292   2HG   ARG  42          2HG       ARG  42   5.871 -12.336   4.477
  293   1HD   ARG  42          1HD       ARG  42   5.035 -12.579   6.814
  294   2HD   ARG  42          2HD       ARG  42   6.605 -13.163   7.328
  295    HE   ARG  42           HE       ARG  42   7.403 -10.962   7.320
  296   1HH1  ARG  42          2HH2      ARG  42   4.428 -11.116   5.446
  297   2HH1  ARG  42          1HH2      ARG  42   4.316  -9.399   5.244
  298   1HH2  ARG  42          2HH1      ARG  42   7.255  -8.697   7.054
  299   2HH2  ARG  42          1HH1      ARG  42   5.934  -8.014   6.165
  300    H    ASN  43           H        ASN  43   4.909 -17.068   4.734
  301    HA   ASN  43           HA       ASN  43   5.523 -17.788   2.183
  302   1HB   ASN  43          1HB       ASN  43   4.702 -19.123   4.676
  303   2HB   ASN  43          2HB       ASN  43   4.084 -19.983   3.280
  304   1HD2  ASN  43          1HD2      ASN  43   5.938 -21.100   4.951
  305   2HD2  ASN  43          2HD2      ASN  43   7.461 -21.288   4.149
  306    H    CYS  44           H        CYS  44   2.336 -17.592   3.892
  307    HA   CYS  44           HA       CYS  44   0.821 -18.705   1.820
  308   1HB   CYS  44          1HB       CYS  44   0.226 -18.313   4.300
  309   2HB   CYS  44          2HB       CYS  44  -0.227 -16.695   3.801
  310    H    LYS  45           H        LYS  45   2.357 -15.592   2.347
  311    HA   LYS  45           HA       LYS  45   0.633 -14.083   0.667
  312   1HB   LYS  45          1HB       LYS  45   2.215 -13.288   2.555
  313   2HB   LYS  45          2HB       LYS  45   3.487 -13.380   1.353
  314   1HG   LYS  45          1HG       LYS  45   1.217 -12.042   0.158
  315   2HG   LYS  45          2HG       LYS  45   1.529 -11.300   1.715
  316   1HD   LYS  45          1HD       LYS  45   3.924 -11.860  -0.011
  317   2HD   LYS  45          2HD       LYS  45   2.850 -10.585  -0.552
  318   1HE   LYS  45          1HE       LYS  45   4.260  -9.354   0.838
  319   2HE   LYS  45          2HE       LYS  45   3.006  -9.777   1.986
  320   1HZ   LYS  45          1HZ       LYS  45   4.490 -11.842   2.331
  321   2HZ   LYS  45          2HZ       LYS  45   5.671 -10.898   1.713
  322   3HZ   LYS  45          3HZ       LYS  45   4.878 -10.434   3.063
  323    H    LYS  46           H        LYS  46   3.637 -15.994   0.242
  324    HA   LYS  46           HA       LYS  46   3.794 -15.187  -2.534
  325   1HB   LYS  46          1HB       LYS  46   5.526 -16.788  -0.664
  326   2HB   LYS  46          2HB       LYS  46   5.760 -16.908  -2.396
  327   1HG   LYS  46          1HG       LYS  46   5.471 -14.116  -1.415
  328   2HG   LYS  46          2HG       LYS  46   6.870 -14.951  -0.768
  329   1HD   LYS  46          1HD       LYS  46   6.240 -14.987  -3.747
  330   2HD   LYS  46          2HD       LYS  46   7.153 -13.678  -3.024
  331   1HE   LYS  46          1HE       LYS  46   8.350 -16.042  -2.005
  332   2HE   LYS  46          2HE       LYS  46   8.031 -16.394  -3.692
  333   1HZ   LYS  46          1HZ       LYS  46  10.136 -15.054  -2.865
  334   2HZ   LYS  46          2HZ       LYS  46   9.489 -14.853  -4.351
  335   3HZ   LYS  46          3HZ       LYS  46   9.138 -13.795  -3.158
  336    H    ALA  47           H        ALA  47   2.077 -17.446  -0.643
  337    HA   ALA  47           HA       ALA  47   2.169 -19.717  -2.262
  338   1HB   ALA  47          1HB       ALA  47   1.288 -19.801  -0.017
  339   2HB   ALA  47          2HB       ALA  47   0.046 -18.584  -0.400
  340   3HB   ALA  47          3HB       ALA  47  -0.040 -20.205  -1.130
  341    H    ASP  48           H        ASP  48  -0.242 -16.993  -2.161
  342    HA   ASP  48           HA       ASP  48  -0.455 -17.119  -4.988
  343   1HB   ASP  48          1HB       ASP  48  -2.067 -18.921  -3.824
  344   2HB   ASP  48          2HB       ASP  48  -3.071 -17.517  -3.526
  345    H    CYS  49           H        CYS  49   0.433 -15.058  -3.345
  346    HA   CYS  49           HA       CYS  49  -1.662 -13.107  -3.714
  347   1HB   CYS  49          1HB       CYS  49  -0.305 -12.998  -1.061
  348   2HB   CYS  49          2HB       CYS  49  -1.856 -12.352  -1.560
  349    H    GLU  50           H        GLU  50   0.868 -13.829  -5.040
  350    HA   GLU  50           HA       GLU  50   2.839 -12.031  -4.067
  351   1HB   GLU  50          1HB       GLU  50   2.621 -14.123  -6.124
  352   2HB   GLU  50          2HB       GLU  50   3.542 -12.745  -6.692
  353   1HG   GLU  50          1HG       GLU  50   4.596 -13.023  -4.169
  354   2HG   GLU  50          2HG       GLU  50   4.182 -14.690  -4.514
  355    HA   PRO  51           HA       PRO  51   1.303  -9.628  -7.867
  356   1HB   PRO  51          1HB       PRO  51  -1.051 -10.346  -9.055
  357   2HB   PRO  51          2HB       PRO  51   0.517 -10.864  -9.644
  358   1HG   PRO  51          1HG       PRO  51  -1.509 -12.418  -8.155
  359   2HG   PRO  51          2HG       PRO  51  -0.158 -13.002  -9.106
  360   1HD   PRO  51          1HD       PRO  51  -0.316 -12.877  -6.244
  361   2HD   PRO  51          2HD       PRO  51   1.076 -13.352  -7.198
  362    H    GLN  52           H        GLN  52  -1.103 -10.839  -5.678
  363    HA   GLN  52           HA       GLN  52  -2.678  -8.528  -5.784
  364   1HB   GLN  52          1HB       GLN  52  -2.443 -10.516  -3.485
  365   2HB   GLN  52          2HB       GLN  52  -3.798  -9.454  -3.815
  366   1HG   GLN  52          1HG       GLN  52  -4.127 -10.619  -6.034
  367   2HG   GLN  52          2HG       GLN  52  -2.828 -11.721  -5.620
  368   1HE2  GLN  52          1HE2      GLN  52  -4.489 -13.339  -5.922
  369   2HE2  GLN  52          2HE2      GLN  52  -5.543 -13.763  -4.614
  370    H    ASP  53           H        ASP  53  -0.209  -9.708  -3.391
  371    HA   ASP  53           HA       ASP  53  -0.331  -7.608  -1.683
  372   1HB   ASP  53          1HB       ASP  53   1.072  -9.794  -1.593
  373   2HB   ASP  53          2HB       ASP  53   2.279  -8.934  -2.529
  374    H    LYS  54           H        LYS  54   1.305  -7.959  -4.858
  375    HA   LYS  54           HA       LYS  54   2.907  -5.652  -4.664
  376   1HB   LYS  54          1HB       LYS  54   1.975  -7.421  -6.917
  377   2HB   LYS  54          2HB       LYS  54   2.850  -5.942  -7.254
  378   1HG   LYS  54          1HG       LYS  54   4.665  -6.725  -5.650
  379   2HG   LYS  54          2HG       LYS  54   3.812  -8.248  -5.498
  380   1HD   LYS  54          1HD       LYS  54   4.763  -9.005  -7.410
  381   2HD   LYS  54          2HD       LYS  54   4.061  -7.676  -8.311
  382   1HE   LYS  54          1HE       LYS  54   6.363  -6.805  -6.687
  383   2HE   LYS  54          2HE       LYS  54   6.800  -8.080  -7.807
  384   1HZ   LYS  54          1HZ       LYS  54   6.730  -6.605  -9.417
  385   2HZ   LYS  54          2HZ       LYS  54   5.155  -6.280  -9.133
  386   3HZ   LYS  54          3HZ       LYS  54   6.316  -5.418  -8.374
  387    H    VAL  55           H        VAL  55  -0.167  -6.245  -6.521
  388    HA   VAL  55           HA       VAL  55  -0.638  -3.751  -7.407
  389    HB   VAL  55           HB       VAL  55  -2.506  -5.850  -6.317
  390   1HG1  VAL  55          1HG1      VAL  55  -3.529  -3.549  -6.175
  391   2HG1  VAL  55          2HG1      VAL  55  -3.348  -3.431  -7.942
  392   3HG1  VAL  55          3HG1      VAL  55  -4.389  -4.690  -7.236
  393   1HG2  VAL  55          1HG2      VAL  55  -2.887  -6.404  -8.623
  394   2HG2  VAL  55          2HG2      VAL  55  -1.966  -4.985  -9.175
  395   3HG2  VAL  55          3HG2      VAL  55  -1.128  -6.329  -8.363
  396    H    CYS  56           H        CYS  56  -1.520  -5.023  -4.124
  397    HA   CYS  56           HA       CYS  56  -2.727  -2.782  -3.157
  398   1HB   CYS  56          1HB       CYS  56  -2.518  -5.034  -2.060
  399   2HB   CYS  56          2HB       CYS  56  -0.898  -4.586  -1.564
  400    H    ASP  57           H        ASP  57   0.766  -3.726  -2.689
  401    HA   ASP  57           HA       ASP  57   1.704  -1.584  -1.479
  402   1HB   ASP  57          1HB       ASP  57   2.848  -3.695  -2.733
  403   2HB   ASP  57          2HB       ASP  57   3.258  -2.460  -3.907
  404    H    ALA  58           H        ALA  58   1.213  -1.937  -5.068
  405    HA   ALA  58           HA       ALA  58   2.192   0.433  -5.953
  406   1HB   ALA  58          1HB       ALA  58  -0.327  -0.149  -7.261
  407   2HB   ALA  58          2HB       ALA  58   1.333  -0.387  -7.860
  408   3HB   ALA  58          3HB       ALA  58   0.539  -1.663  -6.906
  409    H    CYS  59           H        CYS  59  -1.169  -0.195  -4.722
  410    HA   CYS  59           HA       CYS  59  -2.150   2.330  -5.030
  411   1HB   CYS  59          1HB       CYS  59  -3.464   0.358  -4.371
  412   2HB   CYS  59          2HB       CYS  59  -2.733   0.394  -2.779
  413    H    ARG  60           H        ARG  60  -0.710   0.906  -1.994
  414    HA   ARG  60           HA       ARG  60  -0.663   3.191  -0.553
  415   1HB   ARG  60          1HB       ARG  60   1.343   0.881  -0.568
  416   2HB   ARG  60          2HB       ARG  60   1.288   2.098   0.692
  417   1HG   ARG  60          1HG       ARG  60  -1.282   1.439   0.839
  418   2HG   ARG  60          2HG       ARG  60  -0.769  -0.024   0.021
  419   1HD   ARG  60          1HD       ARG  60   1.101   0.530   2.170
  420   2HD   ARG  60          2HD       ARG  60  -0.527   0.615   2.814
  421    HE   ARG  60           HE       ARG  60  -0.831  -1.686   2.362
  422   1HH1  ARG  60          2HH2      ARG  60   2.168  -0.538   0.922
  423   2HH1  ARG  60          1HH2      ARG  60   2.755  -2.128   0.566
  424   1HH2  ARG  60          2HH1      ARG  60  -0.056  -3.785   1.893
  425   2HH2  ARG  60          1HH1      ARG  60   1.481  -3.987   1.121
  426    H    MET  61           H        MET  61   1.497   2.117  -3.169
  427    HA   MET  61           HA       MET  61   3.514   4.017  -2.573
  428   1HB   MET  61          1HB       MET  61   4.240   2.071  -3.768
  429   2HB   MET  61          2HB       MET  61   2.863   2.107  -4.851
  430   1HG   MET  61          1HG       MET  61   3.893   3.543  -6.314
  431   2HG   MET  61          2HG       MET  61   4.522   4.556  -5.029
  432   1HE   MET  61          1HE       MET  61   4.920   1.871  -7.462
  433   2HE   MET  61          2HE       MET  61   6.530   1.152  -7.221
  434   3HE   MET  61          3HE       MET  61   5.167   0.642  -6.197
  435    H    LYS  62           H        LYS  62   0.601   3.876  -4.634
  436    HA   LYS  62           HA       LYS  62   1.285   6.249  -6.076
  437   1HB   LYS  62          1HB       LYS  62  -0.487   4.114  -6.415
  438   2HB   LYS  62          2HB       LYS  62  -1.530   5.490  -6.118
  439   1HG   LYS  62          1HG       LYS  62  -1.215   6.064  -8.293
  440   2HG   LYS  62          2HG       LYS  62   0.413   6.536  -7.849
  441   1HD   LYS  62          1HD       LYS  62   0.199   3.624  -8.222
  442   2HD   LYS  62          2HD       LYS  62  -0.309   4.493  -9.656
  443   1HE   LYS  62          1HE       LYS  62   1.817   5.192 -10.131
  444   2HE   LYS  62          2HE       LYS  62   2.140   5.639  -8.468
  445   1HZ   LYS  62          1HZ       LYS  62   2.776   3.499  -7.959
  446   2HZ   LYS  62          2HZ       LYS  62   2.031   2.826  -9.247
  447   3HZ   LYS  62          3HZ       LYS  62   3.398   3.696  -9.457
  448    H    CYS  63           H        CYS  63  -1.204   5.404  -3.564
  449    HA   CYS  63           HA       CYS  63  -2.332   7.790  -3.180
  450   1HB   CYS  63          1HB       CYS  63  -2.822   5.665  -1.961
  451   2HB   CYS  63          2HB       CYS  63  -1.445   5.980  -0.925
  452    H    HIS  64           H        HIS  64   0.701   6.631  -1.521
  453    HA   HIS  64           HA       HIS  64   1.333   8.801  -0.087
  454   1HB   HIS  64          1HB       HIS  64   2.591   6.486  -0.786
  455   2HB   HIS  64          2HB       HIS  64   3.608   7.658  -1.600
  456    HD1  HIS  64           1HD      HIS  64   2.523   6.548   1.839
  457    HD2  HIS  64           2HD      HIS  64   5.149   9.312   0.090
  458    HE1  HIS  64           1HE      HIS  64   4.016   7.406   3.722
  459    H    LYS  65           H        LYS  65   2.707   8.302  -3.420
  460    HA   LYS  65           HA       LYS  65   3.640  10.871  -3.715
  461   1HB   LYS  65          1HB       LYS  65   2.812   8.722  -5.657
  462   2HB   LYS  65          2HB       LYS  65   3.331  10.291  -6.238
  463   1HG   LYS  65          1HG       LYS  65   5.375   9.922  -4.577
  464   2HG   LYS  65          2HG       LYS  65   4.914   8.235  -4.676
  465   1HD   LYS  65          1HD       LYS  65   4.970   9.491  -7.336
  466   2HD   LYS  65          2HD       LYS  65   6.513   9.651  -6.520
  467   1HE   LYS  65          1HE       LYS  65   6.719   7.257  -6.225
  468   2HE   LYS  65          2HE       LYS  65   5.044   6.984  -6.661
  469   1HZ   LYS  65          1HZ       LYS  65   5.561   7.035  -8.799
  470   2HZ   LYS  65          2HZ       LYS  65   6.495   8.368  -8.675
  471   3HZ   LYS  65          3HZ       LYS  65   7.126   6.897  -8.352
  472    H    ALA  66           H        ALA  66   0.454   9.491  -4.777
  473    HA   ALA  66           HA       ALA  66  -0.628  11.664  -5.958
  474   1HB   ALA  66          1HB       ALA  66  -2.699  10.583  -4.387
  475   2HB   ALA  66          2HB       ALA  66  -2.235  10.091  -6.034
  476   3HB   ALA  66          3HB       ALA  66  -1.552   9.243  -4.626
  477    H    CYS  67           H        CYS  67  -0.886  10.901  -2.408
  478    HA   CYS  67           HA       CYS  67  -2.189  13.103  -1.590
  479   1HB   CYS  67          1HB       CYS  67  -1.751  11.477   0.015
  480   2HB   CYS  67          2HB       CYS  67  -0.028  11.467  -0.304
  481    H    ARG  68           H        ARG  68   1.418  12.742  -1.946
  482    HA   ARG  68           HA       ARG  68   2.196  15.177  -1.200
  483   1HB   ARG  68          1HB       ARG  68   3.617  13.222  -2.082
  484   2HB   ARG  68          2HB       ARG  68   3.271  13.790  -3.704
  485   1HG   ARG  68          1HG       ARG  68   4.188  16.091  -2.938
  486   2HG   ARG  68          2HG       ARG  68   4.779  15.269  -1.508
  487   1HD   ARG  68          1HD       ARG  68   6.656  14.952  -2.810
  488   2HD   ARG  68          2HD       ARG  68   5.757  13.566  -3.393
  489    HE   ARG  68           HE       ARG  68   5.049  15.928  -4.904
  490   1HH1  ARG  68          2HH2      ARG  68   7.594  13.527  -4.533
  491   2HH1  ARG  68          1HH2      ARG  68   8.169  13.699  -6.157
  492   1HH2  ARG  68          2HH1      ARG  68   5.808  16.156  -7.048
  493   2HH2  ARG  68          1HH1      ARG  68   7.147  15.204  -7.597
  494    H    ALA  69           H        ALA  69   0.527  14.256  -4.216
  495    HA   ALA  69           HA       ALA  69   0.915  16.901  -5.347
  496   1HB   ALA  69          1HB       ALA  69  -0.756  14.630  -6.464
  497   2HB   ALA  69          2HB       ALA  69   0.036  15.962  -7.340
  498   3HB   ALA  69          3HB       ALA  69   1.017  14.662  -6.623
  499    H    ALA  70           H        ALA  70  -1.513  14.902  -3.673
  500    HA   ALA  70           HA       ALA  70  -3.692  16.628  -4.276
  501   1HB   ALA  70          1HB       ALA  70  -4.745  14.780  -3.559
  502   2HB   ALA  70          2HB       ALA  70  -3.205  14.097  -2.982
  503   3HB   ALA  70          3HB       ALA  70  -4.181  15.126  -1.906
  504    H    ASN  71           H        ASN  71  -2.641  15.813  -0.933
  505    HA   ASN  71           HA       ASN  71  -3.458  18.219   0.082
  506   1HB   ASN  71          1HB       ASN  71  -1.973  15.862   1.003
  507   2HB   ASN  71          2HB       ASN  71  -1.303  17.312   1.725
  508   1HD2  ASN  71          1HD2      ASN  71  -4.547  16.148   0.800
  509   2HD2  ASN  71          2HD2      ASN  71  -5.335  16.479   2.307
  510    H    CYS  72           H        CYS  72   0.000  17.064  -0.111
  511    HA   CYS  72           HA       CYS  72   1.037  19.659   0.121
  512   1HB   CYS  72          1HB       CYS  72   2.379  17.147  -0.900
  513   2HB   CYS  72          2HB       CYS  72   3.193  18.622  -0.419
  514    H    ALA  73           H        ALA  73   2.528  20.632  -1.654
  515    HA   ALA  73           HA       ALA  73   2.142  19.907  -4.340
  516   1HB   ALA  73          1HB       ALA  73   0.709  22.479  -3.691
  517   2HB   ALA  73          2HB       ALA  73   0.538  21.415  -5.107
  518   3HB   ALA  73          3HB       ALA  73  -0.153  20.930  -3.540
  519    H    SER  74           H        SER  74   2.435  22.884  -2.264
  520    HA   SER  74           HA       SER  74   4.516  23.843  -3.945
  521   1HB   SER  74          1HB       SER  74   2.866  24.848  -1.724
  522   2HB   SER  74          2HB       SER  74   4.533  25.370  -1.586
  523    HG   SER  74           HG       SER  74   4.426  26.358  -3.625
  524    H    GLU  75           H        GLU  75   4.185  22.122  -0.836
  525    HA   GLU  75           HA       GLU  75   6.825  22.571  -0.001
  526   1HB   GLU  75          1HB       GLU  75   4.613  20.668   0.786
  527   2HB   GLU  75          2HB       GLU  75   6.224  20.411   1.424
  528   1HG   GLU  75          1HG       GLU  75   5.123  21.805   3.032
  529   2HG   GLU  75          2HG       GLU  75   6.211  22.870   2.165
  530    H    CYS  76           H        CYS  76   5.477  20.669  -2.517
  531    HA   CYS  76           HA       CYS  76   8.026  19.313  -2.811
  532   1HB   CYS  76          1HB       CYS  76   5.592  17.673  -3.336
  533   2HB   CYS  76          2HB       CYS  76   7.226  17.170  -2.951
  534    HA   PRO  77           HA       PRO  77   6.725  21.108  -6.679
  535   1HB   PRO  77          1HB       PRO  77   9.229  21.556  -7.676
  536   2HB   PRO  77          2HB       PRO  77   8.366  22.723  -6.694
  537   1HG   PRO  77          1HG       PRO  77  10.624  20.972  -5.936
  538   2HG   PRO  77          2HG       PRO  77  10.036  22.414  -5.133
  539   1HD   PRO  77          1HD       PRO  77   9.599  19.698  -4.321
  540   2HD   PRO  77          2HD       PRO  77   8.916  21.134  -3.586
  541    H    LYS  78           H        LYS  78   9.712  19.251  -7.005
  542    HA   LYS  78           HA       LYS  78   8.284  17.126  -8.284
  543   1HB   LYS  78          1HB       LYS  78   8.289  18.587 -10.174
  544   2HB   LYS  78          2HB       LYS  78   9.967  19.027  -9.929
  545   1HG   LYS  78          1HG       LYS  78   9.954  17.408 -11.710
  546   2HG   LYS  78          2HG       LYS  78  10.583  16.576 -10.301
  547   1HD   LYS  78          1HD       LYS  78   8.358  15.579  -9.855
  548   2HD   LYS  78          2HD       LYS  78   7.661  16.474 -11.190
  549   1HE   LYS  78          1HE       LYS  78   8.949  15.241 -12.825
  550   2HE   LYS  78          2HE       LYS  78  10.000  14.563 -11.597
  551   1HZ   LYS  78          1HZ       LYS  78   8.521  12.890 -11.971
  552   2HZ   LYS  78          2HZ       LYS  78   7.808  13.613 -10.692
  553   3HZ   LYS  78          3HZ       LYS  78   7.239  13.875 -12.200
  554    H    HIS  79           H        HIS  79  11.556  18.700  -8.070
  555    HA   HIS  79           HA       HIS  79  12.819  16.170  -7.824
  556   1HB   HIS  79          1HB       HIS  79  13.641  18.598  -8.649
  557   2HB   HIS  79          2HB       HIS  79  14.217  18.666  -6.995
  558    HD1  HIS  79           1HD      HIS  79  16.694  18.306  -7.267
  559    HD2  HIS  79           2HD      HIS  79  14.422  15.474  -9.367
  560    HE1  HIS  79           1HE      HIS  79  18.352  16.595  -8.181
  561    H    GLU  80           H        GLU  80  14.609  16.217  -5.811
  562    HA   GLU  80           HA       GLU  80  14.921  15.945  -3.677
  563   1HB   GLU  80          1HB       GLU  80  12.582  17.873  -3.361
  564   2HB   GLU  80          2HB       GLU  80  13.520  17.274  -2.008
  565   1HG   GLU  80          1HG       GLU  80  15.066  18.432  -4.311
  566   2HG   GLU  80          2HG       GLU  80  14.147  19.561  -3.336
  567    H    HIS  81           H        HIS  81  11.314  16.092  -4.170
  568    HA   HIS  81           HA       HIS  81   9.756  14.562  -3.891
  569   1HB   HIS  81          1HB       HIS  81  11.930  12.525  -3.346
  570   2HB   HIS  81          2HB       HIS  81  10.263  12.198  -3.778
  571    HD1  HIS  81           1HD      HIS  81   9.854  11.772  -6.207
  572    HD2  HIS  81           2HD      HIS  81  13.331  14.028  -5.564
  573    HE1  HIS  81           1HE      HIS  81  10.939  12.081  -8.495
  574    H    LYS  82           H        LYS  82  12.421  13.826  -1.523
  575    HA   LYS  82           HA       LYS  82  10.385  14.049   0.581
  576   1HB   LYS  82          1HB       LYS  82  11.777  12.572   1.913
  577   2HB   LYS  82          2HB       LYS  82  11.380  11.817   0.383
  578   1HG   LYS  82          1HG       LYS  82  13.750  13.178  -0.210
  579   2HG   LYS  82          2HG       LYS  82  14.017  12.651   1.440
  580   1HD   LYS  82          1HD       LYS  82  12.808  10.453   0.026
  581   2HD   LYS  82          2HD       LYS  82  14.095  11.077  -0.987
  582   1HE   LYS  82          1HE       LYS  82  14.458  10.411   1.972
  583   2HE   LYS  82          2HE       LYS  82  14.816   9.284   0.679
  584   1HZ   LYS  82          1HZ       LYS  82  16.158  11.784   1.326
  585   2HZ   LYS  82          2HZ       LYS  82  16.805  10.315   1.025
  586   3HZ   LYS  82          3HZ       LYS  82  16.223  11.218  -0.205
  587    H    SER  83           H        SER  83  11.074  16.469  -0.284
  588    HA   SER  83           HA       SER  83  13.482  17.428   0.761
  589   1HB   SER  83          1HB       SER  83  12.550  18.747  -0.951
  590   2HB   SER  83          2HB       SER  83  10.934  18.672  -0.278
  591    HG   SER  83           HG       SER  83  11.560  20.124   1.393
  592    H    ASP  84           H        ASP  84  13.634  19.127   2.545
  593    HA   ASP  84           HA       ASP  84  12.871  18.135   4.916
  594   1HB   ASP  84          1HB       ASP  84  14.516  19.931   4.704
  595   2HB   ASP  84          2HB       ASP  84  13.308  21.035   4.079
  596    H    THR  85           H        THR  85  11.319  20.936   3.157
  597    HA   THR  85           HA       THR  85   9.134  21.155   4.909
  598    HB   THR  85           HB       THR  85  10.123  22.842   3.196
  599    HG1  THR  85           1HG      THR  85   8.168  23.461   4.125
  600   1HG2  THR  85          1HG2      THR  85   8.112  21.441   1.369
  601   2HG2  THR  85          2HG2      THR  85   9.153  22.829   0.970
  602   3HG2  THR  85          3HG2      THR  85   9.870  21.217   1.206
  603    H    CYS  86           H        CYS  86   9.574  19.355   1.816
  604    HA   CYS  86           HA       CYS  86   6.976  18.562   1.482
  605   1HB   CYS  86          1HB       CYS  86   8.867  18.238  -0.111
  606   2HB   CYS  86          2HB       CYS  86   9.440  16.914   0.883
  607    H    ARG  87           H        ARG  87   9.651  16.563   2.951
  608    HA   ARG  87           HA       ARG  87   8.167  14.571   3.913
  609   1HB   ARG  87          1HB       ARG  87  10.581  15.948   5.182
  610   2HB   ARG  87          2HB       ARG  87   9.938  14.436   5.794
  611   1HG   ARG  87          1HG       ARG  87  10.151  13.629   3.277
  612   2HG   ARG  87          2HG       ARG  87  11.249  14.985   3.115
  613   1HD   ARG  87          1HD       ARG  87  12.719  13.252   3.732
  614   2HD   ARG  87          2HD       ARG  87  12.406  14.016   5.278
  615    HE   ARG  87           HE       ARG  87  10.511  11.871   4.633
  616   1HH1  ARG  87          2HH2      ARG  87  13.617  12.643   6.095
  617   2HH1  ARG  87          1HH2      ARG  87  13.649  11.222   7.085
  618   1HH2  ARG  87          2HH1      ARG  87  10.552   9.996   5.939
  619   2HH2  ARG  87          1HH1      ARG  87  11.894   9.706   6.996
  620    H    ALA  88           H        ALA  88   8.753  17.787   5.453
  621    HA   ALA  88           HA       ALA  88   7.472  17.229   7.875
  622   1HB   ALA  88          1HB       ALA  88   7.244  19.820   7.849
  623   2HB   ALA  88          2HB       ALA  88   8.879  19.118   7.809
  624   3HB   ALA  88          3HB       ALA  88   8.138  19.734   6.313
  625    H    CYS  89           H        CYS  89   6.294  18.371   4.676
  626    HA   CYS  89           HA       CYS  89   3.692  18.941   5.602
  627   1HB   CYS  89          1HB       CYS  89   4.454  20.023   3.633
  628   2HB   CYS  89          2HB       CYS  89   4.866  18.505   2.859
  629    H    MET  90           H        MET  90   5.124  16.228   3.634
  630    HA   MET  90           HA       MET  90   2.833  14.700   3.591
  631   1HB   MET  90          1HB       MET  90   5.808  13.965   3.490
  632   2HB   MET  90          2HB       MET  90   4.543  12.798   3.161
  633   1HG   MET  90          1HG       MET  90   3.670  14.337   1.336
  634   2HG   MET  90          2HG       MET  90   5.041  15.391   1.620
  635   1HE   MET  90          1HE       MET  90   4.898  11.511  -0.683
  636   2HE   MET  90          2HE       MET  90   4.328  11.429   1.001
  637   3HE   MET  90          3HE       MET  90   3.584  12.579  -0.136
  638    H    LYS  91           H        LYS  91   5.251  15.194   6.122
  639    HA   LYS  91           HA       LYS  91   5.033  12.890   7.577
  640   1HB   LYS  91          1HB       LYS  91   6.650  14.551   8.147
  641   2HB   LYS  91          2HB       LYS  91   5.420  15.768   8.426
  642   1HG   LYS  91          1HG       LYS  91   5.420  15.153  10.610
  643   2HG   LYS  91          2HG       LYS  91   4.662  13.650  10.125
  644   1HD   LYS  91          1HD       LYS  91   7.664  13.894   9.870
  645   2HD   LYS  91          2HD       LYS  91   6.979  13.661  11.466
  646   1HE   LYS  91          1HE       LYS  91   5.600  11.777   9.910
  647   2HE   LYS  91          2HE       LYS  91   7.214  11.743   9.229
  648   1HZ   LYS  91          1HZ       LYS  91   7.565  10.382  10.944
  649   2HZ   LYS  91          2HZ       LYS  91   7.763  11.753  11.810
  650   3HZ   LYS  91          3HZ       LYS  91   6.334  10.963  11.847
  651    H    THR  92           H        THR  92   2.873  15.794   7.622
  652    HA   THR  92           HA       THR  92   0.999  14.250   9.271
  653    HB   THR  92           HB       THR  92   1.495  17.204   8.721
  654    HG1  THR  92           1HG      THR  92   1.528  17.006  11.122
  655   1HG2  THR  92          1HG2      THR  92  -1.013  15.828   9.729
  656   2HG2  THR  92          2HG2      THR  92  -0.500  17.355  10.486
  657   3HG2  THR  92          3HG2      THR  92  -0.867  17.304   8.745
  658    H    ASN  93           H        ASN  93   0.963  16.474   6.400
  659    HA   ASN  93           HA       ASN  93  -1.544  16.095   5.612
  660   1HB   ASN  93          1HB       ASN  93   1.031  16.291   3.994
  661   2HB   ASN  93          2HB       ASN  93  -0.516  16.188   3.177
  662   1HD2  ASN  93          1HD2      ASN  93   1.479  18.039   5.379
  663   2HD2  ASN  93          2HD2      ASN  93   0.654  19.556   5.243
  664    H    CYS  94           H        CYS  94   1.318  14.046   4.650
  665    HA   CYS  94           HA       CYS  94  -0.523  12.026   3.662
  666   1HB   CYS  94          1HB       CYS  94   2.493  12.164   3.467
  667   2HB   CYS  94          2HB       CYS  94   1.464  10.965   2.709
  668    H    LYS  95           H        LYS  95  -1.295  11.497   5.882
  669    HA   LYS  95           HA       LYS  95   0.168  10.878   8.048
  670   1HB   LYS  95          1HB       LYS  95  -2.461  10.253   7.031
  671   2HB   LYS  95          2HB       LYS  95  -1.816   8.865   7.883
  672   1HG   LYS  95          1HG       LYS  95  -1.218  11.345   9.332
  673   2HG   LYS  95          2HG       LYS  95  -2.939  11.197   9.035
  674   1HD   LYS  95          1HD       LYS  95  -1.552   8.710   9.975
  675   2HD   LYS  95          2HD       LYS  95  -1.668  10.010  11.144
  676   1HE   LYS  95          1HE       LYS  95  -4.236   9.930   9.986
  677   2HE   LYS  95          2HE       LYS  95  -3.784   8.241  10.108
  678   1HZ   LYS  95          1HZ       LYS  95  -3.010   9.419  12.460
  679   2HZ   LYS  95          2HZ       LYS  95  -4.505  10.000  12.157
  680   3HZ   LYS  95          3HZ       LYS  95  -4.257   8.388  12.237
  Start of MODEL    9
    1   1H    ILE   1           H        ILE   1 -14.665  16.946  17.168
    2    HA   ILE   1           HA       ILE   1 -12.412  16.757  17.756
    3    HB   ILE   1           HB       ILE   1 -12.926  13.781  17.761
    4   1HG1  ILE   1          1HG1      ILE   1 -11.961  14.602  20.251
    5   2HG1  ILE   1          2HG1      ILE   1 -13.116  15.845  19.813
    6   1HG2  ILE   1          1HG2      ILE   1 -10.404  14.716  18.899
    7   2HG2  ILE   1          2HG2      ILE   1 -10.732  13.386  17.761
    8   3HG2  ILE   1          3HG2      ILE   1 -10.546  15.050  17.156
    9   1HD1  ILE   1          1HD1      ILE   1 -13.905  12.973  19.353
   10   2HD1  ILE   1          2HD1      ILE   1 -13.904  13.596  21.021
   11   3HD1  ILE   1          3HD1      ILE   1 -14.921  14.371  19.782
   12    H    SER   2           H        SER   2 -12.625  17.842  15.660
   13    HA   SER   2           HA       SER   2 -12.924  16.555  13.285
   14   1HB   SER   2          1HB       SER   2 -11.684  19.116  14.192
   15   2HB   SER   2          2HB       SER   2 -11.199  18.572  12.598
   16    HG   SER   2           HG       SER   2 -13.619  19.643  13.439
   17    H    GLU   3           H        GLU   3  -9.811  17.434  14.960
   18    HA   GLU   3           HA       GLU   3  -7.818  16.579  14.877
   19   1HB   GLU   3          1HB       GLU   3  -9.555  14.262  14.506
   20   2HB   GLU   3          2HB       GLU   3  -8.033  14.018  13.673
   21   1HG   GLU   3          1HG       GLU   3  -6.775  14.541  15.742
   22   2HG   GLU   3          2HG       GLU   3  -8.266  14.911  16.586
   23    H    PHE   4           H        PHE   4  -5.977  16.412  13.455
   24    HA   PHE   4           HA       PHE   4  -6.036  17.738  11.153
   25   1HB   PHE   4          1HB       PHE   4  -4.354  15.765  12.529
   26   2HB   PHE   4          2HB       PHE   4  -4.236  15.496  10.801
   27    HD1  PHE   4           1HD      PHE   4  -3.803  17.671   9.367
   28    HD2  PHE   4           2HD      PHE   4  -2.944  17.313  13.507
   29    HE1  PHE   4           1HE      PHE   4  -2.150  19.552   9.187
   30    HE2  PHE   4           2HE      PHE   4  -1.291  19.194  13.327
   31    HZ   PHE   4           HZ       PHE   4  -0.914  20.290  11.169
   32    H    ALA   5           H        ALA   5  -6.359  14.124  11.392
   33    HA   ALA   5           HA       ALA   5  -7.279  12.643  10.032
   34   1HB   ALA   5          1HB       ALA   5  -9.149  13.375   8.570
   35   2HB   ALA   5          2HB       ALA   5  -9.282  14.049  10.212
   36   3HB   ALA   5          3HB       ALA   5  -8.706  15.072   8.874
   37    HA   PRO   6           HA       PRO   6  -4.252  13.318   6.845
   38   1HB   PRO   6          1HB       PRO   6  -3.212  10.791   6.869
   39   2HB   PRO   6          2HB       PRO   6  -2.591  12.093   7.865
   40   1HG   PRO   6          1HG       PRO   6  -4.260   9.785   8.659
   41   2HG   PRO   6          2HG       PRO   6  -3.291  10.839   9.670
   42   1HD   PRO   6          1HD       PRO   6  -6.142  10.896   9.369
   43   2HD   PRO   6          2HD       PRO   6  -5.163  12.022  10.288
   44    H    VAL   7           H        VAL   7  -4.030  12.751   4.631
   45    HA   VAL   7           HA       VAL   7  -6.449  12.134   3.461
   46    HB   VAL   7           HB       VAL   7  -3.659  11.746   2.359
   47   1HG1  VAL   7          1HG1      VAL   7  -4.573  11.272   0.375
   48   2HG1  VAL   7          2HG1      VAL   7  -6.132  11.097   1.216
   49   3HG1  VAL   7          3HG1      VAL   7  -5.686  12.657   0.484
   50   1HG2  VAL   7          1HG2      VAL   7  -3.593  13.962   2.978
   51   2HG2  VAL   7          2HG2      VAL   7  -4.320  14.106   1.360
   52   3HG2  VAL   7          3HG2      VAL   7  -5.352  14.180   2.808
   53    H    ASP   8           H        ASP   8  -4.023  10.057   4.922
   54    HA   ASP   8           HA       ASP   8  -3.923   7.917   5.246
   55   1HB   ASP   8          1HB       ASP   8  -6.843   8.282   4.636
   56   2HB   ASP   8          2HB       ASP   8  -6.242   6.636   4.606
   57    H    CYS   9           H        CYS   9  -3.670   5.802   4.060
   58    HA   CYS   9           HA       CYS   9  -4.175   5.999   1.197
   59   1HB   CYS   9          1HB       CYS   9  -1.504   5.580   2.507
   60   2HB   CYS   9          2HB       CYS   9  -1.844   4.868   0.943
   61    H    LYS  10           H        LYS  10  -2.905   3.988   3.949
   62    HA   LYS  10           HA       LYS  10  -3.228   1.508   2.918
   63   1HB   LYS  10          1HB       LYS  10  -2.594   2.556   5.361
   64   2HB   LYS  10          2HB       LYS  10  -4.135   1.802   5.718
   65   1HG   LYS  10          1HG       LYS  10  -3.341  -0.339   5.347
   66   2HG   LYS  10          2HG       LYS  10  -2.273   0.161   4.050
   67   1HD   LYS  10          1HD       LYS  10  -0.556   0.832   5.532
   68   2HD   LYS  10          2HD       LYS  10  -1.658   1.052   6.877
   69   1HE   LYS  10          1HE       LYS  10  -0.793  -0.980   7.540
   70   2HE   LYS  10          2HE       LYS  10  -2.040  -1.607   6.481
   71   1HZ   LYS  10          1HZ       LYS  10  -0.531  -2.097   4.883
   72   2HZ   LYS  10          2HZ       LYS  10   0.524  -0.925   5.308
   73   3HZ   LYS  10          3HZ       LYS  10   0.425  -2.294   6.193
   74    H    GLY  11           H        GLY  11  -5.758   3.030   5.039
   75   1HA   GLY  11          1HA       GLY  11  -7.797   1.288   4.520
   76   2HA   GLY  11          2HA       GLY  11  -8.005   2.985   4.904
   77    H    GLN  12           H        GLN  12  -7.371   4.505   2.864
   78    HA   GLN  12           HA       GLN  12  -9.327   4.328   1.081
   79   1HB   GLN  12          1HB       GLN  12  -6.643   5.607   1.110
   80   2HB   GLN  12          2HB       GLN  12  -7.342   5.436  -0.488
   81   1HG   GLN  12          1HG       GLN  12  -9.010   6.539   1.797
   82   2HG   GLN  12          2HG       GLN  12  -7.898   7.583   0.935
   83   1HE2  GLN  12          1HE2      GLN  12  -8.708   8.652  -0.688
   84   2HE2  GLN  12          2HE2      GLN  12 -10.045   8.198  -1.690
   85    H    CYS  13           H        CYS  13  -6.180   2.615   0.947
   86    HA   CYS  13           HA       CYS  13  -6.753   1.575  -1.668
   87   1HB   CYS  13          1HB       CYS  13  -4.505   1.084   0.290
   88   2HB   CYS  13          2HB       CYS  13  -4.640   0.257  -1.249
   89    H    THR  14           H        THR  14  -8.950   0.829  -0.502
   90    HA   THR  14           HA       THR  14  -8.547  -1.704   0.902
   91    HB   THR  14           HB       THR  14 -10.818   0.285   0.536
   92    HG1  THR  14           1HG      THR  14  -9.266   0.435   2.316
   93   1HG2  THR  14          1HG2      THR  14 -12.354  -1.409   0.673
   94   2HG2  THR  14          2HG2      THR  14 -11.071  -2.630   0.855
   95   3HG2  THR  14          3HG2      THR  14 -11.684  -1.762   2.283
   96    H    THR  15           H        THR  15  -9.694  -0.338  -2.178
   97    HA   THR  15           HA       THR  15 -10.864  -2.793  -3.053
   98    HB   THR  15           HB       THR  15 -10.368  -0.019  -4.057
   99    HG1  THR  15           1HG      THR  15 -12.473  -0.591  -3.430
  100   1HG2  THR  15          1HG2      THR  15  -9.387  -1.207  -5.967
  101   2HG2  THR  15          2HG2      THR  15 -10.665  -2.444  -5.902
  102   3HG2  THR  15          3HG2      THR  15 -11.062  -0.779  -6.391
  103    HA   PRO  16           HA       PRO  16  -6.707  -3.177  -5.240
  104   1HB   PRO  16          1HB       PRO  16  -4.600  -1.636  -4.432
  105   2HB   PRO  16          2HB       PRO  16  -5.615  -1.229  -5.801
  106   1HG   PRO  16          1HG       PRO  16  -5.576  -0.027  -3.101
  107   2HG   PRO  16          2HG       PRO  16  -6.255   0.620  -4.581
  108   1HD   PRO  16          1HD       PRO  16  -7.699  -0.569  -2.407
  109   2HD   PRO  16          2HD       PRO  16  -8.364  -0.027  -3.935
  110    H    CYS  17           H        CYS  17  -7.035  -2.784  -1.888
  111    HA   CYS  17           HA       CYS  17  -5.096  -4.954  -1.537
  112   1HB   CYS  17          1HB       CYS  17  -5.932  -3.023   0.622
  113   2HB   CYS  17          2HB       CYS  17  -4.603  -4.165   0.642
  114    H    GLU  18           H        GLU  18  -8.061  -4.901  -2.311
  115    HA   GLU  18           HA       GLU  18  -9.428  -5.738   0.027
  116   1HB   GLU  18          1HB       GLU  18 -10.114  -4.924  -2.615
  117   2HB   GLU  18          2HB       GLU  18 -10.733  -6.555  -2.443
  118   1HG   GLU  18          1HG       GLU  18 -11.386  -5.345   0.012
  119   2HG   GLU  18          2HG       GLU  18 -11.647  -4.065  -1.156
  120    HA   PRO  19           HA       PRO  19  -8.784  -9.958  -2.049
  121   1HB   PRO  19          1HB       PRO  19  -7.068 -10.189  -4.164
  122   2HB   PRO  19          2HB       PRO  19  -8.801 -10.006  -4.351
  123   1HG   PRO  19          1HG       PRO  19  -6.669  -8.006  -4.786
  124   2HG   PRO  19          2HG       PRO  19  -8.324  -7.988  -5.361
  125   1HD   PRO  19          1HD       PRO  19  -7.249  -6.468  -3.179
  126   2HD   PRO  19          2HD       PRO  19  -8.926  -6.539  -3.680
  127    H    LEU  20           H        LEU  20  -5.953  -7.915  -2.035
  128    HA   LEU  20           HA       LEU  20  -4.135  -9.914  -1.353
  129   1HB   LEU  20          1HB       LEU  20  -3.080  -8.044  -2.043
  130   2HB   LEU  20          2HB       LEU  20  -4.250  -6.962  -1.313
  131    HG   LEU  20           HG       LEU  20  -3.198  -7.681   0.948
  132   1HD1  LEU  20          1HD1      LEU  20  -1.436  -9.031   0.979
  133   2HD1  LEU  20          2HD1      LEU  20  -1.694  -9.325  -0.758
  134   3HD1  LEU  20          3HD1      LEU  20  -0.583  -8.039  -0.227
  135   1HD2  LEU  20          1HD2      LEU  20  -1.982  -5.753   0.948
  136   2HD2  LEU  20          2HD2      LEU  20  -1.262  -6.067  -0.649
  137   3HD2  LEU  20          3HD2      LEU  20  -2.941  -5.491  -0.528
  138    H    THR  21           H        THR  21  -5.624  -7.424   0.844
  139    HA   THR  21           HA       THR  21  -4.808  -8.397   3.223
  140    HB   THR  21           HB       THR  21  -7.361  -7.065   2.253
  141    HG1  THR  21           1HG      THR  21  -5.871  -5.478   2.649
  142   1HG2  THR  21          1HG2      THR  21  -7.540  -6.554   4.862
  143   2HG2  THR  21          2HG2      THR  21  -8.301  -8.023   4.204
  144   3HG2  THR  21          3HG2      THR  21  -6.724  -8.127   5.024
  145    H    ALA  22           H        ALA  22  -7.905  -9.434   1.631
  146    HA   ALA  22           HA       ALA  22  -8.573 -11.364   3.451
  147   1HB   ALA  22          1HB       ALA  22  -9.144 -12.188   0.711
  148   2HB   ALA  22          2HB       ALA  22 -10.260 -11.642   1.986
  149   3HB   ALA  22          3HB       ALA  22  -9.449 -10.450   0.942
  150    H    CYS  23           H        CYS  23  -6.244 -11.501   0.716
  151    HA   CYS  23           HA       CYS  23  -5.825 -14.207   0.654
  152   1HB   CYS  23          1HB       CYS  23  -4.865 -12.196  -0.758
  153   2HB   CYS  23          2HB       CYS  23  -3.509 -12.337   0.344
  154    H    LYS  24           H        LYS  24  -3.966 -11.674   2.505
  155    HA   LYS  24           HA       LYS  24  -2.419 -13.491   3.939
  156   1HB   LYS  24          1HB       LYS  24  -3.199 -10.608   4.367
  157   2HB   LYS  24          2HB       LYS  24  -2.204 -11.462   5.530
  158   1HG   LYS  24          1HG       LYS  24  -0.531 -11.981   3.793
  159   2HG   LYS  24          2HG       LYS  24  -1.553 -11.286   2.551
  160   1HD   LYS  24          1HD       LYS  24  -0.691  -9.231   2.957
  161   2HD   LYS  24          2HD       LYS  24  -1.253  -9.302   4.615
  162   1HE   LYS  24          1HE       LYS  24   1.148  -8.987   4.692
  163   2HE   LYS  24          2HE       LYS  24   0.831 -10.632   5.206
  164   1HZ   LYS  24          1HZ       LYS  24   1.458  -9.965   2.422
  165   2HZ   LYS  24          2HZ       LYS  24   2.612 -10.334   3.516
  166   3HZ   LYS  24          3HZ       LYS  24   1.475 -11.439   3.124
  167    H    GLU  25           H        GLU  25  -5.472 -11.755   4.862
  168    HA   GLU  25           HA       GLU  25  -5.737 -12.763   7.351
  169   1HB   GLU  25          1HB       GLU  25  -7.378 -11.401   5.454
  170   2HB   GLU  25          2HB       GLU  25  -8.335 -12.744   6.049
  171   1HG   GLU  25          1HG       GLU  25  -6.809 -11.207   8.121
  172   2HG   GLU  25          2HG       GLU  25  -8.127 -10.348   7.350
  173    H    LYS  26           H        LYS  26  -7.366 -14.158   4.403
  174    HA   LYS  26           HA       LYS  26  -8.424 -16.380   5.442
  175   1HB   LYS  26          1HB       LYS  26  -8.223 -15.459   2.978
  176   2HB   LYS  26          2HB       LYS  26  -6.918 -16.622   2.856
  177   1HG   LYS  26          1HG       LYS  26  -8.334 -18.442   2.994
  178   2HG   LYS  26          2HG       LYS  26  -9.406 -17.662   4.138
  179   1HD   LYS  26          1HD       LYS  26 -10.685 -16.643   2.475
  180   2HD   LYS  26          2HD       LYS  26  -9.341 -16.522   1.357
  181   1HE   LYS  26          1HE       LYS  26  -9.436 -18.995   0.973
  182   2HE   LYS  26          2HE       LYS  26 -10.779 -19.118   2.092
  183   1HZ   LYS  26          1HZ       LYS  26 -11.755 -17.307   0.522
  184   2HZ   LYS  26          2HZ       LYS  26 -10.724 -17.961  -0.562
  185   3HZ   LYS  26          3HZ       LYS  26 -11.866 -18.892   0.142
  186    H    CYS  27           H        CYS  27  -4.948 -15.852   4.673
  187    HA   CYS  27           HA       CYS  27  -4.224 -18.508   5.319
  188   1HB   CYS  27          1HB       CYS  27  -2.789 -15.971   4.700
  189   2HB   CYS  27          2HB       CYS  27  -1.898 -17.216   5.552
  190    H    ALA  28           H        ALA  28  -3.810 -15.285   6.972
  191    HA   ALA  28           HA       ALA  28  -2.670 -16.057   9.286
  192   1HB   ALA  28          1HB       ALA  28  -4.146 -13.825   8.286
  193   2HB   ALA  28          2HB       ALA  28  -4.776 -14.199   9.909
  194   3HB   ALA  28          3HB       ALA  28  -3.040 -13.878   9.680
  195    H    GLU  29           H        GLU  29  -6.198 -16.207   8.476
  196    HA   GLU  29           HA       GLU  29  -6.948 -17.200  10.958
  197   1HB   GLU  29          1HB       GLU  29  -8.213 -17.232   8.203
  198   2HB   GLU  29          2HB       GLU  29  -8.991 -18.052   9.542
  199   1HG   GLU  29          1HG       GLU  29  -8.089 -15.152   9.762
  200   2HG   GLU  29          2HG       GLU  29  -9.653 -15.575   9.095
  201    H    SER  30           H        SER  30  -5.875 -18.779   7.914
  202    HA   SER  30           HA       SER  30  -6.330 -21.365   9.094
  203   1HB   SER  30          1HB       SER  30  -6.274 -20.335   6.448
  204   2HB   SER  30          2HB       SER  30  -4.887 -21.401   6.555
  205    HG   SER  30           HG       SER  30  -7.654 -22.051   7.091
  206    H    CYS  31           H        CYS  31  -4.282 -19.356  10.137
  207    HA   CYS  31           HA       CYS  31  -2.169 -21.243  10.431
  208   1HB   CYS  31          1HB       CYS  31  -1.833 -18.900   8.623
  209   2HB   CYS  31          2HB       CYS  31  -0.514 -19.269   9.716
  210    H    GLU  32           H        GLU  32  -4.184 -19.953  12.090
  211    HA   GLU  32           HA       GLU  32  -2.862 -17.794  13.412
  212   1HB   GLU  32          1HB       GLU  32  -5.538 -18.838  13.245
  213   2HB   GLU  32          2HB       GLU  32  -5.085 -18.813  14.937
  214   1HG   GLU  32          1HG       GLU  32  -4.201 -16.383  14.432
  215   2HG   GLU  32          2HG       GLU  32  -5.180 -16.491  12.982
  216    H    THR  33           H        THR  33  -4.105 -21.051  14.474
  217    HA   THR  33           HA       THR  33  -2.897 -21.112  16.937
  218    HB   THR  33           HB       THR  33  -3.152 -23.604  16.659
  219    HG1  THR  33           1HG      THR  33  -2.469 -23.741  14.441
  220   1HG2  THR  33          1HG2      THR  33  -5.230 -21.700  16.469
  221   2HG2  THR  33          2HG2      THR  33  -5.521 -22.802  15.102
  222   3HG2  THR  33          3HG2      THR  33  -5.436 -23.443  16.760
  223    H    SER  34           H        SER  34  -1.414 -21.393  13.754
  224    HA   SER  34           HA       SER  34   0.798 -22.815  14.262
  225   1HB   SER  34          1HB       SER  34  -0.022 -21.384  12.164
  226   2HB   SER  34          2HB       SER  34   1.099 -20.194  12.794
  227    HG   SER  34           HG       SER  34   1.675 -22.896  11.946
  228    H    ALA  35           H        ALA  35   2.831 -22.491  15.265
  229    HA   ALA  35           HA       ALA  35   2.891 -20.757  17.449
  230   1HB   ALA  35          1HB       ALA  35   5.095 -22.244  15.966
  231   2HB   ALA  35          2HB       ALA  35   5.295 -21.461  17.552
  232   3HB   ALA  35          3HB       ALA  35   4.168 -22.827  17.369
  233    H    ASP  36           H        ASP  36   4.304 -20.538  14.131
  234    HA   ASP  36           HA       ASP  36   4.926 -17.763  14.775
  235   1HB   ASP  36          1HB       ASP  36   6.127 -19.443  12.531
  236   2HB   ASP  36          2HB       ASP  36   6.672 -17.866  13.066
  237    H    LYS  37           H        LYS  37   2.334 -18.014  14.168
  238    HA   LYS  37           HA       LYS  37   1.392 -18.479  11.699
  239   1HB   LYS  37          1HB       LYS  37  -0.323 -16.723  12.199
  240   2HB   LYS  37          2HB       LYS  37  -0.088 -17.906  13.470
  241   1HG   LYS  37          1HG       LYS  37   1.641 -16.177  14.450
  242   2HG   LYS  37          2HG       LYS  37   0.862 -15.022  13.387
  243   1HD   LYS  37          1HD       LYS  37  -0.503 -14.730  15.228
  244   2HD   LYS  37          2HD       LYS  37  -1.370 -16.064  14.494
  245   1HE   LYS  37          1HE       LYS  37  -0.991 -17.331  16.336
  246   2HE   LYS  37          2HE       LYS  37   0.737 -17.219  16.065
  247   1HZ   LYS  37          1HZ       LYS  37   0.653 -16.147  18.004
  248   2HZ   LYS  37          2HZ       LYS  37   0.236 -14.846  17.110
  249   3HZ   LYS  37          3HZ       LYS  37  -0.917 -15.720  17.867
  250    H    LYS  38           H        LYS  38   3.367 -15.696  12.759
  251    HA   LYS  38           HA       LYS  38   2.983 -13.993  10.654
  252   1HB   LYS  38          1HB       LYS  38   4.578 -14.057  12.864
  253   2HB   LYS  38          2HB       LYS  38   5.774 -14.270  11.602
  254   1HG   LYS  38          1HG       LYS  38   5.698 -12.013  11.329
  255   2HG   LYS  38          2HG       LYS  38   4.150 -12.261  10.545
  256   1HD   LYS  38          1HD       LYS  38   2.986 -12.015  12.738
  257   2HD   LYS  38          2HD       LYS  38   4.528 -11.804  13.544
  258   1HE   LYS  38          1HE       LYS  38   4.359  -9.577  13.139
  259   2HE   LYS  38          2HE       LYS  38   4.585  -9.920  11.435
  260   1HZ   LYS  38          1HZ       LYS  38   2.577  -8.890  11.450
  261   2HZ   LYS  38          2HZ       LYS  38   2.074 -10.440  11.556
  262   3HZ   LYS  38          3HZ       LYS  38   2.106  -9.499  12.890
  263    H    THR  39           H        THR  39   5.652 -16.456  10.890
  264    HA   THR  39           HA       THR  39   6.695 -16.247   8.421
  265    HB   THR  39           HB       THR  39   6.046 -18.893   9.814
  266    HG1  THR  39           1HG      THR  39   7.566 -18.187  11.307
  267   1HG2  THR  39          1HG2      THR  39   7.374 -18.721   7.518
  268   2HG2  THR  39          2HG2      THR  39   8.673 -18.060   8.539
  269   3HG2  THR  39          3HG2      THR  39   8.052 -19.700   8.841
  270    H    CYS  40           H        CYS  40   3.869 -18.394   9.188
  271    HA   CYS  40           HA       CYS  40   3.430 -19.166   6.582
  272   1HB   CYS  40          1HB       CYS  40   2.429 -20.196   8.601
  273   2HB   CYS  40          2HB       CYS  40   1.371 -18.809   8.769
  274    H    ARG  41           H        ARG  41   1.584 -16.671   8.501
  275    HA   ARG  41           HA       ARG  41   0.064 -15.656   6.600
  276   1HB   ARG  41          1HB       ARG  41   1.579 -14.303   8.857
  277   2HB   ARG  41          2HB       ARG  41   0.575 -13.333   7.797
  278   1HG   ARG  41          1HG       ARG  41  -1.417 -14.588   8.375
  279   2HG   ARG  41          2HG       ARG  41  -0.483 -15.840   9.171
  280   1HD   ARG  41          1HD       ARG  41  -1.450 -14.402  10.891
  281   2HD   ARG  41          2HD       ARG  41   0.283 -14.144  10.878
  282    HE   ARG  41           HE       ARG  41  -1.145 -12.295   9.119
  283   1HH1  ARG  41          2HH2      ARG  41  -0.093 -12.870  12.427
  284   2HH1  ARG  41          1HH2      ARG  41  -0.121 -11.194  12.863
  285   1HH2  ARG  41          2HH1      ARG  41  -1.183 -10.083   9.693
  286   2HH2  ARG  41          1HH1      ARG  41  -0.745  -9.598  11.297
  287    H    ARG  42           H        ARG  42   3.539 -14.809   7.182
  288    HA   ARG  42           HA       ARG  42   3.613 -12.895   5.148
  289   1HB   ARG  42          1HB       ARG  42   5.843 -14.502   6.492
  290   2HB   ARG  42          2HB       ARG  42   6.136 -13.150   5.417
  291   1HG   ARG  42          1HG       ARG  42   4.772 -11.676   6.944
  292   2HG   ARG  42          2HG       ARG  42   4.563 -13.032   8.034
  293   1HD   ARG  42          1HD       ARG  42   7.263 -11.844   7.223
  294   2HD   ARG  42          2HD       ARG  42   6.440 -11.521   8.737
  295    HE   ARG  42           HE       ARG  42   6.588 -14.310   8.605
  296   1HH1  ARG  42          2HH2      ARG  42   8.909 -11.666   8.532
  297   2HH1  ARG  42          1HH2      ARG  42  10.184 -12.596   9.244
  298   1HH2  ARG  42          2HH1      ARG  42   8.271 -15.538   9.545
  299   2HH2  ARG  42          1HH1      ARG  42   9.819 -14.813   9.825
  300    H    ASN  43           H        ASN  43   4.238 -16.420   5.339
  301    HA   ASN  43           HA       ASN  43   5.522 -16.646   2.885
  302   1HB   ASN  43          1HB       ASN  43   4.891 -18.357   4.981
  303   2HB   ASN  43          2HB       ASN  43   3.797 -18.934   3.740
  304   1HD2  ASN  43          1HD2      ASN  43   6.809 -19.226   5.027
  305   2HD2  ASN  43          2HD2      ASN  43   7.671 -19.950   3.710
  306    H    CYS  44           H        CYS  44   2.179 -16.175   3.867
  307    HA   CYS  44           HA       CYS  44   0.871 -17.399   1.737
  308   1HB   CYS  44          1HB       CYS  44  -0.120 -16.559   3.903
  309   2HB   CYS  44          2HB       CYS  44  -0.055 -14.942   3.231
  310    H    LYS  45           H        LYS  45   2.628 -14.332   2.130
  311    HA   LYS  45           HA       LYS  45   1.559 -12.970  -0.063
  312   1HB   LYS  45          1HB       LYS  45   3.039 -12.150   1.904
  313   2HB   LYS  45          2HB       LYS  45   4.394 -12.652   0.913
  314   1HG   LYS  45          1HG       LYS  45   2.587 -11.184  -0.784
  315   2HG   LYS  45          2HG       LYS  45   2.793 -10.254   0.687
  316   1HD   LYS  45          1HD       LYS  45   5.398 -11.162   0.071
  317   2HD   LYS  45          2HD       LYS  45   4.711 -10.745  -1.486
  318   1HE   LYS  45          1HE       LYS  45   3.910  -8.538  -0.265
  319   2HE   LYS  45          2HE       LYS  45   5.117  -8.958   0.934
  320   1HZ   LYS  45          1HZ       LYS  45   6.776  -8.949  -0.750
  321   2HZ   LYS  45          2HZ       LYS  45   5.681  -8.728  -1.940
  322   3HZ   LYS  45          3HZ       LYS  45   5.954  -7.541  -0.852
  323    H    LYS  46           H        LYS  46   4.020 -15.526   0.250
  324    HA   LYS  46           HA       LYS  46   4.658 -15.245  -2.581
  325   1HB   LYS  46          1HB       LYS  46   5.936 -16.670  -0.256
  326   2HB   LYS  46          2HB       LYS  46   6.321 -17.134  -1.901
  327   1HG   LYS  46          1HG       LYS  46   6.566 -14.304  -0.773
  328   2HG   LYS  46          2HG       LYS  46   7.903 -15.412  -1.008
  329   1HD   LYS  46          1HD       LYS  46   7.025 -15.519  -3.511
  330   2HD   LYS  46          2HD       LYS  46   6.210 -14.022  -3.103
  331   1HE   LYS  46          1HE       LYS  46   9.110 -14.227  -2.336
  332   2HE   LYS  46          2HE       LYS  46   8.758 -14.100  -4.048
  333   1HZ   LYS  46          1HZ       LYS  46   7.886 -12.041  -3.784
  334   2HZ   LYS  46          2HZ       LYS  46   7.403 -12.279  -2.242
  335   3HZ   LYS  46          3HZ       LYS  46   8.978 -12.002  -2.571
  336    H    ALA  47           H        ALA  47   2.491 -16.872  -0.481
  337    HA   ALA  47           HA       ALA  47   2.372 -19.389  -1.687
  338   1HB   ALA  47          1HB       ALA  47   0.300 -17.704  -0.228
  339   2HB   ALA  47          2HB       ALA  47   0.073 -19.416  -0.658
  340   3HB   ALA  47          3HB       ALA  47   1.366 -18.946   0.472
  341    H    ASP  48           H        ASP  48   0.216 -16.494  -2.168
  342    HA   ASP  48           HA       ASP  48   0.287 -16.777  -4.942
  343   1HB   ASP  48          1HB       ASP  48  -1.252 -18.737  -4.100
  344   2HB   ASP  48          2HB       ASP  48  -2.420 -17.478  -3.751
  345    H    CYS  49           H        CYS  49   0.745 -14.623  -3.249
  346    HA   CYS  49           HA       CYS  49  -1.588 -12.956  -3.782
  347   1HB   CYS  49          1HB       CYS  49  -0.065 -12.531  -1.241
  348   2HB   CYS  49          2HB       CYS  49  -1.683 -12.015  -1.673
  349    H    GLU  50           H        GLU  50   1.256 -13.624  -4.884
  350    HA   GLU  50           HA       GLU  50   2.904 -11.470  -4.304
  351   1HB   GLU  50          1HB       GLU  50   2.813 -13.692  -6.238
  352   2HB   GLU  50          2HB       GLU  50   3.563 -12.258  -6.910
  353   1HG   GLU  50          1HG       GLU  50   4.542 -12.589  -4.212
  354   2HG   GLU  50          2HG       GLU  50   4.674 -14.136  -5.025
  355    HA   PRO  51           HA       PRO  51   0.910  -9.503  -8.141
  356   1HB   PRO  51          1HB       PRO  51  -1.385 -10.572  -9.171
  357   2HB   PRO  51          2HB       PRO  51   0.208 -10.930  -9.807
  358   1HG   PRO  51          1HG       PRO  51  -1.544 -12.627  -8.137
  359   2HG   PRO  51          2HG       PRO  51  -0.173 -13.099  -9.120
  360   1HD   PRO  51          1HD       PRO  51  -0.223 -12.822  -6.266
  361   2HD   PRO  51          2HD       PRO  51   1.175 -13.180  -7.259
  362    H    GLN  52           H        GLN  52  -1.337 -10.903  -5.868
  363    HA   GLN  52           HA       GLN  52  -3.148  -8.796  -5.994
  364   1HB   GLN  52          1HB       GLN  52  -2.550 -10.740  -3.720
  365   2HB   GLN  52          2HB       GLN  52  -3.964  -9.707  -3.799
  366   1HG   GLN  52          1HG       GLN  52  -4.587 -10.789  -5.997
  367   2HG   GLN  52          2HG       GLN  52  -3.217 -11.868  -5.825
  368   1HE2  GLN  52          1HE2      GLN  52  -4.492 -13.687  -5.766
  369   2HE2  GLN  52          2HE2      GLN  52  -5.464 -14.135  -4.404
  370    H    ASP  53           H        ASP  53  -0.409  -9.506  -3.720
  371    HA   ASP  53           HA       ASP  53  -0.753  -7.344  -2.094
  372   1HB   ASP  53          1HB       ASP  53   0.912  -9.345  -1.959
  373   2HB   ASP  53          2HB       ASP  53   1.973  -8.383  -2.968
  374    H    LYS  54           H        LYS  54   0.925  -7.713  -5.264
  375    HA   LYS  54           HA       LYS  54   2.222  -5.245  -5.294
  376   1HB   LYS  54          1HB       LYS  54   1.349  -7.209  -7.401
  377   2HB   LYS  54          2HB       LYS  54   2.034  -5.665  -7.866
  378   1HG   LYS  54          1HG       LYS  54   4.030  -6.152  -6.387
  379   2HG   LYS  54          2HG       LYS  54   3.354  -7.732  -6.043
  380   1HD   LYS  54          1HD       LYS  54   3.250  -7.865  -8.740
  381   2HD   LYS  54          2HD       LYS  54   4.543  -6.689  -8.608
  382   1HE   LYS  54          1HE       LYS  54   4.741  -9.108  -6.834
  383   2HE   LYS  54          2HE       LYS  54   4.983  -9.372  -8.549
  384   1HZ   LYS  54          1HZ       LYS  54   6.357  -7.103  -7.437
  385   2HZ   LYS  54          2HZ       LYS  54   6.886  -8.562  -6.929
  386   3HZ   LYS  54          3HZ       LYS  54   6.876  -8.207  -8.523
  387    H    VAL  55           H        VAL  55  -0.875  -6.208  -6.946
  388    HA   VAL  55           HA       VAL  55  -1.640  -3.829  -7.914
  389    HB   VAL  55           HB       VAL  55  -3.290  -5.949  -6.532
  390   1HG1  VAL  55          1HG1      VAL  55  -4.675  -4.386  -8.572
  391   2HG1  VAL  55          2HG1      VAL  55  -5.186  -4.826  -6.925
  392   3HG1  VAL  55          3HG1      VAL  55  -4.169  -3.389  -7.188
  393   1HG2  VAL  55          1HG2      VAL  55  -3.753  -6.081  -9.255
  394   2HG2  VAL  55          2HG2      VAL  55  -2.019  -5.689  -9.164
  395   3HG2  VAL  55          3HG2      VAL  55  -2.651  -7.130  -8.331
  396    H    CYS  56           H        CYS  56  -1.525  -4.814  -4.495
  397    HA   CYS  56           HA       CYS  56  -3.024  -2.551  -3.619
  398   1HB   CYS  56          1HB       CYS  56  -3.155  -4.497  -2.281
  399   2HB   CYS  56          2HB       CYS  56  -1.413  -4.670  -2.207
  400    H    ASP  57           H        ASP  57   0.450  -3.634  -3.471
  401    HA   ASP  57           HA       ASP  57   1.584  -1.587  -2.243
  402   1HB   ASP  57          1HB       ASP  57   2.585  -3.661  -3.545
  403   2HB   ASP  57          2HB       ASP  57   2.764  -2.534  -4.875
  404    H    ALA  58           H        ALA  58   1.054  -1.764  -5.854
  405    HA   ALA  58           HA       ALA  58   1.928   0.640  -6.645
  406   1HB   ALA  58          1HB       ALA  58  -0.560   0.274  -7.964
  407   2HB   ALA  58          2HB       ALA  58   1.052  -0.242  -8.516
  408   3HB   ALA  58          3HB       ALA  58   0.040  -1.352  -7.560
  409    H    CYS  59           H        CYS  59  -1.491   0.039  -5.543
  410    HA   CYS  59           HA       CYS  59  -2.403   2.565  -5.604
  411   1HB   CYS  59          1HB       CYS  59  -3.740   0.598  -5.013
  412   2HB   CYS  59          2HB       CYS  59  -2.951   0.511  -3.451
  413    H    ARG  60           H        ARG  60  -0.767   0.962  -2.767
  414    HA   ARG  60           HA       ARG  60  -0.696   3.167  -1.173
  415   1HB   ARG  60          1HB       ARG  60   1.298   0.858  -1.403
  416   2HB   ARG  60          2HB       ARG  60   1.301   2.002  -0.076
  417   1HG   ARG  60          1HG       ARG  60  -1.325   1.295  -0.005
  418   2HG   ARG  60          2HG       ARG  60  -0.673  -0.172  -0.708
  419   1HD   ARG  60          1HD       ARG  60  -0.561  -0.578   1.632
  420   2HD   ARG  60          2HD       ARG  60   1.080  -0.124   1.216
  421    HE   ARG  60           HE       ARG  60  -0.895   1.571   2.663
  422   1HH1  ARG  60          2HH2      ARG  60   2.345   1.185   1.345
  423   2HH1  ARG  60          1HH2      ARG  60   3.005   2.514   2.237
  424   1HH2  ARG  60          2HH1      ARG  60  -0.024   3.325   3.841
  425   2HH2  ARG  60          1HH1      ARG  60   1.649   3.740   3.667
  426    H    MET  61           H        MET  61   1.540   2.099  -3.781
  427    HA   MET  61           HA       MET  61   3.537   3.964  -3.216
  428   1HB   MET  61          1HB       MET  61   4.169   2.136  -4.611
  429   2HB   MET  61          2HB       MET  61   2.717   2.249  -5.585
  430   1HG   MET  61          1HG       MET  61   3.629   3.814  -7.003
  431   2HG   MET  61          2HG       MET  61   4.411   4.688  -5.701
  432   1HE   MET  61          1HE       MET  61   4.359   1.862  -8.103
  433   2HE   MET  61          2HE       MET  61   5.471   3.018  -8.876
  434   3HE   MET  61          3HE       MET  61   6.066   1.425  -8.352
  435    H    LYS  62           H        LYS  62   0.753   3.973  -5.535
  436    HA   LYS  62           HA       LYS  62   1.382   6.487  -6.631
  437   1HB   LYS  62          1HB       LYS  62  -0.544   4.422  -7.015
  438   2HB   LYS  62          2HB       LYS  62  -1.425   5.921  -6.801
  439   1HG   LYS  62          1HG       LYS  62  -0.974   6.270  -9.015
  440   2HG   LYS  62          2HG       LYS  62   0.610   6.768  -8.456
  441   1HD   LYS  62          1HD       LYS  62   0.506   3.858  -8.655
  442   2HD   LYS  62          2HD       LYS  62  -0.014   4.574 -10.168
  443   1HE   LYS  62          1HE       LYS  62   2.184   6.149  -9.554
  444   2HE   LYS  62          2HE       LYS  62   2.673   4.605  -8.885
  445   1HZ   LYS  62          1HZ       LYS  62   1.894   5.181 -11.649
  446   2HZ   LYS  62          2HZ       LYS  62   3.318   4.593 -11.105
  447   3HZ   LYS  62          3HZ       LYS  62   1.983   3.653 -11.079
  448    H    CYS  63           H        CYS  63  -1.084   5.472  -4.161
  449    HA   CYS  63           HA       CYS  63  -2.172   7.841  -3.574
  450   1HB   CYS  63          1HB       CYS  63  -2.733   5.660  -2.536
  451   2HB   CYS  63          2HB       CYS  63  -1.310   5.793  -1.521
  452    H    HIS  64           H        HIS  64   0.807   6.482  -1.965
  453    HA   HIS  64           HA       HIS  64   1.501   8.509  -0.386
  454   1HB   HIS  64          1HB       HIS  64   2.728   6.245  -1.364
  455   2HB   HIS  64          2HB       HIS  64   3.785   7.513  -1.951
  456    HD1  HIS  64           1HD      HIS  64   5.291   8.701  -0.253
  457    HD2  HIS  64           2HD      HIS  64   2.513   6.104   1.518
  458    HE1  HIS  64           1HE      HIS  64   5.961   8.503   2.201
  459    H    LYS  65           H        LYS  65   2.359   8.298  -3.911
  460    HA   LYS  65           HA       LYS  65   3.529  10.856  -3.964
  461   1HB   LYS  65          1HB       LYS  65   4.283   9.619  -5.712
  462   2HB   LYS  65          2HB       LYS  65   2.773   8.753  -5.913
  463   1HG   LYS  65          1HG       LYS  65   1.733  10.713  -6.989
  464   2HG   LYS  65          2HG       LYS  65   3.157  11.686  -6.674
  465   1HD   LYS  65          1HD       LYS  65   3.461  11.023  -8.923
  466   2HD   LYS  65          2HD       LYS  65   4.466   9.888  -8.044
  467   1HE   LYS  65          1HE       LYS  65   2.343   8.347  -8.008
  468   2HE   LYS  65          2HE       LYS  65   1.717   9.408  -9.254
  469   1HZ   LYS  65          1HZ       LYS  65   4.073   7.692  -9.360
  470   2HZ   LYS  65          2HZ       LYS  65   2.831   7.795 -10.415
  471   3HZ   LYS  65          3HZ       LYS  65   3.956   8.977 -10.361
  472    H    ALA  66           H        ALA  66   0.226   9.610  -4.720
  473    HA   ALA  66           HA       ALA  66  -0.845  11.927  -5.745
  474   1HB   ALA  66          1HB       ALA  66  -2.566  10.493  -5.877
  475   2HB   ALA  66          2HB       ALA  66  -1.728   9.369  -4.780
  476   3HB   ALA  66          3HB       ALA  66  -2.803  10.623  -4.118
  477    H    CYS  67           H        CYS  67  -0.992  10.776  -2.293
  478    HA   CYS  67           HA       CYS  67  -2.183  12.962  -1.225
  479   1HB   CYS  67          1HB       CYS  67  -1.696  10.882  -0.017
  480   2HB   CYS  67          2HB       CYS  67   0.008  11.289   0.021
  481    H    ARG  68           H        ARG  68   1.337  12.378  -1.873
  482    HA   ARG  68           HA       ARG  68   2.274  14.693  -0.769
  483   1HB   ARG  68          1HB       ARG  68   3.815  12.948  -1.458
  484   2HB   ARG  68          2HB       ARG  68   3.261  13.014  -3.119
  485   1HG   ARG  68          1HG       ARG  68   4.196  15.647  -2.209
  486   2HG   ARG  68          2HG       ARG  68   5.441  14.430  -2.006
  487   1HD   ARG  68          1HD       ARG  68   5.896  14.686  -4.222
  488   2HD   ARG  68          2HD       ARG  68   4.396  13.838  -4.542
  489    HE   ARG  68           HE       ARG  68   3.848  16.621  -4.018
  490   1HH1  ARG  68          2HH2      ARG  68   5.163  14.490  -6.490
  491   2HH1  ARG  68          1HH2      ARG  68   4.750  15.545  -7.800
  492   1HH2  ARG  68          2HH1      ARG  68   3.303  18.013  -5.746
  493   2HH2  ARG  68          1HH1      ARG  68   3.685  17.562  -7.374
  494    H    ALA  69           H        ALA  69   1.089  14.001  -4.119
  495    HA   ALA  69           HA       ALA  69   1.571  16.707  -4.962
  496   1HB   ALA  69          1HB       ALA  69  -0.059  15.464  -6.847
  497   2HB   ALA  69          2HB       ALA  69   1.720  15.497  -6.862
  498   3HB   ALA  69          3HB       ALA  69   0.862  14.114  -6.142
  499    H    ALA  70           H        ALA  70  -0.553  15.462  -2.796
  500    HA   ALA  70           HA       ALA  70  -2.888  16.874  -3.827
  501   1HB   ALA  70          1HB       ALA  70  -4.089  15.386  -2.614
  502   2HB   ALA  70          2HB       ALA  70  -2.567  14.472  -2.492
  503   3HB   ALA  70          3HB       ALA  70  -3.049  15.577  -1.183
  504    H    ASN  71           H        ASN  71  -0.897  16.668  -0.788
  505    HA   ASN  71           HA       ASN  71  -1.834  19.344  -0.181
  506   1HB   ASN  71          1HB       ASN  71  -0.100  17.709   1.693
  507   2HB   ASN  71          2HB       ASN  71  -1.349  18.872   2.093
  508   1HD2  ASN  71          1HD2      ASN  71  -3.493  18.129   0.686
  509   2HD2  ASN  71          2HD2      ASN  71  -4.049  16.548   1.121
  510    H    CYS  72           H        CYS  72   1.205  17.340   0.153
  511    HA   CYS  72           HA       CYS  72   2.868  19.616   0.218
  512   1HB   CYS  72          1HB       CYS  72   3.779  16.827  -0.459
  513   2HB   CYS  72          2HB       CYS  72   4.681  18.113   0.317
  514    H    ALA  73           H        ALA  73   1.570  20.443  -1.850
  515    HA   ALA  73           HA       ALA  73   2.422  19.254  -4.323
  516   1HB   ALA  73          1HB       ALA  73   0.186  20.506  -3.664
  517   2HB   ALA  73          2HB       ALA  73   1.121  21.960  -4.090
  518   3HB   ALA  73          3HB       ALA  73   0.867  20.679  -5.300
  519    H    SER  74           H        SER  74   3.171  22.159  -2.326
  520    HA   SER  74           HA       SER  74   5.145  22.938  -4.276
  521   1HB   SER  74          1HB       SER  74   3.495  24.338  -2.476
  522   2HB   SER  74          2HB       SER  74   5.095  24.483  -1.776
  523    HG   SER  74           HG       SER  74   4.323  26.111  -3.501
  524    H    GLU  75           H        GLU  75   4.858  21.831  -0.849
  525    HA   GLU  75           HA       GLU  75   7.426  22.098  -0.060
  526   1HB   GLU  75          1HB       GLU  75   5.259  20.098   0.587
  527   2HB   GLU  75          2HB       GLU  75   6.855  19.859   1.268
  528   1HG   GLU  75          1HG       GLU  75   5.438  21.176   2.812
  529   2HG   GLU  75          2HG       GLU  75   6.805  22.127   2.267
  530    H    CYS  76           H        CYS  76   6.055  19.801  -2.379
  531    HA   CYS  76           HA       CYS  76   8.690  18.529  -2.553
  532   1HB   CYS  76          1HB       CYS  76   6.171  17.277  -3.606
  533   2HB   CYS  76          2HB       CYS  76   7.705  16.521  -3.225
  534    HA   PRO  77           HA       PRO  77   8.380  20.788  -6.375
  535   1HB   PRO  77          1HB       PRO  77  11.064  20.944  -6.867
  536   2HB   PRO  77          2HB       PRO  77  10.191  22.136  -5.924
  537   1HG   PRO  77          1HG       PRO  77  12.020  20.010  -4.989
  538   2HG   PRO  77          2HG       PRO  77  11.484  21.448  -4.143
  539   1HD   PRO  77          1HD       PRO  77  10.554  18.766  -3.729
  540   2HD   PRO  77          2HD       PRO  77   9.938  20.219  -2.967
  541    H    LYS  78           H        LYS  78   9.633  20.484  -8.636
  542    HA   LYS  78           HA       LYS  78   8.911  17.793  -9.307
  543   1HB   LYS  78          1HB       LYS  78   8.394  19.777 -10.730
  544   2HB   LYS  78          2HB       LYS  78  10.107  19.979 -11.034
  545   1HG   LYS  78          1HG       LYS  78  10.138  17.558 -11.890
  546   2HG   LYS  78          2HG       LYS  78   8.389  17.571 -11.781
  547   1HD   LYS  78          1HD       LYS  78   8.175  18.786 -13.697
  548   2HD   LYS  78          2HD       LYS  78   9.374  19.956 -13.184
  549   1HE   LYS  78          1HE       LYS  78  10.327  18.945 -15.123
  550   2HE   LYS  78          2HE       LYS  78  11.165  18.187 -13.783
  551   1HZ   LYS  78          1HZ       LYS  78  10.172  16.239 -14.187
  552   2HZ   LYS  78          2HZ       LYS  78   8.740  16.889 -14.627
  553   3HZ   LYS  78          3HZ       LYS  78   9.975  16.834 -15.695
  554    H    HIS  79           H        HIS  79  11.950  19.765  -9.647
  555    HA   HIS  79           HA       HIS  79  13.622  17.828 -10.455
  556   1HB   HIS  79          1HB       HIS  79  13.864  20.413  -9.558
  557   2HB   HIS  79          2HB       HIS  79  14.763  19.534  -8.337
  558    HD1  HIS  79           1HD      HIS  79  16.792  17.981  -9.268
  559    HD2  HIS  79           2HD      HIS  79  15.193  20.780 -11.953
  560    HE1  HIS  79           1HE      HIS  79  18.505  18.233 -11.143
  561    H    GLU  80           H        GLU  80  13.413  18.741  -6.941
  562    HA   GLU  80           HA       GLU  80  14.555  16.281  -6.200
  563   1HB   GLU  80          1HB       GLU  80  13.945  18.789  -4.967
  564   2HB   GLU  80          2HB       GLU  80  13.158  17.556  -4.002
  565   1HG   GLU  80          1HG       GLU  80  15.212  17.324  -3.019
  566   2HG   GLU  80          2HG       GLU  80  15.590  16.351  -4.427
  567    H    HIS  81           H        HIS  81  13.196  15.209  -4.096
  568    HA   HIS  81           HA       HIS  81  10.431  14.880  -4.809
  569   1HB   HIS  81          1HB       HIS  81  12.238  12.453  -4.840
  570   2HB   HIS  81          2HB       HIS  81  10.519  12.504  -5.176
  571    HD1  HIS  81           1HD      HIS  81   9.785  13.697  -7.468
  572    HD2  HIS  81           2HD      HIS  81  13.894  12.989  -7.008
  573    HE1  HIS  81           1HE      HIS  81  10.816  13.938  -9.790
  574    H    LYS  82           H        LYS  82  13.252  13.727  -2.857
  575    HA   LYS  82           HA       LYS  82  11.415  13.558  -0.572
  576   1HB   LYS  82          1HB       LYS  82  13.104  12.006   0.401
  577   2HB   LYS  82          2HB       LYS  82  12.331  11.402  -1.051
  578   1HG   LYS  82          1HG       LYS  82  14.838  12.977  -1.489
  579   2HG   LYS  82          2HG       LYS  82  15.047  11.441  -0.673
  580   1HD   LYS  82          1HD       LYS  82  13.290  10.783  -2.741
  581   2HD   LYS  82          2HD       LYS  82  14.316  11.989  -3.491
  582   1HE   LYS  82          1HE       LYS  82  15.800   9.991  -1.860
  583   2HE   LYS  82          2HE       LYS  82  14.954   9.301  -3.231
  584   1HZ   LYS  82          1HZ       LYS  82  17.324  10.438  -3.401
  585   2HZ   LYS  82          2HZ       LYS  82  16.284  10.361  -4.658
  586   3HZ   LYS  82          3HZ       LYS  82  16.393  11.728  -3.772
  587    H    SER  83           H        SER  83  11.641  15.986  -0.544
  588    HA   SER  83           HA       SER  83  14.249  16.864   0.307
  589   1HB   SER  83          1HB       SER  83  13.098  19.148   0.312
  590   2HB   SER  83          2HB       SER  83  13.200  18.347  -1.244
  591    HG   SER  83           HG       SER  83  11.084  18.981  -1.149
  592    H    ASP  84           H        ASP  84  14.467  18.202   2.333
  593    HA   ASP  84           HA       ASP  84  13.537  16.857   4.509
  594   1HB   ASP  84          1HB       ASP  84  14.318  19.806   4.336
  595   2HB   ASP  84          2HB       ASP  84  14.270  18.865   5.813
  596    H    THR  85           H        THR  85  12.284  19.792   2.812
  597    HA   THR  85           HA       THR  85  10.252  20.361   4.708
  598    HB   THR  85           HB       THR  85  11.429  21.814   2.818
  599    HG1  THR  85           1HG      THR  85   9.776  23.108   3.530
  600   1HG2  THR  85          1HG2      THR  85   8.993  20.616   1.396
  601   2HG2  THR  85          2HG2      THR  85   9.867  22.070   0.856
  602   3HG2  THR  85          3HG2      THR  85  10.684  20.489   0.856
  603    H    CYS  86           H        CYS  86  10.409  18.368   1.729
  604    HA   CYS  86           HA       CYS  86   7.643  17.928   1.604
  605   1HB   CYS  86          1HB       CYS  86   9.199  17.600  -0.280
  606   2HB   CYS  86          2HB       CYS  86   9.910  16.226   0.545
  607    H    ARG  87           H        ARG  87  10.395  15.814   2.729
  608    HA   ARG  87           HA       ARG  87   9.029  13.736   3.648
  609   1HB   ARG  87          1HB       ARG  87  11.435  15.155   4.877
  610   2HB   ARG  87          2HB       ARG  87  10.857  13.624   5.503
  611   1HG   ARG  87          1HG       ARG  87  10.970  12.940   2.889
  612   2HG   ARG  87          2HG       ARG  87  12.161  14.225   2.856
  613   1HD   ARG  87          1HD       ARG  87  13.278  12.077   3.311
  614   2HD   ARG  87          2HD       ARG  87  13.419  13.118   4.713
  615    HE   ARG  87           HE       ARG  87  11.984  11.685   5.923
  616   1HH1  ARG  87          2HH2      ARG  87  11.990  10.805   2.516
  617   2HH1  ARG  87          1HH2      ARG  87  11.150   9.312   2.769
  618   1HH2  ARG  87          2HH1      ARG  87  10.876   9.715   6.257
  619   2HH2  ARG  87          1HH1      ARG  87  10.512   8.687   4.911
  620    H    ALA  88           H        ALA  88   9.767  16.747   5.557
  621    HA   ALA  88           HA       ALA  88   8.408  15.994   7.861
  622   1HB   ALA  88          1HB       ALA  88  10.000  18.062   7.106
  623   2HB   ALA  88          2HB       ALA  88   8.414  18.870   7.090
  624   3HB   ALA  88          3HB       ALA  88   8.997  18.082   8.576
  625    H    CYS  89           H        CYS  89   7.316  17.774   4.908
  626    HA   CYS  89           HA       CYS  89   4.794  18.417   5.781
  627   1HB   CYS  89          1HB       CYS  89   5.775  19.291   3.737
  628   2HB   CYS  89          2HB       CYS  89   5.732  17.705   2.995
  629    H    MET  90           H        MET  90   6.046  15.432   4.144
  630    HA   MET  90           HA       MET  90   3.549  14.175   4.072
  631   1HB   MET  90          1HB       MET  90   6.439  13.162   3.961
  632   2HB   MET  90          2HB       MET  90   5.071  12.091   3.732
  633   1HG   MET  90          1HG       MET  90   4.355  13.998   1.949
  634   2HG   MET  90          2HG       MET  90   6.083  14.292   1.939
  635   1HE   MET  90          1HE       MET  90   3.188  12.166   1.325
  636   2HE   MET  90          2HE       MET  90   3.732  10.816   0.300
  637   3HE   MET  90          3HE       MET  90   3.896  10.712   2.069
  638    H    LYS  91           H        LYS  91   6.205  14.292   6.471
  639    HA   LYS  91           HA       LYS  91   5.105  12.185   8.056
  640   1HB   LYS  91          1HB       LYS  91   7.380  12.307   8.326
  641   2HB   LYS  91          2HB       LYS  91   7.427  14.055   8.213
  642   1HG   LYS  91          1HG       LYS  91   6.601  14.330  10.464
  643   2HG   LYS  91          2HG       LYS  91   6.111  12.651  10.573
  644   1HD   LYS  91          1HD       LYS  91   8.384  11.875  10.687
  645   2HD   LYS  91          2HD       LYS  91   9.024  13.408  10.128
  646   1HE   LYS  91          1HE       LYS  91   8.394  14.517  12.216
  647   2HE   LYS  91          2HE       LYS  91   7.501  13.110  12.757
  648   1HZ   LYS  91          1HZ       LYS  91   9.415  11.975  13.173
  649   2HZ   LYS  91          2HZ       LYS  91  10.320  12.814  12.103
  650   3HZ   LYS  91          3HZ       LYS  91   9.907  13.490  13.531
  651    H    THR  92           H        THR  92   4.384  15.519   7.521
  652    HA   THR  92           HA       THR  92   3.336  15.976  10.174
  653    HB   THR  92           HB       THR  92   3.277  17.556   7.549
  654    HG1  THR  92           1HG      THR  92   5.025  18.621   8.676
  655   1HG2  THR  92          1HG2      THR  92   1.676  17.965   9.855
  656   2HG2  THR  92          2HG2      THR  92   3.065  19.058  10.063
  657   3HG2  THR  92          3HG2      THR  92   2.051  19.174   8.604
  658    H    ASN  93           H        ASN  93   1.902  15.758   6.844
  659    HA   ASN  93           HA       ASN  93  -0.283  14.317   7.994
  660   1HB   ASN  93          1HB       ASN  93  -1.531  16.331   6.357
  661   2HB   ASN  93          2HB       ASN  93  -1.772  16.047   8.070
  662   1HD2  ASN  93          1HD2      ASN  93   0.555  17.484   5.796
  663   2HD2  ASN  93          2HD2      ASN  93   0.992  18.855   6.761
  664    H    CYS  94           H        CYS  94   0.743  12.731   6.475
  665    HA   CYS  94           HA       CYS  94  -0.530  12.504   4.075
  666   1HB   CYS  94          1HB       CYS  94   1.484  14.464   3.847
  667   2HB   CYS  94          2HB       CYS  94   2.115  13.034   3.054
  668    H    LYS  95           H        LYS  95  -0.476  10.476   5.440
  669    HA   LYS  95           HA       LYS  95   1.934   9.132   5.929
  670   1HB   LYS  95          1HB       LYS  95  -0.853   8.760   6.419
  671   2HB   LYS  95          2HB       LYS  95  -0.248   7.294   5.676
  672   1HG   LYS  95          1HG       LYS  95   1.787   7.700   7.407
  673   2HG   LYS  95          2HG       LYS  95   0.545   8.569   8.286
  674   1HD   LYS  95          1HD       LYS  95  -0.732   6.185   7.473
  675   2HD   LYS  95          2HD       LYS  95   0.882   5.671   7.921
  676   1HE   LYS  95          1HE       LYS  95  -0.645   7.551   9.747
  677   2HE   LYS  95          2HE       LYS  95  -1.012   5.837   9.770
  678   1HZ   LYS  95          1HZ       LYS  95   1.699   5.964   9.833
  679   2HZ   LYS  95          2HZ       LYS  95   1.234   7.180  10.819
  680   3HZ   LYS  95          3HZ       LYS  95   0.719   5.656  11.102
  Start of MODEL   10
    1   1H    ILE   1           H        ILE   1 -17.271  13.943   6.348
    2    HA   ILE   1           HA       ILE   1 -15.047  14.365   6.097
    3    HB   ILE   1           HB       ILE   1 -14.897  11.523   5.101
    4   1HG1  ILE   1          1HG1      ILE   1 -13.194  12.253   7.334
    5   2HG1  ILE   1          2HG1      ILE   1 -14.870  12.624   7.689
    6   1HG2  ILE   1          1HG2      ILE   1 -13.188  12.299   3.842
    7   2HG2  ILE   1          2HG2      ILE   1 -12.976  13.766   4.827
    8   3HG2  ILE   1          3HG2      ILE   1 -12.312  12.213   5.389
    9   1HD1  ILE   1          1HD1      ILE   1 -13.617   9.954   7.030
   10   2HD1  ILE   1          2HD1      ILE   1 -14.739  10.377   8.345
   11   3HD1  ILE   1          3HD1      ILE   1 -15.341  10.219   6.677
   12    H    SER   2           H        SER   2 -14.571  15.832   4.544
   13    HA   SER   2           HA       SER   2 -14.971  15.122   1.809
   14   1HB   SER   2          1HB       SER   2 -17.035  16.544   3.215
   15   2HB   SER   2          2HB       SER   2 -16.276  17.681   2.118
   16    HG   SER   2           HG       SER   2 -16.842  15.111   1.055
   17    H    GLU   3           H        GLU   3 -13.129  15.871   0.832
   18    HA   GLU   3           HA       GLU   3 -11.204  16.926   0.664
   19   1HB   GLU   3          1HB       GLU   3 -13.419  18.760   0.196
   20   2HB   GLU   3          2HB       GLU   3 -12.012  19.653   0.739
   21   1HG   GLU   3          1HG       GLU   3 -10.630  18.446  -1.011
   22   2HG   GLU   3          2HG       GLU   3 -12.096  17.683  -1.594
   23    H    PHE   4           H        PHE   4 -10.773  16.134   3.021
   24    HA   PHE   4           HA       PHE   4  -9.431  18.163   4.369
   25   1HB   PHE   4          1HB       PHE   4 -12.067  18.486   4.819
   26   2HB   PHE   4          2HB       PHE   4 -11.861  17.122   5.899
   27    HD1  PHE   4           1HD      PHE   4 -11.295  20.661   5.419
   28    HD2  PHE   4           2HD      PHE   4 -10.353  17.327   7.870
   29    HE1  PHE   4           1HE      PHE   4 -10.514  22.213   7.231
   30    HE2  PHE   4           2HE      PHE   4  -9.572  18.878   9.681
   31    HZ   PHE   4           HZ       PHE   4  -9.662  21.303   9.341
   32    H    ALA   5           H        ALA   5  -8.508  17.355   6.501
   33    HA   ALA   5           HA       ALA   5  -7.612  15.780   7.781
   34   1HB   ALA   5          1HB       ALA   5  -8.925  14.027   8.391
   35   2HB   ALA   5          2HB       ALA   5 -10.138  14.804   7.345
   36   3HB   ALA   5          3HB       ALA   5  -9.138  13.474   6.713
   37    HA   PRO   6           HA       PRO   6  -4.673  13.935   5.202
   38   1HB   PRO   6          1HB       PRO   6  -3.532  12.039   6.805
   39   2HB   PRO   6          2HB       PRO   6  -3.144  13.744   6.912
   40   1HG   PRO   6          1HG       PRO   6  -4.808  12.105   8.724
   41   2HG   PRO   6          2HG       PRO   6  -4.066  13.664   9.025
   42   1HD   PRO   6          1HD       PRO   6  -6.831  13.160   8.450
   43   2HD   PRO   6          2HD       PRO   6  -6.068  14.727   8.636
   44    H    VAL   7           H        VAL   7  -4.425  12.527   3.532
   45    HA   VAL   7           HA       VAL   7  -6.562  10.735   3.171
   46    HB   VAL   7           HB       VAL   7  -3.897  10.913   1.750
   47   1HG1  VAL   7          1HG1      VAL   7  -5.462   8.849   1.443
   48   2HG1  VAL   7          2HG1      VAL   7  -6.478   9.976   0.512
   49   3HG1  VAL   7          3HG1      VAL   7  -4.800   9.665   0.006
   50   1HG2  VAL   7          1HG2      VAL   7  -4.602  12.734   0.631
   51   2HG2  VAL   7          2HG2      VAL   7  -6.265  12.119   0.480
   52   3HG2  VAL   7          3HG2      VAL   7  -5.749  12.930   1.978
   53    H    ASP   8           H        ASP   8  -6.875   8.770   4.069
   54    HA   ASP   8           HA       ASP   8  -4.968   7.633   5.721
   55   1HB   ASP   8          1HB       ASP   8  -7.622   6.869   4.578
   56   2HB   ASP   8          2HB       ASP   8  -6.626   5.521   5.089
   57    H    CYS   9           H        CYS   9  -6.007   7.029   2.312
   58    HA   CYS   9           HA       CYS   9  -5.048   5.986   0.635
   59   1HB   CYS   9          1HB       CYS   9  -2.661   6.266   2.425
   60   2HB   CYS   9          2HB       CYS   9  -2.544   5.269   0.989
   61    H    LYS  10           H        LYS  10  -3.345   4.359   3.410
   62    HA   LYS  10           HA       LYS  10  -3.472   1.821   2.591
   63   1HB   LYS  10          1HB       LYS  10  -2.449   2.756   4.704
   64   2HB   LYS  10          2HB       LYS  10  -4.032   2.658   5.448
   65   1HG   LYS  10          1HG       LYS  10  -3.559   0.131   4.165
   66   2HG   LYS  10          2HG       LYS  10  -2.094   0.541   5.036
   67   1HD   LYS  10          1HD       LYS  10  -3.616   1.081   7.061
   68   2HD   LYS  10          2HD       LYS  10  -4.916   0.319   6.166
   69   1HE   LYS  10          1HE       LYS  10  -3.399  -1.747   5.932
   70   2HE   LYS  10          2HE       LYS  10  -2.303  -0.978   7.062
   71   1HZ   LYS  10          1HZ       LYS  10  -4.895  -2.121   7.541
   72   2HZ   LYS  10          2HZ       LYS  10  -3.594  -2.037   8.525
   73   3HZ   LYS  10          3HZ       LYS  10  -4.580  -0.745   8.363
   74    H    GLY  11           H        GLY  11  -6.086   3.403   4.565
   75   1HA   GLY  11          1HA       GLY  11  -7.881   1.237   4.320
   76   2HA   GLY  11          2HA       GLY  11  -8.259   2.875   4.814
   77    H    GLN  12           H        GLN  12  -7.638   4.435   2.603
   78    HA   GLN  12           HA       GLN  12  -9.851   4.137   1.046
   79   1HB   GLN  12          1HB       GLN  12  -7.227   5.598   0.649
   80   2HB   GLN  12          2HB       GLN  12  -8.448   5.634  -0.607
   81   1HG   GLN  12          1HG       GLN  12  -9.587   6.153   2.066
   82   2HG   GLN  12          2HG       GLN  12  -8.338   7.308   1.645
   83   1HE2  GLN  12          1HE2      GLN  12  -9.171   9.075   0.858
   84   2HE2  GLN  12          2HE2      GLN  12 -10.479   9.213  -0.270
   85    H    CYS  13           H        CYS  13  -6.807   2.424   0.915
   86    HA   CYS  13           HA       CYS  13  -7.226   1.614  -1.830
   87   1HB   CYS  13          1HB       CYS  13  -5.040   1.073   0.179
   88   2HB   CYS  13          2HB       CYS  13  -5.123   0.250  -1.367
   89    H    THR  14           H        THR  14  -9.457   0.787  -0.798
   90    HA   THR  14           HA       THR  14  -9.094  -1.819   0.474
   91    HB   THR  14           HB       THR  14 -11.394   0.141   0.087
   92    HG1  THR  14           1HG      THR  14 -10.036  -1.300   2.256
   93   1HG2  THR  14          1HG2      THR  14 -12.131  -2.056   1.788
   94   2HG2  THR  14          2HG2      THR  14 -12.923  -1.544   0.278
   95   3HG2  THR  14          3HG2      THR  14 -11.615  -2.751   0.233
   96    H    THR  15           H        THR  15 -10.275  -0.285  -2.538
   97    HA   THR  15           HA       THR  15 -11.341  -2.684  -3.609
   98    HB   THR  15           HB       THR  15 -10.768   0.131  -4.452
   99    HG1  THR  15           1HG      THR  15 -12.861  -0.729  -3.750
  100   1HG2  THR  15          1HG2      THR  15 -11.092  -2.183  -6.434
  101   2HG2  THR  15          2HG2      THR  15 -11.350  -0.470  -6.841
  102   3HG2  THR  15          3HG2      THR  15  -9.731  -1.039  -6.368
  103    HA   PRO  16           HA       PRO  16  -7.092  -2.995  -5.625
  104   1HB   PRO  16          1HB       PRO  16  -5.011  -1.526  -4.637
  105   2HB   PRO  16          2HB       PRO  16  -5.957  -1.032  -6.026
  106   1HG   PRO  16          1HG       PRO  16  -6.033   0.019  -3.264
  107   2HG   PRO  16          2HG       PRO  16  -6.637   0.755  -4.736
  108   1HD   PRO  16          1HD       PRO  16  -8.191  -0.535  -2.699
  109   2HD   PRO  16          2HD       PRO  16  -8.780   0.097  -4.224
  110    H    CYS  17           H        CYS  17  -7.460  -2.688  -2.240
  111    HA   CYS  17           HA       CYS  17  -5.618  -4.947  -1.940
  112   1HB   CYS  17          1HB       CYS  17  -6.460  -3.101   0.287
  113   2HB   CYS  17          2HB       CYS  17  -5.145  -4.259   0.270
  114    H    GLU  18           H        GLU  18  -8.442  -5.009  -2.871
  115    HA   GLU  18           HA       GLU  18 -10.002  -5.748  -0.618
  116   1HB   GLU  18          1HB       GLU  18 -10.487  -5.022  -3.309
  117   2HB   GLU  18          2HB       GLU  18 -11.042  -6.680  -3.190
  118   1HG   GLU  18          1HG       GLU  18 -12.088  -5.694  -0.865
  119   2HG   GLU  18          2HG       GLU  18 -12.080  -4.224  -1.819
  120    HA   PRO  19           HA       PRO  19  -9.132 -10.045  -2.438
  121   1HB   PRO  19          1HB       PRO  19  -7.235 -10.343  -4.383
  122   2HB   PRO  19          2HB       PRO  19  -8.947 -10.195  -4.728
  123   1HG   PRO  19          1HG       PRO  19  -6.808  -8.183  -5.066
  124   2HG   PRO  19          2HG       PRO  19  -8.406  -8.216  -5.783
  125   1HD   PRO  19          1HD       PRO  19  -7.543  -6.586  -3.586
  126   2HD   PRO  19          2HD       PRO  19  -9.170  -6.704  -4.228
  127    H    LEU  20           H        LEU  20  -6.333  -7.963  -2.275
  128    HA   LEU  20           HA       LEU  20  -4.542  -9.881  -1.369
  129   1HB   LEU  20          1HB       LEU  20  -3.485  -7.989  -1.991
  130   2HB   LEU  20          2HB       LEU  20  -4.750  -6.934  -1.391
  131    HG   LEU  20           HG       LEU  20  -3.905  -7.532   0.965
  132   1HD1  LEU  20          1HD1      LEU  20  -2.540  -9.406   0.635
  133   2HD1  LEU  20          2HD1      LEU  20  -1.676  -8.655  -0.729
  134   3HD1  LEU  20          3HD1      LEU  20  -1.401  -8.071   0.930
  135   1HD2  LEU  20          1HD2      LEU  20  -1.831  -6.005  -0.567
  136   2HD2  LEU  20          2HD2      LEU  20  -3.505  -5.402  -0.513
  137   3HD2  LEU  20          3HD2      LEU  20  -2.597  -5.642   0.999
  138    H    THR  21           H        THR  21  -6.477  -7.489   0.575
  139    HA   THR  21           HA       THR  21  -5.800  -8.379   3.065
  140    HB   THR  21           HB       THR  21  -8.306  -7.160   1.843
  141    HG1  THR  21           1HG      THR  21  -7.349  -5.409   3.207
  142   1HG2  THR  21          1HG2      THR  21  -9.497  -7.561   3.750
  143   2HG2  THR  21          2HG2      THR  21  -8.134  -8.476   4.438
  144   3HG2  THR  21          3HG2      THR  21  -8.230  -6.714   4.669
  145    H    ALA  22           H        ALA  22  -8.743  -9.488   1.247
  146    HA   ALA  22           HA       ALA  22  -9.487 -11.442   3.007
  147   1HB   ALA  22          1HB       ALA  22  -9.781 -10.990   0.050
  148   2HB   ALA  22          2HB       ALA  22 -10.311 -12.546   0.733
  149   3HB   ALA  22          3HB       ALA  22 -11.023 -11.026   1.324
  150    H    CYS  23           H        CYS  23  -6.729 -11.334   0.813
  151    HA   CYS  23           HA       CYS  23  -6.318 -14.128   0.722
  152   1HB   CYS  23          1HB       CYS  23  -5.412 -12.180  -0.790
  153   2HB   CYS  23          2HB       CYS  23  -4.101 -12.141   0.373
  154    H    LYS  24           H        LYS  24  -4.892 -11.367   2.610
  155    HA   LYS  24           HA       LYS  24  -3.108 -12.842   4.110
  156   1HB   LYS  24          1HB       LYS  24  -4.571 -10.247   4.574
  157   2HB   LYS  24          2HB       LYS  24  -3.502 -10.905   5.796
  158   1HG   LYS  24          1HG       LYS  24  -1.587 -10.769   4.380
  159   2HG   LYS  24          2HG       LYS  24  -2.554 -10.658   2.923
  160   1HD   LYS  24          1HD       LYS  24  -1.704  -8.440   3.357
  161   2HD   LYS  24          2HD       LYS  24  -3.413  -8.406   3.741
  162   1HE   LYS  24          1HE       LYS  24  -1.704  -9.189   6.040
  163   2HE   LYS  24          2HE       LYS  24  -1.368  -7.577   5.439
  164   1HZ   LYS  24          1HZ       LYS  24  -4.144  -8.061   5.586
  165   2HZ   LYS  24          2HZ       LYS  24  -3.436  -8.296   7.038
  166   3HZ   LYS  24          3HZ       LYS  24  -3.267  -6.865   6.269
  167    H    GLU  25           H        GLU  25  -6.569 -12.016   4.796
  168    HA   GLU  25           HA       GLU  25  -6.715 -13.172   7.255
  169   1HB   GLU  25          1HB       GLU  25  -8.556 -12.248   5.205
  170   2HB   GLU  25          2HB       GLU  25  -9.190 -13.708   5.938
  171   1HG   GLU  25          1HG       GLU  25  -8.081 -11.500   7.698
  172   2HG   GLU  25          2HG       GLU  25  -9.701 -11.360   7.044
  173    H    LYS  26           H        LYS  26  -7.928 -14.737   4.195
  174    HA   LYS  26           HA       LYS  26  -8.387 -17.212   5.101
  175   1HB   LYS  26          1HB       LYS  26  -8.395 -16.074   2.678
  176   2HB   LYS  26          2HB       LYS  26  -6.927 -17.014   2.504
  177   1HG   LYS  26          1HG       LYS  26  -8.078 -18.975   2.361
  178   2HG   LYS  26          2HG       LYS  26  -9.042 -18.602   3.776
  179   1HD   LYS  26          1HD       LYS  26 -10.744 -17.589   2.535
  180   2HD   LYS  26          2HD       LYS  26  -9.661 -17.077   1.256
  181   1HE   LYS  26          1HE       LYS  26 -10.312 -20.016   1.742
  182   2HE   LYS  26          2HE       LYS  26 -11.294 -19.006   0.699
  183   1HZ   LYS  26          1HZ       LYS  26  -9.160 -20.322  -0.121
  184   2HZ   LYS  26          2HZ       LYS  26  -9.708 -18.969  -0.852
  185   3HZ   LYS  26          3HZ       LYS  26  -8.468 -18.880   0.207
  186    H    CYS  27           H        CYS  27  -5.180 -15.748   4.436
  187    HA   CYS  27           HA       CYS  27  -3.758 -18.153   4.778
  188   1HB   CYS  27          1HB       CYS  27  -3.093 -15.262   4.573
  189   2HB   CYS  27          2HB       CYS  27  -1.901 -16.295   5.336
  190    H    ALA  28           H        ALA  28  -4.214 -15.217   6.893
  191    HA   ALA  28           HA       ALA  28  -2.955 -15.977   9.127
  192   1HB   ALA  28          1HB       ALA  28  -3.923 -14.031   9.696
  193   2HB   ALA  28          2HB       ALA  28  -5.131 -14.209   8.401
  194   3HB   ALA  28          3HB       ALA  28  -5.434 -14.919  10.005
  195    H    GLU  29           H        GLU  29  -6.197 -17.116   8.021
  196    HA   GLU  29           HA       GLU  29  -6.724 -18.590  10.319
  197   1HB   GLU  29          1HB       GLU  29  -7.783 -18.528   7.501
  198   2HB   GLU  29          2HB       GLU  29  -8.221 -19.894   8.507
  199   1HG   GLU  29          1HG       GLU  29  -8.608 -16.969   9.302
  200   2HG   GLU  29          2HG       GLU  29  -9.868 -17.991   8.640
  201    H    SER  30           H        SER  30  -5.462 -19.605   7.061
  202    HA   SER  30           HA       SER  30  -5.118 -22.253   7.742
  203   1HB   SER  30          1HB       SER  30  -4.731 -20.658   5.482
  204   2HB   SER  30          2HB       SER  30  -3.105 -21.195   5.854
  205    HG   SER  30           HG       SER  30  -4.494 -22.616   4.420
  206    H    CYS  31           H        CYS  31  -3.213 -19.356   8.447
  207    HA   CYS  31           HA       CYS  31  -1.045 -21.043   9.445
  208   1HB   CYS  31          1HB       CYS  31  -1.161 -18.141   8.640
  209   2HB   CYS  31          2HB       CYS  31   0.145 -18.774   9.623
  210    H    GLU  32           H        GLU  32  -3.224 -21.332  11.005
  211    HA   GLU  32           HA       GLU  32  -3.282 -19.234  12.963
  212   1HB   GLU  32          1HB       GLU  32  -5.022 -21.422  12.130
  213   2HB   GLU  32          2HB       GLU  32  -4.806 -21.453  13.869
  214   1HG   GLU  32          1HG       GLU  32  -5.297 -18.896  13.807
  215   2HG   GLU  32          2HG       GLU  32  -5.849 -19.156  12.164
  216    H    THR  33           H        THR  33  -2.847 -22.851  13.086
  217    HA   THR  33           HA       THR  33  -1.677 -22.774  15.659
  218    HB   THR  33           HB       THR  33  -1.257 -25.184  15.151
  219    HG1  THR  33           1HG      THR  33  -1.219 -25.751  12.981
  220   1HG2  THR  33          1HG2      THR  33  -3.866 -23.867  14.654
  221   2HG2  THR  33          2HG2      THR  33  -3.695 -25.417  13.795
  222   3HG2  THR  33          3HG2      THR  33  -3.512 -25.355  15.565
  223    H    SER  34           H        SER  34  -0.419 -22.263  12.414
  224    HA   SER  34           HA       SER  34   2.142 -23.018  12.652
  225   1HB   SER  34          1HB       SER  34   0.716 -20.823  11.217
  226   2HB   SER  34          2HB       SER  34   2.452 -20.623  11.347
  227    HG   SER  34           HG       SER  34   1.942 -23.213  10.658
  228    H    ALA  35           H        ALA  35   3.811 -22.544  14.039
  229    HA   ALA  35           HA       ALA  35   3.500 -20.822  16.184
  230   1HB   ALA  35          1HB       ALA  35   5.083 -22.576  16.353
  231   2HB   ALA  35          2HB       ALA  35   5.889 -22.111  14.835
  232   3HB   ALA  35          3HB       ALA  35   6.068 -21.095  16.285
  233    H    ASP  36           H        ASP  36   5.812 -20.362  13.412
  234    HA   ASP  36           HA       ASP  36   6.081 -17.639  14.025
  235   1HB   ASP  36          1HB       ASP  36   6.697 -18.883  11.321
  236   2HB   ASP  36          2HB       ASP  36   7.519 -17.547  12.102
  237    H    LYS  37           H        LYS  37   3.519 -17.429  13.992
  238    HA   LYS  37           HA       LYS  37   1.962 -17.623  11.796
  239   1HB   LYS  37          1HB       LYS  37   1.458 -16.838  14.223
  240   2HB   LYS  37          2HB       LYS  37   1.769 -15.226  13.612
  241   1HG   LYS  37          1HG       LYS  37   0.066 -15.631  11.786
  242   2HG   LYS  37          2HG       LYS  37  -0.286 -17.193  12.498
  243   1HD   LYS  37          1HD       LYS  37  -0.378 -15.003  14.481
  244   2HD   LYS  37          2HD       LYS  37  -1.515 -14.765  13.169
  245   1HE   LYS  37          1HE       LYS  37  -2.331 -17.154  13.537
  246   2HE   LYS  37          2HE       LYS  37  -1.296 -17.238  14.949
  247   1HZ   LYS  37          1HZ       LYS  37  -3.666 -16.525  15.291
  248   2HZ   LYS  37          2HZ       LYS  37  -2.525 -15.597  16.002
  249   3HZ   LYS  37          3HZ       LYS  37  -3.255 -15.087  14.633
  250    H    LYS  38           H        LYS  38   3.703 -14.568  12.737
  251    HA   LYS  38           HA       LYS  38   3.192 -13.088  10.556
  252   1HB   LYS  38          1HB       LYS  38   5.096 -13.090  12.678
  253   2HB   LYS  38          2HB       LYS  38   5.964 -12.736  11.198
  254   1HG   LYS  38          1HG       LYS  38   5.236 -10.596  11.786
  255   2HG   LYS  38          2HG       LYS  38   3.941 -11.091  10.714
  256   1HD   LYS  38          1HD       LYS  38   2.931 -12.078  13.028
  257   2HD   LYS  38          2HD       LYS  38   3.928 -10.808  13.710
  258   1HE   LYS  38          1HE       LYS  38   2.826  -9.152  12.148
  259   2HE   LYS  38          2HE       LYS  38   1.784 -10.434  11.564
  260   1HZ   LYS  38          1HZ       LYS  38   1.317  -8.875  13.713
  261   2HZ   LYS  38          2HZ       LYS  38   0.536 -10.266  13.363
  262   3HZ   LYS  38          3HZ       LYS  38   1.803 -10.279  14.392
  263    H    THR  39           H        THR  39   6.252 -15.037  10.803
  264    HA   THR  39           HA       THR  39   7.044 -14.845   8.218
  265    HB   THR  39           HB       THR  39   7.176 -17.356   9.968
  266    HG1  THR  39           1HG      THR  39   8.563 -16.095  11.180
  267   1HG2  THR  39          1HG2      THR  39   8.232 -17.005   7.449
  268   2HG2  THR  39          2HG2      THR  39   9.520 -16.285   8.445
  269   3HG2  THR  39          3HG2      THR  39   9.025 -17.973   8.715
  270    H    CYS  40           H        CYS  40   4.857 -17.441   9.503
  271    HA   CYS  40           HA       CYS  40   4.442 -18.748   7.162
  272   1HB   CYS  40          1HB       CYS  40   3.604 -19.303   9.498
  273   2HB   CYS  40          2HB       CYS  40   2.256 -18.230   9.178
  274    H    ARG  41           H        ARG  41   2.284 -16.158   8.559
  275    HA   ARG  41           HA       ARG  41   0.679 -15.860   6.417
  276   1HB   ARG  41          1HB       ARG  41   1.580 -14.085   8.661
  277   2HB   ARG  41          2HB       ARG  41   0.810 -13.266   7.317
  278   1HG   ARG  41          1HG       ARG  41  -1.179 -14.716   7.511
  279   2HG   ARG  41          2HG       ARG  41  -0.402 -15.671   8.759
  280   1HD   ARG  41          1HD       ARG  41  -1.932 -14.067   9.814
  281   2HD   ARG  41          2HD       ARG  41  -0.284 -13.641  10.232
  282    HE   ARG  41           HE       ARG  41  -1.126 -12.267   7.821
  283   1HH1  ARG  41          2HH2      ARG  41  -1.419 -12.203  11.327
  284   2HH1  ARG  41          1HH2      ARG  41  -1.734 -10.501  11.397
  285   1HH2  ARG  41          2HH1      ARG  41  -1.542 -10.022   7.913
  286   2HH2  ARG  41          1HH1      ARG  41  -1.805  -9.252   9.442
  287    H    ARG  42           H        ARG  42   3.917 -14.403   7.032
  288    HA   ARG  42           HA       ARG  42   3.902 -12.590   4.979
  289   1HB   ARG  42          1HB       ARG  42   5.856 -13.810   6.781
  290   2HB   ARG  42          2HB       ARG  42   6.564 -13.606   5.191
  291   1HG   ARG  42          1HG       ARG  42   7.008 -11.495   6.025
  292   2HG   ARG  42          2HG       ARG  42   5.411 -11.178   5.377
  293   1HD   ARG  42          1HD       ARG  42   4.546 -10.801   7.451
  294   2HD   ARG  42          2HD       ARG  42   5.211 -12.297   8.078
  295    HE   ARG  42           HE       ARG  42   6.870 -11.018   9.088
  296   1HH1  ARG  42          2HH2      ARG  42   5.811  -9.347   6.178
  297   2HH1  ARG  42          1HH2      ARG  42   6.874  -8.000   6.411
  298   1HH2  ARG  42          2HH1      ARG  42   8.272  -9.241   9.396
  299   2HH2  ARG  42          1HH1      ARG  42   8.284  -7.939   8.254
  300    H    ASN  43           H        ASN  43   5.285 -15.962   5.055
  301    HA   ASN  43           HA       ASN  43   5.929 -15.938   2.340
  302   1HB   ASN  43          1HB       ASN  43   5.882 -17.897   4.581
  303   2HB   ASN  43          2HB       ASN  43   5.611 -18.634   3.014
  304   1HD2  ASN  43          1HD2      ASN  43   7.845 -17.178   5.149
  305   2HD2  ASN  43          2HD2      ASN  43   9.270 -17.266   4.169
  306    H    CYS  44           H        CYS  44   2.974 -16.380   4.154
  307    HA   CYS  44           HA       CYS  44   1.679 -18.040   2.225
  308   1HB   CYS  44          1HB       CYS  44   1.211 -17.888   4.745
  309   2HB   CYS  44          2HB       CYS  44   0.326 -16.420   4.377
  310    H    LYS  45           H        LYS  45   2.333 -14.627   2.764
  311    HA   LYS  45           HA       LYS  45   0.142 -13.696   1.168
  312   1HB   LYS  45          1HB       LYS  45   1.321 -12.496   3.124
  313   2HB   LYS  45          2HB       LYS  45   2.583 -12.110   1.971
  314   1HG   LYS  45          1HG       LYS  45   1.130 -10.803   0.615
  315   2HG   LYS  45          2HG       LYS  45  -0.314 -11.550   1.268
  316   1HD   LYS  45          1HD       LYS  45  -0.130  -9.315   2.216
  317   2HD   LYS  45          2HD       LYS  45   0.171 -10.472   3.497
  318   1HE   LYS  45          1HE       LYS  45   2.701 -10.202   2.896
  319   2HE   LYS  45          2HE       LYS  45   2.207  -8.787   1.988
  320   1HZ   LYS  45          1HZ       LYS  45   0.956  -8.482   4.349
  321   2HZ   LYS  45          2HZ       LYS  45   2.383  -9.138   4.798
  322   3HZ   LYS  45          3HZ       LYS  45   2.357  -7.759   3.924
  323    H    LYS  46           H        LYS  46   3.753 -13.830   0.775
  324    HA   LYS  46           HA       LYS  46   3.573 -13.117  -1.969
  325   1HB   LYS  46          1HB       LYS  46   5.746 -13.956  -0.081
  326   2HB   LYS  46          2HB       LYS  46   6.058 -14.014  -1.804
  327   1HG   LYS  46          1HG       LYS  46   4.727 -11.518  -0.833
  328   2HG   LYS  46          2HG       LYS  46   6.367 -11.760  -0.264
  329   1HD   LYS  46          1HD       LYS  46   6.013 -12.332  -3.159
  330   2HD   LYS  46          2HD       LYS  46   5.671 -10.669  -2.724
  331   1HE   LYS  46          1HE       LYS  46   8.138 -11.809  -1.484
  332   2HE   LYS  46          2HE       LYS  46   8.196 -11.650  -3.228
  333   1HZ   LYS  46          1HZ       LYS  46   8.595  -9.666  -1.446
  334   2HZ   LYS  46          2HZ       LYS  46   8.319  -9.465  -3.043
  335   3HZ   LYS  46          3HZ       LYS  46   7.083  -9.362  -1.982
  336    H    ALA  47           H        ALA  47   2.695 -15.907  -0.301
  337    HA   ALA  47           HA       ALA  47   3.711 -17.868  -2.079
  338   1HB   ALA  47          1HB       ALA  47   1.960 -17.687   0.283
  339   2HB   ALA  47          2HB       ALA  47   1.460 -18.943  -0.875
  340   3HB   ALA  47          3HB       ALA  47   3.105 -18.963  -0.195
  341    H    ASP  48           H        ASP  48   0.346 -16.568  -1.577
  342    HA   ASP  48           HA       ASP  48  -0.074 -17.155  -4.403
  343   1HB   ASP  48          1HB       ASP  48  -2.490 -17.410  -3.824
  344   2HB   ASP  48          2HB       ASP  48  -1.481 -18.575  -2.989
  345    H    CYS  49           H        CYS  49  -0.347 -14.907  -1.656
  346    HA   CYS  49           HA       CYS  49  -1.898 -12.997  -3.129
  347   1HB   CYS  49          1HB       CYS  49  -0.478 -12.274  -0.610
  348   2HB   CYS  49          2HB       CYS  49  -2.066 -11.802  -1.183
  349    H    GLU  50           H        GLU  50   0.208 -13.564  -4.745
  350    HA   GLU  50           HA       GLU  50   2.384 -11.806  -4.115
  351   1HB   GLU  50          1HB       GLU  50   2.038 -14.145  -5.696
  352   2HB   GLU  50          2HB       GLU  50   2.441 -12.868  -6.826
  353   1HG   GLU  50          1HG       GLU  50   4.202 -12.419  -4.680
  354   2HG   GLU  50          2HG       GLU  50   4.135 -14.167  -4.791
  355    HA   PRO  51           HA       PRO  51   0.467  -9.639  -7.869
  356   1HB   PRO  51          1HB       PRO  51  -1.893 -10.526  -8.922
  357   2HB   PRO  51          2HB       PRO  51  -0.327 -10.987  -9.558
  358   1HG   PRO  51          1HG       PRO  51  -2.203 -12.578  -7.919
  359   2HG   PRO  51          2HG       PRO  51  -0.865 -13.133  -8.905
  360   1HD   PRO  51          1HD       PRO  51  -0.908 -12.895  -6.047
  361   2HD   PRO  51          2HD       PRO  51   0.466 -13.338  -7.041
  362    H    GLN  52           H        GLN  52  -1.971 -10.927  -5.710
  363    HA   GLN  52           HA       GLN  52  -3.618  -8.723  -5.786
  364   1HB   GLN  52          1HB       GLN  52  -3.098 -10.621  -3.455
  365   2HB   GLN  52          2HB       GLN  52  -4.493  -9.573  -3.613
  366   1HG   GLN  52          1HG       GLN  52  -5.188 -10.741  -5.680
  367   2HG   GLN  52          2HG       GLN  52  -3.742 -11.731  -5.641
  368   1HE2  GLN  52          1HE2      GLN  52  -4.185 -13.707  -5.064
  369   2HE2  GLN  52          2HE2      GLN  52  -5.265 -14.224  -3.812
  370    H    ASP  53           H        ASP  53  -0.756  -9.477  -3.717
  371    HA   ASP  53           HA       ASP  53  -1.017  -7.304  -2.039
  372   1HB   ASP  53          1HB       ASP  53   0.547  -9.339  -1.847
  373   2HB   ASP  53          2HB       ASP  53   1.603  -8.541  -2.995
  374    H    LYS  54           H        LYS  54   0.585  -7.786  -5.237
  375    HA   LYS  54           HA       LYS  54   1.954  -5.356  -5.330
  376   1HB   LYS  54          1HB       LYS  54   1.014  -7.348  -7.380
  377   2HB   LYS  54          2HB       LYS  54   1.721  -5.829  -7.894
  378   1HG   LYS  54          1HG       LYS  54   3.685  -6.358  -6.295
  379   2HG   LYS  54          2HG       LYS  54   3.011  -7.969  -6.148
  380   1HD   LYS  54          1HD       LYS  54   3.989  -8.576  -8.099
  381   2HD   LYS  54          2HD       LYS  54   3.083  -7.343  -8.953
  382   1HE   LYS  54          1HE       LYS  54   4.878  -5.924  -9.065
  383   2HE   LYS  54          2HE       LYS  54   5.344  -6.226  -7.403
  384   1HZ   LYS  54          1HZ       LYS  54   6.288  -8.326  -8.127
  385   2HZ   LYS  54          2HZ       LYS  54   5.883  -8.008  -9.677
  386   3HZ   LYS  54          3HZ       LYS  54   6.978  -7.071  -8.910
  387    H    VAL  55           H        VAL  55  -1.208  -6.281  -6.876
  388    HA   VAL  55           HA       VAL  55  -1.909  -3.891  -7.901
  389    HB   VAL  55           HB       VAL  55  -3.523  -6.043  -6.549
  390   1HG1  VAL  55          1HG1      VAL  55  -4.670  -3.739  -8.158
  391   2HG1  VAL  55          2HG1      VAL  55  -5.564  -5.067  -7.379
  392   3HG1  VAL  55          3HG1      VAL  55  -4.727  -3.854  -6.382
  393   1HG2  VAL  55          1HG2      VAL  55  -4.247  -6.257  -9.062
  394   2HG2  VAL  55          2HG2      VAL  55  -2.747  -5.350  -9.370
  395   3HG2  VAL  55          3HG2      VAL  55  -2.683  -6.915  -8.525
  396    H    CYS  56           H        CYS  56  -1.810  -4.842  -4.470
  397    HA   CYS  56           HA       CYS  56  -3.244  -2.529  -3.618
  398   1HB   CYS  56          1HB       CYS  56  -3.354  -4.561  -2.319
  399   2HB   CYS  56          2HB       CYS  56  -1.614  -4.581  -2.111
  400    H    ASP  57           H        ASP  57   0.196  -3.711  -3.377
  401    HA   ASP  57           HA       ASP  57   1.387  -1.686  -2.201
  402   1HB   ASP  57          1HB       ASP  57   2.324  -3.798  -3.502
  403   2HB   ASP  57          2HB       ASP  57   2.552  -2.671  -4.823
  404    H    ALA  58           H        ALA  58   0.808  -1.872  -5.803
  405    HA   ALA  58           HA       ALA  58   1.762   0.518  -6.597
  406   1HB   ALA  58          1HB       ALA  58  -0.110   0.411  -8.332
  407   2HB   ALA  58          2HB       ALA  58   0.900  -1.047  -8.185
  408   3HB   ALA  58          3HB       ALA  58  -0.721  -1.009  -7.450
  409    H    CYS  59           H        CYS  59  -1.615  -0.081  -5.386
  410    HA   CYS  59           HA       CYS  59  -2.524   2.474  -5.522
  411   1HB   CYS  59          1HB       CYS  59  -3.842   0.456  -4.923
  412   2HB   CYS  59          2HB       CYS  59  -3.130   0.488  -3.322
  413    H    ARG  60           H        ARG  60  -0.977   0.848  -2.647
  414    HA   ARG  60           HA       ARG  60  -0.883   3.048  -1.058
  415   1HB   ARG  60          1HB       ARG  60   1.124   0.745  -1.254
  416   2HB   ARG  60          2HB       ARG  60   1.041   1.859   0.096
  417   1HG   ARG  60          1HG       ARG  60  -1.622   0.993  -0.216
  418   2HG   ARG  60          2HG       ARG  60  -0.679  -0.451  -0.526
  419   1HD   ARG  60          1HD       ARG  60   0.603   0.006   1.633
  420   2HD   ARG  60          2HD       ARG  60  -0.508   1.323   1.956
  421    HE   ARG  60           HE       ARG  60  -2.166  -0.234   2.527
  422   1HH1  ARG  60          2HH2      ARG  60   0.428  -1.873   0.805
  423   2HH1  ARG  60          1HH2      ARG  60  -0.197  -3.459   1.113
  424   1HH2  ARG  60          2HH1      ARG  60  -2.991  -2.326   2.934
  425   2HH2  ARG  60          1HH1      ARG  60  -2.155  -3.718   2.333
  426    H    MET  61           H        MET  61   1.294   2.012  -3.708
  427    HA   MET  61           HA       MET  61   3.341   3.828  -3.093
  428   1HB   MET  61          1HB       MET  61   3.948   1.991  -4.493
  429   2HB   MET  61          2HB       MET  61   2.512   2.147  -5.486
  430   1HG   MET  61          1HG       MET  61   3.491   3.684  -6.883
  431   2HG   MET  61          2HG       MET  61   4.237   4.559  -5.560
  432   1HE   MET  61          1HE       MET  61   5.009   0.482  -6.313
  433   2HE   MET  61          2HE       MET  61   4.061   1.418  -7.494
  434   3HE   MET  61          3HE       MET  61   5.741   0.960  -7.864
  435    H    LYS  62           H        LYS  62   0.751   3.845  -5.650
  436    HA   LYS  62           HA       LYS  62   1.371   6.385  -6.615
  437   1HB   LYS  62          1HB       LYS  62  -0.842   4.434  -6.872
  438   2HB   LYS  62          2HB       LYS  62  -1.280   6.101  -7.186
  439   1HG   LYS  62          1HG       LYS  62  -0.505   5.590  -9.297
  440   2HG   LYS  62          2HG       LYS  62   1.034   6.041  -8.592
  441   1HD   LYS  62          1HD       LYS  62   1.003   3.431  -7.847
  442   2HD   LYS  62          2HD       LYS  62  -0.024   3.307  -9.261
  443   1HE   LYS  62          1HE       LYS  62   1.694   3.797 -10.731
  444   2HE   LYS  62          2HE       LYS  62   2.452   4.939  -9.639
  445   1HZ   LYS  62          1HZ       LYS  62   3.160   2.321 -10.064
  446   2HZ   LYS  62          2HZ       LYS  62   3.806   3.355  -8.978
  447   3HZ   LYS  62          3HZ       LYS  62   2.577   2.373  -8.540
  448    H    CYS  63           H        CYS  63  -1.207   5.334  -4.278
  449    HA   CYS  63           HA       CYS  63  -2.247   7.772  -3.723
  450   1HB   CYS  63          1HB       CYS  63  -2.878   5.423  -2.864
  451   2HB   CYS  63          2HB       CYS  63  -1.762   5.743  -1.552
  452    H    HIS  64           H        HIS  64   0.729   6.200  -2.414
  453    HA   HIS  64           HA       HIS  64   1.316   8.071  -0.472
  454   1HB   HIS  64          1HB       HIS  64   2.616   6.221  -0.256
  455   2HB   HIS  64          2HB       HIS  64   2.785   5.987  -1.984
  456    HD1  HIS  64           1HD      HIS  64   4.971   6.695  -3.019
  457    HD2  HIS  64           2HD      HIS  64   4.370   8.381   0.774
  458    HE1  HIS  64           1HE      HIS  64   7.142   7.893  -2.417
  459    H    LYS  65           H        LYS  65   2.517   7.885  -3.900
  460    HA   LYS  65           HA       LYS  65   3.854  10.352  -3.756
  461   1HB   LYS  65          1HB       LYS  65   4.691   9.099  -5.457
  462   2HB   LYS  65          2HB       LYS  65   3.148   8.364  -5.843
  463   1HG   LYS  65          1HG       LYS  65   2.387  10.529  -6.866
  464   2HG   LYS  65          2HG       LYS  65   3.948  11.238  -6.505
  465   1HD   LYS  65          1HD       LYS  65   3.720   8.687  -8.149
  466   2HD   LYS  65          2HD       LYS  65   3.567  10.265  -8.897
  467   1HE   LYS  65          1HE       LYS  65   5.815  10.911  -8.014
  468   2HE   LYS  65          2HE       LYS  65   5.968   9.345  -7.243
  469   1HZ   LYS  65          1HZ       LYS  65   5.520   8.492  -9.612
  470   2HZ   LYS  65          2HZ       LYS  65   6.002   9.980 -10.081
  471   3HZ   LYS  65          3HZ       LYS  65   7.014   9.026  -9.224
  472    H    ALA  66           H        ALA  66   0.489   9.438  -4.172
  473    HA   ALA  66           HA       ALA  66  -0.297  11.863  -5.447
  474   1HB   ALA  66          1HB       ALA  66  -1.421   9.324  -4.793
  475   2HB   ALA  66          2HB       ALA  66  -2.443  10.566  -4.031
  476   3HB   ALA  66          3HB       ALA  66  -2.135  10.620  -5.783
  477    H    CYS  67           H        CYS  67  -0.701  10.520  -2.089
  478    HA   CYS  67           HA       CYS  67  -1.769  12.865  -1.048
  479   1HB   CYS  67          1HB       CYS  67  -1.885  10.589  -0.029
  480   2HB   CYS  67          2HB       CYS  67  -0.201  10.742   0.429
  481    H    ARG  68           H        ARG  68   1.418  12.012  -2.120
  482    HA   ARG  68           HA       ARG  68   2.677  13.916  -0.374
  483   1HB   ARG  68          1HB       ARG  68   3.871  11.810  -0.855
  484   2HB   ARG  68          2HB       ARG  68   3.771  12.101  -2.580
  485   1HG   ARG  68          1HG       ARG  68   4.964  14.430  -1.351
  486   2HG   ARG  68          2HG       ARG  68   5.788  13.011  -0.734
  487   1HD   ARG  68          1HD       ARG  68   5.251  13.264  -3.711
  488   2HD   ARG  68          2HD       ARG  68   6.608  14.111  -2.996
  489    HE   ARG  68           HE       ARG  68   6.678  11.409  -2.076
  490   1HH1  ARG  68          2HH2      ARG  68   7.110  13.235  -5.053
  491   2HH1  ARG  68          1HH2      ARG  68   8.198  12.083  -5.752
  492   1HH2  ARG  68          2HH1      ARG  68   8.114   9.889  -2.998
  493   2HH2  ARG  68          1HH1      ARG  68   8.773  10.167  -4.575
  494    H    ALA  69           H        ALA  69   1.875  13.398  -3.854
  495    HA   ALA  69           HA       ALA  69   3.021  15.961  -4.564
  496   1HB   ALA  69          1HB       ALA  69   1.592  13.791  -6.151
  497   2HB   ALA  69          2HB       ALA  69   2.289  15.269  -6.857
  498   3HB   ALA  69          3HB       ALA  69   3.347  14.074  -6.068
  499    H    ALA  70           H        ALA  70   0.325  15.083  -2.913
  500    HA   ALA  70           HA       ALA  70  -1.385  17.015  -4.316
  501   1HB   ALA  70          1HB       ALA  70  -2.365  14.792  -4.158
  502   2HB   ALA  70          2HB       ALA  70  -2.039  14.734  -2.410
  503   3HB   ALA  70          3HB       ALA  70  -3.231  15.887  -3.055
  504    H    ASN  71           H        ASN  71  -1.452  15.832  -0.913
  505    HA   ASN  71           HA       ASN  71  -2.064  18.244   0.152
  506   1HB   ASN  71          1HB       ASN  71  -0.939  15.669   1.148
  507   2HB   ASN  71          2HB       ASN  71  -0.563  17.039   2.175
  508   1HD2  ASN  71          1HD2      ASN  71  -2.831  14.722   1.338
  509   2HD2  ASN  71          2HD2      ASN  71  -4.225  15.339   2.159
  510    H    CYS  72           H        CYS  72   1.172  16.616   0.587
  511    HA   CYS  72           HA       CYS  72   2.509  18.898   1.359
  512   1HB   CYS  72          1HB       CYS  72   3.514  16.356   0.073
  513   2HB   CYS  72          2HB       CYS  72   4.577  17.615   0.670
  514    H    ALA  73           H        ALA  73   3.584  17.247  -1.642
  515    HA   ALA  73           HA       ALA  73   3.819  17.959  -3.740
  516   1HB   ALA  73          1HB       ALA  73   2.393  19.541  -4.628
  517   2HB   ALA  73          2HB       ALA  73   1.531  19.192  -3.111
  518   3HB   ALA  73          3HB       ALA  73   2.565  20.636  -3.236
  519    H    SER  74           H        SER  74   4.000  20.940  -1.657
  520    HA   SER  74           HA       SER  74   6.403  21.696  -2.953
  521   1HB   SER  74          1HB       SER  74   4.428  22.924  -1.278
  522   2HB   SER  74          2HB       SER  74   5.971  23.127  -0.472
  523    HG   SER  74           HG       SER  74   5.133  24.076  -3.043
  524    H    GLU  75           H        GLU  75   5.525  20.778   0.462
  525    HA   GLU  75           HA       GLU  75   8.062  20.771   1.456
  526   1HB   GLU  75          1HB       GLU  75   5.606  19.133   2.180
  527   2HB   GLU  75          2HB       GLU  75   7.087  19.029   3.111
  528   1HG   GLU  75          1HG       GLU  75   5.746  21.700   2.517
  529   2HG   GLU  75          2HG       GLU  75   5.304  20.734   3.911
  530    H    CYS  76           H        CYS  76   6.504  18.505  -0.735
  531    HA   CYS  76           HA       CYS  76   8.772  16.683  -0.389
  532   1HB   CYS  76          1HB       CYS  76   6.119  16.026  -1.672
  533   2HB   CYS  76          2HB       CYS  76   7.413  14.918  -1.266
  534    HA   PRO  77           HA       PRO  77   9.586  18.569  -4.347
  535   1HB   PRO  77          1HB       PRO  77  12.291  18.179  -4.330
  536   2HB   PRO  77          2HB       PRO  77  11.525  19.607  -3.664
  537   1HG   PRO  77          1HG       PRO  77  12.705  17.301  -2.239
  538   2HG   PRO  77          2HG       PRO  77  12.329  18.897  -1.622
  539   1HD   PRO  77          1HD       PRO  77  10.826  16.493  -1.191
  540   2HD   PRO  77          2HD       PRO  77  10.390  18.108  -0.671
  541    H    LYS  78           H        LYS  78  11.508  17.668  -6.102
  542    HA   LYS  78           HA       LYS  78  10.266  15.128  -6.766
  543   1HB   LYS  78          1HB       LYS  78  11.194  15.469  -8.968
  544   2HB   LYS  78          2HB       LYS  78  10.367  16.925  -8.451
  545   1HG   LYS  78          1HG       LYS  78  12.355  18.134  -8.170
  546   2HG   LYS  78          2HG       LYS  78  13.309  16.703  -7.834
  547   1HD   LYS  78          1HD       LYS  78  12.264  16.432 -10.505
  548   2HD   LYS  78          2HD       LYS  78  12.922  18.050 -10.363
  549   1HE   LYS  78          1HE       LYS  78  14.999  16.868  -9.255
  550   2HE   LYS  78          2HE       LYS  78  14.350  15.399  -9.957
  551   1HZ   LYS  78          1HZ       LYS  78  14.839  16.093 -12.013
  552   2HZ   LYS  78          2HZ       LYS  78  14.507  17.666 -11.723
  553   3HZ   LYS  78          3HZ       LYS  78  15.939  17.034 -11.256
  554    H    HIS  79           H        HIS  79  11.561  13.242  -7.359
  555    HA   HIS  79           HA       HIS  79  13.166  11.777  -7.054
  556   1HB   HIS  79          1HB       HIS  79  14.893  14.237  -6.701
  557   2HB   HIS  79          2HB       HIS  79  15.536  12.607  -6.689
  558    HD1  HIS  79           1HD      HIS  79  16.840  13.835  -8.852
  559    HD2  HIS  79           2HD      HIS  79  12.839  12.674  -9.339
  560    HE1  HIS  79           1HE      HIS  79  16.432  13.713 -11.368
  561    H    GLU  80           H        GLU  80  13.993  14.384  -4.651
  562    HA   GLU  80           HA       GLU  80  14.779  12.835  -2.635
  563   1HB   GLU  80          1HB       GLU  80  13.793  15.525  -2.945
  564   2HB   GLU  80          2HB       GLU  80  13.103  14.868  -1.474
  565   1HG   GLU  80          1HG       GLU  80  15.198  14.551  -0.458
  566   2HG   GLU  80          2HG       GLU  80  16.040  14.402  -1.987
  567    H    HIS  81           H        HIS  81  13.773  10.840  -2.287
  568    HA   HIS  81           HA       HIS  81  10.920  10.731  -2.050
  569   1HB   HIS  81          1HB       HIS  81  11.165   8.410  -1.997
  570   2HB   HIS  81          2HB       HIS  81  12.429   8.958  -3.080
  571    HD1  HIS  81           1HD      HIS  81  12.308   6.269  -1.204
  572    HD2  HIS  81           2HD      HIS  81  14.657   9.699  -0.649
  573    HE1  HIS  81           1HE      HIS  81  14.297   5.550   0.223
  574    H    LYS  82           H        LYS  82   9.829  11.261  -0.231
  575    HA   LYS  82           HA       LYS  82   9.370  11.652   1.892
  576   1HB   LYS  82          1HB       LYS  82  11.251   9.313   2.306
  577   2HB   LYS  82          2HB       LYS  82  10.286  10.021   3.584
  578   1HG   LYS  82          1HG       LYS  82   8.645   8.581   2.934
  579   2HG   LYS  82          2HG       LYS  82   8.390   9.667   1.583
  580   1HD   LYS  82          1HD       LYS  82   8.673   7.453   0.655
  581   2HD   LYS  82          2HD       LYS  82  10.128   8.352   0.274
  582   1HE   LYS  82          1HE       LYS  82  11.450   7.136   1.769
  583   2HE   LYS  82          2HE       LYS  82  10.117   6.813   2.860
  584   1HZ   LYS  82          1HZ       LYS  82  10.052   5.649   0.197
  585   2HZ   LYS  82          2HZ       LYS  82  11.016   4.971   1.328
  586   3HZ   LYS  82          3HZ       LYS  82   9.407   5.084   1.587
  587    H    SER  83           H        SER  83  10.637  13.715   1.196
  588    HA   SER  83           HA       SER  83  13.231  14.041   2.144
  589   1HB   SER  83          1HB       SER  83  12.907  15.834   0.804
  590   2HB   SER  83          2HB       SER  83  11.166  15.651   0.878
  591    HG   SER  83           HG       SER  83  12.896  17.193   2.572
  592    H    ASP  84           H        ASP  84  13.885  15.598   3.948
  593    HA   ASP  84           HA       ASP  84  12.953  14.728   6.339
  594   1HB   ASP  84          1HB       ASP  84  15.023  15.851   6.389
  595   2HB   ASP  84          2HB       ASP  84  14.438  17.190   5.421
  596    H    THR  85           H        THR  85  12.268  17.900   4.667
  597    HA   THR  85           HA       THR  85  10.309  18.706   6.549
  598    HB   THR  85           HB       THR  85  11.828  19.964   4.687
  599    HG1  THR  85           1HG      THR  85  10.241  20.705   6.446
  600   1HG2  THR  85          1HG2      THR  85  10.366  20.772   2.863
  601   2HG2  THR  85          2HG2      THR  85  10.514  19.001   2.751
  602   3HG2  THR  85          3HG2      THR  85   9.041  19.730   3.435
  603    H    CYS  86           H        CYS  86  10.267  16.569   3.760
  604    HA   CYS  86           HA       CYS  86   7.511  16.825   3.236
  605   1HB   CYS  86          1HB       CYS  86   9.001  15.978   1.552
  606   2HB   CYS  86          2HB       CYS  86   9.510  14.655   2.582
  607    H    ARG  87           H        ARG  87   9.422  14.097   4.727
  608    HA   ARG  87           HA       ARG  87   7.440  12.600   5.625
  609   1HB   ARG  87          1HB       ARG  87  10.041  13.333   7.050
  610   2HB   ARG  87          2HB       ARG  87   8.996  12.045   7.617
  611   1HG   ARG  87          1HG       ARG  87   9.150  11.157   5.133
  612   2HG   ARG  87          2HG       ARG  87  10.552  12.202   5.016
  613   1HD   ARG  87          1HD       ARG  87  11.388  10.044   5.689
  614   2HD   ARG  87          2HD       ARG  87  11.472  11.058   7.116
  615    HE   ARG  87           HE       ARG  87   8.936   9.855   7.223
  616   1HH1  ARG  87          2HH2      ARG  87  12.277   8.751   7.151
  617   2HH1  ARG  87          1HH2      ARG  87  11.953   7.304   8.045
  618   1HH2  ARG  87          2HH1      ARG  87   8.508   7.946   8.403
  619   2HH2  ARG  87          1HH1      ARG  87   9.794   6.843   8.763
  620    H    ALA  88           H        ALA  88   8.513  15.732   6.961
  621    HA   ALA  88           HA       ALA  88   7.076  15.523   9.395
  622   1HB   ALA  88          1HB       ALA  88   8.097  17.500   9.840
  623   2HB   ALA  88          2HB       ALA  88   9.030  17.160   8.363
  624   3HB   ALA  88          3HB       ALA  88   7.600  18.217   8.289
  625    H    CYS  89           H        CYS  89   6.439  17.069   6.181
  626    HA   CYS  89           HA       CYS  89   3.995  18.177   6.881
  627   1HB   CYS  89          1HB       CYS  89   4.832  19.030   4.932
  628   2HB   CYS  89          2HB       CYS  89   5.365  17.472   4.332
  629    H    MET  90           H        MET  90   4.709  15.139   4.990
  630    HA   MET  90           HA       MET  90   2.164  14.212   4.868
  631   1HB   MET  90          1HB       MET  90   4.882  12.831   5.057
  632   2HB   MET  90          2HB       MET  90   3.422  11.882   4.861
  633   1HG   MET  90          1HG       MET  90   2.882  13.389   2.823
  634   2HG   MET  90          2HG       MET  90   4.519  13.999   2.959
  635   1HE   MET  90          1HE       MET  90   2.394  10.700   2.812
  636   2HE   MET  90          2HE       MET  90   2.351  11.566   1.257
  637   3HE   MET  90          3HE       MET  90   3.141   9.975   1.368
  638    H    LYS  91           H        LYS  91   4.240  14.464   7.665
  639    HA   LYS  91           HA       LYS  91   3.386  12.366   9.222
  640   1HB   LYS  91          1HB       LYS  91   5.194  14.192   9.607
  641   2HB   LYS  91          2HB       LYS  91   3.901  15.114  10.346
  642   1HG   LYS  91          1HG       LYS  91   3.464  13.332  11.970
  643   2HG   LYS  91          2HG       LYS  91   4.572  12.248  11.153
  644   1HD   LYS  91          1HD       LYS  91   5.901  13.057  12.917
  645   2HD   LYS  91          2HD       LYS  91   6.379  14.105  11.596
  646   1HE   LYS  91          1HE       LYS  91   5.369  15.969  12.519
  647   2HE   LYS  91          2HE       LYS  91   4.019  15.056  13.162
  648   1HZ   LYS  91          1HZ       LYS  91   6.466  14.361  14.408
  649   2HZ   LYS  91          2HZ       LYS  91   6.136  15.952  14.572
  650   3HZ   LYS  91          3HZ       LYS  91   5.058  14.837  15.084
  651    H    THR  92           H        THR  92   1.968  15.703   8.993
  652    HA   THR  92           HA       THR  92  -0.435  14.648  10.302
  653    HB   THR  92           HB       THR  92   0.814  17.397   9.911
  654    HG1  THR  92           1HG      THR  92   1.041  17.044  12.106
  655   1HG2  THR  92          1HG2      THR  92  -2.072  16.672  10.389
  656   2HG2  THR  92          2HG2      THR  92  -1.369  17.929  11.434
  657   3HG2  THR  92          3HG2      THR  92  -1.386  18.147   9.668
  658    H    ASN  93           H        ASN  93   0.630  16.511   7.392
  659    HA   ASN  93           HA       ASN  93  -1.784  16.884   6.262
  660   1HB   ASN  93          1HB       ASN  93   1.000  16.434   5.202
  661   2HB   ASN  93          2HB       ASN  93  -0.300  16.343   4.030
  662   1HD2  ASN  93          1HD2      ASN  93   0.736  18.326   6.802
  663   2HD2  ASN  93          2HD2      ASN  93   0.384  19.874   6.110
  664    H    CYS  94           H        CYS  94   0.256  13.933   6.410
  665    HA   CYS  94           HA       CYS  94  -1.980  12.446   5.252
  666   1HB   CYS  94          1HB       CYS  94   0.179  12.843   3.770
  667   2HB   CYS  94          2HB       CYS  94   0.814  11.524   4.734
  668    H    LYS  95           H        LYS  95  -0.019  10.026   5.612
  669    HA   LYS  95           HA       LYS  95  -0.724   9.597   8.385
  670   1HB   LYS  95          1HB       LYS  95  -1.273   7.832   6.866
  671   2HB   LYS  95          2HB       LYS  95   0.343   7.806   6.192
  672   1HG   LYS  95          1HG       LYS  95   0.843   6.197   7.715
  673   2HG   LYS  95          2HG       LYS  95   0.799   7.452   8.938
  674   1HD   LYS  95          1HD       LYS  95  -1.926   6.687   8.366
  675   2HD   LYS  95          2HD       LYS  95  -0.998   5.219   8.602
  676   1HE   LYS  95          1HE       LYS  95  -0.070   6.910  10.649
  677   2HE   LYS  95          2HE       LYS  95  -1.783   7.269  10.572
  678   1HZ   LYS  95          1HZ       LYS  95  -0.576   5.038  11.654
  679   2HZ   LYS  95          2HZ       LYS  95  -2.174   5.361  11.562
  680   3HZ   LYS  95          3HZ       LYS  95  -1.441   4.517  10.371
  Start of MODEL   11
    1   1H    ILE   1           H        ILE   1 -19.768  21.062   7.890
    2    HA   ILE   1           HA       ILE   1 -17.928  21.124   9.109
    3    HB   ILE   1           HB       ILE   1 -19.227  20.455  10.986
    4   1HG1  ILE   1          1HG1      ILE   1 -17.171  18.548  11.636
    5   2HG1  ILE   1          2HG1      ILE   1 -16.473  19.840  10.680
    6   1HG2  ILE   1          1HG2      ILE   1 -20.470  18.612  10.759
    7   2HG2  ILE   1          2HG2      ILE   1 -19.347  17.881   9.587
    8   3HG2  ILE   1          3HG2      ILE   1 -19.030  17.736  11.333
    9   1HD1  ILE   1          1HD1      ILE   1 -17.218  21.533  12.215
   10   2HD1  ILE   1          2HD1      ILE   1 -18.313  20.399  13.041
   11   3HD1  ILE   1          3HD1      ILE   1 -16.551  20.224  13.221
   12    H    SER   2           H        SER   2 -17.691  20.182   6.562
   13    HA   SER   2           HA       SER   2 -16.593  17.647   6.359
   14   1HB   SER   2          1HB       SER   2 -17.430  19.303   4.520
   15   2HB   SER   2          2HB       SER   2 -15.816  19.983   4.579
   16    HG   SER   2           HG       SER   2 -16.327  17.165   4.163
   17    H    GLU   3           H        GLU   3 -15.068  20.923   6.717
   18    HA   GLU   3           HA       GLU   3 -13.096  21.558   7.362
   19   1HB   GLU   3          1HB       GLU   3 -13.529  19.074   8.957
   20   2HB   GLU   3          2HB       GLU   3 -11.871  19.641   8.895
   21   1HG   GLU   3          1HG       GLU   3 -12.731  21.960   9.552
   22   2HG   GLU   3          2HG       GLU   3 -14.309  21.240   9.801
   23    H    PHE   4           H        PHE   4 -10.601  20.994   7.320
   24    HA   PHE   4           HA       PHE   4 -10.144  19.791   4.750
   25   1HB   PHE   4          1HB       PHE   4  -8.740  21.460   6.834
   26   2HB   PHE   4          2HB       PHE   4  -7.683  20.457   5.861
   27    HD1  PHE   4           1HD      PHE   4 -10.446  22.934   5.494
   28    HD2  PHE   4           2HD      PHE   4  -6.920  21.262   3.827
   29    HE1  PHE   4           1HE      PHE   4 -10.494  24.655   3.668
   30    HE2  PHE   4           2HE      PHE   4  -6.968  22.983   2.000
   31    HZ   PHE   4           HZ       PHE   4  -8.754  24.659   1.943
   32    H    ALA   5           H        ALA   5  -9.909  17.614   4.554
   33    HA   ALA   5           HA       ALA   5  -8.525  16.238   6.754
   34   1HB   ALA   5          1HB       ALA   5 -10.761  15.395   4.887
   35   2HB   ALA   5          2HB       ALA   5  -9.788  14.211   5.792
   36   3HB   ALA   5          3HB       ALA   5 -10.754  15.424   6.666
   37    HA   PRO   6           HA       PRO   6  -5.529  15.051   3.872
   38   1HB   PRO   6          1HB       PRO   6  -4.668  12.650   4.852
   39   2HB   PRO   6          2HB       PRO   6  -4.160  14.192   5.511
   40   1HG   PRO   6          1HG       PRO   6  -6.084  12.243   6.625
   41   2HG   PRO   6          2HG       PRO   6  -5.251  13.552   7.440
   42   1HD   PRO   6          1HD       PRO   6  -7.992  13.524   6.594
   43   2HD   PRO   6          2HD       PRO   6  -7.128  14.874   7.304
   44    H    VAL   7           H        VAL   7  -4.628  12.882   2.645
   45    HA   VAL   7           HA       VAL   7  -6.919  12.255   1.003
   46    HB   VAL   7           HB       VAL   7  -3.955  11.727   0.815
   47   1HG1  VAL   7          1HG1      VAL   7  -5.310  11.189  -1.659
   48   2HG1  VAL   7          2HG1      VAL   7  -4.276  10.113  -0.688
   49   3HG1  VAL   7          3HG1      VAL   7  -6.027  10.188  -0.374
   50   1HG2  VAL   7          1HG2      VAL   7  -4.018  13.820   0.006
   51   2HG2  VAL   7          2HG2      VAL   7  -4.776  13.104  -1.436
   52   3HG2  VAL   7          3HG2      VAL   7  -5.791  13.802  -0.151
   53    H    ASP   8           H        ASP   8  -4.817  10.763   3.456
   54    HA   ASP   8           HA       ASP   8  -4.958   8.894   4.545
   55   1HB   ASP   8          1HB       ASP   8  -7.470   9.549   4.559
   56   2HB   ASP   8          2HB       ASP   8  -7.680   8.371   3.278
   57    H    CYS   9           H        CYS   9  -4.171   6.767   4.126
   58    HA   CYS   9           HA       CYS   9  -4.613   5.774   1.407
   59   1HB   CYS   9          1HB       CYS   9  -2.015   5.815   2.952
   60   2HB   CYS   9          2HB       CYS   9  -2.279   4.854   1.511
   61    H    LYS  10           H        LYS  10  -3.420   3.279   1.646
   62    HA   LYS  10           HA       LYS  10  -3.690   1.241   2.449
   63   1HB   LYS  10          1HB       LYS  10  -2.604   2.175   4.469
   64   2HB   LYS  10          2HB       LYS  10  -4.177   2.585   5.124
   65   1HG   LYS  10          1HG       LYS  10  -4.835   0.152   4.987
   66   2HG   LYS  10          2HG       LYS  10  -3.225  -0.230   4.409
   67   1HD   LYS  10          1HD       LYS  10  -2.294   0.827   6.540
   68   2HD   LYS  10          2HD       LYS  10  -3.941   0.983   7.119
   69   1HE   LYS  10          1HE       LYS  10  -4.188  -1.558   6.716
   70   2HE   LYS  10          2HE       LYS  10  -2.454  -1.599   6.464
   71   1HZ   LYS  10          1HZ       LYS  10  -3.304  -1.999   8.782
   72   2HZ   LYS  10          2HZ       LYS  10  -2.077  -0.931   8.635
   73   3HZ   LYS  10          3HZ       LYS  10  -3.602  -0.395   8.871
   74    H    GLY  11           H        GLY  11  -6.110   2.972   4.523
   75   1HA   GLY  11          1HA       GLY  11  -8.142   1.098   4.101
   76   2HA   GLY  11          2HA       GLY  11  -8.338   2.736   4.693
   77    H    GLN  12           H        GLN  12  -7.268   4.146   2.375
   78    HA   GLN  12           HA       GLN  12  -9.612   4.197   0.849
   79   1HB   GLN  12          1HB       GLN  12  -7.106   5.704   1.051
   80   2HB   GLN  12          2HB       GLN  12  -7.608   5.537  -0.619
   81   1HG   GLN  12          1HG       GLN  12  -9.486   6.471   1.599
   82   2HG   GLN  12          2HG       GLN  12  -8.551   7.574   0.608
   83   1HE2  GLN  12          1HE2      GLN  12  -9.721   8.469  -0.893
   84   2HE2  GLN  12          2HE2      GLN  12 -10.952   7.725  -1.858
   85    H    CYS  13           H        CYS  13  -6.642   2.349   0.666
   86    HA   CYS  13           HA       CYS  13  -7.139   1.688  -2.121
   87   1HB   CYS  13          1HB       CYS  13  -4.833   1.147  -0.253
   88   2HB   CYS  13          2HB       CYS  13  -4.983   0.353  -1.808
   89    H    THR  14           H        THR  14  -9.290   0.758  -1.043
   90    HA   THR  14           HA       THR  14  -8.804  -1.871   0.142
   91    HB   THR  14           HB       THR  14 -11.156   0.049  -0.080
   92    HG1  THR  14           1HG      THR  14  -9.857  -1.524   2.031
   93   1HG2  THR  14          1HG2      THR  14 -12.645  -1.678   0.046
   94   2HG2  THR  14          2HG2      THR  14 -11.317  -2.859  -0.047
   95   3HG2  THR  14          3HG2      THR  14 -11.830  -2.220   1.533
   96    H    THR  15           H        THR  15 -10.363  -0.307  -2.706
   97    HA   THR  15           HA       THR  15 -11.331  -2.696  -3.816
   98    HB   THR  15           HB       THR  15 -10.919   0.159  -4.575
   99    HG1  THR  15           1HG      THR  15 -13.113  -0.479  -5.438
  100   1HG2  THR  15          1HG2      THR  15 -11.280  -0.202  -6.958
  101   2HG2  THR  15          2HG2      THR  15  -9.823  -1.125  -6.516
  102   3HG2  THR  15          3HG2      THR  15 -11.378  -1.964  -6.729
  103    HA   PRO  16           HA       PRO  16  -7.185  -2.837  -6.054
  104   1HB   PRO  16          1HB       PRO  16  -5.092  -1.343  -5.128
  105   2HB   PRO  16          2HB       PRO  16  -6.120  -0.835  -6.453
  106   1HG   PRO  16          1HG       PRO  16  -6.081   0.133  -3.660
  107   2HG   PRO  16          2HG       PRO  16  -6.777   0.896  -5.076
  108   1HD   PRO  16          1HD       PRO  16  -8.193  -0.493  -3.004
  109   2HD   PRO  16          2HD       PRO  16  -8.874   0.168  -4.477
  110    H    CYS  17           H        CYS  17  -7.436  -2.680  -2.660
  111    HA   CYS  17           HA       CYS  17  -5.511  -4.886  -2.519
  112   1HB   CYS  17          1HB       CYS  17  -6.279  -3.089  -0.220
  113   2HB   CYS  17          2HB       CYS  17  -4.979  -4.262  -0.286
  114    H    GLU  18           H        GLU  18  -8.382  -4.973  -3.306
  115    HA   GLU  18           HA       GLU  18  -9.841  -5.781  -1.026
  116   1HB   GLU  18          1HB       GLU  18 -10.350  -5.253  -3.823
  117   2HB   GLU  18          2HB       GLU  18 -11.034  -6.815  -3.421
  118   1HG   GLU  18          1HG       GLU  18 -11.806  -5.345  -1.220
  119   2HG   GLU  18          2HG       GLU  18 -11.808  -4.100  -2.453
  120    HA   PRO  19           HA       PRO  19  -8.964 -10.091  -2.782
  121   1HB   PRO  19          1HB       PRO  19  -7.325 -10.408  -4.946
  122   2HB   PRO  19          2HB       PRO  19  -9.071 -10.321  -5.071
  123   1HG   PRO  19          1HG       PRO  19  -7.060  -8.264  -5.751
  124   2HG   PRO  19          2HG       PRO  19  -8.736  -8.369  -6.252
  125   1HD   PRO  19          1HD       PRO  19  -7.651  -6.633  -4.243
  126   2HD   PRO  19          2HD       PRO  19  -9.342  -6.821  -4.663
  127    H    LEU  20           H        LEU  20  -6.395  -7.803  -2.730
  128    HA   LEU  20           HA       LEU  20  -4.386  -9.690  -2.080
  129   1HB   LEU  20          1HB       LEU  20  -3.534  -7.779  -2.987
  130   2HB   LEU  20          2HB       LEU  20  -4.664  -6.730  -2.153
  131    HG   LEU  20           HG       LEU  20  -2.195  -6.618  -1.488
  132   1HD1  LEU  20          1HD1      LEU  20  -4.562  -6.193  -0.059
  133   2HD1  LEU  20          2HD1      LEU  20  -3.478  -7.036   1.074
  134   3HD1  LEU  20          3HD1      LEU  20  -2.949  -5.527   0.293
  135   1HD2  LEU  20          1HD2      LEU  20  -2.699  -8.883   0.384
  136   2HD2  LEU  20          2HD2      LEU  20  -2.252  -9.270  -1.295
  137   3HD2  LEU  20          3HD2      LEU  20  -1.174  -8.266  -0.296
  138    H    THR  21           H        THR  21  -6.335  -7.335  -0.121
  139    HA   THR  21           HA       THR  21  -5.291  -8.097   2.349
  140    HB   THR  21           HB       THR  21  -7.951  -6.881   1.451
  141    HG1  THR  21           1HG      THR  21  -6.693  -5.001   2.314
  142   1HG2  THR  21          1HG2      THR  21  -8.655  -7.091   3.621
  143   2HG2  THR  21          2HG2      THR  21  -7.096  -7.791   4.118
  144   3HG2  THR  21          3HG2      THR  21  -7.303  -6.023   4.067
  145    H    ALA  22           H        ALA  22  -8.242  -9.284   0.618
  146    HA   ALA  22           HA       ALA  22  -9.142 -11.009   2.535
  147   1HB   ALA  22          1HB       ALA  22  -9.895 -12.355   0.413
  148   2HB   ALA  22          2HB       ALA  22 -10.515 -10.705   0.664
  149   3HB   ALA  22          3HB       ALA  22  -9.185 -10.991  -0.484
  150    H    CYS  23           H        CYS  23  -6.450 -11.409   0.189
  151    HA   CYS  23           HA       CYS  23  -6.044 -14.128   0.677
  152   1HB   CYS  23          1HB       CYS  23  -5.111 -12.478  -1.158
  153   2HB   CYS  23          2HB       CYS  23  -3.776 -12.310  -0.036
  154    H    LYS  24           H        LYS  24  -4.207 -11.203   1.853
  155    HA   LYS  24           HA       LYS  24  -2.600 -12.482   3.656
  156   1HB   LYS  24          1HB       LYS  24  -3.290  -9.811   2.969
  157   2HB   LYS  24          2HB       LYS  24  -3.401  -9.930   4.714
  158   1HG   LYS  24          1HG       LYS  24  -1.133 -10.544   4.959
  159   2HG   LYS  24          2HG       LYS  24  -1.014 -11.164   3.325
  160   1HD   LYS  24          1HD       LYS  24  -0.087  -9.177   2.737
  161   2HD   LYS  24          2HD       LYS  24  -1.671  -8.457   2.944
  162   1HE   LYS  24          1HE       LYS  24  -0.164  -8.852   5.485
  163   2HE   LYS  24          2HE       LYS  24   0.587  -7.729   4.370
  164   1HZ   LYS  24          1HZ       LYS  24  -1.302  -7.014   6.014
  165   2HZ   LYS  24          2HZ       LYS  24  -1.119  -6.299   4.558
  166   3HZ   LYS  24          3HZ       LYS  24  -2.259  -7.450   4.765
  167    H    GLU  25           H        GLU  25  -5.951 -11.207   4.136
  168    HA   GLU  25           HA       GLU  25  -6.119 -11.744   6.813
  169   1HB   GLU  25          1HB       GLU  25  -7.888 -10.993   4.676
  170   2HB   GLU  25          2HB       GLU  25  -8.669 -12.282   5.570
  171   1HG   GLU  25          1HG       GLU  25  -7.350 -10.135   7.204
  172   2HG   GLU  25          2HG       GLU  25  -8.791  -9.667   6.322
  173    H    LYS  26           H        LYS  26  -7.589 -13.790   4.180
  174    HA   LYS  26           HA       LYS  26  -8.292 -15.940   5.607
  175   1HB   LYS  26          1HB       LYS  26  -8.364 -15.415   3.041
  176   2HB   LYS  26          2HB       LYS  26  -6.878 -16.342   2.982
  177   1HG   LYS  26          1HG       LYS  26  -8.967 -17.655   4.613
  178   2HG   LYS  26          2HG       LYS  26  -9.475 -17.395   2.956
  179   1HD   LYS  26          1HD       LYS  26  -6.957 -18.332   2.489
  180   2HD   LYS  26          2HD       LYS  26  -7.268 -19.128   4.019
  181   1HE   LYS  26          1HE       LYS  26  -9.138 -20.330   3.167
  182   2HE   LYS  26          2HE       LYS  26  -9.361 -19.225   1.825
  183   1HZ   LYS  26          1HZ       LYS  26  -7.211 -20.017   0.971
  184   2HZ   LYS  26          2HZ       LYS  26  -7.157 -21.135   2.160
  185   3HZ   LYS  26          3HZ       LYS  26  -8.344 -21.192   1.040
  186    H    CYS  27           H        CYS  27  -4.956 -15.126   4.510
  187    HA   CYS  27           HA       CYS  27  -3.778 -17.495   5.352
  188   1HB   CYS  27          1HB       CYS  27  -2.563 -14.728   5.193
  189   2HB   CYS  27          2HB       CYS  27  -1.669 -16.231   5.321
  190    H    ALA  28           H        ALA  28  -3.919 -14.226   6.964
  191    HA   ALA  28           HA       ALA  28  -2.744 -14.785   9.316
  192   1HB   ALA  28          1HB       ALA  28  -5.005 -13.013   8.457
  193   2HB   ALA  28          2HB       ALA  28  -4.691 -13.176  10.202
  194   3HB   ALA  28          3HB       ALA  28  -3.409 -12.586   9.117
  195    H    GLU  29           H        GLU  29  -6.288 -15.250   8.631
  196    HA   GLU  29           HA       GLU  29  -6.919 -16.369  11.028
  197   1HB   GLU  29          1HB       GLU  29  -8.051 -16.631   8.239
  198   2HB   GLU  29          2HB       GLU  29  -8.713 -17.627   9.520
  199   1HG   GLU  29          1HG       GLU  29  -8.355 -14.693  10.100
  200   2HG   GLU  29          2HG       GLU  29  -9.643 -15.143   8.999
  201    H    SER  30           H        SER  30  -6.032 -18.108   7.955
  202    HA   SER  30           HA       SER  30  -6.100 -20.625   9.060
  203   1HB   SER  30          1HB       SER  30  -5.628 -19.555   6.558
  204   2HB   SER  30          2HB       SER  30  -4.039 -20.173   6.963
  205    HG   SER  30           HG       SER  30  -5.823 -22.075   7.678
  206    H    CYS  31           H        CYS  31  -3.857 -18.006   9.513
  207    HA   CYS  31           HA       CYS  31  -1.920 -19.882  10.661
  208   1HB   CYS  31          1HB       CYS  31  -1.501 -17.159   9.424
  209   2HB   CYS  31          2HB       CYS  31  -0.292 -17.958  10.409
  210    H    GLU  32           H        GLU  32  -3.963 -19.570  12.313
  211    HA   GLU  32           HA       GLU  32  -3.748 -17.138  13.797
  212   1HB   GLU  32          1HB       GLU  32  -5.662 -19.288  13.511
  213   2HB   GLU  32          2HB       GLU  32  -5.296 -19.092  15.213
  214   1HG   GLU  32          1HG       GLU  32  -5.667 -16.564  14.881
  215   2HG   GLU  32          2HG       GLU  32  -6.287 -16.945  13.287
  216    H    THR  33           H        THR  33  -2.339 -16.788  15.459
  217    HA   THR  33           HA       THR  33  -0.603 -17.237  16.818
  218    HB   THR  33           HB       THR  33  -2.778 -17.562  18.141
  219    HG1  THR  33           1HG      THR  33  -0.400 -17.686  18.883
  220   1HG2  THR  33          1HG2      THR  33  -3.703 -19.656  17.514
  221   2HG2  THR  33          2HG2      THR  33  -2.105 -20.434  17.415
  222   3HG2  THR  33          3HG2      THR  33  -2.821 -20.073  19.004
  223    H    SER  34           H        SER  34  -0.498 -18.700  14.276
  224    HA   SER  34           HA       SER  34   0.382 -21.314  14.952
  225   1HB   SER  34          1HB       SER  34  -0.287 -19.841  12.563
  226   2HB   SER  34          2HB       SER  34   1.318 -20.513  12.351
  227    HG   SER  34           HG       SER  34  -1.178 -21.843  12.686
  228    H    ALA  35           H        ALA  35   2.577 -22.105  14.896
  229    HA   ALA  35           HA       ALA  35   4.478 -20.520  16.049
  230   1HB   ALA  35          1HB       ALA  35   5.364 -22.687  14.180
  231   2HB   ALA  35          2HB       ALA  35   5.822 -22.381  15.872
  232   3HB   ALA  35          3HB       ALA  35   4.254 -23.135  15.497
  233    H    ASP  36           H        ASP  36   5.408 -18.671  15.337
  234    HA   ASP  36           HA       ASP  36   6.484 -17.281  14.060
  235   1HB   ASP  36          1HB       ASP  36   6.586 -19.365  11.839
  236   2HB   ASP  36          2HB       ASP  36   7.660 -17.997  12.054
  237    H    LYS  37           H        LYS  37   3.888 -16.762  14.105
  238    HA   LYS  37           HA       LYS  37   2.217 -17.138  12.034
  239   1HB   LYS  37          1HB       LYS  37   1.989 -15.782  14.253
  240   2HB   LYS  37          2HB       LYS  37   2.464 -14.406  13.277
  241   1HG   LYS  37          1HG       LYS  37   0.606 -15.133  11.617
  242   2HG   LYS  37          2HG       LYS  37   0.047 -16.217  12.875
  243   1HD   LYS  37          1HD       LYS  37   0.513 -13.285  13.505
  244   2HD   LYS  37          2HD       LYS  37  -0.966 -13.781  12.707
  245   1HE   LYS  37          1HE       LYS  37  -0.870 -15.636  14.734
  246   2HE   LYS  37          2HE       LYS  37  -0.057 -14.292  15.511
  247   1HZ   LYS  37          1HZ       LYS  37  -2.675 -14.114  14.187
  248   2HZ   LYS  37          2HZ       LYS  37  -2.446 -14.225  15.800
  249   3HZ   LYS  37          3HZ       LYS  37  -1.926 -12.906  14.991
  250    H    LYS  38           H        LYS  38   4.665 -14.460  12.249
  251    HA   LYS  38           HA       LYS  38   4.226 -13.243   9.889
  252   1HB   LYS  38          1HB       LYS  38   6.480 -13.572  11.717
  253   2HB   LYS  38          2HB       LYS  38   7.007 -13.332  10.064
  254   1HG   LYS  38          1HG       LYS  38   6.775 -11.129  10.969
  255   2HG   LYS  38          2HG       LYS  38   5.370 -11.351   9.945
  256   1HD   LYS  38          1HD       LYS  38   3.897 -11.582  11.770
  257   2HD   LYS  38          2HD       LYS  38   5.158 -12.126  12.858
  258   1HE   LYS  38          1HE       LYS  38   6.172  -9.729  12.576
  259   2HE   LYS  38          2HE       LYS  38   4.621  -9.292  11.888
  260   1HZ   LYS  38          1HZ       LYS  38   4.888 -10.591  14.506
  261   2HZ   LYS  38          2HZ       LYS  38   4.827  -8.970  14.314
  262   3HZ   LYS  38          3HZ       LYS  38   3.551  -9.892  13.880
  263    H    THR  39           H        THR  39   6.597 -15.975  10.290
  264    HA   THR  39           HA       THR  39   7.089 -16.353   7.606
  265    HB   THR  39           HB       THR  39   6.957 -18.474   9.812
  266    HG1  THR  39           1HG      THR  39   9.240 -17.622  10.040
  267   1HG2  THR  39          1HG2      THR  39   8.889 -19.440   8.618
  268   2HG2  THR  39          2HG2      THR  39   7.527 -19.298   7.480
  269   3HG2  THR  39          3HG2      THR  39   8.853 -18.112   7.433
  270    H    CYS  40           H        CYS  40   4.631 -18.093   9.633
  271    HA   CYS  40           HA       CYS  40   3.584 -19.695   7.753
  272   1HB   CYS  40          1HB       CYS  40   2.919 -19.481  10.170
  273   2HB   CYS  40          2HB       CYS  40   1.906 -18.125   9.717
  274    H    ARG  41           H        ARG  41   2.315 -16.361   8.526
  275    HA   ARG  41           HA       ARG  41   0.620 -16.205   6.408
  276   1HB   ARG  41          1HB       ARG  41   2.042 -14.221   8.163
  277   2HB   ARG  41          2HB       ARG  41   1.322 -13.579   6.700
  278   1HG   ARG  41          1HG       ARG  41  -0.882 -14.342   7.321
  279   2HG   ARG  41          2HG       ARG  41  -0.252 -15.378   8.586
  280   1HD   ARG  41          1HD       ARG  41  -0.713 -13.644  10.001
  281   2HD   ARG  41          2HD       ARG  41   0.742 -12.905   9.362
  282    HE   ARG  41           HE       ARG  41  -1.542 -12.372   7.649
  283   1HH1  ARG  41          2HH2      ARG  41   0.023 -11.373  10.638
  284   2HH1  ARG  41          1HH2      ARG  41  -0.633  -9.771  10.596
  285   1HH2  ARG  41          2HH1      ARG  41  -2.408 -10.258   7.593
  286   2HH2  ARG  41          1HH1      ARG  41  -2.026  -9.132   8.853
  287    H    ARG  42           H        ARG  42   4.086 -15.166   6.663
  288    HA   ARG  42           HA       ARG  42   4.356 -13.943   4.282
  289   1HB   ARG  42          1HB       ARG  42   6.097 -15.182   6.253
  290   2HB   ARG  42          2HB       ARG  42   6.714 -15.549   4.655
  291   1HG   ARG  42          1HG       ARG  42   7.718 -13.488   4.887
  292   2HG   ARG  42          2HG       ARG  42   6.178 -12.916   4.277
  293   1HD   ARG  42          1HD       ARG  42   5.515 -13.007   6.893
  294   2HD   ARG  42          2HD       ARG  42   7.248 -12.845   7.096
  295    HE   ARG  42           HE       ARG  42   7.149 -10.656   6.217
  296   1HH1  ARG  42          2HH2      ARG  42   4.070 -12.295   5.749
  297   2HH1  ARG  42          1HH2      ARG  42   3.230 -10.855   5.276
  298   1HH2  ARG  42          2HH1      ARG  42   6.041  -8.757   5.593
  299   2HH2  ARG  42          1HH1      ARG  42   4.359  -8.830   5.187
  300    H    ASN  43           H        ASN  43   4.692 -17.486   5.008
  301    HA   ASN  43           HA       ASN  43   5.404 -18.265   2.476
  302   1HB   ASN  43          1HB       ASN  43   4.419 -19.519   4.949
  303   2HB   ASN  43          2HB       ASN  43   3.778 -20.345   3.542
  304   1HD2  ASN  43          1HD2      ASN  43   6.497 -19.731   5.509
  305   2HD2  ASN  43          2HD2      ASN  43   7.677 -20.678   4.665
  306    H    CYS  44           H        CYS  44   2.175 -17.896   4.084
  307    HA   CYS  44           HA       CYS  44   0.647 -18.916   2.000
  308   1HB   CYS  44          1HB       CYS  44  -0.116 -18.539   4.337
  309   2HB   CYS  44          2HB       CYS  44  -0.144 -16.814   4.026
  310    H    LYS  45           H        LYS  45   1.941 -15.639   2.762
  311    HA   LYS  45           HA       LYS  45   0.548 -14.191   0.869
  312   1HB   LYS  45          1HB       LYS  45   2.402 -13.640   2.786
  313   2HB   LYS  45          2HB       LYS  45   3.371 -13.425   1.342
  314   1HG   LYS  45          1HG       LYS  45   0.750 -12.215   0.942
  315   2HG   LYS  45          2HG       LYS  45   1.449 -11.616   2.434
  316   1HD   LYS  45          1HD       LYS  45   3.209 -11.751  -0.019
  317   2HD   LYS  45          2HD       LYS  45   2.014 -10.472   0.076
  318   1HE   LYS  45          1HE       LYS  45   3.158  -9.350   1.718
  319   2HE   LYS  45          2HE       LYS  45   3.543 -10.819   2.593
  320   1HZ   LYS  45          1HZ       LYS  45   5.568 -10.326   1.810
  321   2HZ   LYS  45          2HZ       LYS  45   5.064 -11.137   0.485
  322   3HZ   LYS  45          3HZ       LYS  45   5.030  -9.504   0.505
  323    H    LYS  46           H        LYS  46   3.183 -16.518   0.526
  324    HA   LYS  46           HA       LYS  46   3.731 -15.659  -2.180
  325   1HB   LYS  46          1HB       LYS  46   5.584 -16.347  -0.753
  326   2HB   LYS  46          2HB       LYS  46   4.847 -17.914  -0.488
  327   1HG   LYS  46          1HG       LYS  46   6.325 -18.421  -2.228
  328   2HG   LYS  46          2HG       LYS  46   4.864 -18.081  -3.134
  329   1HD   LYS  46          1HD       LYS  46   5.756 -16.210  -4.099
  330   2HD   LYS  46          2HD       LYS  46   6.426 -15.637  -2.585
  331   1HE   LYS  46          1HE       LYS  46   7.774 -18.048  -3.722
  332   2HE   LYS  46          2HE       LYS  46   7.937 -16.591  -4.682
  333   1HZ   LYS  46          1HZ       LYS  46   8.353 -16.304  -1.842
  334   2HZ   LYS  46          2HZ       LYS  46   9.498 -17.134  -2.659
  335   3HZ   LYS  46          3HZ       LYS  46   9.140 -15.599  -3.087
  336    H    ALA  47           H        ALA  47   1.658 -17.877  -0.433
  337    HA   ALA  47           HA       ALA  47   1.291 -19.932  -2.163
  338   1HB   ALA  47          1HB       ALA  47  -1.000 -18.469  -0.814
  339   2HB   ALA  47          2HB       ALA  47  -0.830 -20.214  -1.121
  340   3HB   ALA  47          3HB       ALA  47   0.192 -19.422   0.102
  341    H    ASP  48           H        ASP  48  -0.538 -16.785  -2.231
  342    HA   ASP  48           HA       ASP  48  -0.351 -16.680  -5.029
  343   1HB   ASP  48          1HB       ASP  48  -2.219 -18.446  -4.504
  344   2HB   ASP  48          2HB       ASP  48  -3.178 -17.076  -3.980
  345    H    CYS  49           H        CYS  49   0.336 -14.925  -2.920
  346    HA   CYS  49           HA       CYS  49  -1.660 -12.820  -3.286
  347   1HB   CYS  49          1HB       CYS  49  -0.146 -12.922  -0.720
  348   2HB   CYS  49          2HB       CYS  49  -1.708 -12.212  -1.078
  349    H    GLU  50           H        GLU  50   1.010 -13.736  -4.546
  350    HA   GLU  50           HA       GLU  50   2.879 -11.793  -3.657
  351   1HB   GLU  50          1HB       GLU  50   2.822 -14.077  -5.511
  352   2HB   GLU  50          2HB       GLU  50   3.740 -12.732  -6.160
  353   1HG   GLU  50          1HG       GLU  50   4.539 -12.853  -3.457
  354   2HG   GLU  50          2HG       GLU  50   4.401 -14.535  -3.930
  355    HA   PRO  51           HA       PRO  51   1.509  -9.807  -7.747
  356   1HB   PRO  51          1HB       PRO  51  -0.724 -10.733  -9.023
  357   2HB   PRO  51          2HB       PRO  51   0.901 -11.230  -9.452
  358   1HG   PRO  51          1HG       PRO  51  -1.166 -12.735  -7.969
  359   2HG   PRO  51          2HG       PRO  51   0.272 -13.340  -8.767
  360   1HD   PRO  51          1HD       PRO  51  -0.097 -12.968  -5.947
  361   2HD   PRO  51          2HD       PRO  51   1.377 -13.463  -6.755
  362    H    GLN  52           H        GLN  52  -0.793 -10.829  -5.426
  363    HA   GLN  52           HA       GLN  52  -2.516  -8.629  -5.912
  364   1HB   GLN  52          1HB       GLN  52  -2.408 -10.330  -3.393
  365   2HB   GLN  52          2HB       GLN  52  -3.783  -9.452  -4.031
  366   1HG   GLN  52          1HG       GLN  52  -3.711 -10.940  -6.088
  367   2HG   GLN  52          2HG       GLN  52  -2.432 -11.866  -5.327
  368   1HE2  GLN  52          1HE2      GLN  52  -4.608 -13.191  -6.040
  369   2HE2  GLN  52          2HE2      GLN  52  -5.591 -13.646  -4.688
  370    H    ASP  53           H        ASP  53  -0.105  -9.517  -3.347
  371    HA   ASP  53           HA       ASP  53  -0.415  -7.268  -1.825
  372   1HB   ASP  53          1HB       ASP  53   1.001  -9.423  -1.437
  373   2HB   ASP  53          2HB       ASP  53   2.269  -8.613  -2.337
  374    H    LYS  54           H        LYS  54   1.291  -7.856  -4.896
  375    HA   LYS  54           HA       LYS  54   2.928  -5.546  -4.804
  376   1HB   LYS  54          1HB       LYS  54   2.125  -7.523  -6.928
  377   2HB   LYS  54          2HB       LYS  54   3.002  -6.069  -7.359
  378   1HG   LYS  54          1HG       LYS  54   4.720  -6.687  -5.557
  379   2HG   LYS  54          2HG       LYS  54   3.893  -8.223  -5.391
  380   1HD   LYS  54          1HD       LYS  54   5.017  -9.043  -7.178
  381   2HD   LYS  54          2HD       LYS  54   4.321  -7.802  -8.202
  382   1HE   LYS  54          1HE       LYS  54   6.238  -6.546  -8.196
  383   2HE   LYS  54          2HE       LYS  54   6.494  -6.769  -6.476
  384   1HZ   LYS  54          1HZ       LYS  54   7.957  -7.925  -8.350
  385   2HZ   LYS  54          2HZ       LYS  54   7.788  -8.530  -6.842
  386   3HZ   LYS  54          3HZ       LYS  54   6.884  -9.123  -8.066
  387    H    VAL  55           H        VAL  55  -0.032  -6.324  -6.773
  388    HA   VAL  55           HA       VAL  55  -0.445  -3.883  -7.861
  389    HB   VAL  55           HB       VAL  55  -2.315  -6.020  -6.874
  390   1HG1  VAL  55          1HG1      VAL  55  -4.189  -4.931  -7.942
  391   2HG1  VAL  55          2HG1      VAL  55  -3.488  -3.819  -6.742
  392   3HG1  VAL  55          3HG1      VAL  55  -3.157  -3.581  -8.474
  393   1HG2  VAL  55          1HG2      VAL  55  -1.239  -6.815  -8.759
  394   2HG2  VAL  55          2HG2      VAL  55  -2.675  -6.049  -9.480
  395   3HG2  VAL  55          3HG2      VAL  55  -1.110  -5.202  -9.501
  396    H    CYS  56           H        CYS  56  -1.509  -5.006  -4.585
  397    HA   CYS  56           HA       CYS  56  -2.831  -2.688  -3.881
  398   1HB   CYS  56          1HB       CYS  56  -3.097  -4.697  -2.610
  399   2HB   CYS  56          2HB       CYS  56  -1.392  -4.749  -2.207
  400    H    ASP  57           H        ASP  57   0.584  -3.750  -3.185
  401    HA   ASP  57           HA       ASP  57   1.519  -1.712  -1.812
  402   1HB   ASP  57          1HB       ASP  57   2.615  -3.599  -3.755
  403   2HB   ASP  57          2HB       ASP  57   3.477  -2.077  -3.856
  404    H    ALA  58           H        ALA  58   1.185  -1.826  -5.435
  405    HA   ALA  58           HA       ALA  58   2.245   0.585  -6.106
  406   1HB   ALA  58          1HB       ALA  58   1.569  -0.265  -8.071
  407   2HB   ALA  58          2HB       ALA  58   0.467  -1.391  -7.244
  408   3HB   ALA  58          3HB       ALA  58  -0.092   0.241  -7.682
  409    H    CYS  59           H        CYS  59  -1.296   0.004  -5.483
  410    HA   CYS  59           HA       CYS  59  -2.172   2.528  -5.564
  411   1HB   CYS  59          1HB       CYS  59  -3.493   0.437  -5.115
  412   2HB   CYS  59          2HB       CYS  59  -3.017   0.558  -3.433
  413    H    ARG  60           H        ARG  60  -0.812   0.851  -2.630
  414    HA   ARG  60           HA       ARG  60  -0.944   3.023  -0.973
  415   1HB   ARG  60          1HB       ARG  60   0.974   0.648  -1.049
  416   2HB   ARG  60          2HB       ARG  60   0.989   1.810   0.263
  417   1HG   ARG  60          1HG       ARG  60  -1.690   1.258   0.179
  418   2HG   ARG  60          2HG       ARG  60  -1.061  -0.267  -0.413
  419   1HD   ARG  60          1HD       ARG  60   0.609   0.403   1.786
  420   2HD   ARG  60          2HD       ARG  60  -1.012   0.816   2.310
  421    HE   ARG  60           HE       ARG  60  -1.094  -1.746   1.029
  422   1HH1  ARG  60          2HH2      ARG  60   0.107  -0.230   3.968
  423   2HH1  ARG  60          1HH2      ARG  60   0.010  -1.681   4.909
  424   1HH2  ARG  60          2HH1      ARG  60  -1.222  -3.661   2.269
  425   2HH2  ARG  60          1HH1      ARG  60  -0.751  -3.646   3.936
  426    H    MET  61           H        MET  61   1.502   2.045  -3.403
  427    HA   MET  61           HA       MET  61   3.437   3.901  -2.549
  428   1HB   MET  61          1HB       MET  61   4.247   2.057  -3.836
  429   2HB   MET  61          2HB       MET  61   2.947   2.176  -5.005
  430   1HG   MET  61          1HG       MET  61   4.065   3.722  -6.283
  431   2HG   MET  61          2HG       MET  61   4.628   4.618  -4.885
  432   1HE   MET  61          1HE       MET  61   6.583   1.256  -7.168
  433   2HE   MET  61          2HE       MET  61   5.467   0.620  -5.936
  434   3HE   MET  61          3HE       MET  61   4.877   1.764  -7.165
  435    H    LYS  62           H        LYS  62   0.688   3.970  -4.826
  436    HA   LYS  62           HA       LYS  62   1.511   6.470  -5.977
  437   1HB   LYS  62          1HB       LYS  62  -0.319   4.365  -6.608
  438   2HB   LYS  62          2HB       LYS  62  -1.230   5.859  -6.518
  439   1HG   LYS  62          1HG       LYS  62  -0.498   6.032  -8.709
  440   2HG   LYS  62          2HG       LYS  62   0.855   6.817  -7.919
  441   1HD   LYS  62          1HD       LYS  62   1.756   4.276  -7.752
  442   2HD   LYS  62          2HD       LYS  62   0.699   4.064  -9.133
  443   1HE   LYS  62          1HE       LYS  62   2.750   6.317  -9.000
  444   2HE   LYS  62          2HE       LYS  62   3.151   4.732  -9.630
  445   1HZ   LYS  62          1HZ       LYS  62   1.919   5.076 -11.450
  446   2HZ   LYS  62          2HZ       LYS  62   0.754   5.926 -10.683
  447   3HZ   LYS  62          3HZ       LYS  62   2.151   6.656 -11.107
  448    H    CYS  63           H        CYS  63  -1.204   5.345  -3.838
  449    HA   CYS  63           HA       CYS  63  -2.439   7.660  -3.358
  450   1HB   CYS  63          1HB       CYS  63  -3.093   5.511  -2.396
  451   2HB   CYS  63          2HB       CYS  63  -1.731   5.564  -1.294
  452    H    HIS  64           H        HIS  64   0.559   6.447  -1.699
  453    HA   HIS  64           HA       HIS  64   0.952   8.468   0.060
  454   1HB   HIS  64          1HB       HIS  64   2.325   6.269  -0.666
  455   2HB   HIS  64          2HB       HIS  64   3.349   7.482  -1.408
  456    HD1  HIS  64           1HD      HIS  64   5.284   7.882   0.110
  457    HD2  HIS  64           2HD      HIS  64   1.686   7.481   2.227
  458    HE1  HIS  64           1HE      HIS  64   5.854   8.266   2.567
  459    H    LYS  65           H        LYS  65   2.611   8.345  -3.177
  460    HA   LYS  65           HA       LYS  65   3.454  10.967  -3.131
  461   1HB   LYS  65          1HB       LYS  65   2.942   8.966  -5.319
  462   2HB   LYS  65          2HB       LYS  65   3.395  10.609  -5.725
  463   1HG   LYS  65          1HG       LYS  65   5.393  10.374  -4.163
  464   2HG   LYS  65          2HG       LYS  65   4.968   8.688  -3.945
  465   1HD   LYS  65          1HD       LYS  65   5.205   9.673  -6.777
  466   2HD   LYS  65          2HD       LYS  65   6.693   9.526  -5.864
  467   1HE   LYS  65          1HE       LYS  65   4.910   7.184  -5.534
  468   2HE   LYS  65          2HE       LYS  65   5.389   7.444  -7.200
  469   1HZ   LYS  65          1HZ       LYS  65   7.607   7.806  -5.556
  470   2HZ   LYS  65          2HZ       LYS  65   6.908   6.383  -5.162
  471   3HZ   LYS  65          3HZ       LYS  65   7.369   6.668  -6.703
  472    H    ALA  66           H        ALA  66   0.466   9.570  -4.649
  473    HA   ALA  66           HA       ALA  66  -0.602  11.811  -5.715
  474   1HB   ALA  66          1HB       ALA  66  -1.546   9.233  -4.703
  475   2HB   ALA  66          2HB       ALA  66  -2.778  10.506  -4.536
  476   3HB   ALA  66          3HB       ALA  66  -2.072  10.155  -6.131
  477    H    CYS  67           H        CYS  67  -1.124  10.669  -2.299
  478    HA   CYS  67           HA       CYS  67  -2.630  12.743  -1.425
  479   1HB   CYS  67          1HB       CYS  67  -2.322  10.908   0.002
  480   2HB   CYS  67          2HB       CYS  67  -0.575  11.040  -0.039
  481    H    ARG  68           H        ARG  68   0.989  12.475  -1.564
  482    HA   ARG  68           HA       ARG  68   1.539  14.897  -0.427
  483   1HB   ARG  68          1HB       ARG  68   3.200  13.069  -0.982
  484   2HB   ARG  68          2HB       ARG  68   3.091  13.514  -2.674
  485   1HG   ARG  68          1HG       ARG  68   3.637  15.969  -1.610
  486   2HG   ARG  68          2HG       ARG  68   4.419  14.962  -0.408
  487   1HD   ARG  68          1HD       ARG  68   4.960  14.191  -3.246
  488   2HD   ARG  68          2HD       ARG  68   5.605  15.748  -2.765
  489    HE   ARG  68           HE       ARG  68   6.390  14.171  -0.670
  490   1HH1  ARG  68          2HH2      ARG  68   6.636  13.733  -4.153
  491   2HH1  ARG  68          1HH2      ARG  68   8.079  12.780  -4.060
  492   1HH2  ARG  68          2HH1      ARG  68   8.294  12.914  -0.547
  493   2HH2  ARG  68          1HH1      ARG  68   9.029  12.311  -1.994
  494    H    ALA  69           H        ALA  69   0.929  14.007  -3.882
  495    HA   ALA  69           HA       ALA  69   1.277  16.732  -4.743
  496   1HB   ALA  69          1HB       ALA  69   1.030  14.053  -5.925
  497   2HB   ALA  69          2HB       ALA  69   0.115  15.291  -6.818
  498   3HB   ALA  69          3HB       ALA  69   1.861  15.500  -6.544
  499    H    ALA  70           H        ALA  70  -1.022  15.326  -2.885
  500    HA   ALA  70           HA       ALA  70  -3.279  16.515  -4.317
  501   1HB   ALA  70          1HB       ALA  70  -4.662  15.155  -2.915
  502   2HB   ALA  70          2HB       ALA  70  -3.315  14.118  -3.444
  503   3HB   ALA  70          3HB       ALA  70  -3.315  14.809  -1.804
  504    H    ASN  71           H        ASN  71  -2.153  16.246  -0.866
  505    HA   ASN  71           HA       ASN  71  -3.372  18.789  -0.366
  506   1HB   ASN  71          1HB       ASN  71  -1.779  16.927   1.475
  507   2HB   ASN  71          2HB       ASN  71  -2.674  18.335   2.010
  508   1HD2  ASN  71          1HD2      ASN  71  -2.833  15.258   2.274
  509   2HD2  ASN  71          2HD2      ASN  71  -4.512  14.893   2.058
  510    H    CYS  72           H        CYS  72  -0.109  17.201   0.018
  511    HA   CYS  72           HA       CYS  72   1.197  19.635   0.596
  512   1HB   CYS  72          1HB       CYS  72   2.442  17.060  -0.379
  513   2HB   CYS  72          2HB       CYS  72   3.239  18.367   0.473
  514    H    ALA  73           H        ALA  73  -0.096  20.596  -1.432
  515    HA   ALA  73           HA       ALA  73   1.315  20.046  -3.919
  516   1HB   ALA  73          1HB       ALA  73  -1.241  21.435  -3.117
  517   2HB   ALA  73          2HB       ALA  73  -0.499  21.781  -4.698
  518   3HB   ALA  73          3HB       ALA  73  -0.991  20.119  -4.289
  519    H    SER  74           H        SER  74   1.381  22.178  -1.194
  520    HA   SER  74           HA       SER  74   2.754  24.185  -2.791
  521   1HB   SER  74          1HB       SER  74   0.741  24.674  -1.135
  522   2HB   SER  74          2HB       SER  74   1.974  24.573   0.106
  523    HG   SER  74           HG       SER  74   3.124  26.292  -0.882
  524    H    GLU  75           H        GLU  75   3.078  21.730  -0.280
  525    HA   GLU  75           HA       GLU  75   5.633  22.751   0.549
  526   1HB   GLU  75          1HB       GLU  75   4.052  20.274   1.361
  527   2HB   GLU  75          2HB       GLU  75   5.605  20.704   2.050
  528   1HG   GLU  75          1HG       GLU  75   3.638  22.934   2.044
  529   2HG   GLU  75          2HG       GLU  75   3.142  21.557   3.009
  530    H    CYS  76           H        CYS  76   4.514  21.099  -2.117
  531    HA   CYS  76           HA       CYS  76   7.147  20.026  -2.607
  532   1HB   CYS  76          1HB       CYS  76   4.890  18.161  -3.195
  533   2HB   CYS  76          2HB       CYS  76   6.594  17.824  -2.969
  534    HA   PRO  77           HA       PRO  77   5.332  22.057  -6.168
  535   1HB   PRO  77          1HB       PRO  77   7.631  23.225  -7.073
  536   2HB   PRO  77          2HB       PRO  77   6.533  24.009  -5.955
  537   1HG   PRO  77          1HG       PRO  77   9.164  22.776  -5.411
  538   2HG   PRO  77          2HG       PRO  77   8.262  23.916  -4.431
  539   1HD   PRO  77          1HD       PRO  77   8.515  21.093  -3.987
  540   2HD   PRO  77          2HD       PRO  77   7.520  22.212  -3.077
  541    H    LYS  78           H        LYS  78   6.676  22.323  -8.566
  542    HA   LYS  78           HA       LYS  78   6.241  19.972  -9.771
  543   1HB   LYS  78          1HB       LYS  78   6.723  21.965 -11.017
  544   2HB   LYS  78          2HB       LYS  78   8.350  22.059 -10.374
  545   1HG   LYS  78          1HG       LYS  78   8.522  21.113 -12.594
  546   2HG   LYS  78          2HG       LYS  78   8.850  19.818 -11.460
  547   1HD   LYS  78          1HD       LYS  78   5.973  20.055 -12.080
  548   2HD   LYS  78          2HD       LYS  78   6.938  19.774 -13.516
  549   1HE   LYS  78          1HE       LYS  78   7.196  17.591 -12.957
  550   2HE   LYS  78          2HE       LYS  78   7.939  18.041 -11.434
  551   1HZ   LYS  78          1HZ       LYS  78   6.117  17.119 -10.591
  552   2HZ   LYS  78          2HZ       LYS  78   5.369  18.524 -10.953
  553   3HZ   LYS  78          3HZ       LYS  78   5.244  17.249 -11.965
  554    H    HIS  79           H        HIS  79   9.577  20.985  -8.728
  555    HA   HIS  79           HA       HIS  79  10.119  18.127  -8.371
  556   1HB   HIS  79          1HB       HIS  79  11.862  20.387  -9.351
  557   2HB   HIS  79          2HB       HIS  79  12.558  18.915  -8.702
  558    HD1  HIS  79           1HD      HIS  79  13.175  19.505 -11.587
  559    HD2  HIS  79           2HD      HIS  79   9.769  17.355 -10.415
  560    HE1  HIS  79           1HE      HIS  79  12.464  18.131 -13.616
  561    H    GLU  80           H        GLU  80   9.841  17.718  -6.217
  562    HA   GLU  80           HA       GLU  80  10.658  19.752  -4.351
  563   1HB   GLU  80          1HB       GLU  80   9.543  18.370  -2.665
  564   2HB   GLU  80          2HB       GLU  80   8.487  18.572  -4.049
  565   1HG   GLU  80          1HG       GLU  80   8.291  16.276  -3.779
  566   2HG   GLU  80          2HG       GLU  80   9.665  16.305  -4.867
  567    H    HIS  81           H        HIS  81  11.538  16.445  -5.433
  568    HA   HIS  81           HA       HIS  81  13.184  15.087  -4.839
  569   1HB   HIS  81          1HB       HIS  81  15.468  16.274  -4.857
  570   2HB   HIS  81          2HB       HIS  81  14.481  16.324  -6.304
  571    HD1  HIS  81           1HD      HIS  81  16.114  18.492  -3.791
  572    HD2  HIS  81           2HD      HIS  81  13.164  18.890  -6.746
  573    HE1  HIS  81           1HE      HIS  81  15.830  20.997  -4.185
  574    H    LYS  82           H        LYS  82  12.436  14.392  -2.772
  575    HA   LYS  82           HA       LYS  82  12.245  14.487  -0.513
  576   1HB   LYS  82          1HB       LYS  82  14.226  13.616   0.460
  577   2HB   LYS  82          2HB       LYS  82  14.180  13.038  -1.194
  578   1HG   LYS  82          1HG       LYS  82  15.546  15.471  -1.428
  579   2HG   LYS  82          2HG       LYS  82  16.120  14.852   0.107
  580   1HD   LYS  82          1HD       LYS  82  17.308  13.165  -0.879
  581   2HD   LYS  82          2HD       LYS  82  16.001  12.756  -1.971
  582   1HE   LYS  82          1HE       LYS  82  17.047  13.832  -3.671
  583   2HE   LYS  82          2HE       LYS  82  17.020  15.334  -2.769
  584   1HZ   LYS  82          1HZ       LYS  82  19.249  14.779  -3.196
  585   2HZ   LYS  82          2HZ       LYS  82  19.020  14.503  -1.602
  586   3HZ   LYS  82          3HZ       LYS  82  19.081  13.250  -2.647
  587    H    SER  83           H        SER  83  11.337  16.660  -0.320
  588    HA   SER  83           HA       SER  83  13.282  18.692   0.338
  589   1HB   SER  83          1HB       SER  83  11.259  19.087  -1.199
  590   2HB   SER  83          2HB       SER  83  10.251  18.970   0.230
  591    HG   SER  83           HG       SER  83  10.903  20.918   0.909
  592    H    ASP  84           H        ASP  84  12.929  20.031   2.358
  593    HA   ASP  84           HA       ASP  84  12.481  18.257   4.530
  594   1HB   ASP  84          1HB       ASP  84  14.264  20.084   4.413
  595   2HB   ASP  84          2HB       ASP  84  12.982  21.269   4.571
  596    H    THR  85           H        THR  85  10.890  21.051   2.926
  597    HA   THR  85           HA       THR  85   8.887  21.350   4.963
  598    HB   THR  85           HB       THR  85   9.982  22.979   3.040
  599    HG1  THR  85           1HG      THR  85   8.124  24.299   3.697
  600   1HG2  THR  85          1HG2      THR  85   8.767  21.863   1.161
  601   2HG2  THR  85          2HG2      THR  85   7.230  22.078   2.034
  602   3HG2  THR  85          3HG2      THR  85   8.126  23.499   1.444
  603    H    CYS  86           H        CYS  86   9.352  19.352   2.114
  604    HA   CYS  86           HA       CYS  86   6.585  18.865   1.713
  605   1HB   CYS  86          1HB       CYS  86   8.294  18.650  -0.061
  606   2HB   CYS  86          2HB       CYS  86   8.989  17.280   0.782
  607    H    ARG  87           H        ARG  87   9.286  16.634   2.725
  608    HA   ARG  87           HA       ARG  87   7.851  14.611   3.636
  609   1HB   ARG  87          1HB       ARG  87  10.349  15.840   4.901
  610   2HB   ARG  87          2HB       ARG  87   9.734  14.264   5.357
  611   1HG   ARG  87          1HG       ARG  87   9.836  13.676   2.821
  612   2HG   ARG  87          2HG       ARG  87  10.796  15.131   2.639
  613   1HD   ARG  87          1HD       ARG  87  12.544  14.291   4.072
  614   2HD   ARG  87          2HD       ARG  87  11.527  13.007   4.696
  615    HE   ARG  87           HE       ARG  87  11.743  12.724   1.846
  616   1HH1  ARG  87          2HH2      ARG  87  13.658  12.343   4.774
  617   2HH1  ARG  87          1HH2      ARG  87  14.689  11.128   4.094
  618   1HH2  ARG  87          2HH1      ARG  87  13.103  11.122   0.949
  619   2HH2  ARG  87          1HH1      ARG  87  14.371  10.429   1.904
  620    H    ALA  88           H        ALA  88   8.331  17.773   5.236
  621    HA   ALA  88           HA       ALA  88   7.386  17.053   7.774
  622   1HB   ALA  88          1HB       ALA  88   8.017  19.501   6.239
  623   2HB   ALA  88          2HB       ALA  88   6.765  19.720   7.485
  624   3HB   ALA  88          3HB       ALA  88   8.368  19.092   7.936
  625    H    CYS  89           H        CYS  89   5.733  18.582   4.922
  626    HA   CYS  89           HA       CYS  89   3.236  18.737   6.068
  627   1HB   CYS  89          1HB       CYS  89   3.580  19.924   4.086
  628   2HB   CYS  89          2HB       CYS  89   4.193  18.524   3.229
  629    H    MET  90           H        MET  90   4.571  16.191   3.824
  630    HA   MET  90           HA       MET  90   2.484  14.493   3.859
  631   1HB   MET  90          1HB       MET  90   5.504  14.068   3.783
  632   2HB   MET  90          2HB       MET  90   4.429  12.687   3.678
  633   1HG   MET  90          1HG       MET  90   3.226  14.096   1.778
  634   2HG   MET  90          2HG       MET  90   4.728  14.998   1.734
  635   1HE   MET  90          1HE       MET  90   4.050  10.633   0.526
  636   2HE   MET  90          2HE       MET  90   3.604  11.209   2.150
  637   3HE   MET  90          3HE       MET  90   2.830  11.916   0.711
  638    H    LYS  91           H        LYS  91   4.826  15.118   6.452
  639    HA   LYS  91           HA       LYS  91   4.692  12.869   7.956
  640   1HB   LYS  91          1HB       LYS  91   5.927  15.119   8.320
  641   2HB   LYS  91          2HB       LYS  91   4.495  15.608   9.204
  642   1HG   LYS  91          1HG       LYS  91   4.753  13.855  10.825
  643   2HG   LYS  91          2HG       LYS  91   5.880  12.970   9.816
  644   1HD   LYS  91          1HD       LYS  91   7.663  14.153  10.597
  645   2HD   LYS  91          2HD       LYS  91   6.857  15.687  10.338
  646   1HE   LYS  91          1HE       LYS  91   7.197  15.570  12.701
  647   2HE   LYS  91          2HE       LYS  91   5.499  15.199  12.477
  648   1HZ   LYS  91          1HZ       LYS  91   5.855  13.257  13.412
  649   2HZ   LYS  91          2HZ       LYS  91   6.959  12.840  12.282
  650   3HZ   LYS  91          3HZ       LYS  91   7.432  13.612  13.641
  651    H    THR  92           H        THR  92   2.331  15.628   8.019
  652    HA   THR  92           HA       THR  92   0.472  13.833   9.420
  653    HB   THR  92           HB       THR  92   0.841  16.854   9.242
  654    HG1  THR  92           1HG      THR  92   0.461  14.826  11.334
  655   1HG2  THR  92          1HG2      THR  92  -1.492  16.934   9.283
  656   2HG2  THR  92          2HG2      THR  92  -1.636  15.260   9.873
  657   3HG2  THR  92          3HG2      THR  92  -1.211  16.569  11.003
  658    H    ASN  93           H        ASN  93   0.481  16.371   6.823
  659    HA   ASN  93           HA       ASN  93  -1.964  16.049   5.871
  660   1HB   ASN  93          1HB       ASN  93   0.700  16.505   4.511
  661   2HB   ASN  93          2HB       ASN  93  -0.701  16.261   3.487
  662   1HD2  ASN  93          1HD2      ASN  93   0.606  18.170   6.150
  663   2HD2  ASN  93          2HD2      ASN  93  -0.314  19.612   5.879
  664    H    CYS  94           H        CYS  94   0.917  13.955   5.198
  665    HA   CYS  94           HA       CYS  94  -0.911  12.013   3.980
  666   1HB   CYS  94          1HB       CYS  94   2.023  12.512   3.449
  667   2HB   CYS  94          2HB       CYS  94   1.155  11.104   2.870
  668    H    LYS  95           H        LYS  95  -1.302  11.579   6.423
  669    HA   LYS  95           HA       LYS  95   0.529  10.761   8.214
  670   1HB   LYS  95          1HB       LYS  95  -2.307  10.049   7.656
  671   2HB   LYS  95          2HB       LYS  95  -1.439   9.000   8.758
  672   1HG   LYS  95          1HG       LYS  95  -1.029  11.923   9.217
  673   2HG   LYS  95          2HG       LYS  95  -2.661  11.351   9.502
  674   1HD   LYS  95          1HD       LYS  95  -1.175   9.373  10.746
  675   2HD   LYS  95          2HD       LYS  95  -0.162  10.777  11.016
  676   1HE   LYS  95          1HE       LYS  95  -1.533  11.327  12.742
  677   2HE   LYS  95          2HE       LYS  95  -2.760  11.724  11.555
  678   1HZ   LYS  95          1HZ       LYS  95  -2.629   8.943  11.972
  679   2HZ   LYS  95          2HZ       LYS  95  -2.868   9.719  13.389
  680   3HZ   LYS  95          3HZ       LYS  95  -3.902   9.951  12.146
  Start of MODEL   12
    1   1H    ILE   1           H        ILE   1 -13.797  13.670   7.943
    2    HA   ILE   1           HA       ILE   1 -14.834  13.698  10.690
    3    HB   ILE   1           HB       ILE   1 -12.945  11.782   9.319
    4   1HG1  ILE   1          1HG1      ILE   1 -15.150  10.411  10.352
    5   2HG1  ILE   1          2HG1      ILE   1 -15.842  11.857   9.645
    6   1HG2  ILE   1          1HG2      ILE   1 -12.559  12.356  11.821
    7   2HG2  ILE   1          2HG2      ILE   1 -14.043  11.411  12.092
    8   3HG2  ILE   1          3HG2      ILE   1 -12.633  10.650  11.316
    9   1HD1  ILE   1          1HD1      ILE   1 -15.071  11.348   7.484
   10   2HD1  ILE   1          2HD1      ILE   1 -13.751  10.319   8.090
   11   3HD1  ILE   1          3HD1      ILE   1 -15.430   9.730   8.133
   12    H    SER   2           H        SER   2 -11.647  13.590   8.936
   13    HA   SER   2           HA       SER   2 -10.806  16.007   9.999
   14   1HB   SER   2          1HB       SER   2 -10.445  13.687  11.755
   15   2HB   SER   2          2HB       SER   2  -8.902  14.410  11.344
   16    HG   SER   2           HG       SER   2  -9.367  16.159  12.513
   17    H    GLU   3           H        GLU   3  -8.521  16.481   9.347
   18    HA   GLU   3           HA       GLU   3  -7.405  14.445   7.609
   19   1HB   GLU   3          1HB       GLU   3  -8.820  16.069   6.256
   20   2HB   GLU   3          2HB       GLU   3  -7.731  17.351   6.747
   21   1HG   GLU   3          1HG       GLU   3  -6.186  16.744   5.196
   22   2HG   GLU   3          2HG       GLU   3  -6.192  15.082   5.750
   23    H    PHE   4           H        PHE   4  -5.939  14.233   9.499
   24    HA   PHE   4           HA       PHE   4  -3.890  16.324   9.406
   25   1HB   PHE   4          1HB       PHE   4  -5.632  15.403  11.594
   26   2HB   PHE   4          2HB       PHE   4  -3.963  15.050  11.995
   27    HD1  PHE   4           1HD      PHE   4  -2.288  17.063  11.618
   28    HD2  PHE   4           2HD      PHE   4  -6.480  17.485  12.129
   29    HE1  PHE   4           1HE      PHE   4  -1.960  19.442  12.345
   30    HE2  PHE   4           2HE      PHE   4  -6.151  19.865  12.856
   31    HZ   PHE   4           HZ       PHE   4  -3.895  20.815  12.956
   32    H    ALA   5           H        ALA   5  -4.668  12.990  10.641
   33    HA   ALA   5           HA       ALA   5  -2.074  12.096  10.852
   34   1HB   ALA   5          1HB       ALA   5  -4.727  11.057  10.997
   35   2HB   ALA   5          2HB       ALA   5  -3.795   9.978   9.932
   36   3HB   ALA   5          3HB       ALA   5  -3.222  10.311  11.584
   37    HA   PRO   6           HA       PRO   6  -0.720  11.451   6.797
   38   1HB   PRO   6          1HB       PRO   6   0.859   9.230   7.000
   39   2HB   PRO   6          2HB       PRO   6   1.386  10.828   7.489
   40   1HG   PRO   6          1HG       PRO   6   0.566   8.548   9.182
   41   2HG   PRO   6          2HG       PRO   6   1.482   9.973   9.629
   42   1HD   PRO   6          1HD       PRO   6  -1.283   9.463  10.194
   43   2HD   PRO   6          2HD       PRO   6  -0.397  10.936  10.538
   44    H    VAL   7           H        VAL   7  -1.275  10.658   4.809
   45    HA   VAL   7           HA       VAL   7  -3.529   8.990   4.812
   46    HB   VAL   7           HB       VAL   7  -1.617   9.775   2.603
   47   1HG1  VAL   7          1HG1      VAL   7  -4.285   9.322   1.670
   48   2HG1  VAL   7          2HG1      VAL   7  -2.784   8.479   1.215
   49   3HG1  VAL   7          3HG1      VAL   7  -3.758   7.889   2.584
   50   1HG2  VAL   7          1HG2      VAL   7  -4.328  10.997   2.996
   51   2HG2  VAL   7          2HG2      VAL   7  -2.981  11.535   4.028
   52   3HG2  VAL   7          3HG2      VAL   7  -2.860  11.684   2.258
   53    H    ASP   8           H        ASP   8  -0.356   8.279   3.198
   54    HA   ASP   8           HA       ASP   8   0.807   6.456   3.031
   55   1HB   ASP   8          1HB       ASP   8  -0.763   5.427   5.443
   56   2HB   ASP   8          2HB       ASP   8   0.714   4.716   4.823
   57    H    CYS   9           H        CYS   9  -2.151   6.790   2.058
   58    HA   CYS   9           HA       CYS   9  -3.786   5.610   1.143
   59   1HB   CYS   9          1HB       CYS   9  -1.443   5.165  -0.191
   60   2HB   CYS   9          2HB       CYS   9  -1.990   3.524   0.090
   61    H    LYS  10           H        LYS  10  -4.306   4.999   3.543
   62    HA   LYS  10           HA       LYS  10  -3.897   2.131   3.970
   63   1HB   LYS  10          1HB       LYS  10  -3.667   4.379   5.672
   64   2HB   LYS  10          2HB       LYS  10  -5.095   3.515   6.204
   65   1HG   LYS  10          1HG       LYS  10  -2.728   1.804   5.553
   66   2HG   LYS  10          2HG       LYS  10  -2.541   2.847   6.949
   67   1HD   LYS  10          1HD       LYS  10  -5.160   1.442   6.841
   68   2HD   LYS  10          2HD       LYS  10  -3.784   0.365   6.969
   69   1HE   LYS  10          1HE       LYS  10  -3.789   0.799   9.201
   70   2HE   LYS  10          2HE       LYS  10  -3.168   2.391   8.809
   71   1HZ   LYS  10          1HZ       LYS  10  -5.135   2.608  10.086
   72   2HZ   LYS  10          2HZ       LYS  10  -5.484   3.116   8.574
   73   3HZ   LYS  10          3HZ       LYS  10  -5.997   1.651   9.082
   74    H    GLY  11           H        GLY  11  -6.521   4.354   5.071
   75   1HA   GLY  11          1HA       GLY  11  -8.519   2.389   4.591
   76   2HA   GLY  11          2HA       GLY  11  -8.757   4.062   5.059
   77    H    GLN  12           H        GLN  12  -6.779   4.413   2.456
   78    HA   GLN  12           HA       GLN  12  -9.064   4.804   0.728
   79   1HB   GLN  12          1HB       GLN  12  -7.350   6.639   1.188
   80   2HB   GLN  12          2HB       GLN  12  -6.183   5.692   0.286
   81   1HG   GLN  12          1HG       GLN  12  -7.084   7.208  -1.318
   82   2HG   GLN  12          2HG       GLN  12  -7.884   5.687  -1.658
   83   1HE2  GLN  12          1HE2      GLN  12  -8.191   8.717   0.146
   84   2HE2  GLN  12          2HE2      GLN  12  -9.917   8.854   0.074
   85    H    CYS  13           H        CYS  13  -6.100   2.878   1.093
   86    HA   CYS  13           HA       CYS  13  -6.454   1.783  -1.575
   87   1HB   CYS  13          1HB       CYS  13  -4.254   1.617   0.473
   88   2HB   CYS  13          2HB       CYS  13  -4.331   0.490  -0.867
   89    H    THR  14           H        THR  14  -8.674   1.125  -0.274
   90    HA   THR  14           HA       THR  14  -8.225  -1.386   1.159
   91    HB   THR  14           HB       THR  14 -10.631   0.469   0.778
   92    HG1  THR  14           1HG      THR  14 -10.064   0.909   2.978
   93   1HG2  THR  14          1HG2      THR  14 -11.723  -0.943   2.518
   94   2HG2  THR  14          2HG2      THR  14 -11.404  -1.903   1.054
   95   3HG2  THR  14          3HG2      THR  14 -10.344  -2.068   2.475
   96    H    THR  15           H        THR  15  -9.407  -0.067  -1.910
   97    HA   THR  15           HA       THR  15 -10.703  -2.497  -2.687
   98    HB   THR  15           HB       THR  15 -10.152   0.235  -3.762
   99    HG1  THR  15           1HG      THR  15 -12.417  -0.318  -4.446
  100   1HG2  THR  15          1HG2      THR  15 -10.847  -2.071  -5.646
  101   2HG2  THR  15          2HG2      THR  15 -10.620  -0.358  -6.073
  102   3HG2  THR  15          3HG2      THR  15  -9.224  -1.345  -5.575
  103    HA   PRO  16           HA       PRO  16  -6.629  -3.080  -4.982
  104   1HB   PRO  16          1HB       PRO  16  -4.448  -1.591  -4.281
  105   2HB   PRO  16          2HB       PRO  16  -5.491  -1.186  -5.629
  106   1HG   PRO  16          1HG       PRO  16  -5.329   0.085  -2.965
  107   2HG   PRO  16          2HG       PRO  16  -6.031   0.716  -4.441
  108   1HD   PRO  16          1HD       PRO  16  -7.446  -0.366  -2.193
  109   2HD   PRO  16          2HD       PRO  16  -8.140   0.157  -3.715
  110    H    CYS  17           H        CYS  17  -6.738  -2.504  -1.617
  111    HA   CYS  17           HA       CYS  17  -4.849  -4.712  -1.259
  112   1HB   CYS  17          1HB       CYS  17  -5.723  -2.724   0.840
  113   2HB   CYS  17          2HB       CYS  17  -4.429  -3.901   0.952
  114    H    GLU  18           H        GLU  18  -7.924  -4.489  -1.929
  115    HA   GLU  18           HA       GLU  18  -9.209  -5.433   0.388
  116   1HB   GLU  18          1HB       GLU  18 -10.007  -4.435  -2.083
  117   2HB   GLU  18          2HB       GLU  18 -10.460  -6.123  -2.205
  118   1HG   GLU  18          1HG       GLU  18 -11.433  -5.716   0.255
  119   2HG   GLU  18          2HG       GLU  18 -11.431  -4.036  -0.246
  120    HA   PRO  19           HA       PRO  19  -8.627  -9.610  -1.796
  121   1HB   PRO  19          1HB       PRO  19  -6.927  -9.802  -3.926
  122   2HB   PRO  19          2HB       PRO  19  -8.659  -9.602  -4.098
  123   1HG   PRO  19          1HG       PRO  19  -6.515  -7.607  -4.499
  124   2HG   PRO  19          2HG       PRO  19  -8.174  -7.564  -5.062
  125   1HD   PRO  19          1HD       PRO  19  -7.073  -6.105  -2.851
  126   2HD   PRO  19          2HD       PRO  19  -8.754  -6.152  -3.343
  127    H    LEU  20           H        LEU  20  -5.817  -7.560  -1.674
  128    HA   LEU  20           HA       LEU  20  -3.982  -9.582  -1.092
  129   1HB   LEU  20          1HB       LEU  20  -2.949  -7.668  -1.704
  130   2HB   LEU  20          2HB       LEU  20  -4.115  -6.633  -0.903
  131    HG   LEU  20           HG       LEU  20  -3.044  -7.441   1.305
  132   1HD1  LEU  20          1HD1      LEU  20  -1.699  -9.239   0.801
  133   2HD1  LEU  20          2HD1      LEU  20  -1.119  -8.525  -0.722
  134   3HD1  LEU  20          3HD1      LEU  20  -0.512  -7.914   0.835
  135   1HD2  LEU  20          1HD2      LEU  20  -2.748  -5.207  -0.108
  136   2HD2  LEU  20          2HD2      LEU  20  -1.809  -5.531   1.369
  137   3HD2  LEU  20          3HD2      LEU  20  -1.078  -5.810  -0.231
  138    H    THR  21           H        THR  21  -5.703  -7.290   1.148
  139    HA   THR  21           HA       THR  21  -4.814  -8.411   3.505
  140    HB   THR  21           HB       THR  21  -7.373  -6.957   2.687
  141    HG1  THR  21           1HG      THR  21  -5.891  -5.341   2.967
  142   1HG2  THR  21          1HG2      THR  21  -6.507  -6.822   5.520
  143   2HG2  THR  21          2HG2      THR  21  -8.150  -6.975   4.851
  144   3HG2  THR  21          3HG2      THR  21  -7.134  -8.423   5.058
  145    H    ALA  22           H        ALA  22  -7.864  -9.211   1.711
  146    HA   ALA  22           HA       ALA  22  -8.772 -11.152   3.409
  147   1HB   ALA  22          1HB       ALA  22  -9.168 -11.887   0.620
  148   2HB   ALA  22          2HB       ALA  22 -10.347 -11.282   1.809
  149   3HB   ALA  22          3HB       ALA  22  -9.379 -10.135   0.853
  150    H    CYS  23           H        CYS  23  -6.022 -11.202   1.184
  151    HA   CYS  23           HA       CYS  23  -5.798 -13.999   1.018
  152   1HB   CYS  23          1HB       CYS  23  -4.702 -12.038  -0.368
  153   2HB   CYS  23          2HB       CYS  23  -3.415 -12.202   0.810
  154    H    LYS  24           H        LYS  24  -4.255 -11.438   3.080
  155    HA   LYS  24           HA       LYS  24  -2.648 -13.169   4.556
  156   1HB   LYS  24          1HB       LYS  24  -3.737 -10.397   4.987
  157   2HB   LYS  24          2HB       LYS  24  -2.855 -11.202   6.269
  158   1HG   LYS  24          1HG       LYS  24  -0.845 -11.256   5.054
  159   2HG   LYS  24          2HG       LYS  24  -1.655 -11.226   3.500
  160   1HD   LYS  24          1HD       LYS  24  -0.942  -9.028   3.535
  161   2HD   LYS  24          2HD       LYS  24  -2.463  -8.805   4.376
  162   1HE   LYS  24          1HE       LYS  24  -0.332  -9.616   6.232
  163   2HE   LYS  24          2HE       LYS  24   0.112  -8.167   5.351
  164   1HZ   LYS  24          1HZ       LYS  24  -2.399  -7.632   5.985
  165   2HZ   LYS  24          2HZ       LYS  24  -1.984  -8.551   7.270
  166   3HZ   LYS  24          3HZ       LYS  24  -1.127  -7.207   6.916
  167    H    GLU  25           H        GLU  25  -5.979 -11.887   5.186
  168    HA   GLU  25           HA       GLU  25  -6.316 -13.077   7.622
  169   1HB   GLU  25          1HB       GLU  25  -7.942 -11.735   5.658
  170   2HB   GLU  25          2HB       GLU  25  -8.819 -13.152   6.199
  171   1HG   GLU  25          1HG       GLU  25  -7.475 -11.477   8.310
  172   2HG   GLU  25          2HG       GLU  25  -8.899 -10.805   7.541
  173    H    LYS  26           H        LYS  26  -7.739 -14.312   4.504
  174    HA   LYS  26           HA       LYS  26  -8.590 -16.716   5.316
  175   1HB   LYS  26          1HB       LYS  26  -8.367 -15.488   2.929
  176   2HB   LYS  26          2HB       LYS  26  -7.113 -16.696   2.729
  177   1HG   LYS  26          1HG       LYS  26  -8.610 -18.445   2.686
  178   2HG   LYS  26          2HG       LYS  26  -9.630 -17.743   3.926
  179   1HD   LYS  26          1HD       LYS  26 -10.751 -16.310   2.358
  180   2HD   LYS  26          2HD       LYS  26  -9.521 -16.546   1.133
  181   1HE   LYS  26          1HE       LYS  26 -10.230 -19.103   1.305
  182   2HE   LYS  26          2HE       LYS  26 -11.693 -18.461   2.024
  183   1HZ   LYS  26          1HZ       LYS  26 -11.807 -18.696  -0.389
  184   2HZ   LYS  26          2HZ       LYS  26 -12.056 -17.153   0.087
  185   3HZ   LYS  26          3HZ       LYS  26 -10.624 -17.585  -0.568
  186    H    CYS  27           H        CYS  27  -5.188 -15.919   4.359
  187    HA   CYS  27           HA       CYS  27  -4.197 -18.482   4.748
  188   1HB   CYS  27          1HB       CYS  27  -2.822 -15.797   4.955
  189   2HB   CYS  27          2HB       CYS  27  -1.985 -17.337   4.967
  190    H    ALA  28           H        ALA  28  -4.303 -15.566   6.919
  191    HA   ALA  28           HA       ALA  28  -3.062 -16.601   9.114
  192   1HB   ALA  28          1HB       ALA  28  -3.780 -14.262   8.859
  193   2HB   ALA  28          2HB       ALA  28  -5.484 -14.759   8.984
  194   3HB   ALA  28          3HB       ALA  28  -4.399 -14.943  10.382
  195    H    GLU  29           H        GLU  29  -6.515 -16.963   8.101
  196    HA   GLU  29           HA       GLU  29  -7.300 -18.339  10.372
  197   1HB   GLU  29          1HB       GLU  29  -8.358 -18.009   7.576
  198   2HB   GLU  29          2HB       GLU  29  -9.055 -19.282   8.557
  199   1HG   GLU  29          1HG       GLU  29  -8.840 -16.352   9.398
  200   2HG   GLU  29          2HG       GLU  29 -10.292 -17.109   8.773
  201    H    SER  30           H        SER  30  -6.425 -19.602   7.070
  202    HA   SER  30           HA       SER  30  -6.610 -22.253   7.737
  203   1HB   SER  30          1HB       SER  30  -5.893 -20.744   5.484
  204   2HB   SER  30          2HB       SER  30  -4.446 -21.671   5.823
  205    HG   SER  30           HG       SER  30  -6.173 -23.533   6.056
  206    H    CYS  31           H        CYS  31  -4.164 -19.842   8.510
  207    HA   CYS  31           HA       CYS  31  -2.331 -21.950   9.360
  208   1HB   CYS  31          1HB       CYS  31  -1.921 -18.994   8.890
  209   2HB   CYS  31          2HB       CYS  31  -0.723 -20.023   9.650
  210    H    GLU  32           H        GLU  32  -4.617 -21.873  10.885
  211    HA   GLU  32           HA       GLU  32  -4.209 -20.021  13.039
  212   1HB   GLU  32          1HB       GLU  32  -6.397 -21.663  12.017
  213   2HB   GLU  32          2HB       GLU  32  -6.222 -21.890  13.746
  214   1HG   GLU  32          1HG       GLU  32  -6.260 -19.114  12.493
  215   2HG   GLU  32          2HG       GLU  32  -7.737 -19.938  12.950
  216    H    THR  33           H        THR  33  -4.456 -23.637  12.669
  217    HA   THR  33           HA       THR  33  -3.374 -24.075  15.279
  218    HB   THR  33           HB       THR  33  -3.735 -26.395  14.710
  219    HG1  THR  33           1HG      THR  33  -3.877 -25.373  11.964
  220   1HG2  THR  33          1HG2      THR  33  -5.993 -26.243  14.384
  221   2HG2  THR  33          2HG2      THR  33  -5.773 -24.496  14.122
  222   3HG2  THR  33          3HG2      THR  33  -5.752 -25.613  12.736
  223    H    SER  34           H        SER  34  -2.054 -23.587  12.056
  224    HA   SER  34           HA       SER  34   0.251 -24.950  12.150
  225   1HB   SER  34          1HB       SER  34  -0.585 -22.324  10.982
  226   2HB   SER  34          2HB       SER  34   1.141 -22.624  11.037
  227    HG   SER  34           HG       SER  34  -0.904 -24.098   9.657
  228    H    ALA  35           H        ALA  35   2.093 -24.956  13.412
  229    HA   ALA  35           HA       ALA  35   2.197 -23.459  15.759
  230   1HB   ALA  35          1HB       ALA  35   3.998 -25.289  14.222
  231   2HB   ALA  35          2HB       ALA  35   4.746 -24.272  15.476
  232   3HB   ALA  35          3HB       ALA  35   3.431 -25.392  15.906
  233    H    ASP  36           H        ASP  36   4.469 -23.246  12.923
  234    HA   ASP  36           HA       ASP  36   5.390 -20.741  13.781
  235   1HB   ASP  36          1HB       ASP  36   5.606 -21.763  10.930
  236   2HB   ASP  36          2HB       ASP  36   6.758 -20.785  11.817
  237    H    LYS  37           H        LYS  37   3.123 -19.728  13.952
  238    HA   LYS  37           HA       LYS  37   1.482 -19.366  11.745
  239   1HB   LYS  37          1HB       LYS  37   1.828 -18.048  14.407
  240   2HB   LYS  37          2HB       LYS  37   0.858 -17.222  13.205
  241   1HG   LYS  37          1HG       LYS  37  -0.400 -19.456  12.874
  242   2HG   LYS  37          2HG       LYS  37   0.432 -20.034  14.304
  243   1HD   LYS  37          1HD       LYS  37  -1.562 -19.195  15.221
  244   2HD   LYS  37          2HD       LYS  37  -0.472 -17.841  15.446
  245   1HE   LYS  37          1HE       LYS  37  -1.426 -17.317  12.906
  246   2HE   LYS  37          2HE       LYS  37  -2.820 -18.101  13.624
  247   1HZ   LYS  37          1HZ       LYS  37  -2.839 -16.526  15.350
  248   2HZ   LYS  37          2HZ       LYS  37  -1.385 -15.906  14.939
  249   3HZ   LYS  37          3HZ       LYS  37  -2.676 -15.671  13.967
  250    H    LYS  38           H        LYS  38   4.014 -17.158  13.131
  251    HA   LYS  38           HA       LYS  38   3.825 -15.109  11.383
  252   1HB   LYS  38          1HB       LYS  38   5.477 -15.706  13.398
  253   2HB   LYS  38          2HB       LYS  38   6.569 -16.067  12.077
  254   1HG   LYS  38          1HG       LYS  38   6.908 -13.744  12.588
  255   2HG   LYS  38          2HG       LYS  38   5.997 -13.775  11.091
  256   1HD   LYS  38          1HD       LYS  38   4.324 -12.582  12.046
  257   2HD   LYS  38          2HD       LYS  38   4.100 -13.823  13.263
  258   1HE   LYS  38          1HE       LYS  38   6.323 -12.670  14.297
  259   2HE   LYS  38          2HE       LYS  38   5.715 -11.287  13.410
  260   1HZ   LYS  38          1HZ       LYS  38   4.672 -11.143  15.430
  261   2HZ   LYS  38          2HZ       LYS  38   3.521 -11.879  14.534
  262   3HZ   LYS  38          3HZ       LYS  38   4.426 -12.751  15.576
  263    H    THR  39           H        THR  39   6.042 -17.956  10.907
  264    HA   THR  39           HA       THR  39   6.775 -17.325   8.318
  265    HB   THR  39           HB       THR  39   6.414 -20.087   9.595
  266    HG1  THR  39           1HG      THR  39   8.211 -19.447  10.756
  267   1HG2  THR  39          1HG2      THR  39   8.511 -19.056   7.618
  268   2HG2  THR  39          2HG2      THR  39   8.320 -20.726   8.203
  269   3HG2  THR  39          3HG2      THR  39   7.095 -20.015   7.126
  270    H    CYS  40           H        CYS  40   4.222 -19.724   9.283
  271    HA   CYS  40           HA       CYS  40   3.293 -20.337   6.850
  272   1HB   CYS  40          1HB       CYS  40   2.511 -21.072   9.197
  273   2HB   CYS  40          2HB       CYS  40   1.375 -19.742   9.093
  274    H    ARG  41           H        ARG  41   2.051 -17.598   8.914
  275    HA   ARG  41           HA       ARG  41   0.343 -16.534   7.132
  276   1HB   ARG  41          1HB       ARG  41   2.096 -15.309   9.285
  277   2HB   ARG  41          2HB       ARG  41   1.105 -14.255   8.295
  278   1HG   ARG  41          1HG       ARG  41  -0.661 -16.323   9.002
  279   2HG   ARG  41          2HG       ARG  41   0.298 -16.101  10.452
  280   1HD   ARG  41          1HD       ARG  41  -1.228 -13.914   8.957
  281   2HD   ARG  41          2HD       ARG  41  -1.677 -14.613  10.499
  282    HE   ARG  41           HE       ARG  41   1.010 -13.592  10.658
  283   1HH1  ARG  41          2HH2      ARG  41  -2.333 -12.503  10.515
  284   2HH1  ARG  41          1HH2      ARG  41  -2.020 -11.021  11.356
  285   1HH2  ARG  41          2HH1      ARG  41   1.423 -11.637  11.768
  286   2HH2  ARG  41          1HH1      ARG  41   0.131 -10.525  12.073
  287    H    ARG  42           H        ARG  42   3.793 -15.460   7.645
  288    HA   ARG  42           HA       ARG  42   3.918 -13.655   5.654
  289   1HB   ARG  42          1HB       ARG  42   5.847 -15.339   7.145
  290   2HB   ARG  42          2HB       ARG  42   6.444 -14.879   5.563
  291   1HG   ARG  42          1HG       ARG  42   6.756 -12.713   6.196
  292   2HG   ARG  42          2HG       ARG  42   5.156 -12.606   6.905
  293   1HD   ARG  42          1HD       ARG  42   6.105 -13.972   8.897
  294   2HD   ARG  42          2HD       ARG  42   7.692 -13.679   8.215
  295    HE   ARG  42           HE       ARG  42   6.054 -11.256   8.545
  296   1HH1  ARG  42          2HH2      ARG  42   8.432 -13.393  10.014
  297   2HH1  ARG  42          1HH2      ARG  42   9.004 -12.198  11.130
  298   1HH2  ARG  42          2HH1      ARG  42   6.808  -9.679  10.017
  299   2HH2  ARG  42          1HH1      ARG  42   8.074 -10.072  11.132
  300    H    ASN  43           H        ASN  43   4.059 -17.222   5.465
  301    HA   ASN  43           HA       ASN  43   5.096 -17.420   2.913
  302   1HB   ASN  43          1HB       ASN  43   4.362 -19.208   4.852
  303   2HB   ASN  43          2HB       ASN  43   2.991 -19.392   3.778
  304   1HD2  ASN  43          1HD2      ASN  43   6.171 -20.248   4.430
  305   2HD2  ASN  43          2HD2      ASN  43   6.580 -21.058   2.955
  306    H    CYS  44           H        CYS  44   1.892 -16.601   4.196
  307    HA   CYS  44           HA       CYS  44   0.159 -17.299   2.283
  308   1HB   CYS  44          1HB       CYS  44  -0.489 -16.104   4.281
  309   2HB   CYS  44          2HB       CYS  44   0.325 -14.651   3.734
  310    H    LYS  45           H        LYS  45   2.460 -14.501   2.241
  311    HA   LYS  45           HA       LYS  45   1.630 -13.431  -0.189
  312   1HB   LYS  45          1HB       LYS  45   3.451 -12.782   1.776
  313   2HB   LYS  45          2HB       LYS  45   4.496 -13.173   0.425
  314   1HG   LYS  45          1HG       LYS  45   3.828 -11.347  -0.794
  315   2HG   LYS  45          2HG       LYS  45   2.144 -11.536  -0.346
  316   1HD   LYS  45          1HD       LYS  45   3.843 -10.743   1.941
  317   2HD   LYS  45          2HD       LYS  45   3.896  -9.580   0.632
  318   1HE   LYS  45          1HE       LYS  45   1.945  -8.760   1.476
  319   2HE   LYS  45          2HE       LYS  45   1.177 -10.166   0.766
  320   1HZ   LYS  45          1HZ       LYS  45   2.360 -10.226   3.447
  321   2HZ   LYS  45          2HZ       LYS  45   0.802  -9.814   3.186
  322   3HZ   LYS  45          3HZ       LYS  45   1.330 -11.306   2.785
  323    H    LYS  46           H        LYS  46   4.087 -15.954   0.607
  324    HA   LYS  46           HA       LYS  46   4.829 -16.274  -2.124
  325   1HB   LYS  46          1HB       LYS  46   5.488 -17.589   0.482
  326   2HB   LYS  46          2HB       LYS  46   5.824 -18.469  -0.995
  327   1HG   LYS  46          1HG       LYS  46   6.719 -15.583  -0.597
  328   2HG   LYS  46          2HG       LYS  46   7.706 -16.939  -0.088
  329   1HD   LYS  46          1HD       LYS  46   7.587 -17.843  -2.460
  330   2HD   LYS  46          2HD       LYS  46   6.735 -16.386  -2.930
  331   1HE   LYS  46          1HE       LYS  46   8.631 -15.071  -2.823
  332   2HE   LYS  46          2HE       LYS  46   9.269 -15.914  -1.425
  333   1HZ   LYS  46          1HZ       LYS  46   9.542 -16.579  -4.231
  334   2HZ   LYS  46          2HZ       LYS  46  10.652 -16.645  -3.035
  335   3HZ   LYS  46          3HZ       LYS  46   9.519 -17.814  -3.163
  336    H    ALA  47           H        ALA  47   2.020 -17.013  -0.413
  337    HA   ALA  47           HA       ALA  47   1.516 -19.590  -1.529
  338   1HB   ALA  47          1HB       ALA  47   0.574 -18.387   0.623
  339   2HB   ALA  47          2HB       ALA  47  -0.622 -17.724  -0.516
  340   3HB   ALA  47          3HB       ALA  47  -0.468 -19.485  -0.314
  341    H    ASP  48           H        ASP  48   0.033 -16.309  -2.075
  342    HA   ASP  48           HA       ASP  48   0.254 -16.459  -4.816
  343   1HB   ASP  48          1HB       ASP  48  -2.255 -17.624  -3.627
  344   2HB   ASP  48          2HB       ASP  48  -2.447 -16.605  -5.040
  345    H    CYS  49           H        CYS  49   0.634 -14.563  -2.692
  346    HA   CYS  49           HA       CYS  49  -1.479 -12.629  -3.311
  347   1HB   CYS  49          1HB       CYS  49   0.052 -12.399  -0.762
  348   2HB   CYS  49          2HB       CYS  49  -1.565 -11.851  -1.158
  349    H    GLU  50           H        GLU  50   1.103 -13.314  -4.693
  350    HA   GLU  50           HA       GLU  50   2.962 -11.328  -3.918
  351   1HB   GLU  50          1HB       GLU  50   2.780 -13.498  -5.917
  352   2HB   GLU  50          2HB       GLU  50   3.646 -12.095  -6.510
  353   1HG   GLU  50          1HG       GLU  50   4.599 -12.451  -3.866
  354   2HG   GLU  50          2HG       GLU  50   4.477 -14.076  -4.512
  355    HA   PRO  51           HA       PRO  51   1.103  -9.213  -7.746
  356   1HB   PRO  51          1HB       PRO  51  -1.253 -10.134  -8.781
  357   2HB   PRO  51          2HB       PRO  51   0.315 -10.581  -9.423
  358   1HG   PRO  51          1HG       PRO  51  -1.535 -12.183  -7.763
  359   2HG   PRO  51          2HG       PRO  51  -0.196 -12.729  -8.753
  360   1HD   PRO  51          1HD       PRO  51  -0.226 -12.473  -5.896
  361   2HD   PRO  51          2HD       PRO  51   1.147 -12.907  -6.895
  362    H    GLN  52           H        GLN  52  -1.220 -10.494  -5.480
  363    HA   GLN  52           HA       GLN  52  -2.912  -8.294  -5.586
  364   1HB   GLN  52          1HB       GLN  52  -2.384 -10.322  -3.372
  365   2HB   GLN  52          2HB       GLN  52  -3.689  -9.153  -3.319
  366   1HG   GLN  52          1HG       GLN  52  -4.606 -10.071  -5.455
  367   2HG   GLN  52          2HG       GLN  52  -3.295 -11.232  -5.524
  368   1HE2  GLN  52          1HE2      GLN  52  -4.218 -13.126  -5.211
  369   2HE2  GLN  52          2HE2      GLN  52  -5.216 -13.582  -3.871
  370    H    ASP  53           H        ASP  53  -0.181  -9.133  -3.348
  371    HA   ASP  53           HA       ASP  53  -0.401  -6.950  -1.724
  372   1HB   ASP  53          1HB       ASP  53   1.152  -9.027  -1.574
  373   2HB   ASP  53          2HB       ASP  53   2.250  -8.153  -2.624
  374    H    LYS  54           H        LYS  54   1.094  -7.393  -4.955
  375    HA   LYS  54           HA       LYS  54   2.576  -5.016  -5.006
  376   1HB   LYS  54          1HB       LYS  54   1.587  -6.993  -7.027
  377   2HB   LYS  54          2HB       LYS  54   2.185  -5.448  -7.599
  378   1HG   LYS  54          1HG       LYS  54   4.241  -5.907  -6.022
  379   2HG   LYS  54          2HG       LYS  54   3.674  -7.565  -6.008
  380   1HD   LYS  54          1HD       LYS  54   3.606  -7.259  -8.655
  381   2HD   LYS  54          2HD       LYS  54   4.716  -5.940  -8.340
  382   1HE   LYS  54          1HE       LYS  54   6.401  -7.363  -7.511
  383   2HE   LYS  54          2HE       LYS  54   5.265  -8.610  -7.034
  384   1HZ   LYS  54          1HZ       LYS  54   5.472  -9.545  -9.004
  385   2HZ   LYS  54          2HZ       LYS  54   5.153  -8.161  -9.811
  386   3HZ   LYS  54          3HZ       LYS  54   6.683  -8.507  -9.354
  387    H    VAL  55           H        VAL  55  -0.621  -5.789  -6.564
  388    HA   VAL  55           HA       VAL  55  -1.247  -3.330  -7.480
  389    HB   VAL  55           HB       VAL  55  -3.016  -5.403  -6.175
  390   1HG1  VAL  55          1HG1      VAL  55  -4.172  -3.583  -8.207
  391   2HG1  VAL  55          2HG1      VAL  55  -4.889  -4.256  -6.723
  392   3HG1  VAL  55          3HG1      VAL  55  -3.810  -2.843  -6.629
  393   1HG2  VAL  55          1HG2      VAL  55  -3.478  -6.092  -8.497
  394   2HG2  VAL  55          2HG2      VAL  55  -2.325  -4.870  -9.084
  395   3HG2  VAL  55          3HG2      VAL  55  -1.750  -6.233  -8.095
  396    H    CYS  56           H        CYS  56  -1.181  -4.452  -4.104
  397    HA   CYS  56           HA       CYS  56  -2.621  -2.232  -3.097
  398   1HB   CYS  56          1HB       CYS  56  -2.528  -4.342  -1.897
  399   2HB   CYS  56          2HB       CYS  56  -0.787  -4.214  -1.735
  400    H    ASP  57           H        ASP  57   0.877  -3.191  -3.309
  401    HA   ASP  57           HA       ASP  57   1.953  -1.051  -2.049
  402   1HB   ASP  57          1HB       ASP  57   3.115  -3.120  -3.024
  403   2HB   ASP  57          2HB       ASP  57   3.073  -2.327  -4.586
  404    H    ALA  58           H        ALA  58   1.557  -1.487  -5.656
  405    HA   ALA  58           HA       ALA  58   2.338   0.908  -6.563
  406   1HB   ALA  58          1HB       ALA  58  -0.250  -0.131  -7.650
  407   2HB   ALA  58          2HB       ALA  58   1.247   0.319  -8.500
  408   3HB   ALA  58          3HB       ALA  58   1.141  -1.240  -7.649
  409    H    CYS  59           H        CYS  59  -0.917   0.144  -5.167
  410    HA   CYS  59           HA       CYS  59  -2.071   2.595  -5.564
  411   1HB   CYS  59          1HB       CYS  59  -3.222   0.557  -4.770
  412   2HB   CYS  59          2HB       CYS  59  -2.464   0.747  -3.201
  413    H    ARG  60           H        ARG  60  -0.307   1.368  -2.619
  414    HA   ARG  60           HA       ARG  60  -0.385   3.720  -1.238
  415   1HB   ARG  60          1HB       ARG  60   1.797   1.573  -1.232
  416   2HB   ARG  60          2HB       ARG  60   1.605   2.789   0.015
  417   1HG   ARG  60          1HG       ARG  60  -0.898   1.855   0.112
  418   2HG   ARG  60          2HG       ARG  60  -0.184   0.437  -0.631
  419   1HD   ARG  60          1HD       ARG  60   1.620   0.627   1.290
  420   2HD   ARG  60          2HD       ARG  60   0.442   1.657   2.080
  421    HE   ARG  60           HE       ARG  60  -0.977  -0.638   1.261
  422   1HH1  ARG  60          2HH2      ARG  60   1.720   0.097   3.399
  423   2HH1  ARG  60          1HH2      ARG  60   1.409  -1.236   4.459
  424   1HH2  ARG  60          2HH1      ARG  60  -1.388  -2.397   2.660
  425   2HH2  ARG  60          1HH1      ARG  60  -0.371  -2.665   4.037
  426    H    MET  61           H        MET  61   1.687   2.665  -3.923
  427    HA   MET  61           HA       MET  61   3.669   4.633  -3.491
  428   1HB   MET  61          1HB       MET  61   4.360   2.708  -4.736
  429   2HB   MET  61          2HB       MET  61   2.904   2.699  -5.712
  430   1HG   MET  61          1HG       MET  61   3.778   4.158  -7.252
  431   2HG   MET  61          2HG       MET  61   4.473   5.193  -6.021
  432   1HE   MET  61          1HE       MET  61   4.970   2.521  -8.599
  433   2HE   MET  61          2HE       MET  61   6.423   1.618  -8.106
  434   3HE   MET  61          3HE       MET  61   4.896   1.404  -7.215
  435    H    LYS  62           H        LYS  62   0.702   4.351  -5.505
  436    HA   LYS  62           HA       LYS  62   1.199   6.767  -6.920
  437   1HB   LYS  62          1HB       LYS  62  -0.989   4.750  -6.732
  438   2HB   LYS  62          2HB       LYS  62  -1.431   6.351  -7.291
  439   1HG   LYS  62          1HG       LYS  62  -0.541   5.915  -9.328
  440   2HG   LYS  62          2HG       LYS  62   1.030   5.633  -8.605
  441   1HD   LYS  62          1HD       LYS  62  -0.321   3.290  -7.955
  442   2HD   LYS  62          2HD       LYS  62  -1.004   3.673  -9.523
  443   1HE   LYS  62          1HE       LYS  62   1.686   4.147  -9.985
  444   2HE   LYS  62          2HE       LYS  62   1.769   2.842  -8.819
  445   1HZ   LYS  62          1HZ       LYS  62   0.325   2.825 -11.373
  446   2HZ   LYS  62          2HZ       LYS  62   1.609   1.907 -10.954
  447   3HZ   LYS  62          3HZ       LYS  62   0.159   1.653 -10.248
  448    H    CYS  63           H        CYS  63  -0.632   5.814  -3.976
  449    HA   CYS  63           HA       CYS  63  -2.065   8.088  -3.569
  450   1HB   CYS  63          1HB       CYS  63  -1.239   5.826  -2.032
  451   2HB   CYS  63          2HB       CYS  63  -1.029   7.260  -1.047
  452    H    HIS  64           H        HIS  64   1.378   7.349  -2.710
  453    HA   HIS  64           HA       HIS  64   1.985   9.609  -1.323
  454   1HB   HIS  64          1HB       HIS  64   3.536   7.812  -1.454
  455   2HB   HIS  64          2HB       HIS  64   3.629   7.909  -3.201
  456    HD1  HIS  64           1HD      HIS  64   5.350   8.994  -0.192
  457    HD2  HIS  64           2HD      HIS  64   4.899  10.480  -4.088
  458    HE1  HIS  64           1HE      HIS  64   7.225  10.690  -0.531
  459    H    LYS  65           H        LYS  65   2.566   9.139  -4.887
  460    HA   LYS  65           HA       LYS  65   3.179  11.805  -5.369
  461   1HB   LYS  65          1HB       LYS  65   2.860   9.376  -6.858
  462   2HB   LYS  65          2HB       LYS  65   1.998  10.651  -7.695
  463   1HG   LYS  65          1HG       LYS  65   3.943  11.990  -7.943
  464   2HG   LYS  65          2HG       LYS  65   4.786  11.187  -6.634
  465   1HD   LYS  65          1HD       LYS  65   5.844  10.205  -8.466
  466   2HD   LYS  65          2HD       LYS  65   4.568   9.036  -8.184
  467   1HE   LYS  65          1HE       LYS  65   3.205   9.940  -9.967
  468   2HE   LYS  65          2HE       LYS  65   4.194  11.381 -10.094
  469   1HZ   LYS  65          1HZ       LYS  65   5.593  10.321 -11.411
  470   2HZ   LYS  65          2HZ       LYS  65   5.724   9.026 -10.426
  471   3HZ   LYS  65          3HZ       LYS  65   4.510   9.103 -11.515
  472    H    ALA  66           H        ALA  66   0.117  10.177  -4.799
  473    HA   ALA  66           HA       ALA  66  -1.502  12.127  -6.079
  474   1HB   ALA  66          1HB       ALA  66  -1.800   9.592  -4.838
  475   2HB   ALA  66          2HB       ALA  66  -2.835  10.721  -3.931
  476   3HB   ALA  66          3HB       ALA  66  -3.043  10.540  -5.690
  477    H    CYS  67           H        CYS  67  -0.665  11.428  -2.610
  478    HA   CYS  67           HA       CYS  67  -1.987  13.690  -1.637
  479   1HB   CYS  67          1HB       CYS  67  -1.373  11.693  -0.302
  480   2HB   CYS  67          2HB       CYS  67   0.312  12.165  -0.395
  481    H    ARG  68           H        ARG  68   1.082  13.148  -3.260
  482    HA   ARG  68           HA       ARG  68   2.446  15.340  -2.217
  483   1HB   ARG  68          1HB       ARG  68   3.451  13.380  -3.501
  484   2HB   ARG  68          2HB       ARG  68   2.781  14.053  -4.973
  485   1HG   ARG  68          1HG       ARG  68   4.365  15.976  -3.330
  486   2HG   ARG  68          2HG       ARG  68   5.290  14.644  -3.994
  487   1HD   ARG  68          1HD       ARG  68   3.722  15.402  -6.172
  488   2HD   ARG  68          2HD       ARG  68   4.027  16.940  -5.389
  489    HE   ARG  68           HE       ARG  68   6.489  15.486  -5.497
  490   1HH1  ARG  68          2HH2      ARG  68   4.225  17.113  -7.644
  491   2HH1  ARG  68          1HH2      ARG  68   5.428  17.498  -8.829
  492   1HH2  ARG  68          2HH1      ARG  68   8.076  15.994  -7.060
  493   2HH2  ARG  68          1HH1      ARG  68   7.634  16.857  -8.495
  494    H    ALA  69           H        ALA  69   0.054  14.905  -4.819
  495    HA   ALA  69           HA       ALA  69   0.474  17.658  -5.706
  496   1HB   ALA  69          1HB       ALA  69  -0.436  15.142  -6.911
  497   2HB   ALA  69          2HB       ALA  69  -1.531  16.501  -7.258
  498   3HB   ALA  69          3HB       ALA  69   0.193  16.615  -7.687
  499    H    ALA  70           H        ALA  70  -1.925  15.415  -4.236
  500    HA   ALA  70           HA       ALA  70  -4.070  17.210  -4.236
  501   1HB   ALA  70          1HB       ALA  70  -3.303  14.668  -2.858
  502   2HB   ALA  70          2HB       ALA  70  -4.615  15.625  -2.128
  503   3HB   ALA  70          3HB       ALA  70  -4.755  15.059  -3.810
  504    H    ASN  71           H        ASN  71  -2.882  16.098  -1.073
  505    HA   ASN  71           HA       ASN  71  -3.478  18.251   0.320
  506   1HB   ASN  71          1HB       ASN  71  -1.581  16.043   0.601
  507   2HB   ASN  71          2HB       ASN  71  -0.905  17.486   1.330
  508   1HD2  ASN  71          1HD2      ASN  71  -3.878  15.557   1.138
  509   2HD2  ASN  71          2HD2      ASN  71  -4.413  15.804   2.767
  510    H    CYS  72           H        CYS  72  -0.085  17.636  -0.890
  511    HA   CYS  72           HA       CYS  72   0.593  20.385  -0.537
  512   1HB   CYS  72          1HB       CYS  72   2.164  18.171  -1.870
  513   2HB   CYS  72          2HB       CYS  72   2.783  19.738  -1.389
  514    H    ALA  73           H        ALA  73  -1.025  21.395  -1.957
  515    HA   ALA  73           HA       ALA  73  -0.733  20.779  -4.794
  516   1HB   ALA  73          1HB       ALA  73  -2.957  21.111  -3.323
  517   2HB   ALA  73          2HB       ALA  73  -2.671  22.813  -3.760
  518   3HB   ALA  73          3HB       ALA  73  -2.873  21.588  -5.036
  519    H    SER  74           H        SER  74   0.510  22.861  -2.376
  520    HA   SER  74           HA       SER  74   1.153  24.832  -4.428
  521   1HB   SER  74          1HB       SER  74   0.533  25.076  -1.496
  522   2HB   SER  74          2HB       SER  74   1.713  26.188  -2.162
  523    HG   SER  74           HG       SER  74  -0.162  27.265  -2.531
  524    H    GLU  75           H        GLU  75   2.343  23.049  -1.507
  525    HA   GLU  75           HA       GLU  75   4.972  23.918  -1.747
  526   1HB   GLU  75          1HB       GLU  75   3.680  21.523  -0.397
  527   2HB   GLU  75          2HB       GLU  75   5.412  21.778  -0.330
  528   1HG   GLU  75          1HG       GLU  75   4.223  22.757   1.648
  529   2HG   GLU  75          2HG       GLU  75   5.121  23.960   0.744
  530    H    CYS  76           H        CYS  76   3.088  21.523  -3.487
  531    HA   CYS  76           HA       CYS  76   5.442  20.924  -5.065
  532   1HB   CYS  76          1HB       CYS  76   3.727  18.599  -4.296
  533   2HB   CYS  76          2HB       CYS  76   5.376  18.627  -4.887
  534    HA   PRO  77           HA       PRO  77   1.734  21.743  -7.493
  535   1HB   PRO  77          1HB       PRO  77   2.911  23.356  -9.359
  536   2HB   PRO  77          2HB       PRO  77   2.157  23.969  -7.901
  537   1HG   PRO  77          1HG       PRO  77   5.033  23.698  -8.527
  538   2HG   PRO  77          2HG       PRO  77   4.266  24.676  -7.292
  539   1HD   PRO  77          1HD       PRO  77   5.640  22.189  -6.903
  540   2HD   PRO  77          2HD       PRO  77   4.774  23.109  -5.689
  541    H    LYS  78           H        LYS  78   4.281  22.042  -9.830
  542    HA   LYS  78           HA       LYS  78   3.993  19.262 -10.567
  543   1HB   LYS  78          1HB       LYS  78   2.075  20.486 -11.659
  544   2HB   LYS  78          2HB       LYS  78   3.252  21.421 -12.559
  545   1HG   LYS  78          1HG       LYS  78   4.206  18.905 -13.052
  546   2HG   LYS  78          2HG       LYS  78   2.507  18.532 -12.834
  547   1HD   LYS  78          1HD       LYS  78   2.231  19.148 -15.006
  548   2HD   LYS  78          2HD       LYS  78   2.405  20.801 -14.451
  549   1HE   LYS  78          1HE       LYS  78   4.336  21.011 -15.620
  550   2HE   LYS  78          2HE       LYS  78   5.057  19.709 -14.694
  551   1HZ   LYS  78          1HZ       LYS  78   3.848  18.187 -16.243
  552   2HZ   LYS  78          2HZ       LYS  78   3.522  19.484 -17.180
  553   3HZ   LYS  78          3HZ       LYS  78   5.070  19.040 -16.911
  554    H    HIS  79           H        HIS  79   6.177  20.495  -9.401
  555    HA   HIS  79           HA       HIS  79   8.134  20.019 -11.351
  556   1HB   HIS  79          1HB       HIS  79   7.123  22.568 -11.575
  557   2HB   HIS  79          2HB       HIS  79   8.490  22.819 -10.508
  558    HD1  HIS  79           1HD      HIS  79  10.160  23.874 -12.082
  559    HD2  HIS  79           2HD      HIS  79   8.498  20.344 -13.621
  560    HE1  HIS  79           1HE      HIS  79  11.450  23.349 -14.219
  561    H    GLU  80           H        GLU  80  10.349  21.271 -10.229
  562    HA   GLU  80           HA       GLU  80  11.763  21.115  -8.591
  563   1HB   GLU  80          1HB       GLU  80   9.227  21.744  -7.128
  564   2HB   GLU  80          2HB       GLU  80  10.561  21.169  -6.148
  565   1HG   GLU  80          1HG       GLU  80  11.686  23.062  -7.969
  566   2HG   GLU  80          2HG       GLU  80  10.197  23.780  -7.388
  567    H    HIS  81           H        HIS  81  12.576  19.030  -8.955
  568    HA   HIS  81           HA       HIS  81  11.141  16.733  -8.146
  569   1HB   HIS  81          1HB       HIS  81  13.019  15.504  -8.919
  570   2HB   HIS  81          2HB       HIS  81  12.784  16.844 -10.023
  571    HD1  HIS  81           1HD      HIS  81  15.439  15.109  -8.506
  572    HD2  HIS  81           2HD      HIS  81  14.578  19.189  -8.962
  573    HE1  HIS  81           1HE      HIS  81  17.656  16.342  -8.234
  574    H    LYS  82           H        LYS  82  13.471  18.932  -6.629
  575    HA   LYS  82           HA       LYS  82  13.187  17.356  -4.180
  576   1HB   LYS  82          1HB       LYS  82  15.574  17.773  -3.657
  577   2HB   LYS  82          2HB       LYS  82  15.339  16.717  -5.034
  578   1HG   LYS  82          1HG       LYS  82  16.667  18.106  -6.238
  579   2HG   LYS  82          2HG       LYS  82  15.390  19.304  -6.162
  580   1HD   LYS  82          1HD       LYS  82  16.452  19.770  -3.731
  581   2HD   LYS  82          2HD       LYS  82  17.877  19.067  -4.472
  582   1HE   LYS  82          1HE       LYS  82  17.511  20.725  -6.427
  583   2HE   LYS  82          2HE       LYS  82  16.329  21.522  -5.408
  584   1HZ   LYS  82          1HZ       LYS  82  18.972  20.978  -4.324
  585   2HZ   LYS  82          2HZ       LYS  82  18.781  22.238  -5.345
  586   3HZ   LYS  82          3HZ       LYS  82  17.931  22.181  -3.952
  587    H    SER  83           H        SER  83  11.573  18.834  -3.483
  588    HA   SER  83           HA       SER  83  12.560  21.554  -3.155
  589   1HB   SER  83          1HB       SER  83  10.552  21.883  -4.237
  590   2HB   SER  83          2HB       SER  83   9.873  20.368  -3.677
  591    HG   SER  83           HG       SER  83   9.534  22.883  -2.652
  592    H    ASP  84           H        ASP  84  13.217  22.104  -1.110
  593    HA   ASP  84           HA       ASP  84  13.242  20.429   0.982
  594   1HB   ASP  84          1HB       ASP  84  14.524  22.485   1.002
  595   2HB   ASP  84          2HB       ASP  84  13.078  23.468   0.888
  596    H    THR  85           H        THR  85  10.943  23.237   0.547
  597    HA   THR  85           HA       THR  85   9.286  22.646   2.687
  598    HB   THR  85           HB       THR  85   9.365  24.792   1.387
  599    HG1  THR  85           1HG      THR  85   6.987  24.934   1.416
  600   1HG2  THR  85          1HG2      THR  85   9.445  24.003  -0.936
  601   2HG2  THR  85          2HG2      THR  85   7.943  23.073  -0.711
  602   3HG2  THR  85          3HG2      THR  85   7.899  24.853  -0.701
  603    H    CYS  86           H        CYS  86   9.287  21.357  -0.656
  604    HA   CYS  86           HA       CYS  86   6.808  20.111  -0.495
  605   1HB   CYS  86          1HB       CYS  86   8.049  20.495  -2.582
  606   2HB   CYS  86          2HB       CYS  86   9.245  19.309  -2.098
  607    H    ARG  87           H        ARG  87  10.097  18.544  -0.350
  608    HA   ARG  87           HA       ARG  87   9.428  16.141   0.477
  609   1HB   ARG  87          1HB       ARG  87  11.716  17.832   1.605
  610   2HB   ARG  87          2HB       ARG  87  11.626  16.088   1.748
  611   1HG   ARG  87          1HG       ARG  87  11.344  16.147  -0.888
  612   2HG   ARG  87          2HG       ARG  87  12.018  17.759  -0.751
  613   1HD   ARG  87          1HD       ARG  87  13.809  16.090  -1.159
  614   2HD   ARG  87          2HD       ARG  87  14.024  16.857   0.402
  615    HE   ARG  87           HE       ARG  87  13.619  14.800   1.446
  616   1HH1  ARG  87          2HH2      ARG  87  12.488  14.647  -1.883
  617   2HH1  ARG  87          1HH2      ARG  87  12.154  12.948  -1.825
  618   1HH2  ARG  87          2HH1      ARG  87  13.178  12.559   1.522
  619   2HH2  ARG  87          1HH1      ARG  87  12.549  11.753   0.124
  620    H    ALA  88           H        ALA  88   9.488  19.111   2.494
  621    HA   ALA  88           HA       ALA  88   9.029  17.721   4.941
  622   1HB   ALA  88          1HB       ALA  88   9.229  19.808   5.896
  623   2HB   ALA  88          2HB       ALA  88  10.038  20.131   4.344
  624   3HB   ALA  88          3HB       ALA  88   8.342  20.615   4.582
  625    H    CYS  89           H        CYS  89   6.994  19.799   2.759
  626    HA   CYS  89           HA       CYS  89   4.657  19.717   4.053
  627   1HB   CYS  89          1HB       CYS  89   5.039  20.886   1.940
  628   2HB   CYS  89          2HB       CYS  89   5.059  19.361   1.075
  629    H    MET  90           H        MET  90   6.097  17.135   1.964
  630    HA   MET  90           HA       MET  90   3.902  15.419   2.187
  631   1HB   MET  90          1HB       MET  90   6.859  15.054   1.494
  632   2HB   MET  90          2HB       MET  90   5.756  13.692   1.481
  633   1HG   MET  90          1HG       MET  90   4.272  15.366  -0.028
  634   2HG   MET  90          2HG       MET  90   5.835  16.089  -0.349
  635   1HE   MET  90          1HE       MET  90   4.340  12.516   0.215
  636   2HE   MET  90          2HE       MET  90   3.416  13.227  -1.130
  637   3HE   MET  90          3HE       MET  90   4.483  11.832  -1.422
  638    H    LYS  91           H        LYS  91   7.192  15.283   3.749
  639    HA   LYS  91           HA       LYS  91   6.767  13.142   5.372
  640   1HB   LYS  91          1HB       LYS  91   8.944  13.956   5.279
  641   2HB   LYS  91          2HB       LYS  91   8.464  15.610   5.597
  642   1HG   LYS  91          1HG       LYS  91   7.933  15.074   7.934
  643   2HG   LYS  91          2HG       LYS  91   8.190  13.364   7.647
  644   1HD   LYS  91          1HD       LYS  91  10.370  13.644   8.201
  645   2HD   LYS  91          2HD       LYS  91  10.577  14.615   6.758
  646   1HE   LYS  91          1HE       LYS  91   9.777  16.639   8.082
  647   2HE   LYS  91          2HE       LYS  91   9.760  15.636   9.519
  648   1HZ   LYS  91          1HZ       LYS  91  11.877  16.179   9.700
  649   2HZ   LYS  91          2HZ       LYS  91  12.199  15.202   8.432
  650   3HZ   LYS  91          3HZ       LYS  91  11.966  16.800   8.192
  651    H    THR  92           H        THR  92   5.461  16.429   5.635
  652    HA   THR  92           HA       THR  92   4.694  16.293   8.340
  653    HB   THR  92           HB       THR  92   3.392  17.848   6.048
  654    HG1  THR  92           1HG      THR  92   5.348  18.888   6.012
  655   1HG2  THR  92          1HG2      THR  92   2.326  18.936   7.750
  656   2HG2  THR  92          2HG2      THR  92   3.126  17.888   8.945
  657   3HG2  THR  92          3HG2      THR  92   3.916  19.390   8.409
  658    H    ASN  93           H        ASN  93   2.738  15.749   5.330
  659    HA   ASN  93           HA       ASN  93   0.989  14.159   7.039
  660   1HB   ASN  93          1HB       ASN  93   0.192  15.417   4.374
  661   2HB   ASN  93          2HB       ASN  93  -0.872  14.790   5.617
  662   1HD2  ASN  93          1HD2      ASN  93   1.012  17.438   4.500
  663   2HD2  ASN  93          2HD2      ASN  93   0.591  18.603   5.711
  664    H    CYS  94           H        CYS  94   1.892  14.652   3.532
  665    HA   CYS  94           HA       CYS  94   1.314  11.987   2.841
  666   1HB   CYS  94          1HB       CYS  94   3.151  13.764   1.260
  667   2HB   CYS  94          2HB       CYS  94   2.050  12.525   0.689
  668    H    LYS  95           H        LYS  95   2.585  11.072   4.782
  669    HA   LYS  95           HA       LYS  95   5.221  11.252   5.230
  670   1HB   LYS  95          1HB       LYS  95   3.346   9.759   6.281
  671   2HB   LYS  95          2HB       LYS  95   3.929   8.535   5.171
  672   1HG   LYS  95          1HG       LYS  95   6.321   9.201   6.107
  673   2HG   LYS  95          2HG       LYS  95   5.415   9.887   7.441
  674   1HD   LYS  95          1HD       LYS  95   4.233   7.631   7.687
  675   2HD   LYS  95          2HD       LYS  95   5.342   6.986   6.493
  676   1HE   LYS  95          1HE       LYS  95   7.280   7.605   7.939
  677   2HE   LYS  95          2HE       LYS  95   6.188   8.289   9.126
  678   1HZ   LYS  95          1HZ       LYS  95   5.165   5.872   8.840
  679   2HZ   LYS  95          2HZ       LYS  95   6.735   5.534   8.543
  680   3HZ   LYS  95          3HZ       LYS  95   6.303   6.236   9.953
  Start of MODEL   13
    1   1H    ILE   1           H        ILE   1 -17.243  12.553   8.941
    2    HA   ILE   1           HA       ILE   1 -16.047  11.544   6.648
    3    HB   ILE   1           HB       ILE   1 -18.193  11.926   5.184
    4   1HG1  ILE   1          1HG1      ILE   1 -19.510  10.683   7.595
    5   2HG1  ILE   1          2HG1      ILE   1 -19.514  12.420   7.361
    6   1HG2  ILE   1          1HG2      ILE   1 -16.848   9.921   5.129
    7   2HG2  ILE   1          2HG2      ILE   1 -17.559   9.357   6.660
    8   3HG2  ILE   1          3HG2      ILE   1 -18.571   9.480   5.201
    9   1HD1  ILE   1          1HD1      ILE   1 -21.266  10.527   6.178
   10   2HD1  ILE   1          2HD1      ILE   1 -21.162  12.266   5.817
   11   3HD1  ILE   1          3HD1      ILE   1 -20.215  11.101   4.861
   12    H    SER   2           H        SER   2 -15.209  13.603   7.967
   13    HA   SER   2           HA       SER   2 -16.451  15.920   6.706
   14   1HB   SER   2          1HB       SER   2 -15.617  17.267   8.540
   15   2HB   SER   2          2HB       SER   2 -16.449  15.884   9.222
   16    HG   SER   2           HG       SER   2 -14.607  15.742  10.351
   17    H    GLU   3           H        GLU   3 -14.975  17.604   5.859
   18    HA   GLU   3           HA       GLU   3 -12.641  16.370   4.743
   19   1HB   GLU   3          1HB       GLU   3 -14.402  18.636   4.102
   20   2HB   GLU   3          2HB       GLU   3 -12.711  19.051   3.905
   21   1HG   GLU   3          1HG       GLU   3 -12.744  16.559   2.737
   22   2HG   GLU   3          2HG       GLU   3 -14.375  17.092   2.381
   23    H    PHE   4           H        PHE   4 -11.555  16.173   6.916
   24    HA   PHE   4           HA       PHE   4  -9.988  18.575   7.379
   25   1HB   PHE   4          1HB       PHE   4 -11.911  17.153   9.242
   26   2HB   PHE   4          2HB       PHE   4 -10.402  17.689   9.952
   27    HD1  PHE   4           1HD      PHE   4  -9.981  20.010  10.358
   28    HD2  PHE   4           2HD      PHE   4 -13.494  18.812   8.301
   29    HE1  PHE   4           1HE      PHE   4 -10.931  22.315  10.640
   30    HE2  PHE   4           2HE      PHE   4 -14.445  21.118   8.583
   31    HZ   PHE   4           HZ       PHE   4 -13.152  22.842   9.749
   32    H    ALA   5           H        ALA   5  -8.220  17.966   9.175
   33    HA   ALA   5           HA       ALA   5  -6.428  16.759   9.647
   34   1HB   ALA   5          1HB       ALA   5  -8.647  15.069  10.050
   35   2HB   ALA   5          2HB       ALA   5  -7.454  14.076   9.179
   36   3HB   ALA   5          3HB       ALA   5  -7.007  14.864  10.711
   37    HA   PRO   6           HA       PRO   6  -4.519  15.626   5.936
   38   1HB   PRO   6          1HB       PRO   6  -2.465  14.002   6.719
   39   2HB   PRO   6          2HB       PRO   6  -2.410  15.748   6.852
   40   1HG   PRO   6          1HG       PRO   6  -2.807  13.739   8.983
   41   2HG   PRO   6          2HG       PRO   6  -2.330  15.419   9.133
   42   1HD   PRO   6          1HD       PRO   6  -4.924  14.317   9.669
   43   2HD   PRO   6          2HD       PRO   6  -4.476  16.011   9.706
   44    H    VAL   7           H        VAL   7  -3.586  13.748   4.518
   45    HA   VAL   7           HA       VAL   7  -5.734  11.785   4.581
   46    HB   VAL   7           HB       VAL   7  -4.855  13.237   2.567
   47   1HG1  VAL   7          1HG1      VAL   7  -3.232  12.073   1.169
   48   2HG1  VAL   7          2HG1      VAL   7  -2.516  12.454   2.753
   49   3HG1  VAL   7          3HG1      VAL   7  -3.056  10.796   2.396
   50   1HG2  VAL   7          1HG2      VAL   7  -6.501  12.008   1.690
   51   2HG2  VAL   7          2HG2      VAL   7  -5.282  10.777   1.282
   52   3HG2  VAL   7          3HG2      VAL   7  -6.179  10.667   2.815
   53    H    ASP   8           H        ASP   8  -5.430   9.612   4.989
   54    HA   ASP   8           HA       ASP   8  -2.720   8.936   5.807
   55   1HB   ASP   8          1HB       ASP   8  -4.529   8.757   7.535
   56   2HB   ASP   8          2HB       ASP   8  -5.390   7.627   6.510
   57    H    CYS   9           H        CYS   9  -2.001   8.327   3.633
   58    HA   CYS   9           HA       CYS   9  -3.325   6.911   1.773
   59   1HB   CYS   9          1HB       CYS   9  -0.429   6.948   2.562
   60   2HB   CYS   9          2HB       CYS   9  -0.975   5.885   1.281
   61    H    LYS  10           H        LYS  10  -1.351   5.578   4.525
   62    HA   LYS  10           HA       LYS  10  -1.601   2.931   4.081
   63   1HB   LYS  10          1HB       LYS  10  -1.520   4.576   6.596
   64   2HB   LYS  10          2HB       LYS  10  -1.720   2.839   6.702
   65   1HG   LYS  10          1HG       LYS  10   0.443   2.428   6.083
   66   2HG   LYS  10          2HG       LYS  10   0.397   3.610   4.790
   67   1HD   LYS  10          1HD       LYS  10   1.266   5.287   6.104
   68   2HD   LYS  10          2HD       LYS  10   0.347   4.802   7.516
   69   1HE   LYS  10          1HE       LYS  10   2.240   2.702   6.968
   70   2HE   LYS  10          2HE       LYS  10   3.110   4.220   6.883
   71   1HZ   LYS  10          1HZ       LYS  10   2.505   2.953   9.140
   72   2HZ   LYS  10          2HZ       LYS  10   2.840   4.549   9.051
   73   3HZ   LYS  10          3HZ       LYS  10   1.289   4.041   9.078
   74    H    GLY  11           H        GLY  11  -4.023   5.033   5.778
   75   1HA   GLY  11          1HA       GLY  11  -5.912   2.940   6.119
   76   2HA   GLY  11          2HA       GLY  11  -6.186   4.662   6.293
   77    H    GLN  12           H        GLN  12  -5.392   5.523   3.643
   78    HA   GLN  12           HA       GLN  12  -7.799   4.848   2.303
   79   1HB   GLN  12          1HB       GLN  12  -6.807   7.145   2.293
   80   2HB   GLN  12          2HB       GLN  12  -5.438   6.545   1.378
   81   1HG   GLN  12          1HG       GLN  12  -6.601   6.866  -0.538
   82   2HG   GLN  12          2HG       GLN  12  -7.755   5.650  -0.026
   83   1HE2  GLN  12          1HE2      GLN  12  -7.766   8.452  -1.348
   84   2HE2  GLN  12          2HE2      GLN  12  -9.065   9.289  -0.565
   85    H    CYS  13           H        CYS  13  -6.753   2.428   2.496
   86    HA   CYS  13           HA       CYS  13  -6.129   1.778  -0.214
   87   1HB   CYS  13          1HB       CYS  13  -4.052   1.438   1.942
   88   2HB   CYS  13          2HB       CYS  13  -4.095   0.393   0.536
   89    H    THR  14           H        THR  14  -8.405   1.022   0.599
   90    HA   THR  14           HA       THR  14  -8.114  -1.550   2.008
   91    HB   THR  14           HB       THR  14 -10.316   0.562   1.924
   92    HG1  THR  14           1HG      THR  14  -8.873  -0.969   3.972
   93   1HG2  THR  14          1HG2      THR  14 -10.775  -2.241   1.980
   94   2HG2  THR  14          2HG2      THR  14 -10.797  -1.733   3.686
   95   3HG2  THR  14          3HG2      THR  14 -11.904  -0.974   2.517
   96    H    THR  15           H        THR  15  -9.856   0.171  -0.653
   97    HA   THR  15           HA       THR  15 -11.022  -2.176  -1.688
   98    HB   THR  15           HB       THR  15 -10.672   0.699  -2.405
   99    HG1  THR  15           1HG      THR  15 -12.954   0.260  -2.774
  100   1HG2  THR  15          1HG2      THR  15 -11.261  -1.443  -4.518
  101   2HG2  THR  15          2HG2      THR  15 -11.526   0.304  -4.729
  102   3HG2  THR  15          3HG2      THR  15  -9.873  -0.328  -4.535
  103    HA   PRO  16           HA       PRO  16  -7.203  -2.278  -4.449
  104   1HB   PRO  16          1HB       PRO  16  -4.988  -0.837  -3.752
  105   2HB   PRO  16          2HB       PRO  16  -6.171  -0.273  -4.915
  106   1HG   PRO  16          1HG       PRO  16  -5.758   0.597  -2.120
  107   2HG   PRO  16          2HG       PRO  16  -6.620   1.415  -3.408
  108   1HD   PRO  16          1HD       PRO  16  -7.777  -0.032  -1.218
  109   2HD   PRO  16          2HD       PRO  16  -8.633   0.686  -2.568
  110    H    CYS  17           H        CYS  17  -7.073  -2.287  -1.059
  111    HA   CYS  17           HA       CYS  17  -5.154  -4.496  -1.237
  112   1HB   CYS  17          1HB       CYS  17  -5.595  -2.629   1.102
  113   2HB   CYS  17          2HB       CYS  17  -4.474  -3.975   1.052
  114    H    GLU  18           H        GLU  18  -8.113  -4.500  -1.648
  115    HA   GLU  18           HA       GLU  18  -9.248  -5.427   0.778
  116   1HB   GLU  18          1HB       GLU  18 -10.166  -4.631  -1.831
  117   2HB   GLU  18          2HB       GLU  18 -10.805  -6.231  -1.510
  118   1HG   GLU  18          1HG       GLU  18 -11.409  -5.233   0.869
  119   2HG   GLU  18          2HG       GLU  18 -11.218  -3.681   0.078
  120    HA   PRO  19           HA       PRO  19  -8.777  -9.594  -1.428
  121   1HB   PRO  19          1HB       PRO  19  -7.435  -9.763  -3.802
  122   2HB   PRO  19          2HB       PRO  19  -9.179  -9.624  -3.695
  123   1HG   PRO  19          1HG       PRO  19  -7.199  -7.565  -4.455
  124   2HG   PRO  19          2HG       PRO  19  -8.927  -7.585  -4.744
  125   1HD   PRO  19          1HD       PRO  19  -7.538  -6.056  -2.754
  126   2HD   PRO  19          2HD       PRO  19  -9.274  -6.167  -2.968
  127    H    LEU  20           H        LEU  20  -6.040  -7.472  -1.844
  128    HA   LEU  20           HA       LEU  20  -4.080  -9.427  -1.511
  129   1HB   LEU  20          1HB       LEU  20  -3.287  -7.469  -2.369
  130   2HB   LEU  20          2HB       LEU  20  -4.246  -6.465  -1.300
  131    HG   LEU  20           HG       LEU  20  -1.674  -6.540  -1.016
  132   1HD1  LEU  20          1HD1      LEU  20  -3.655  -5.731   0.595
  133   2HD1  LEU  20          2HD1      LEU  20  -2.958  -7.007   1.623
  134   3HD1  LEU  20          3HD1      LEU  20  -1.937  -5.663   1.056
  135   1HD2  LEU  20          1HD2      LEU  20  -0.640  -8.311  -0.050
  136   2HD2  LEU  20          2HD2      LEU  20  -2.085  -8.806   0.865
  137   3HD2  LEU  20          3HD2      LEU  20  -1.950  -9.197  -0.867
  138    H    THR  21           H        THR  21  -5.602  -7.180   0.905
  139    HA   THR  21           HA       THR  21  -4.258  -8.229   3.117
  140    HB   THR  21           HB       THR  21  -6.900  -6.745   2.715
  141    HG1  THR  21           1HG      THR  21  -4.774  -5.730   2.260
  142   1HG2  THR  21          1HG2      THR  21  -6.050  -8.113   5.091
  143   2HG2  THR  21          2HG2      THR  21  -5.677  -6.389   5.330
  144   3HG2  THR  21          3HG2      THR  21  -7.341  -6.896   4.951
  145    H    ALA  22           H        ALA  22  -7.513  -9.055   1.760
  146    HA   ALA  22           HA       ALA  22  -8.251 -10.895   3.640
  147   1HB   ALA  22          1HB       ALA  22  -8.733 -10.613   0.668
  148   2HB   ALA  22          2HB       ALA  22  -9.434 -11.974   1.577
  149   3HB   ALA  22          3HB       ALA  22  -9.846 -10.300   2.022
  150    H    CYS  23           H        CYS  23  -6.166 -11.361   0.718
  151    HA   CYS  23           HA       CYS  23  -5.843 -14.014   0.711
  152   1HB   CYS  23          1HB       CYS  23  -4.684 -12.059  -0.626
  153   2HB   CYS  23          2HB       CYS  23  -3.376 -12.330   0.509
  154    H    LYS  24           H        LYS  24  -3.827 -11.686   2.666
  155    HA   LYS  24           HA       LYS  24  -2.459 -13.634   4.091
  156   1HB   LYS  24          1HB       LYS  24  -3.059 -10.719   4.537
  157   2HB   LYS  24          2HB       LYS  24  -2.242 -11.646   5.779
  158   1HG   LYS  24          1HG       LYS  24  -0.294 -11.757   4.586
  159   2HG   LYS  24          2HG       LYS  24  -1.121 -12.141   3.090
  160   1HD   LYS  24          1HD       LYS  24  -0.533 -10.033   2.441
  161   2HD   LYS  24          2HD       LYS  24  -1.875  -9.505   3.438
  162   1HE   LYS  24          1HE       LYS  24  -0.371  -9.183   5.372
  163   2HE   LYS  24          2HE       LYS  24   0.981  -9.843   4.472
  164   1HZ   LYS  24          1HZ       LYS  24   0.550  -7.303   4.576
  165   2HZ   LYS  24          2HZ       LYS  24   1.136  -7.985   3.213
  166   3HZ   LYS  24          3HZ       LYS  24  -0.447  -7.599   3.317
  167    H    GLU  25           H        GLU  25  -5.465 -11.791   4.942
  168    HA   GLU  25           HA       GLU  25  -5.865 -12.845   7.399
  169   1HB   GLU  25          1HB       GLU  25  -7.372 -11.363   5.476
  170   2HB   GLU  25          2HB       GLU  25  -8.410 -12.669   6.015
  171   1HG   GLU  25          1HG       GLU  25  -6.877 -11.238   8.159
  172   2HG   GLU  25          2HG       GLU  25  -8.138 -10.313   7.369
  173    H    LYS  26           H        LYS  26  -7.470 -14.075   4.366
  174    HA   LYS  26           HA       LYS  26  -8.650 -16.279   5.311
  175   1HB   LYS  26          1HB       LYS  26  -8.246 -15.268   2.860
  176   2HB   LYS  26          2HB       LYS  26  -7.128 -16.614   2.767
  177   1HG   LYS  26          1HG       LYS  26  -8.818 -18.129   2.609
  178   2HG   LYS  26          2HG       LYS  26  -9.645 -17.460   4.001
  179   1HD   LYS  26          1HD       LYS  26 -10.940 -15.992   2.715
  180   2HD   LYS  26          2HD       LYS  26  -9.743 -15.876   1.440
  181   1HE   LYS  26          1HE       LYS  26 -10.261 -18.351   0.904
  182   2HE   LYS  26          2HE       LYS  26 -11.629 -18.209   1.990
  183   1HZ   LYS  26          1HZ       LYS  26 -12.657 -16.737   0.605
  184   2HZ   LYS  26          2HZ       LYS  26 -11.283 -16.229  -0.116
  185   3HZ   LYS  26          3HZ       LYS  26 -11.910 -17.690  -0.489
  186    H    CYS  27           H        CYS  27  -5.177 -16.121   4.256
  187    HA   CYS  27           HA       CYS  27  -4.560 -18.726   4.898
  188   1HB   CYS  27          1HB       CYS  27  -2.879 -16.223   4.819
  189   2HB   CYS  27          2HB       CYS  27  -2.195 -17.798   5.168
  190    H    ALA  28           H        ALA  28  -4.197 -15.674   6.850
  191    HA   ALA  28           HA       ALA  28  -3.115 -16.592   9.118
  192   1HB   ALA  28          1HB       ALA  28  -3.588 -14.441   9.566
  193   2HB   ALA  28          2HB       ALA  28  -4.849 -14.410   8.309
  194   3HB   ALA  28          3HB       ALA  28  -5.251 -14.940   9.960
  195    H    GLU  29           H        GLU  29  -6.680 -16.676   8.395
  196    HA   GLU  29           HA       GLU  29  -7.370 -18.027  10.681
  197   1HB   GLU  29          1HB       GLU  29  -8.618 -17.746   7.942
  198   2HB   GLU  29          2HB       GLU  29  -9.353 -18.828   9.109
  199   1HG   GLU  29          1HG       GLU  29  -8.642 -15.970   9.868
  200   2HG   GLU  29          2HG       GLU  29 -10.148 -16.332   9.047
  201    H    SER  30           H        SER  30  -6.599 -19.313   7.376
  202    HA   SER  30           HA       SER  30  -7.057 -21.945   7.915
  203   1HB   SER  30          1HB       SER  30  -4.711 -21.612   6.204
  204   2HB   SER  30          2HB       SER  30  -6.311 -22.195   5.789
  205    HG   SER  30           HG       SER  30  -6.844 -20.265   5.008
  206    H    CYS  31           H        CYS  31  -4.428 -19.828   8.946
  207    HA   CYS  31           HA       CYS  31  -2.965 -22.160   9.934
  208   1HB   CYS  31          1HB       CYS  31  -2.139 -19.454   9.019
  209   2HB   CYS  31          2HB       CYS  31  -1.244 -20.146  10.357
  210    H    GLU  32           H        GLU  32  -5.138 -21.906  11.416
  211    HA   GLU  32           HA       GLU  32  -4.971 -19.854  13.349
  212   1HB   GLU  32          1HB       GLU  32  -6.820 -21.959  12.593
  213   2HB   GLU  32          2HB       GLU  32  -6.579 -22.005  14.328
  214   1HG   GLU  32          1HG       GLU  32  -6.882 -19.362  14.147
  215   2HG   GLU  32          2HG       GLU  32  -7.662 -19.748  12.625
  216    H    THR  33           H        THR  33  -4.296 -23.419  13.335
  217    HA   THR  33           HA       THR  33  -2.599 -22.965  15.699
  218    HB   THR  33           HB       THR  33  -3.445 -25.025  16.647
  219    HG1  THR  33           1HG      THR  33  -4.892 -25.231  14.103
  220   1HG2  THR  33          1HG2      THR  33  -5.260 -22.933  16.023
  221   2HG2  THR  33          2HG2      THR  33  -6.092 -24.428  15.529
  222   3HG2  THR  33          3HG2      THR  33  -5.520 -24.239  17.204
  223    H    SER  34           H        SER  34  -1.282 -22.542  13.492
  224    HA   SER  34           HA       SER  34  -0.265 -25.110  12.609
  225   1HB   SER  34          1HB       SER  34  -0.693 -22.543  11.346
  226   2HB   SER  34          2HB       SER  34   1.013 -22.932  11.246
  227    HG   SER  34           HG       SER  34  -0.492 -23.764   9.487
  228    H    ALA  35           H        ALA  35   2.134 -25.414  12.484
  229    HA   ALA  35           HA       ALA  35   3.380 -24.804  14.887
  230   1HB   ALA  35          1HB       ALA  35   4.862 -25.414  12.319
  231   2HB   ALA  35          2HB       ALA  35   5.227 -25.949  13.977
  232   3HB   ALA  35          3HB       ALA  35   3.839 -26.641  13.105
  233    H    ASP  36           H        ASP  36   4.285 -23.556  11.589
  234    HA   ASP  36           HA       ASP  36   5.427 -21.269  12.947
  235   1HB   ASP  36          1HB       ASP  36   5.593 -21.802   9.966
  236   2HB   ASP  36          2HB       ASP  36   6.716 -20.908  10.972
  237    H    LYS  37           H        LYS  37   3.485 -20.021  13.355
  238    HA   LYS  37           HA       LYS  37   1.610 -19.586  11.233
  239   1HB   LYS  37          1HB       LYS  37   1.874 -18.755  14.103
  240   2HB   LYS  37          2HB       LYS  37   0.791 -17.856  13.059
  241   1HG   LYS  37          1HG       LYS  37  -0.556 -19.773  12.592
  242   2HG   LYS  37          2HG       LYS  37   0.687 -20.891  13.116
  243   1HD   LYS  37          1HD       LYS  37  -0.881 -20.877  14.909
  244   2HD   LYS  37          2HD       LYS  37   0.429 -19.861  15.475
  245   1HE   LYS  37          1HE       LYS  37  -0.917 -17.856  14.513
  246   2HE   LYS  37          2HE       LYS  37  -2.263 -18.969  14.362
  247   1HZ   LYS  37          1HZ       LYS  37  -0.838 -18.303  16.843
  248   2HZ   LYS  37          2HZ       LYS  37  -2.365 -17.877  16.450
  249   3HZ   LYS  37          3HZ       LYS  37  -2.002 -19.443  16.736
  250    H    LYS  38           H        LYS  38   3.888 -17.461  13.112
  251    HA   LYS  38           HA       LYS  38   3.549 -15.167  11.711
  252   1HB   LYS  38          1HB       LYS  38   5.053 -15.782  13.757
  253   2HB   LYS  38          2HB       LYS  38   6.301 -16.048  12.556
  254   1HG   LYS  38          1HG       LYS  38   6.609 -13.816  12.263
  255   2HG   LYS  38          2HG       LYS  38   4.899 -13.553  11.986
  256   1HD   LYS  38          1HD       LYS  38   4.565 -12.785  14.106
  257   2HD   LYS  38          2HD       LYS  38   5.435 -14.131  14.816
  258   1HE   LYS  38          1HE       LYS  38   7.511 -13.020  14.735
  259   2HE   LYS  38          2HE       LYS  38   7.030 -11.987  13.404
  260   1HZ   LYS  38          1HZ       LYS  38   7.127 -10.977  15.691
  261   2HZ   LYS  38          2HZ       LYS  38   5.783 -10.668  14.817
  262   3HZ   LYS  38          3HZ       LYS  38   5.739 -11.772  16.020
  263    H    THR  39           H        THR  39   5.448 -18.069  10.780
  264    HA   THR  39           HA       THR  39   6.522 -16.822   8.441
  265    HB   THR  39           HB       THR  39   6.303 -19.759   9.290
  266    HG1  THR  39           1HG      THR  39   7.387 -17.991  10.684
  267   1HG2  THR  39          1HG2      THR  39   8.297 -18.322   7.461
  268   2HG2  THR  39          2HG2      THR  39   8.318 -20.050   7.889
  269   3HG2  THR  39          3HG2      THR  39   7.003 -19.398   6.883
  270    H    CYS  40           H        CYS  40   4.041 -19.430   8.927
  271    HA   CYS  40           HA       CYS  40   3.271 -19.790   6.398
  272   1HB   CYS  40          1HB       CYS  40   2.201 -21.121   7.942
  273   2HB   CYS  40          2HB       CYS  40   1.754 -19.775   8.973
  274    H    ARG  41           H        ARG  41   1.787 -17.325   8.641
  275    HA   ARG  41           HA       ARG  41   0.147 -16.101   6.965
  276   1HB   ARG  41          1HB       ARG  41   1.988 -14.923   9.088
  277   2HB   ARG  41          2HB       ARG  41   0.825 -13.916   8.250
  278   1HG   ARG  41          1HG       ARG  41  -0.997 -15.553   8.949
  279   2HG   ARG  41          2HG       ARG  41   0.199 -16.404   9.905
  280   1HD   ARG  41          1HD       ARG  41   0.046 -13.444  10.354
  281   2HD   ARG  41          2HD       ARG  41  -1.345 -14.367  10.886
  282    HE   ARG  41           HE       ARG  41   1.101 -15.649  11.747
  283   1HH1  ARG  41          2HH2      ARG  41  -1.022 -12.939  12.475
  284   2HH1  ARG  41          1HH2      ARG  41  -0.570 -12.869  14.145
  285   1HH2  ARG  41          2HH1      ARG  41   1.698 -15.557  13.951
  286   2HH2  ARG  41          1HH1      ARG  41   0.987 -14.367  14.990
  287    H    ARG  42           H        ARG  42   3.720 -15.658   7.160
  288    HA   ARG  42           HA       ARG  42   3.749 -13.552   5.305
  289   1HB   ARG  42          1HB       ARG  42   5.724 -15.210   6.788
  290   2HB   ARG  42          2HB       ARG  42   6.305 -14.672   5.224
  291   1HG   ARG  42          1HG       ARG  42   6.874 -12.761   6.353
  292   2HG   ARG  42          2HG       ARG  42   5.188 -12.338   6.129
  293   1HD   ARG  42          1HD       ARG  42   4.630 -13.330   8.351
  294   2HD   ARG  42          2HD       ARG  42   6.304 -13.798   8.574
  295    HE   ARG  42           HE       ARG  42   6.869 -11.556   9.037
  296   1HH1  ARG  42          2HH2      ARG  42   3.594 -11.735   7.762
  297   2HH1  ARG  42          1HH2      ARG  42   3.218 -10.088   8.146
  298   1HH2  ARG  42          2HH1      ARG  42   6.373  -9.384   9.544
  299   2HH2  ARG  42          1HH1      ARG  42   4.809  -8.742   9.167
  300    H    ASN  43           H        ASN  43   4.601 -17.085   5.145
  301    HA   ASN  43           HA       ASN  43   5.430 -17.250   2.606
  302   1HB   ASN  43          1HB       ASN  43   3.986 -19.078   4.486
  303   2HB   ASN  43          2HB       ASN  43   3.897 -19.550   2.800
  304   1HD2  ASN  43          1HD2      ASN  43   5.162 -21.126   4.612
  305   2HD2  ASN  43          2HD2      ASN  43   6.873 -21.147   4.344
  306    H    CYS  44           H        CYS  44   2.063 -17.046   3.878
  307    HA   CYS  44           HA       CYS  44   0.563 -17.739   1.772
  308   1HB   CYS  44          1HB       CYS  44  -0.363 -17.018   3.890
  309   2HB   CYS  44          2HB       CYS  44   0.161 -15.370   3.607
  310    H    LYS  45           H        LYS  45   2.422 -14.689   2.263
  311    HA   LYS  45           HA       LYS  45   1.470 -13.217   0.158
  312   1HB   LYS  45          1HB       LYS  45   3.242 -12.743   2.060
  313   2HB   LYS  45          2HB       LYS  45   4.397 -13.189   0.819
  314   1HG   LYS  45          1HG       LYS  45   3.732 -11.413  -0.624
  315   2HG   LYS  45          2HG       LYS  45   2.194 -11.199   0.188
  316   1HD   LYS  45          1HD       LYS  45   3.090  -9.684   1.619
  317   2HD   LYS  45          2HD       LYS  45   4.327 -10.820   2.120
  318   1HE   LYS  45          1HE       LYS  45   4.514  -9.215  -0.469
  319   2HE   LYS  45          2HE       LYS  45   5.175  -8.643   1.050
  320   1HZ   LYS  45          1HZ       LYS  45   6.828  -9.799  -0.201
  321   2HZ   LYS  45          2HZ       LYS  45   6.497 -10.665   1.143
  322   3HZ   LYS  45          3HZ       LYS  45   5.910 -11.146  -0.303
  323    H    LYS  46           H        LYS  46   4.046 -15.754   0.177
  324    HA   LYS  46           HA       LYS  46   4.365 -15.488  -2.674
  325   1HB   LYS  46          1HB       LYS  46   5.645 -17.198  -0.540
  326   2HB   LYS  46          2HB       LYS  46   5.929 -17.495  -2.243
  327   1HG   LYS  46          1HG       LYS  46   6.210 -14.655  -1.294
  328   2HG   LYS  46          2HG       LYS  46   7.449 -15.786  -0.786
  329   1HD   LYS  46          1HD       LYS  46   8.294 -16.039  -2.918
  330   2HD   LYS  46          2HD       LYS  46   6.714 -15.961  -3.672
  331   1HE   LYS  46          1HE       LYS  46   6.676 -13.576  -3.646
  332   2HE   LYS  46          2HE       LYS  46   7.919 -13.473  -2.415
  333   1HZ   LYS  46          1HZ       LYS  46   8.698 -14.809  -4.836
  334   2HZ   LYS  46          2HZ       LYS  46   8.393 -13.212  -4.993
  335   3HZ   LYS  46          3HZ       LYS  46   9.521 -13.727  -3.930
  336    H    ALA  47           H        ALA  47   2.577 -17.456  -0.334
  337    HA   ALA  47           HA       ALA  47   2.067 -19.731  -1.709
  338   1HB   ALA  47          1HB       ALA  47   0.070 -18.053  -0.138
  339   2HB   ALA  47          2HB       ALA  47  -0.043 -19.800  -0.457
  340   3HB   ALA  47          3HB       ALA  47   1.263 -19.166   0.572
  341    H    ASP  48           H        ASP  48   0.121 -16.664  -1.947
  342    HA   ASP  48           HA       ASP  48  -0.049 -16.871  -4.720
  343   1HB   ASP  48          1HB       ASP  48  -1.730 -18.687  -3.656
  344   2HB   ASP  48          2HB       ASP  48  -2.761 -17.283  -3.459
  345    H    CYS  49           H        CYS  49   0.759 -14.726  -3.394
  346    HA   CYS  49           HA       CYS  49  -1.403 -12.859  -3.684
  347   1HB   CYS  49          1HB       CYS  49   0.029 -12.626  -1.079
  348   2HB   CYS  49          2HB       CYS  49  -1.553 -12.038  -1.551
  349    H    GLU  50           H        GLU  50   0.996 -13.460  -5.167
  350    HA   GLU  50           HA       GLU  50   3.036 -11.693  -4.286
  351   1HB   GLU  50          1HB       GLU  50   2.639 -13.673  -6.443
  352   2HB   GLU  50          2HB       GLU  50   3.575 -12.284  -6.958
  353   1HG   GLU  50          1HG       GLU  50   4.429 -13.161  -4.299
  354   2HG   GLU  50          2HG       GLU  50   4.490 -14.497  -5.431
  355    HA   PRO  51           HA       PRO  51   1.187  -9.151  -7.851
  356   1HB   PRO  51          1HB       PRO  51  -1.271  -9.819  -8.842
  357   2HB   PRO  51          2HB       PRO  51   0.232 -10.321  -9.590
  358   1HG   PRO  51          1HG       PRO  51  -1.659 -11.920  -7.975
  359   2HG   PRO  51          2HG       PRO  51  -0.405 -12.475  -9.067
  360   1HD   PRO  51          1HD       PRO  51  -0.298 -12.450  -6.200
  361   2HD   PRO  51          2HD       PRO  51   0.997 -12.896  -7.294
  362    H    GLN  52           H        GLN  52  -1.241 -10.456  -5.686
  363    HA   GLN  52           HA       GLN  52  -2.730  -8.143  -5.511
  364   1HB   GLN  52          1HB       GLN  52  -2.278 -10.236  -3.338
  365   2HB   GLN  52          2HB       GLN  52  -3.627  -9.121  -3.425
  366   1HG   GLN  52          1HG       GLN  52  -4.237 -10.129  -5.678
  367   2HG   GLN  52          2HG       GLN  52  -2.969 -11.315  -5.445
  368   1HE2  GLN  52          1HE2      GLN  52  -4.792 -12.793  -5.671
  369   2HE2  GLN  52          2HE2      GLN  52  -5.717 -13.237  -4.276
  370    H    ASP  53           H        ASP  53  -0.017  -9.347  -3.417
  371    HA   ASP  53           HA       ASP  53  -0.017  -7.303  -1.628
  372   1HB   ASP  53          1HB       ASP  53   1.412  -9.462  -1.717
  373   2HB   ASP  53          2HB       ASP  53   2.509  -8.580  -2.761
  374    H    LYS  54           H        LYS  54   1.433  -7.571  -4.917
  375    HA   LYS  54           HA       LYS  54   2.967  -5.227  -4.806
  376   1HB   LYS  54          1HB       LYS  54   1.884  -6.952  -7.027
  377   2HB   LYS  54          2HB       LYS  54   2.721  -5.456  -7.386
  378   1HG   LYS  54          1HG       LYS  54   4.669  -6.252  -5.984
  379   2HG   LYS  54          2HG       LYS  54   3.837  -7.775  -5.739
  380   1HD   LYS  54          1HD       LYS  54   3.691  -7.708  -8.434
  381   2HD   LYS  54          2HD       LYS  54   5.097  -6.679  -8.247
  382   1HE   LYS  54          1HE       LYS  54   5.621  -8.806  -6.486
  383   2HE   LYS  54          2HE       LYS  54   4.847  -9.593  -7.847
  384   1HZ   LYS  54          1HZ       LYS  54   7.427  -8.722  -7.717
  385   2HZ   LYS  54          2HZ       LYS  54   6.654  -9.284  -9.041
  386   3HZ   LYS  54          3HZ       LYS  54   6.698  -7.679  -8.741
  387    H    VAL  55           H        VAL  55  -0.216  -5.825  -6.465
  388    HA   VAL  55           HA       VAL  55  -0.797  -3.317  -7.228
  389    HB   VAL  55           HB       VAL  55  -2.535  -5.500  -6.095
  390   1HG1  VAL  55          1HG1      VAL  55  -4.507  -4.337  -6.889
  391   2HG1  VAL  55          2HG1      VAL  55  -3.643  -3.301  -5.728
  392   3HG1  VAL  55          3HG1      VAL  55  -3.517  -2.979  -7.475
  393   1HG2  VAL  55          1HG2      VAL  55  -1.415  -4.805  -8.719
  394   2HG2  VAL  55          2HG2      VAL  55  -2.053  -6.354  -8.116
  395   3HG2  VAL  55          3HG2      VAL  55  -3.166  -5.122  -8.756
  396    H    CYS  56           H        CYS  56  -1.415  -4.710  -3.935
  397    HA   CYS  56           HA       CYS  56  -2.623  -2.580  -2.787
  398   1HB   CYS  56          1HB       CYS  56  -2.249  -4.767  -1.720
  399   2HB   CYS  56          2HB       CYS  56  -0.553  -4.381  -1.511
  400    H    ASP  57           H        ASP  57   0.951  -3.281  -2.573
  401    HA   ASP  57           HA       ASP  57   1.798  -1.039  -1.462
  402   1HB   ASP  57          1HB       ASP  57   3.171  -3.008  -2.352
  403   2HB   ASP  57          2HB       ASP  57   3.121  -2.251  -3.932
  404    H    ALA  58           H        ALA  58   0.958  -1.547  -4.947
  405    HA   ALA  58           HA       ALA  58   1.817   0.789  -6.045
  406   1HB   ALA  58          1HB       ALA  58   0.430  -1.355  -6.910
  407   2HB   ALA  58          2HB       ALA  58  -0.903  -0.179  -6.820
  408   3HB   ALA  58          3HB       ALA  58   0.520   0.164  -7.833
  409    H    CYS  59           H        CYS  59  -1.217   0.175  -4.180
  410    HA   CYS  59           HA       CYS  59  -2.413   2.606  -4.561
  411   1HB   CYS  59          1HB       CYS  59  -3.556   0.783  -3.499
  412   2HB   CYS  59          2HB       CYS  59  -2.430   0.776  -2.157
  413    H    ARG  60           H        ARG  60  -0.309   1.584  -1.760
  414    HA   ARG  60           HA       ARG  60  -0.139   4.020  -0.589
  415   1HB   ARG  60          1HB       ARG  60   1.934   1.779  -0.756
  416   2HB   ARG  60          2HB       ARG  60   2.100   3.146   0.328
  417   1HG   ARG  60          1HG       ARG  60  -0.197   2.548   1.290
  418   2HG   ARG  60          2HG       ARG  60  -0.152   1.085   0.326
  419   1HD   ARG  60          1HD       ARG  60   0.654   0.597   2.602
  420   2HD   ARG  60          2HD       ARG  60   1.969   0.394   1.461
  421    HE   ARG  60           HE       ARG  60   1.704   2.541   3.476
  422   1HH1  ARG  60          2HH2      ARG  60   3.422   1.342   0.649
  423   2HH1  ARG  60          1HH2      ARG  60   4.821   2.326   0.923
  424   1HH2  ARG  60          2HH1      ARG  60   3.549   3.839   3.839
  425   2HH2  ARG  60          1HH1      ARG  60   4.894   3.756   2.750
  426    H    MET  61           H        MET  61   1.560   2.735  -3.443
  427    HA   MET  61           HA       MET  61   3.559   4.724  -3.461
  428   1HB   MET  61          1HB       MET  61   4.071   2.710  -4.647
  429   2HB   MET  61          2HB       MET  61   2.488   2.635  -5.395
  430   1HG   MET  61          1HG       MET  61   3.115   3.975  -7.150
  431   2HG   MET  61          2HG       MET  61   3.986   5.090  -6.116
  432   1HE   MET  61          1HE       MET  61   5.599   0.946  -7.205
  433   2HE   MET  61          2HE       MET  61   3.945   1.392  -6.721
  434   3HE   MET  61          3HE       MET  61   4.502   1.706  -8.382
  435    H    LYS  62           H        LYS  62   0.580   4.167  -5.476
  436    HA   LYS  62           HA       LYS  62   0.814   6.564  -6.897
  437   1HB   LYS  62          1HB       LYS  62  -1.170   4.410  -6.551
  438   2HB   LYS  62          2HB       LYS  62  -1.870   5.969  -6.936
  439   1HG   LYS  62          1HG       LYS  62  -1.368   5.466  -9.104
  440   2HG   LYS  62          2HG       LYS  62   0.277   5.901  -8.685
  441   1HD   LYS  62          1HD       LYS  62   0.114   3.265  -7.782
  442   2HD   LYS  62          2HD       LYS  62  -0.886   3.227  -9.221
  443   1HE   LYS  62          1HE       LYS  62   0.930   4.094 -10.604
  444   2HE   LYS  62          2HE       LYS  62   1.914   4.441  -9.196
  445   1HZ   LYS  62          1HZ       LYS  62   1.357   1.900 -10.444
  446   2HZ   LYS  62          2HZ       LYS  62   2.732   2.439  -9.746
  447   3HZ   LYS  62          3HZ       LYS  62   1.505   1.892  -8.818
  448    H    CYS  63           H        CYS  63  -1.132   5.686  -3.964
  449    HA   CYS  63           HA       CYS  63  -2.446   7.998  -3.570
  450   1HB   CYS  63          1HB       CYS  63  -2.670   5.997  -2.175
  451   2HB   CYS  63          2HB       CYS  63  -1.106   6.308  -1.449
  452    H    HIS  64           H        HIS  64   0.876   7.191  -2.302
  453    HA   HIS  64           HA       HIS  64   1.503   9.511  -1.111
  454   1HB   HIS  64          1HB       HIS  64   2.961   7.591  -1.093
  455   2HB   HIS  64          2HB       HIS  64   3.251   7.721  -2.816
  456    HD1  HIS  64           1HD      HIS  64   4.891   8.418   0.239
  457    HD2  HIS  64           2HD      HIS  64   4.442  10.547  -3.347
  458    HE1  HIS  64           1HE      HIS  64   6.774  10.140   0.190
  459    H    LYS  65           H        LYS  65   2.179   8.799  -4.617
  460    HA   LYS  65           HA       LYS  65   2.976  11.399  -5.220
  461   1HB   LYS  65          1HB       LYS  65   3.660   9.987  -6.853
  462   2HB   LYS  65          2HB       LYS  65   2.266   8.936  -6.698
  463   1HG   LYS  65          1HG       LYS  65   0.852  10.618  -7.882
  464   2HG   LYS  65          2HG       LYS  65   2.228  11.695  -8.013
  465   1HD   LYS  65          1HD       LYS  65   2.780  10.672  -9.959
  466   2HD   LYS  65          2HD       LYS  65   3.155   9.224  -9.046
  467   1HE   LYS  65          1HE       LYS  65   1.434   8.180 -10.093
  468   2HE   LYS  65          2HE       LYS  65   0.326   9.235  -9.239
  469   1HZ   LYS  65          1HZ       LYS  65   0.202   9.283 -11.708
  470   2HZ   LYS  65          2HZ       LYS  65   0.363  10.748 -11.005
  471   3HZ   LYS  65          3HZ       LYS  65   1.647  10.045 -11.728
  472    H    ALA  66           H        ALA  66  -0.218   9.882  -4.894
  473    HA   ALA  66           HA       ALA  66  -1.660  11.860  -6.285
  474   1HB   ALA  66          1HB       ALA  66  -3.316  10.397  -5.873
  475   2HB   ALA  66          2HB       ALA  66  -2.148   9.412  -4.959
  476   3HB   ALA  66          3HB       ALA  66  -3.144  10.623  -4.116
  477    H    CYS  67           H        CYS  67  -1.187  11.301  -2.718
  478    HA   CYS  67           HA       CYS  67  -2.423  13.618  -1.907
  479   1HB   CYS  67          1HB       CYS  67  -1.834  11.760  -0.425
  480   2HB   CYS  67          2HB       CYS  67  -0.132  12.143  -0.593
  481    H    ARG  68           H        ARG  68   1.047  12.926  -2.708
  482    HA   ARG  68           HA       ARG  68   2.111  15.314  -2.042
  483   1HB   ARG  68          1HB       ARG  68   3.521  13.474  -2.782
  484   2HB   ARG  68          2HB       ARG  68   2.756  13.432  -4.358
  485   1HG   ARG  68          1HG       ARG  68   3.739  16.109  -3.956
  486   2HG   ARG  68          2HG       ARG  68   5.025  15.008  -3.502
  487   1HD   ARG  68          1HD       ARG  68   5.486  14.784  -5.718
  488   2HD   ARG  68          2HD       ARG  68   3.998  13.869  -5.862
  489    HE   ARG  68           HE       ARG  68   3.058  16.430  -6.015
  490   1HH1  ARG  68          2HH2      ARG  68   5.728  14.826  -7.653
  491   2HH1  ARG  68          1HH2      ARG  68   5.613  15.808  -9.075
  492   1HH2  ARG  68          2HH1      ARG  68   2.906  17.726  -7.891
  493   2HH2  ARG  68          1HH1      ARG  68   3.998  17.469  -9.211
  494    H    ALA  69           H        ALA  69   0.907  14.344  -5.346
  495    HA   ALA  69           HA       ALA  69   1.189  16.889  -6.466
  496   1HB   ALA  69          1HB       ALA  69   1.004  15.220  -8.050
  497   2HB   ALA  69          2HB       ALA  69  -0.230  14.329  -7.127
  498   3HB   ALA  69          3HB       ALA  69  -0.680  15.794  -8.032
  499    H    ALA  70           H        ALA  70  -0.995  15.674  -4.091
  500    HA   ALA  70           HA       ALA  70  -3.227  17.301  -4.804
  501   1HB   ALA  70          1HB       ALA  70  -4.259  16.119  -3.167
  502   2HB   ALA  70          2HB       ALA  70  -2.794  15.108  -3.192
  503   3HB   ALA  70          3HB       ALA  70  -2.952  16.417  -1.997
  504    H    ASN  71           H        ASN  71  -1.265  17.386  -1.754
  505    HA   ASN  71           HA       ASN  71  -1.815  20.174  -1.560
  506   1HB   ASN  71          1HB       ASN  71  -0.026  18.376   0.161
  507   2HB   ASN  71          2HB       ASN  71  -0.545  19.993   0.594
  508   1HD2  ASN  71          1HD2      ASN  71  -1.318  16.671   0.483
  509   2HD2  ASN  71          2HD2      ASN  71  -2.913  16.728   1.158
  510    H    CYS  72           H        CYS  72   1.203  18.112  -1.477
  511    HA   CYS  72           HA       CYS  72   2.886  20.322  -1.991
  512   1HB   CYS  72          1HB       CYS  72   3.741  17.496  -2.481
  513   2HB   CYS  72          2HB       CYS  72   4.657  18.844  -1.836
  514    H    ALA  73           H        ALA  73   1.385  20.982  -3.924
  515    HA   ALA  73           HA       ALA  73   1.784  19.400  -6.308
  516   1HB   ALA  73          1HB       ALA  73  -0.154  21.218  -5.327
  517   2HB   ALA  73          2HB       ALA  73   0.595  22.009  -6.735
  518   3HB   ALA  73          3HB       ALA  73  -0.139  20.396  -6.906
  519    H    SER  74           H        SER  74   2.737  22.620  -4.959
  520    HA   SER  74           HA       SER  74   4.456  22.998  -7.240
  521   1HB   SER  74          1HB       SER  74   3.811  24.770  -4.843
  522   2HB   SER  74          2HB       SER  74   4.909  25.236  -6.126
  523    HG   SER  74           HG       SER  74   2.999  26.077  -6.824
  524    H    GLU  75           H        GLU  75   4.549  22.310  -3.727
  525    HA   GLU  75           HA       GLU  75   7.141  22.834  -3.171
  526   1HB   GLU  75          1HB       GLU  75   5.188  20.754  -2.181
  527   2HB   GLU  75          2HB       GLU  75   6.844  20.694  -1.610
  528   1HG   GLU  75          1HG       GLU  75   5.747  22.069  -0.013
  529   2HG   GLU  75          2HG       GLU  75   6.581  23.214  -1.045
  530    H    CYS  76           H        CYS  76   5.776  20.213  -5.133
  531    HA   CYS  76           HA       CYS  76   8.413  18.972  -5.278
  532   1HB   CYS  76          1HB       CYS  76   5.630  18.006  -5.657
  533   2HB   CYS  76          2HB       CYS  76   6.850  17.310  -6.704
  534    HA   PRO  77           HA       PRO  77   8.525  21.209  -9.107
  535   1HB   PRO  77          1HB       PRO  77  11.223  21.034  -9.502
  536   2HB   PRO  77          2HB       PRO  77  10.473  22.315  -8.572
  537   1HG   PRO  77          1HG       PRO  77  11.987  19.967  -7.606
  538   2HG   PRO  77          2HG       PRO  77  11.604  21.452  -6.757
  539   1HD   PRO  77          1HD       PRO  77  10.332  18.904  -6.417
  540   2HD   PRO  77          2HD       PRO  77   9.874  20.414  -5.655
  541    H    LYS  78           H        LYS  78   9.161  20.828 -11.388
  542    HA   LYS  78           HA       LYS  78   8.697  18.015 -11.878
  543   1HB   LYS  78          1HB       LYS  78   7.407  19.782 -13.055
  544   2HB   LYS  78          2HB       LYS  78   8.886  20.348 -13.806
  545   1HG   LYS  78          1HG       LYS  78   7.930  18.888 -15.426
  546   2HG   LYS  78          2HG       LYS  78   9.201  17.935 -14.686
  547   1HD   LYS  78          1HD       LYS  78   7.376  17.048 -13.063
  548   2HD   LYS  78          2HD       LYS  78   6.207  17.773 -14.148
  549   1HE   LYS  78          1HE       LYS  78   7.295  16.443 -16.054
  550   2HE   LYS  78          2HE       LYS  78   8.243  15.606 -14.841
  551   1HZ   LYS  78          1HZ       LYS  78   5.682  15.035 -15.617
  552   2HZ   LYS  78          2HZ       LYS  78   6.515  14.342 -14.395
  553   3HZ   LYS  78          3HZ       LYS  78   5.543  15.621 -14.099
  554    H    HIS  79           H        HIS  79  10.849  17.462 -10.852
  555    HA   HIS  79           HA       HIS  79  12.670  16.853 -12.857
  556   1HB   HIS  79          1HB       HIS  79  13.161  19.278 -12.770
  557   2HB   HIS  79          2HB       HIS  79  13.568  19.132 -11.071
  558    HD1  HIS  79           1HD      HIS  79  15.956  20.102 -11.958
  559    HD2  HIS  79           2HD      HIS  79  14.989  16.175 -13.072
  560    HE1  HIS  79           1HE      HIS  79  18.138  19.015 -12.711
  561    H    GLU  80           H        GLU  80  12.814  17.891  -9.369
  562    HA   GLU  80           HA       GLU  80  14.431  15.749  -8.651
  563   1HB   GLU  80          1HB       GLU  80  12.618  17.586  -7.037
  564   2HB   GLU  80          2HB       GLU  80  13.641  16.380  -6.281
  565   1HG   GLU  80          1HG       GLU  80  15.415  17.641  -8.024
  566   2HG   GLU  80          2HG       GLU  80  14.383  18.967  -7.529
  567    H    HIS  81           H        HIS  81  13.381  14.447  -6.463
  568    HA   HIS  81           HA       HIS  81  10.948  13.195  -7.503
  569   1HB   HIS  81          1HB       HIS  81  11.929  11.023  -6.578
  570   2HB   HIS  81          2HB       HIS  81  12.560  11.625  -8.098
  571    HD1  HIS  81           1HD      HIS  81  13.694  10.262  -4.995
  572    HD2  HIS  81           2HD      HIS  81  15.077  13.294  -7.542
  573    HE1  HIS  81           1HE      HIS  81  16.154  10.614  -4.417
  574    H    LYS  82           H        LYS  82  13.163  13.302  -4.616
  575    HA   LYS  82           HA       LYS  82  10.751  13.711  -2.994
  576   1HB   LYS  82          1HB       LYS  82  12.849  11.622  -2.767
  577   2HB   LYS  82          2HB       LYS  82  12.373  12.394  -1.268
  578   1HG   LYS  82          1HG       LYS  82  10.429  11.230  -1.229
  579   2HG   LYS  82          2HG       LYS  82   9.980  11.853  -2.804
  580   1HD   LYS  82          1HD       LYS  82  10.062   9.523  -3.177
  581   2HD   LYS  82          2HD       LYS  82  11.621  10.059  -3.771
  582   1HE   LYS  82          1HE       LYS  82  12.610   8.613  -2.330
  583   2HE   LYS  82          2HE       LYS  82  12.031   9.599  -1.003
  584   1HZ   LYS  82          1HZ       LYS  82  10.470   7.456  -2.271
  585   2HZ   LYS  82          2HZ       LYS  82  11.298   7.300  -0.872
  586   3HZ   LYS  82          3HZ       LYS  82  10.028   8.323  -0.960
  587    H    SER  83           H        SER  83  11.211  16.010  -3.230
  588    HA   SER  83           HA       SER  83  13.728  16.918  -2.237
  589   1HB   SER  83          1HB       SER  83  12.536  19.214  -2.528
  590   2HB   SER  83          2HB       SER  83  12.890  18.278  -3.967
  591    HG   SER  83           HG       SER  83  10.642  19.209  -3.732
  592    H    ASP  84           H        ASP  84  14.161  17.699  -0.167
  593    HA   ASP  84           HA       ASP  84  12.824  16.902   1.959
  594   1HB   ASP  84          1HB       ASP  84  14.326  19.516   1.527
  595   2HB   ASP  84          2HB       ASP  84  13.746  19.048   3.113
  596    H    THR  85           H        THR  85  12.481  20.212   0.454
  597    HA   THR  85           HA       THR  85  10.531  21.270   2.007
  598    HB   THR  85           HB       THR  85  11.768  22.331   0.059
  599    HG1  THR  85           1HG      THR  85   8.842  22.342  -0.136
  600   1HG2  THR  85          1HG2      THR  85  11.202  20.447  -1.608
  601   2HG2  THR  85          2HG2      THR  85   9.535  21.071  -1.607
  602   3HG2  THR  85          3HG2      THR  85  10.868  22.097  -2.187
  603    H    CYS  86           H        CYS  86  10.017  19.020  -0.778
  604    HA   CYS  86           HA       CYS  86   7.234  19.059  -0.554
  605   1HB   CYS  86          1HB       CYS  86   8.869  18.172  -2.425
  606   2HB   CYS  86          2HB       CYS  86   8.688  16.651  -1.574
  607    H    ARG  87           H        ARG  87   9.781  16.749   0.634
  608    HA   ARG  87           HA       ARG  87   8.129  14.980   1.849
  609   1HB   ARG  87          1HB       ARG  87  10.868  15.932   2.832
  610   2HB   ARG  87          2HB       ARG  87  10.102  14.427   3.302
  611   1HG   ARG  87          1HG       ARG  87  10.043  13.768   0.841
  612   2HG   ARG  87          2HG       ARG  87  10.969  15.212   0.481
  613   1HD   ARG  87          1HD       ARG  87  12.491  13.287   0.690
  614   2HD   ARG  87          2HD       ARG  87  12.801  14.420   1.990
  615    HE   ARG  87           HE       ARG  87  11.584  11.742   2.244
  616   1HH1  ARG  87          2HH2      ARG  87  12.262  14.825   3.797
  617   2HH1  ARG  87          1HH2      ARG  87  12.074  14.203   5.403
  618   1HH2  ARG  87          2HH1      ARG  87  11.336  10.920   4.362
  619   2HH2  ARG  87          1HH1      ARG  87  11.543  11.967   5.726
  620    H    ALA  88           H        ALA  88   9.287  18.182   2.967
  621    HA   ALA  88           HA       ALA  88   8.418  17.877   5.645
  622   1HB   ALA  88          1HB       ALA  88   9.795  19.796   4.006
  623   2HB   ALA  88          2HB       ALA  88   8.467  20.625   4.853
  624   3HB   ALA  88          3HB       ALA  88   9.688  19.723   5.782
  625    H    CYS  89           H        CYS  89   6.890  18.768   2.570
  626    HA   CYS  89           HA       CYS  89   4.625  19.969   3.804
  627   1HB   CYS  89          1HB       CYS  89   4.947  20.796   1.695
  628   2HB   CYS  89          2HB       CYS  89   5.447  19.253   1.031
  629    H    MET  90           H        MET  90   5.229  16.878   1.967
  630    HA   MET  90           HA       MET  90   2.747  15.794   2.522
  631   1HB   MET  90          1HB       MET  90   3.656  13.822   1.521
  632   2HB   MET  90          2HB       MET  90   4.639  15.097   0.828
  633   1HG   MET  90          1HG       MET  90   6.415  13.855   1.566
  634   2HG   MET  90          2HG       MET  90   6.061  14.553   3.133
  635   1HE   MET  90          1HE       MET  90   4.934  12.053   0.625
  636   2HE   MET  90          2HE       MET  90   4.741  10.513   1.497
  637   3HE   MET  90          3HE       MET  90   3.442  11.729   1.541
  638    H    LYS  91           H        LYS  91   5.607  16.160   4.510
  639    HA   LYS  91           HA       LYS  91   5.299  13.978   6.210
  640   1HB   LYS  91          1HB       LYS  91   7.337  15.041   6.402
  641   2HB   LYS  91          2HB       LYS  91   6.642  16.649   6.357
  642   1HG   LYS  91          1HG       LYS  91   5.812  16.455   8.632
  643   2HG   LYS  91          2HG       LYS  91   6.159  14.738   8.682
  644   1HD   LYS  91          1HD       LYS  91   8.652  15.475   8.207
  645   2HD   LYS  91          2HD       LYS  91   8.114  17.057   8.736
  646   1HE   LYS  91          1HE       LYS  91   7.299  16.054  10.887
  647   2HE   LYS  91          2HE       LYS  91   7.856  14.479  10.359
  648   1HZ   LYS  91          1HZ       LYS  91   9.617  15.249  11.550
  649   2HZ   LYS  91          2HZ       LYS  91  10.071  15.725  10.055
  650   3HZ   LYS  91          3HZ       LYS  91   9.432  16.808  11.097
  651    H    THR  92           H        THR  92   3.772  17.232   6.161
  652    HA   THR  92           HA       THR  92   2.184  16.452   8.501
  653    HB   THR  92           HB       THR  92   2.863  19.090   7.121
  654    HG1  THR  92           1HG      THR  92   4.314  18.111   8.731
  655   1HG2  THR  92          1HG2      THR  92   1.564  20.023   9.195
  656   2HG2  THR  92          2HG2      THR  92   0.598  19.501   7.794
  657   3HG2  THR  92          3HG2      THR  92   0.746  18.442   9.217
  658    H    ASN  93           H        ASN  93   1.711  18.007   5.253
  659    HA   ASN  93           HA       ASN  93  -0.982  17.874   5.225
  660   1HB   ASN  93          1HB       ASN  93   1.133  17.674   3.058
  661   2HB   ASN  93          2HB       ASN  93  -0.547  17.461   2.607
  662   1HD2  ASN  93          1HD2      ASN  93   1.761  19.617   4.169
  663   2HD2  ASN  93          2HD2      ASN  93   0.922  21.106   3.888
  664    H    CYS  94           H        CYS  94   1.377  15.439   3.869
  665    HA   CYS  94           HA       CYS  94  -0.772  13.517   3.636
  666   1HB   CYS  94          1HB       CYS  94   2.143  13.213   2.896
  667   2HB   CYS  94          2HB       CYS  94   0.832  12.133   2.467
  668    H    LYS  95           H        LYS  95   1.786  11.565   4.066
  669    HA   LYS  95           HA       LYS  95   1.247  11.284   6.924
  670   1HB   LYS  95          1HB       LYS  95   1.690   9.441   4.695
  671   2HB   LYS  95          2HB       LYS  95   2.690   9.061   6.082
  672   1HG   LYS  95          1HG       LYS  95  -0.208   9.729   6.585
  673   2HG   LYS  95          2HG       LYS  95   0.156   8.170   5.871
  674   1HD   LYS  95          1HD       LYS  95   0.479   7.465   8.018
  675   2HD   LYS  95          2HD       LYS  95   2.032   8.268   7.900
  676   1HE   LYS  95          1HE       LYS  95   1.119  10.322   8.888
  677   2HE   LYS  95          2HE       LYS  95  -0.510   9.678   8.838
  678   1HZ   LYS  95          1HZ       LYS  95   0.748   7.793  10.205
  679   2HZ   LYS  95          2HZ       LYS  95   1.611   9.097  10.676
  680   3HZ   LYS  95          3HZ       LYS  95  -0.006   9.062  10.904
  Start of MODEL   14
    1   1H    ILE   1           H        ILE   1 -18.415  16.120   3.454
    2    HA   ILE   1           HA       ILE   1 -16.080  14.613   3.076
    3    HB   ILE   1           HB       ILE   1 -17.788  13.159   1.921
    4   1HG1  ILE   1          1HG1      ILE   1 -15.890  13.904  -0.209
    5   2HG1  ILE   1          2HG1      ILE   1 -15.149  13.682   1.364
    6   1HG2  ILE   1          1HG2      ILE   1 -19.064  15.100   0.947
    7   2HG2  ILE   1          2HG2      ILE   1 -17.733  15.296  -0.219
    8   3HG2  ILE   1          3HG2      ILE   1 -18.677  13.787  -0.191
    9   1HD1  ILE   1          1HD1      ILE   1 -15.401  11.431   1.254
   10   2HD1  ILE   1          2HD1      ILE   1 -17.130  11.587   0.857
   11   3HD1  ILE   1          3HD1      ILE   1 -15.910  11.651  -0.438
   12    H    SER   2           H        SER   2 -14.516  15.857   2.013
   13    HA   SER   2           HA       SER   2 -15.423  18.165   0.571
   14   1HB   SER   2          1HB       SER   2 -13.830  18.376   3.159
   15   2HB   SER   2          2HB       SER   2 -13.901  19.673   1.983
   16    HG   SER   2           HG       SER   2 -16.339  19.453   2.215
   17    H    GLU   3           H        GLU   3 -13.454  19.357  -0.414
   18    HA   GLU   3           HA       GLU   3 -11.272  17.445  -0.727
   19   1HB   GLU   3          1HB       GLU   3 -12.840  18.986  -2.790
   20   2HB   GLU   3          2HB       GLU   3 -11.145  18.668  -3.104
   21   1HG   GLU   3          1HG       GLU   3 -11.448  16.301  -3.059
   22   2HG   GLU   3          2HG       GLU   3 -12.976  16.418  -2.210
   23    H    PHE   4           H        PHE   4  -9.979  18.513   0.868
   24    HA   PHE   4           HA       PHE   4  -8.403  20.594  -0.110
   25   1HB   PHE   4          1HB       PHE   4 -10.905  21.420   0.934
   26   2HB   PHE   4          2HB       PHE   4  -9.830  21.618   2.303
   27    HD1  PHE   4           1HD      PHE   4 -11.250  23.332  -0.286
   28    HD2  PHE   4           2HD      PHE   4  -7.440  22.726   1.481
   29    HE1  PHE   4           1HE      PHE   4 -10.470  25.529  -1.216
   30    HE2  PHE   4           2HE      PHE   4  -6.659  24.923   0.551
   31    HZ   PHE   4           HZ       PHE   4  -8.183  26.298  -0.787
   32    H    ALA   5           H        ALA   5  -9.853  19.316   2.968
   33    HA   ALA   5           HA       ALA   5  -7.771  19.714   4.654
   34   1HB   ALA   5          1HB       ALA   5 -10.131  18.071   4.500
   35   2HB   ALA   5          2HB       ALA   5  -8.799  17.104   5.177
   36   3HB   ALA   5          3HB       ALA   5  -9.262  18.642   5.944
   37    HA   PRO   6           HA       PRO   6  -4.546  17.079   3.483
   38   1HB   PRO   6          1HB       PRO   6  -3.541  16.131   5.841
   39   2HB   PRO   6          2HB       PRO   6  -3.203  17.740   5.233
   40   1HG   PRO   6          1HG       PRO   6  -5.014  16.929   7.424
   41   2HG   PRO   6          2HG       PRO   6  -4.344  18.511   7.083
   42   1HD   PRO   6          1HD       PRO   6  -7.020  17.630   6.547
   43   2HD   PRO   6          2HD       PRO   6  -6.315  19.171   6.102
   44    H    VAL   7           H        VAL   7  -4.559  15.270   2.321
   45    HA   VAL   7           HA       VAL   7  -6.369  13.221   3.161
   46    HB   VAL   7           HB       VAL   7  -4.403  13.459   0.877
   47   1HG1  VAL   7          1HG1      VAL   7  -6.466  11.313   1.467
   48   2HG1  VAL   7          2HG1      VAL   7  -5.689  11.544  -0.118
   49   3HG1  VAL   7          3HG1      VAL   7  -4.705  11.113   1.302
   50   1HG2  VAL   7          1HG2      VAL   7  -6.414  13.837  -0.489
   51   2HG2  VAL   7          2HG2      VAL   7  -7.427  13.742   0.971
   52   3HG2  VAL   7          3HG2      VAL   7  -6.252  15.067   0.788
   53    H    ASP   8           H        ASP   8  -5.639  10.882   3.308
   54    HA   ASP   8           HA       ASP   8  -2.940  10.694   4.349
   55   1HB   ASP   8          1HB       ASP   8  -3.862   9.210   6.210
   56   2HB   ASP   8          2HB       ASP   8  -4.219  10.918   6.368
   57    H    CYS   9           H        CYS   9  -2.080   8.471   4.166
   58    HA   CYS   9           HA       CYS   9  -3.597   6.896   2.243
   59   1HB   CYS   9          1HB       CYS   9  -0.725   6.453   3.038
   60   2HB   CYS   9          2HB       CYS   9  -1.561   5.878   1.609
   61    H    LYS  10           H        LYS  10  -1.965   4.460   2.964
   62    HA   LYS  10           HA       LYS  10  -2.124   2.675   4.249
   63   1HB   LYS  10          1HB       LYS  10  -0.953   3.991   5.904
   64   2HB   LYS  10          2HB       LYS  10  -2.443   4.738   6.445
   65   1HG   LYS  10          1HG       LYS  10  -3.264   2.698   7.396
   66   2HG   LYS  10          2HG       LYS  10  -2.119   1.717   6.504
   67   1HD   LYS  10          1HD       LYS  10  -0.460   2.024   8.050
   68   2HD   LYS  10          2HD       LYS  10  -0.793   3.737   8.209
   69   1HE   LYS  10          1HE       LYS  10  -3.047   2.500   9.372
   70   2HE   LYS  10          2HE       LYS  10  -1.705   1.499   9.890
   71   1HZ   LYS  10          1HZ       LYS  10  -0.989   3.105  11.206
   72   2HZ   LYS  10          2HZ       LYS  10  -1.110   4.265  10.063
   73   3HZ   LYS  10          3HZ       LYS  10  -2.412   3.867  10.964
   74    H    GLY  11           H        GLY  11  -4.482   4.631   6.157
   75   1HA   GLY  11          1HA       GLY  11  -6.432   2.623   6.173
   76   2HA   GLY  11          2HA       GLY  11  -6.668   4.314   6.567
   77    H    GLN  12           H        GLN  12  -5.623   5.147   3.803
   78    HA   GLN  12           HA       GLN  12  -8.170   4.766   2.499
   79   1HB   GLN  12          1HB       GLN  12  -7.158   7.062   2.796
   80   2HB   GLN  12          2HB       GLN  12  -5.852   6.591   1.727
   81   1HG   GLN  12          1HG       GLN  12  -7.224   7.482   0.110
   82   2HG   GLN  12          2HG       GLN  12  -7.951   5.888   0.147
   83   1HE2  GLN  12          1HE2      GLN  12  -8.163   9.189   1.319
   84   2HE2  GLN  12          2HE2      GLN  12  -9.849   9.196   1.720
   85    H    CYS  13           H        CYS  13  -7.027   2.362   2.419
   86    HA   CYS  13           HA       CYS  13  -6.429   2.051  -0.358
   87   1HB   CYS  13          1HB       CYS  13  -4.311   1.534   1.721
   88   2HB   CYS  13          2HB       CYS  13  -4.342   0.655   0.205
   89    H    THR  14           H        THR  14  -8.695   1.197   0.593
   90    HA   THR  14           HA       THR  14  -8.326  -1.483   1.725
   91    HB   THR  14           HB       THR  14 -10.610   0.531   1.590
   92    HG1  THR  14           1HG      THR  14  -9.067   0.597   3.360
   93   1HG2  THR  14          1HG2      THR  14 -12.175  -1.112   1.856
   94   2HG2  THR  14          2HG2      THR  14 -10.925  -2.315   1.458
   95   3HG2  THR  14          3HG2      THR  14 -11.207  -1.851   3.153
   96    H    THR  15           H        THR  15  -9.960   0.263  -0.985
   97    HA   THR  15           HA       THR  15 -10.990  -2.027  -2.206
   98    HB   THR  15           HB       THR  15 -10.518   0.846  -2.813
   99    HG1  THR  15           1HG      THR  15 -12.470  -1.210  -3.579
  100   1HG2  THR  15          1HG2      THR  15 -11.215   0.354  -5.267
  101   2HG2  THR  15          2HG2      THR  15  -9.496   0.112  -4.875
  102   3HG2  THR  15          3HG2      THR  15 -10.587  -1.289  -4.996
  103    HA   PRO  16           HA       PRO  16  -6.903  -2.207  -4.544
  104   1HB   PRO  16          1HB       PRO  16  -4.743  -0.811  -3.620
  105   2HB   PRO  16          2HB       PRO  16  -5.789  -0.223  -4.897
  106   1HG   PRO  16          1HG       PRO  16  -5.649   0.637  -2.072
  107   2HG   PRO  16          2HG       PRO  16  -6.358   1.472  -3.441
  108   1HD   PRO  16          1HD       PRO  16  -7.762   0.048  -1.384
  109   2HD   PRO  16          2HD       PRO  16  -8.460   0.784  -2.813
  110    H    CYS  17           H        CYS  17  -7.306  -2.385  -1.234
  111    HA   CYS  17           HA       CYS  17  -5.330  -4.549  -1.182
  112   1HB   CYS  17          1HB       CYS  17  -6.092  -2.773   1.144
  113   2HB   CYS  17          2HB       CYS  17  -4.934  -4.089   1.169
  114    H    GLU  18           H        GLU  18  -8.253  -4.447  -1.951
  115    HA   GLU  18           HA       GLU  18  -9.672  -5.478   0.269
  116   1HB   GLU  18          1HB       GLU  18 -10.261  -4.551  -2.393
  117   2HB   GLU  18          2HB       GLU  18 -10.957  -6.150  -2.220
  118   1HG   GLU  18          1HG       GLU  18 -11.905  -5.317   0.054
  119   2HG   GLU  18          2HG       GLU  18 -11.464  -3.706  -0.477
  120    HA   PRO  19           HA       PRO  19  -9.013  -9.554  -2.051
  121   1HB   PRO  19          1HB       PRO  19  -7.453  -9.645  -4.293
  122   2HB   PRO  19          2HB       PRO  19  -9.198  -9.485  -4.345
  123   1HG   PRO  19          1HG       PRO  19  -7.133  -7.425  -4.828
  124   2HG   PRO  19          2HG       PRO  19  -8.826  -7.409  -5.279
  125   1HD   PRO  19          1HD       PRO  19  -7.616  -5.983  -3.105
  126   2HD   PRO  19          2HD       PRO  19  -9.325  -6.059  -3.486
  127    H    LEU  20           H        LEU  20  -6.320  -7.395  -1.889
  128    HA   LEU  20           HA       LEU  20  -4.387  -9.420  -1.515
  129   1HB   LEU  20          1HB       LEU  20  -3.526  -7.425  -2.253
  130   2HB   LEU  20          2HB       LEU  20  -4.526  -6.458  -1.186
  131    HG   LEU  20           HG       LEU  20  -1.954  -6.671  -0.773
  132   1HD1  LEU  20          1HD1      LEU  20  -2.330  -5.752   1.248
  133   2HD1  LEU  20          2HD1      LEU  20  -4.031  -5.809   0.730
  134   3HD1  LEU  20          3HD1      LEU  20  -3.380  -7.085   1.786
  135   1HD2  LEU  20          1HD2      LEU  20  -2.654  -8.940   1.027
  136   2HD2  LEU  20          2HD2      LEU  20  -2.377  -9.301  -0.694
  137   3HD2  LEU  20          3HD2      LEU  20  -1.104  -8.507   0.265
  138    H    THR  21           H        THR  21  -6.058  -7.174   0.805
  139    HA   THR  21           HA       THR  21  -4.991  -8.264   3.114
  140    HB   THR  21           HB       THR  21  -7.644  -6.881   2.478
  141    HG1  THR  21           1HG      THR  21  -5.554  -5.756   2.179
  142   1HG2  THR  21          1HG2      THR  21  -6.714  -6.409   5.162
  143   2HG2  THR  21          2HG2      THR  21  -8.257  -7.142   4.661
  144   3HG2  THR  21          3HG2      THR  21  -6.832  -8.171   4.943
  145    H    ALA  22           H        ALA  22  -8.038  -9.172   1.383
  146    HA   ALA  22           HA       ALA  22  -8.910 -11.075   3.151
  147   1HB   ALA  22          1HB       ALA  22  -9.819 -10.090   0.843
  148   2HB   ALA  22          2HB       ALA  22  -9.115 -11.593   0.201
  149   3HB   ALA  22          3HB       ALA  22 -10.370 -11.666   1.460
  150    H    CYS  23           H        CYS  23  -6.478 -11.360   0.494
  151    HA   CYS  23           HA       CYS  23  -6.112 -14.083   0.636
  152   1HB   CYS  23          1HB       CYS  23  -5.150 -12.212  -0.956
  153   2HB   CYS  23          2HB       CYS  23  -3.781 -12.274   0.135
  154    H    LYS  24           H        LYS  24  -4.571 -11.360   2.464
  155    HA   LYS  24           HA       LYS  24  -2.798 -12.969   3.918
  156   1HB   LYS  24          1HB       LYS  24  -3.714 -10.175   3.909
  157   2HB   LYS  24          2HB       LYS  24  -3.277 -10.758   5.503
  158   1HG   LYS  24          1HG       LYS  24  -1.050 -10.929   4.976
  159   2HG   LYS  24          2HG       LYS  24  -1.371 -11.592   3.386
  160   1HD   LYS  24          1HD       LYS  24  -0.702  -9.558   2.597
  161   2HD   LYS  24          2HD       LYS  24  -2.292  -8.999   3.078
  162   1HE   LYS  24          1HE       LYS  24   0.029  -9.024   5.048
  163   2HE   LYS  24          2HE       LYS  24  -0.213  -7.680   3.951
  164   1HZ   LYS  24          1HZ       LYS  24  -1.783  -6.939   5.278
  165   2HZ   LYS  24          2HZ       LYS  24  -2.646  -8.319   5.148
  166   3HZ   LYS  24          3HZ       LYS  24  -1.523  -8.165   6.324
  167    H    GLU  25           H        GLU  25  -6.123 -11.732   4.637
  168    HA   GLU  25           HA       GLU  25  -6.306 -12.687   7.181
  169   1HB   GLU  25          1HB       GLU  25  -8.062 -11.606   5.195
  170   2HB   GLU  25          2HB       GLU  25  -8.844 -13.041   5.829
  171   1HG   GLU  25          1HG       GLU  25  -7.577 -11.236   7.860
  172   2HG   GLU  25          2HG       GLU  25  -8.982 -10.592   7.036
  173    H    LYS  26           H        LYS  26  -7.696 -14.327   4.237
  174    HA   LYS  26           HA       LYS  26  -8.437 -16.662   5.303
  175   1HB   LYS  26          1HB       LYS  26  -8.364 -15.747   2.828
  176   2HB   LYS  26          2HB       LYS  26  -6.916 -16.727   2.717
  177   1HG   LYS  26          1HG       LYS  26  -8.075 -18.717   2.874
  178   2HG   LYS  26          2HG       LYS  26  -9.239 -18.076   4.017
  179   1HD   LYS  26          1HD       LYS  26 -10.736 -17.813   2.338
  180   2HD   LYS  26          2HD       LYS  26  -9.666 -16.659   1.569
  181   1HE   LYS  26          1HE       LYS  26  -8.523 -19.191   0.994
  182   2HE   LYS  26          2HE       LYS  26 -10.249 -19.431   0.809
  183   1HZ   LYS  26          1HZ       LYS  26 -10.345 -17.940  -0.873
  184   2HZ   LYS  26          2HZ       LYS  26  -9.083 -17.043  -0.352
  185   3HZ   LYS  26          3HZ       LYS  26  -8.817 -18.467  -1.106
  186    H    CYS  27           H        CYS  27  -5.066 -15.696   4.472
  187    HA   CYS  27           HA       CYS  27  -3.924 -18.173   5.040
  188   1HB   CYS  27          1HB       CYS  27  -2.721 -15.400   5.184
  189   2HB   CYS  27          2HB       CYS  27  -1.807 -16.894   5.256
  190    H    ALA  28           H        ALA  28  -4.052 -15.107   7.013
  191    HA   ALA  28           HA       ALA  28  -2.956 -15.950   9.313
  192   1HB   ALA  28          1HB       ALA  28  -3.601 -13.833   9.718
  193   2HB   ALA  28          2HB       ALA  28  -4.858 -13.916   8.460
  194   3HB   ALA  28          3HB       ALA  28  -5.216 -14.470  10.113
  195    H    GLU  29           H        GLU  29  -6.474 -16.312   8.460
  196    HA   GLU  29           HA       GLU  29  -7.201 -17.669  10.702
  197   1HB   GLU  29          1HB       GLU  29  -8.222 -17.699   7.850
  198   2HB   GLU  29          2HB       GLU  29  -8.961 -18.734   9.055
  199   1HG   GLU  29          1HG       GLU  29  -8.538 -15.825   9.745
  200   2HG   GLU  29          2HG       GLU  29  -9.834 -16.231   8.638
  201    H    SER  30           H        SER  30  -5.633 -18.872   7.706
  202    HA   SER  30           HA       SER  30  -5.803 -21.571   8.689
  203   1HB   SER  30          1HB       SER  30  -5.516 -20.308   6.116
  204   2HB   SER  30          2HB       SER  30  -4.126 -21.347   6.355
  205    HG   SER  30           HG       SER  30  -5.663 -22.697   5.488
  206    H    CYS  31           H        CYS  31  -4.170 -19.299   9.992
  207    HA   CYS  31           HA       CYS  31  -1.764 -20.878  10.271
  208   1HB   CYS  31          1HB       CYS  31  -1.548 -17.927   9.673
  209   2HB   CYS  31          2HB       CYS  31  -0.242 -19.071   9.907
  210    H    GLU  32           H        GLU  32  -4.058 -20.569  11.951
  211    HA   GLU  32           HA       GLU  32  -3.114 -18.672  13.945
  212   1HB   GLU  32          1HB       GLU  32  -5.820 -19.878  13.332
  213   2HB   GLU  32          2HB       GLU  32  -5.495 -19.264  14.940
  214   1HG   GLU  32          1HG       GLU  32  -4.530 -17.191  13.389
  215   2HG   GLU  32          2HG       GLU  32  -5.835 -17.779  12.377
  216    H    THR  33           H        THR  33  -1.910 -19.518  15.584
  217    HA   THR  33           HA       THR  33  -1.449 -20.863  17.337
  218    HB   THR  33           HB       THR  33  -4.043 -21.614  16.835
  219    HG1  THR  33           1HG      THR  33  -1.923 -22.838  18.454
  220   1HG2  THR  33          1HG2      THR  33  -2.629 -24.273  16.956
  221   2HG2  THR  33          2HG2      THR  33  -4.257 -23.889  16.347
  222   3HG2  THR  33          3HG2      THR  33  -2.827 -23.533  15.349
  223    H    SER  34           H        SER  34  -1.501 -21.833  13.980
  224    HA   SER  34           HA       SER  34  -0.148 -24.159  14.016
  225   1HB   SER  34          1HB       SER  34  -0.716 -22.095  12.127
  226   2HB   SER  34          2HB       SER  34   0.997 -22.434  11.976
  227    HG   SER  34           HG       SER  34  -1.215 -24.262  11.681
  228    H    ALA  35           H        ALA  35   2.150 -24.742  13.863
  229    HA   ALA  35           HA       ALA  35   3.759 -23.781  15.785
  230   1HB   ALA  35          1HB       ALA  35   4.350 -25.023  13.086
  231   2HB   ALA  35          2HB       ALA  35   5.655 -24.636  14.234
  232   3HB   ALA  35          3HB       ALA  35   4.374 -25.783  14.695
  233    H    ASP  36           H        ASP  36   4.098 -22.828  12.286
  234    HA   ASP  36           HA       ASP  36   5.301 -20.370  13.279
  235   1HB   ASP  36          1HB       ASP  36   5.432 -21.242  10.388
  236   2HB   ASP  36          2HB       ASP  36   6.575 -20.269  11.291
  237    H    LYS  37           H        LYS  37   3.371 -19.096  13.531
  238    HA   LYS  37           HA       LYS  37   1.336 -19.121  11.541
  239   1HB   LYS  37          1HB       LYS  37   1.819 -17.262  13.889
  240   2HB   LYS  37          2HB       LYS  37   0.367 -17.297  12.909
  241   1HG   LYS  37          1HG       LYS  37  -0.456 -19.019  14.130
  242   2HG   LYS  37          2HG       LYS  37   0.934 -20.006  13.723
  243   1HD   LYS  37          1HD       LYS  37   0.871 -19.838  16.136
  244   2HD   LYS  37          2HD       LYS  37   2.222 -18.862  15.591
  245   1HE   LYS  37          1HE       LYS  37   1.171 -16.844  16.121
  246   2HE   LYS  37          2HE       LYS  37  -0.439 -17.479  15.844
  247   1HZ   LYS  37          1HZ       LYS  37   1.192 -17.632  18.214
  248   2HZ   LYS  37          2HZ       LYS  37  -0.428 -17.485  18.071
  249   3HZ   LYS  37          3HZ       LYS  37   0.278 -18.947  17.890
  250    H    LYS  38           H        LYS  38   3.811 -16.678  12.597
  251    HA   LYS  38           HA       LYS  38   3.253 -14.796  10.675
  252   1HB   LYS  38          1HB       LYS  38   5.340 -15.354  12.597
  253   2HB   LYS  38          2HB       LYS  38   6.043 -14.750  11.111
  254   1HG   LYS  38          1HG       LYS  38   5.513 -12.821  12.467
  255   2HG   LYS  38          2HG       LYS  38   4.354 -12.850  11.153
  256   1HD   LYS  38          1HD       LYS  38   3.307 -14.439  13.341
  257   2HD   LYS  38          2HD       LYS  38   3.826 -12.891  13.976
  258   1HE   LYS  38          1HE       LYS  38   2.144 -11.756  12.919
  259   2HE   LYS  38          2HE       LYS  38   2.378 -12.622  11.414
  260   1HZ   LYS  38          1HZ       LYS  38   1.221 -14.089  13.624
  261   2HZ   LYS  38          2HZ       LYS  38   0.277 -12.981  12.884
  262   3HZ   LYS  38          3HZ       LYS  38   0.919 -14.212  12.024
  263    H    THR  39           H        THR  39   5.880 -17.310  10.525
  264    HA   THR  39           HA       THR  39   6.653 -16.869   7.938
  265    HB   THR  39           HB       THR  39   6.416 -19.576   9.352
  266    HG1  THR  39           1HG      THR  39   8.354 -17.369   9.426
  267   1HG2  THR  39          1HG2      THR  39   7.449 -19.065   6.852
  268   2HG2  THR  39          2HG2      THR  39   8.863 -18.698   7.868
  269   3HG2  THR  39          3HG2      THR  39   8.106 -20.307   7.945
  270    H    CYS  40           H        CYS  40   4.010 -19.078   9.058
  271    HA   CYS  40           HA       CYS  40   3.292 -20.170   6.721
  272   1HB   CYS  40          1HB       CYS  40   2.205 -20.709   8.805
  273   2HB   CYS  40          2HB       CYS  40   1.486 -19.114   8.903
  274    H    ARG  41           H        ARG  41   1.745 -17.136   8.029
  275    HA   ARG  41           HA       ARG  41   0.419 -16.437   5.804
  276   1HB   ARG  41          1HB       ARG  41   1.708 -14.822   8.023
  277   2HB   ARG  41          2HB       ARG  41   0.943 -13.970   6.696
  278   1HG   ARG  41          1HG       ARG  41  -1.191 -15.153   7.115
  279   2HG   ARG  41          2HG       ARG  41  -0.440 -16.120   8.369
  280   1HD   ARG  41          1HD       ARG  41  -1.672 -14.284   9.424
  281   2HD   ARG  41          2HD       ARG  41   0.043 -14.026   9.677
  282    HE   ARG  41           HE       ARG  41  -0.915 -12.725   7.248
  283   1HH1  ARG  41          2HH2      ARG  41  -0.650 -12.388  10.741
  284   2HH1  ARG  41          1HH2      ARG  41  -0.714 -10.658  10.707
  285   1HH2  ARG  41          2HH1      ARG  41  -0.999 -10.442   7.203
  286   2HH2  ARG  41          1HH1      ARG  41  -0.914  -9.543   8.681
  287    H    ARG  42           H        ARG  42   3.789 -15.433   6.737
  288    HA   ARG  42           HA       ARG  42   4.373 -13.797   4.717
  289   1HB   ARG  42          1HB       ARG  42   5.944 -15.740   6.366
  290   2HB   ARG  42          2HB       ARG  42   6.749 -15.181   4.913
  291   1HG   ARG  42          1HG       ARG  42   7.393 -13.556   6.492
  292   2HG   ARG  42          2HG       ARG  42   6.043 -12.778   5.690
  293   1HD   ARG  42          1HD       ARG  42   4.510 -13.500   7.511
  294   2HD   ARG  42          2HD       ARG  42   5.818 -14.360   8.298
  295    HE   ARG  42           HE       ARG  42   6.678 -12.319   9.086
  296   1HH1  ARG  42          2HH2      ARG  42   4.260 -11.706   6.604
  297   2HH1  ARG  42          1HH2      ARG  42   4.209  -9.999   6.895
  298   1HH2  ARG  42          2HH1      ARG  42   6.612 -10.067   9.470
  299   2HH2  ARG  42          1HH1      ARG  42   5.556  -9.061   8.536
  300    H    ASN  43           H        ASN  43   5.105 -17.372   4.681
  301    HA   ASN  43           HA       ASN  43   5.809 -17.424   2.017
  302   1HB   ASN  43          1HB       ASN  43   5.839 -19.233   4.085
  303   2HB   ASN  43          2HB       ASN  43   4.479 -19.860   3.174
  304   1HD2  ASN  43          1HD2      ASN  43   7.158 -20.948   3.646
  305   2HD2  ASN  43          2HD2      ASN  43   7.865 -21.259   2.095
  306    H    CYS  44           H        CYS  44   2.706 -17.302   3.671
  307    HA   CYS  44           HA       CYS  44   1.168 -18.504   1.622
  308   1HB   CYS  44          1HB       CYS  44   0.597 -18.182   4.113
  309   2HB   CYS  44          2HB       CYS  44   0.128 -16.553   3.668
  310    H    LYS  45           H        LYS  45   2.627 -15.357   2.231
  311    HA   LYS  45           HA       LYS  45   0.875 -13.826   0.627
  312   1HB   LYS  45          1HB       LYS  45   2.716 -13.199   2.456
  313   2HB   LYS  45          2HB       LYS  45   3.727 -13.028   1.036
  314   1HG   LYS  45          1HG       LYS  45   2.673 -11.114   0.379
  315   2HG   LYS  45          2HG       LYS  45   1.081 -11.801   0.631
  316   1HD   LYS  45          1HD       LYS  45   1.226 -10.012   2.207
  317   2HD   LYS  45          2HD       LYS  45   1.467 -11.464   3.158
  318   1HE   LYS  45          1HE       LYS  45   3.869 -10.029   1.989
  319   2HE   LYS  45          2HE       LYS  45   3.119  -9.411   3.447
  320   1HZ   LYS  45          1HZ       LYS  45   3.317 -11.825   4.222
  321   2HZ   LYS  45          2HZ       LYS  45   4.429 -11.980   3.035
  322   3HZ   LYS  45          3HZ       LYS  45   4.655 -10.890   4.230
  323    H    LYS  46           H        LYS  46   3.643 -15.950  -0.002
  324    HA   LYS  46           HA       LYS  46   3.806 -14.992  -2.742
  325   1HB   LYS  46          1HB       LYS  46   5.474 -16.893  -1.083
  326   2HB   LYS  46          2HB       LYS  46   5.694 -16.719  -2.812
  327   1HG   LYS  46          1HG       LYS  46   5.581 -14.183  -1.200
  328   2HG   LYS  46          2HG       LYS  46   7.010 -15.179  -1.006
  329   1HD   LYS  46          1HD       LYS  46   7.691 -14.899  -3.231
  330   2HD   LYS  46          2HD       LYS  46   6.059 -14.647  -3.816
  331   1HE   LYS  46          1HE       LYS  46   6.645 -12.434  -3.870
  332   2HE   LYS  46          2HE       LYS  46   6.323 -12.472  -2.148
  333   1HZ   LYS  46          1HZ       LYS  46   8.443 -12.082  -1.793
  334   2HZ   LYS  46          2HZ       LYS  46   8.898 -13.428  -2.600
  335   3HZ   LYS  46          3HZ       LYS  46   8.736 -12.012  -3.398
  336    H    ALA  47           H        ALA  47   2.260 -17.435  -0.796
  337    HA   ALA  47           HA       ALA  47   2.071 -19.550  -2.535
  338   1HB   ALA  47          1HB       ALA  47  -0.117 -18.482  -0.708
  339   2HB   ALA  47          2HB       ALA  47   0.101 -20.161  -1.256
  340   3HB   ALA  47          3HB       ALA  47   1.286 -19.425  -0.150
  341    H    ASP  48           H        ASP  48  -0.239 -16.757  -2.203
  342    HA   ASP  48           HA       ASP  48  -0.552 -16.701  -5.017
  343   1HB   ASP  48          1HB       ASP  48  -2.158 -18.555  -3.892
  344   2HB   ASP  48          2HB       ASP  48  -3.142 -17.150  -3.537
  345    H    CYS  49           H        CYS  49   0.419 -14.718  -3.413
  346    HA   CYS  49           HA       CYS  49  -1.661 -12.744  -3.547
  347   1HB   CYS  49          1HB       CYS  49  -0.259 -12.823  -0.916
  348   2HB   CYS  49          2HB       CYS  49  -1.807 -12.122  -1.346
  349    H    GLU  50           H        GLU  50   0.832 -13.410  -4.963
  350    HA   GLU  50           HA       GLU  50   2.850 -11.713  -3.913
  351   1HB   GLU  50          1HB       GLU  50   2.546 -13.635  -6.129
  352   2HB   GLU  50          2HB       GLU  50   3.510 -12.243  -6.581
  353   1HG   GLU  50          1HG       GLU  50   4.530 -12.800  -4.070
  354   2HG   GLU  50          2HG       GLU  50   4.113 -14.408  -4.627
  355    HA   PRO  51           HA       PRO  51   1.278  -9.024  -7.502
  356   1HB   PRO  51          1HB       PRO  51  -1.109  -9.623  -8.690
  357   2HB   PRO  51          2HB       PRO  51   0.439 -10.120  -9.345
  358   1HG   PRO  51          1HG       PRO  51  -1.583 -11.747  -7.928
  359   2HG   PRO  51          2HG       PRO  51  -0.259 -12.282  -8.945
  360   1HD   PRO  51          1HD       PRO  51  -0.360 -12.357  -6.080
  361   2HD   PRO  51          2HD       PRO  51   1.005 -12.783  -7.092
  362    H    GLN  52           H        GLN  52  -1.106 -10.353  -5.357
  363    HA   GLN  52           HA       GLN  52  -2.646  -8.018  -5.268
  364   1HB   GLN  52          1HB       GLN  52  -2.401 -10.154  -3.108
  365   2HB   GLN  52          2HB       GLN  52  -3.752  -9.066  -3.359
  366   1HG   GLN  52          1HG       GLN  52  -4.067 -10.093  -5.668
  367   2HG   GLN  52          2HG       GLN  52  -2.819 -11.258  -5.270
  368   1HE2  GLN  52          1HE2      GLN  52  -4.504 -12.817  -5.659
  369   2HE2  GLN  52          2HE2      GLN  52  -5.612 -13.248  -4.399
  370    H    ASP  53           H        ASP  53  -0.161  -9.401  -3.002
  371    HA   ASP  53           HA       ASP  53  -0.212  -7.435  -1.147
  372   1HB   ASP  53          1HB       ASP  53   1.173  -9.627  -1.254
  373   2HB   ASP  53          2HB       ASP  53   2.361  -8.714  -2.163
  374    H    LYS  54           H        LYS  54   1.149  -7.474  -4.434
  375    HA   LYS  54           HA       LYS  54   2.818  -5.193  -4.076
  376   1HB   LYS  54          1HB       LYS  54   1.914  -6.858  -6.414
  377   2HB   LYS  54          2HB       LYS  54   2.719  -5.326  -6.689
  378   1HG   LYS  54          1HG       LYS  54   4.530  -6.188  -5.012
  379   2HG   LYS  54          2HG       LYS  54   3.799  -7.766  -5.227
  380   1HD   LYS  54          1HD       LYS  54   4.839  -8.047  -7.223
  381   2HD   LYS  54          2HD       LYS  54   4.177  -6.544  -7.835
  382   1HE   LYS  54          1HE       LYS  54   6.047  -5.278  -7.166
  383   2HE   LYS  54          2HE       LYS  54   6.482  -6.395  -5.887
  384   1HZ   LYS  54          1HZ       LYS  54   8.003  -6.820  -7.529
  385   2HZ   LYS  54          2HZ       LYS  54   6.905  -7.996  -7.805
  386   3HZ   LYS  54          3HZ       LYS  54   6.935  -6.668  -8.755
  387    H    VAL  55           H        VAL  55  -0.267  -5.735  -5.931
  388    HA   VAL  55           HA       VAL  55  -0.802  -3.214  -6.676
  389    HB   VAL  55           HB       VAL  55  -2.766  -5.205  -5.521
  390   1HG1  VAL  55          1HG1      VAL  55  -3.482  -2.740  -5.985
  391   2HG1  VAL  55          2HG1      VAL  55  -3.385  -3.216  -7.697
  392   3HG1  VAL  55          3HG1      VAL  55  -4.491  -4.073  -6.597
  393   1HG2  VAL  55          1HG2      VAL  55  -1.031  -5.501  -7.707
  394   2HG2  VAL  55          2HG2      VAL  55  -2.455  -6.494  -7.317
  395   3HG2  VAL  55          3HG2      VAL  55  -2.614  -5.104  -8.417
  396    H    CYS  56           H        CYS  56  -1.351  -4.637  -3.402
  397    HA   CYS  56           HA       CYS  56  -2.651  -2.469  -2.301
  398   1HB   CYS  56          1HB       CYS  56  -2.374  -4.760  -1.314
  399   2HB   CYS  56          2HB       CYS  56  -0.738  -4.320  -0.868
  400    H    ASP  57           H        ASP  57   0.852  -3.382  -1.844
  401    HA   ASP  57           HA       ASP  57   1.732  -1.186  -0.657
  402   1HB   ASP  57          1HB       ASP  57   3.260  -2.982  -1.113
  403   2HB   ASP  57          2HB       ASP  57   2.999  -2.875  -2.842
  404    H    ALA  58           H        ALA  58   1.380  -1.694  -4.242
  405    HA   ALA  58           HA       ALA  58   2.399   0.607  -5.218
  406   1HB   ALA  58          1HB       ALA  58   0.869  -1.502  -6.159
  407   2HB   ALA  58          2HB       ALA  58  -0.194  -0.100  -6.425
  408   3HB   ALA  58          3HB       ALA  58   1.439  -0.125  -7.132
  409    H    CYS  59           H        CYS  59  -0.793   0.122  -3.623
  410    HA   CYS  59           HA       CYS  59  -1.874   2.590  -4.186
  411   1HB   CYS  59          1HB       CYS  59  -3.057   0.652  -3.179
  412   2HB   CYS  59          2HB       CYS  59  -2.241   0.966  -1.660
  413    H    ARG  60           H        ARG  60  -0.182   1.523  -1.134
  414    HA   ARG  60           HA       ARG  60  -0.035   3.968   0.015
  415   1HB   ARG  60          1HB       ARG  60   2.005   1.691   0.141
  416   2HB   ARG  60          2HB       ARG  60   1.955   3.025   1.275
  417   1HG   ARG  60          1HG       ARG  60  -0.494   2.363   1.753
  418   2HG   ARG  60          2HG       ARG  60  -0.191   0.904   0.830
  419   1HD   ARG  60          1HD       ARG  60   1.713   0.339   2.375
  420   2HD   ARG  60          2HD       ARG  60   1.370   1.780   3.310
  421    HE   ARG  60           HE       ARG  60  -1.063   0.342   3.131
  422   1HH1  ARG  60          2HH2      ARG  60   2.146  -0.116   4.499
  423   2HH1  ARG  60          1HH2      ARG  60   1.595  -1.152   5.773
  424   1HH2  ARG  60          2HH1      ARG  60  -1.791  -1.024   4.812
  425   2HH2  ARG  60          1HH1      ARG  60  -0.660  -1.672   5.953
  426    H    MET  61           H        MET  61   1.711   2.714  -2.754
  427    HA   MET  61           HA       MET  61   3.838   4.619  -2.496
  428   1HB   MET  61          1HB       MET  61   4.500   2.533  -3.474
  429   2HB   MET  61          2HB       MET  61   3.050   2.423  -4.452
  430   1HG   MET  61          1HG       MET  61   3.961   3.652  -6.159
  431   2HG   MET  61          2HG       MET  61   4.651   4.836  -5.067
  432   1HE   MET  61          1HE       MET  61   5.709   2.403  -7.702
  433   2HE   MET  61          2HE       MET  61   6.593   1.129  -6.829
  434   3HE   MET  61          3HE       MET  61   4.849   1.353  -6.551
  435    H    LYS  62           H        LYS  62   0.781   4.181  -4.292
  436    HA   LYS  62           HA       LYS  62   1.315   6.357  -6.075
  437   1HB   LYS  62          1HB       LYS  62  -0.600   4.218  -5.826
  438   2HB   LYS  62          2HB       LYS  62  -1.452   5.736  -6.019
  439   1HG   LYS  62          1HG       LYS  62  -1.069   5.234  -8.255
  440   2HG   LYS  62          2HG       LYS  62   0.378   6.165  -7.922
  441   1HD   LYS  62          1HD       LYS  62   1.316   3.743  -7.176
  442   2HD   LYS  62          2HD       LYS  62   0.071   3.189  -8.278
  443   1HE   LYS  62          1HE       LYS  62   1.626   5.426  -9.410
  444   2HE   LYS  62          2HE       LYS  62   2.647   4.066  -8.989
  445   1HZ   LYS  62          1HZ       LYS  62   1.545   4.072 -11.246
  446   2HZ   LYS  62          2HZ       LYS  62   1.472   2.682 -10.391
  447   3HZ   LYS  62          3HZ       LYS  62   0.165   3.658 -10.477
  448    H    CYS  63           H        CYS  63  -0.909   5.796  -3.258
  449    HA   CYS  63           HA       CYS  63  -2.125   8.159  -3.094
  450   1HB   CYS  63          1HB       CYS  63  -2.533   6.367  -1.531
  451   2HB   CYS  63          2HB       CYS  63  -0.941   6.553  -0.823
  452    H    HIS  64           H        HIS  64   1.290   7.395  -2.272
  453    HA   HIS  64           HA       HIS  64   1.922   9.774  -1.008
  454   1HB   HIS  64          1HB       HIS  64   3.377   7.882  -0.872
  455   2HB   HIS  64          2HB       HIS  64   3.576   7.816  -2.612
  456    HD1  HIS  64           1HD      HIS  64   5.131   9.649  -3.725
  457    HD2  HIS  64           2HD      HIS  64   5.041   9.700   0.469
  458    HE1  HIS  64           1HE      HIS  64   7.106  11.085  -2.985
  459    H    LYS  65           H        LYS  65   2.474   8.836  -4.481
  460    HA   LYS  65           HA       LYS  65   3.242  11.435  -5.228
  461   1HB   LYS  65          1HB       LYS  65   2.803   8.833  -6.501
  462   2HB   LYS  65          2HB       LYS  65   2.347  10.173  -7.533
  463   1HG   LYS  65          1HG       LYS  65   4.657  11.218  -6.741
  464   2HG   LYS  65          2HG       LYS  65   5.052   9.566  -6.309
  465   1HD   LYS  65          1HD       LYS  65   3.959   9.283  -8.869
  466   2HD   LYS  65          2HD       LYS  65   4.822  10.804  -8.987
  467   1HE   LYS  65          1HE       LYS  65   6.876   9.674  -8.043
  468   2HE   LYS  65          2HE       LYS  65   6.005   8.154  -8.028
  469   1HZ   LYS  65          1HZ       LYS  65   6.637   9.776 -10.391
  470   2HZ   LYS  65          2HZ       LYS  65   7.240   8.306 -10.018
  471   3HZ   LYS  65          3HZ       LYS  65   5.668   8.462 -10.431
  472    H    ALA  66           H        ALA  66   0.129   9.604  -5.577
  473    HA   ALA  66           HA       ALA  66  -1.311  11.545  -6.869
  474   1HB   ALA  66          1HB       ALA  66  -2.531   9.627  -6.716
  475   2HB   ALA  66          2HB       ALA  66  -1.861   9.206  -5.121
  476   3HB   ALA  66          3HB       ALA  66  -3.181  10.394  -5.247
  477    H    CYS  67           H        CYS  67  -1.170  10.980  -3.275
  478    HA   CYS  67           HA       CYS  67  -2.630  13.178  -2.558
  479   1HB   CYS  67          1HB       CYS  67  -1.871  11.299  -1.088
  480   2HB   CYS  67          2HB       CYS  67  -0.284  12.039  -1.028
  481    H    ARG  68           H        ARG  68   0.915  12.814  -3.195
  482    HA   ARG  68           HA       ARG  68   1.667  15.329  -2.440
  483   1HB   ARG  68          1HB       ARG  68   3.302  13.573  -2.959
  484   2HB   ARG  68          2HB       ARG  68   2.767  13.496  -4.626
  485   1HG   ARG  68          1HG       ARG  68   3.409  16.216  -4.250
  486   2HG   ARG  68          2HG       ARG  68   4.655  15.365  -3.359
  487   1HD   ARG  68          1HD       ARG  68   4.106  14.106  -5.974
  488   2HD   ARG  68          2HD       ARG  68   4.599  15.779  -6.139
  489    HE   ARG  68           HE       ARG  68   6.306  14.394  -4.251
  490   1HH1  ARG  68          2HH2      ARG  68   5.699  14.792  -7.695
  491   2HH1  ARG  68          1HH2      ARG  68   7.321  14.398  -8.156
  492   1HH2  ARG  68          2HH1      ARG  68   8.446  13.873  -4.860
  493   2HH2  ARG  68          1HH1      ARG  68   8.894  13.872  -6.533
  494    H    ALA  69           H        ALA  69   0.479  14.088  -5.625
  495    HA   ALA  69           HA       ALA  69   0.754  16.638  -6.891
  496   1HB   ALA  69          1HB       ALA  69   0.364  15.446  -8.784
  497   2HB   ALA  69          2HB       ALA  69   0.598  14.027  -7.734
  498   3HB   ALA  69          3HB       ALA  69  -1.045  14.613  -8.086
  499    H    ALA  70           H        ALA  70  -1.455  15.232  -4.665
  500    HA   ALA  70           HA       ALA  70  -3.817  16.489  -5.653
  501   1HB   ALA  70          1HB       ALA  70  -3.603  14.395  -4.177
  502   2HB   ALA  70          2HB       ALA  70  -3.285  15.514  -2.829
  503   3HB   ALA  70          3HB       ALA  70  -4.835  15.588  -3.701
  504    H    ASN  71           H        ASN  71  -1.909  17.030  -2.601
  505    HA   ASN  71           HA       ASN  71  -2.966  19.690  -2.518
  506   1HB   ASN  71          1HB       ASN  71  -1.148  18.061  -0.681
  507   2HB   ASN  71          2HB       ASN  71  -1.477  19.754  -0.372
  508   1HD2  ASN  71          1HD2      ASN  71  -2.983  16.601  -0.897
  509   2HD2  ASN  71          2HD2      ASN  71  -4.411  16.865   0.047
  510    H    CYS  72           H        CYS  72   0.365  18.255  -2.071
  511    HA   CYS  72           HA       CYS  72   1.726  20.599  -2.608
  512   1HB   CYS  72          1HB       CYS  72   2.684  17.759  -3.021
  513   2HB   CYS  72          2HB       CYS  72   3.700  19.183  -2.902
  514    H    ALA  73           H        ALA  73   3.331  20.772  -4.598
  515    HA   ALA  73           HA       ALA  73   2.751  19.532  -7.008
  516   1HB   ALA  73          1HB       ALA  73   0.609  21.068  -6.377
  517   2HB   ALA  73          2HB       ALA  73   1.615  22.282  -7.202
  518   3HB   ALA  73          3HB       ALA  73   1.148  20.788  -8.050
  519    H    SER  74           H        SER  74   3.467  22.773  -5.537
  520    HA   SER  74           HA       SER  74   5.482  23.224  -7.502
  521   1HB   SER  74          1HB       SER  74   4.036  24.777  -5.508
  522   2HB   SER  74          2HB       SER  74   5.755  25.086  -5.362
  523    HG   SER  74           HG       SER  74   4.193  26.255  -7.071
  524    H    GLU  75           H        GLU  75   5.266  22.401  -3.995
  525    HA   GLU  75           HA       GLU  75   7.977  22.605  -3.473
  526   1HB   GLU  75          1HB       GLU  75   5.672  21.131  -2.181
  527   2HB   GLU  75          2HB       GLU  75   7.301  20.871  -1.590
  528   1HG   GLU  75          1HG       GLU  75   6.300  22.671  -0.288
  529   2HG   GLU  75          2HG       GLU  75   7.564  23.358  -1.288
  530    H    CYS  76           H        CYS  76   6.127  20.248  -5.262
  531    HA   CYS  76           HA       CYS  76   8.500  18.531  -5.318
  532   1HB   CYS  76          1HB       CYS  76   5.790  17.379  -5.821
  533   2HB   CYS  76          2HB       CYS  76   7.257  16.595  -5.269
  534    HA   PRO  77           HA       PRO  77   7.873  19.929  -9.502
  535   1HB   PRO  77          1HB       PRO  77  10.467  19.657 -10.316
  536   2HB   PRO  77          2HB       PRO  77   9.840  21.122  -9.588
  537   1HG   PRO  77          1HG       PRO  77  11.586  19.059  -8.391
  538   2HG   PRO  77          2HG       PRO  77  11.299  20.702  -7.852
  539   1HD   PRO  77          1HD       PRO  77  10.202  18.307  -6.717
  540   2HD   PRO  77          2HD       PRO  77   9.826  19.954  -6.253
  541    H    LYS  78           H        LYS  78   9.019  18.944 -11.723
  542    HA   LYS  78           HA       LYS  78   7.688  16.488 -11.940
  543   1HB   LYS  78          1HB       LYS  78   8.019  18.023 -13.817
  544   2HB   LYS  78          2HB       LYS  78   9.753  17.790 -13.740
  545   1HG   LYS  78          1HG       LYS  78   9.042  15.191 -13.929
  546   2HG   LYS  78          2HG       LYS  78   7.619  15.883 -14.682
  547   1HD   LYS  78          1HD       LYS  78   8.757  16.443 -16.580
  548   2HD   LYS  78          2HD       LYS  78  10.093  17.133 -15.681
  549   1HE   LYS  78          1HE       LYS  78  11.292  15.329 -16.400
  550   2HE   LYS  78          2HE       LYS  78  10.430  14.425 -15.171
  551   1HZ   LYS  78          1HZ       LYS  78  10.333  13.960 -17.819
  552   2HZ   LYS  78          2HZ       LYS  78   9.280  13.371 -16.719
  553   3HZ   LYS  78          3HZ       LYS  78   8.918  14.729 -17.551
  554    H    HIS  79           H        HIS  79  11.250  17.231 -12.005
  555    HA   HIS  79           HA       HIS  79  11.908  14.494 -11.763
  556   1HB   HIS  79          1HB       HIS  79  13.243  16.980 -12.256
  557   2HB   HIS  79          2HB       HIS  79  14.078  16.162 -10.950
  558    HD1  HIS  79           1HD      HIS  79  14.832  16.557 -14.177
  559    HD2  HIS  79           2HD      HIS  79  13.834  13.051 -12.101
  560    HE1  HIS  79           1HE      HIS  79  15.813  14.625 -15.524
  561    H    GLU  80           H        GLU  80  13.862  14.290  -9.816
  562    HA   GLU  80           HA       GLU  80  14.214  13.979  -7.694
  563   1HB   GLU  80          1HB       GLU  80  12.675  16.473  -7.685
  564   2HB   GLU  80          2HB       GLU  80  12.391  15.553  -6.220
  565   1HG   GLU  80          1HG       GLU  80  14.336  16.493  -5.479
  566   2HG   GLU  80          2HG       GLU  80  15.128  15.286  -6.472
  567    H    HIS  81           H        HIS  81  13.426  12.640  -5.939
  568    HA   HIS  81           HA       HIS  81  10.835  11.457  -6.587
  569   1HB   HIS  81          1HB       HIS  81  11.714   9.541  -5.178
  570   2HB   HIS  81          2HB       HIS  81  12.493   9.808  -6.725
  571    HD1  HIS  81           1HD      HIS  81  13.275   9.236  -3.252
  572    HD2  HIS  81           2HD      HIS  81  15.024  11.440  -6.364
  573    HE1  HIS  81           1HE      HIS  81  15.691   9.667  -2.553
  574    H    LYS  82           H        LYS  82  12.881  12.723  -3.896
  575    HA   LYS  82           HA       LYS  82  10.477  13.528  -2.530
  576   1HB   LYS  82          1HB       LYS  82  11.083  12.373  -0.422
  577   2HB   LYS  82          2HB       LYS  82  10.608  11.276  -1.703
  578   1HG   LYS  82          1HG       LYS  82  12.566  10.175  -1.397
  579   2HG   LYS  82          2HG       LYS  82  13.396  11.573  -2.050
  580   1HD   LYS  82          1HD       LYS  82  13.252  12.560   0.364
  581   2HD   LYS  82          2HD       LYS  82  12.826  10.938   0.871
  582   1HE   LYS  82          1HE       LYS  82  15.140  10.825  -0.899
  583   2HE   LYS  82          2HE       LYS  82  15.443  11.976   0.387
  584   1HZ   LYS  82          1HZ       LYS  82  14.574   9.192   0.743
  585   2HZ   LYS  82          2HZ       LYS  82  16.055   9.794   1.074
  586   3HZ   LYS  82          3HZ       LYS  82  14.766  10.262   1.961
  587    H    SER  83           H        SER  83  10.987  15.663  -2.422
  588    HA   SER  83           HA       SER  83  13.726  16.340  -1.811
  589   1HB   SER  83          1HB       SER  83  13.333  18.203  -3.035
  590   2HB   SER  83          2HB       SER  83  11.810  17.467  -3.492
  591    HG   SER  83           HG       SER  83  12.155  19.735  -2.127
  592    H    ASP  84           H        ASP  84  14.005  18.285  -0.202
  593    HA   ASP  84           HA       ASP  84  12.942  17.443   2.242
  594   1HB   ASP  84          1HB       ASP  84  15.081  18.465   2.334
  595   2HB   ASP  84          2HB       ASP  84  14.602  19.789   1.292
  596    H    THR  85           H        THR  85  12.302  20.147  -0.061
  597    HA   THR  85           HA       THR  85  10.417  21.450   1.651
  598    HB   THR  85           HB       THR  85  11.967  22.294  -0.376
  599    HG1  THR  85           1HG      THR  85   9.177  22.977   0.229
  600   1HG2  THR  85          1HG2      THR  85  10.189  20.755  -1.856
  601   2HG2  THR  85          2HG2      THR  85   9.390  22.346  -1.869
  602   3HG2  THR  85          3HG2      THR  85  11.050  22.178  -2.489
  603    H    CYS  86           H        CYS  86  10.331  18.671  -0.425
  604    HA   CYS  86           HA       CYS  86   7.524  18.925  -0.960
  605   1HB   CYS  86          1HB       CYS  86   9.075  17.883  -2.570
  606   2HB   CYS  86          2HB       CYS  86   9.409  16.604  -1.420
  607    H    ARG  87           H        ARG  87   9.526  16.323   0.623
  608    HA   ARG  87           HA       ARG  87   7.590  15.026   1.885
  609   1HB   ARG  87          1HB       ARG  87  10.352  15.726   3.002
  610   2HB   ARG  87          2HB       ARG  87   9.327  14.467   3.663
  611   1HG   ARG  87          1HG       ARG  87   9.289  13.400   1.334
  612   2HG   ARG  87          2HG       ARG  87  10.495  14.573   0.845
  613   1HD   ARG  87          1HD       ARG  87  11.604  12.477   1.517
  614   2HD   ARG  87          2HD       ARG  87  12.033  13.753   2.639
  615    HE   ARG  87           HE       ARG  87  10.299  11.427   3.201
  616   1HH1  ARG  87          2HH2      ARG  87  11.495  14.549   4.298
  617   2HH1  ARG  87          1HH2      ARG  87  11.093  14.264   5.958
  618   1HH2  ARG  87          2HH1      ARG  87   9.768  11.050   5.392
  619   2HH2  ARG  87          1HH1      ARG  87  10.104  12.260   6.585
  620    H    ALA  88           H        ALA  88   8.851  18.243   2.663
  621    HA   ALA  88           HA       ALA  88   7.790  18.336   5.307
  622   1HB   ALA  88          1HB       ALA  88   9.702  19.697   4.679
  623   2HB   ALA  88          2HB       ALA  88   8.775  20.468   3.370
  624   3HB   ALA  88          3HB       ALA  88   8.339  20.774   5.068
  625    H    CYS  89           H        CYS  89   6.775  19.551   2.050
  626    HA   CYS  89           HA       CYS  89   4.504  20.870   2.905
  627   1HB   CYS  89          1HB       CYS  89   5.162  21.355   0.746
  628   2HB   CYS  89          2HB       CYS  89   5.389  19.673   0.310
  629    H    MET  90           H        MET  90   4.807  17.556   1.410
  630    HA   MET  90           HA       MET  90   2.221  16.799   1.813
  631   1HB   MET  90          1HB       MET  90   3.011  14.620   1.248
  632   2HB   MET  90          2HB       MET  90   4.255  15.654   0.574
  633   1HG   MET  90          1HG       MET  90   5.709  14.356   1.775
  634   2HG   MET  90          2HG       MET  90   5.204  15.321   3.148
  635   1HE   MET  90          1HE       MET  90   4.721  12.262   1.024
  636   2HE   MET  90          2HE       MET  90   3.742  11.135   1.994
  637   3HE   MET  90          3HE       MET  90   2.966  12.516   1.182
  638    H    LYS  91           H        LYS  91   4.772  17.237   4.160
  639    HA   LYS  91           HA       LYS  91   4.102  15.399   6.094
  640   1HB   LYS  91          1HB       LYS  91   6.032  17.162   5.906
  641   2HB   LYS  91          2HB       LYS  91   4.941  18.199   6.802
  642   1HG   LYS  91          1HG       LYS  91   4.847  16.676   8.668
  643   2HG   LYS  91          2HG       LYS  91   5.556  15.369   7.740
  644   1HD   LYS  91          1HD       LYS  91   7.611  16.001   8.451
  645   2HD   LYS  91          2HD       LYS  91   7.426  17.519   7.595
  646   1HE   LYS  91          1HE       LYS  91   6.710  18.681   9.509
  647   2HE   LYS  91          2HE       LYS  91   6.072  17.242  10.279
  648   1HZ   LYS  91          1HZ       LYS  91   8.050  16.770  11.147
  649   2HZ   LYS  91          2HZ       LYS  91   8.893  17.172   9.807
  650   3HZ   LYS  91          3HZ       LYS  91   8.421  18.333  10.855
  651    H    THR  92           H        THR  92   2.838  18.778   5.667
  652    HA   THR  92           HA       THR  92   0.676  18.089   7.522
  653    HB   THR  92           HB       THR  92   1.891  20.678   6.456
  654    HG1  THR  92           1HG      THR  92   2.718  19.377   8.352
  655   1HG2  THR  92          1HG2      THR  92  -0.300  21.480   6.630
  656   2HG2  THR  92          2HG2      THR  92  -0.799  20.168   7.724
  657   3HG2  THR  92          3HG2      THR  92   0.154  21.535   8.350
  658    H    ASN  93           H        ASN  93   1.116  19.740   4.317
  659    HA   ASN  93           HA       ASN  93  -1.423  19.976   3.600
  660   1HB   ASN  93          1HB       ASN  93   1.103  19.338   2.098
  661   2HB   ASN  93          2HB       ASN  93  -0.389  19.115   1.206
  662   1HD2  ASN  93          1HD2      ASN  93   1.383  21.405   3.245
  663   2HD2  ASN  93          2HD2      ASN  93   0.803  22.863   2.511
  664    H    CYS  94           H        CYS  94   0.661  17.043   2.978
  665    HA   CYS  94           HA       CYS  94  -1.720  15.521   2.345
  666   1HB   CYS  94          1HB       CYS  94   0.178  15.296   0.860
  667   2HB   CYS  94          2HB       CYS  94   1.222  14.837   2.191
  668    H    LYS  95           H        LYS  95   0.907  13.706   3.701
  669    HA   LYS  95           HA       LYS  95  -0.456  13.627   6.301
  670   1HB   LYS  95          1HB       LYS  95  -0.299  11.271   6.381
  671   2HB   LYS  95          2HB       LYS  95  -0.972  11.655   4.810
  672   1HG   LYS  95          1HG       LYS  95   0.775  10.678   3.739
  673   2HG   LYS  95          2HG       LYS  95   1.936  11.635   4.638
  674   1HD   LYS  95          1HD       LYS  95   2.124  10.029   6.373
  675   2HD   LYS  95          2HD       LYS  95   0.578   9.294   5.999
  676   1HE   LYS  95          1HE       LYS  95   1.518   8.418   3.845
  677   2HE   LYS  95          2HE       LYS  95   3.066   9.147   4.227
  678   1HZ   LYS  95          1HZ       LYS  95   3.105   7.787   6.237
  679   2HZ   LYS  95          2HZ       LYS  95   1.709   7.064   5.794
  680   3HZ   LYS  95          3HZ       LYS  95   3.052   6.875   4.883
  Start of MODEL   15
    1   1H    ILE   1           H        ILE   1 -12.268  14.431  13.167
    2    HA   ILE   1           HA       ILE   1 -12.224  12.211  14.499
    3    HB   ILE   1           HB       ILE   1 -12.977  11.420  11.690
    4   1HG1  ILE   1          1HG1      ILE   1 -14.332  10.011  13.801
    5   2HG1  ILE   1          2HG1      ILE   1 -14.455  11.734  14.097
    6   1HG2  ILE   1          1HG2      ILE   1 -12.480   9.128  12.250
    7   2HG2  ILE   1          2HG2      ILE   1 -11.015  10.116  12.466
    8   3HG2  ILE   1          3HG2      ILE   1 -11.956   9.598  13.885
    9   1HD1  ILE   1          1HD1      ILE   1 -15.151  10.337  11.472
   10   2HD1  ILE   1          2HD1      ILE   1 -16.316  10.960  12.665
   11   3HD1  ILE   1          3HD1      ILE   1 -15.272  12.088  11.768
   12    H    SER   2           H        SER   2 -11.168  12.882  11.083
   13    HA   SER   2           HA       SER   2  -8.455  12.450  12.018
   14   1HB   SER   2          1HB       SER   2  -9.886  11.838   9.580
   15   2HB   SER   2          2HB       SER   2  -8.547  12.898   9.184
   16    HG   SER   2           HG       SER   2  -7.993  10.757  10.973
   17    H    GLU   3           H        GLU   3  -6.941  14.124  12.058
   18    HA   GLU   3           HA       GLU   3  -7.793  16.626  10.841
   19   1HB   GLU   3          1HB       GLU   3  -8.130  16.475  13.419
   20   2HB   GLU   3          2HB       GLU   3  -6.382  16.540  13.530
   21   1HG   GLU   3          1HG       GLU   3  -6.275  18.753  12.860
   22   2HG   GLU   3          2HG       GLU   3  -7.625  18.599  11.752
   23    H    PHE   4           H        PHE   4  -5.024  14.992  12.552
   24    HA   PHE   4           HA       PHE   4  -3.337  15.824  10.313
   25   1HB   PHE   4          1HB       PHE   4  -3.169  17.329  12.410
   26   2HB   PHE   4          2HB       PHE   4  -2.662  15.916  13.314
   27    HD1  PHE   4           1HD      PHE   4  -1.702  18.221  10.597
   28    HD2  PHE   4           2HD      PHE   4  -0.422  15.122  13.198
   29    HE1  PHE   4           1HE      PHE   4   0.682  18.664   9.951
   30    HE2  PHE   4           2HE      PHE   4   1.963  15.565  12.551
   31    HZ   PHE   4           HZ       PHE   4   2.486  17.330  10.935
   32    H    ALA   5           H        ALA   5  -3.354  13.677   9.483
   33    HA   ALA   5           HA       ALA   5  -1.698  11.859  11.052
   34   1HB   ALA   5          1HB       ALA   5  -3.222  10.131  11.087
   35   2HB   ALA   5          2HB       ALA   5  -4.352  11.504  11.180
   36   3HB   ALA   5          3HB       ALA   5  -4.060  10.695   9.622
   37    HA   PRO   6           HA       PRO   6   0.084  11.266   7.157
   38   1HB   PRO   6          1HB       PRO   6   1.350   8.867   7.491
   39   2HB   PRO   6          2HB       PRO   6   1.999  10.383   8.082
   40   1HG   PRO   6          1HG       PRO   6   0.711   8.200   9.603
   41   2HG   PRO   6          2HG       PRO   6   1.728   9.498  10.195
   42   1HD   PRO   6          1HD       PRO   6  -1.127   9.322  10.407
   43   2HD   PRO   6          2HD       PRO   6  -0.121  10.672  10.895
   44    H    VAL   7           H        VAL   7  -0.397  10.643   5.108
   45    HA   VAL   7           HA       VAL   7  -2.583   8.720   5.017
   46    HB   VAL   7           HB       VAL   7  -1.453  10.548   2.889
   47   1HG1  VAL   7          1HG1      VAL   7  -4.057   8.988   2.993
   48   2HG1  VAL   7          2HG1      VAL   7  -3.565  10.116   1.708
   49   3HG1  VAL   7          3HG1      VAL   7  -2.650   8.613   1.971
   50   1HG2  VAL   7          1HG2      VAL   7  -3.354  12.014   3.349
   51   2HG2  VAL   7          2HG2      VAL   7  -3.896  10.930   4.653
   52   3HG2  VAL   7          3HG2      VAL   7  -2.356  11.809   4.809
   53    H    ASP   8           H        ASP   8  -1.511   6.728   5.324
   54    HA   ASP   8           HA       ASP   8   0.666   6.172   3.516
   55   1HB   ASP   8          1HB       ASP   8  -0.463   4.947   6.016
   56   2HB   ASP   8          2HB       ASP   8   0.313   3.846   4.894
   57    H    CYS   9           H        CYS   9  -2.320   6.480   2.771
   58    HA   CYS   9           HA       CYS   9  -3.776   5.553   1.417
   59   1HB   CYS   9          1HB       CYS   9  -1.442   4.897   0.301
   60   2HB   CYS   9          2HB       CYS   9  -2.011   3.277   0.653
   61    H    LYS  10           H        LYS  10  -4.561   5.041   3.817
   62    HA   LYS  10           HA       LYS  10  -4.537   2.195   4.374
   63   1HB   LYS  10          1HB       LYS  10  -4.856   4.651   5.900
   64   2HB   LYS  10          2HB       LYS  10  -6.143   3.516   6.255
   65   1HG   LYS  10          1HG       LYS  10  -4.436   1.720   6.659
   66   2HG   LYS  10          2HG       LYS  10  -3.156   2.870   6.324
   67   1HD   LYS  10          1HD       LYS  10  -3.187   3.363   8.543
   68   2HD   LYS  10          2HD       LYS  10  -4.688   4.214   8.237
   69   1HE   LYS  10          1HE       LYS  10  -5.952   2.064   8.647
   70   2HE   LYS  10          2HE       LYS  10  -4.437   1.274   9.036
   71   1HZ   LYS  10          1HZ       LYS  10  -5.619   3.555  10.460
   72   2HZ   LYS  10          2HZ       LYS  10  -5.466   2.028  11.017
   73   3HZ   LYS  10          3HZ       LYS  10  -4.137   2.948  10.782
   74    H    GLY  11           H        GLY  11  -7.288   4.464   4.822
   75   1HA   GLY  11          1HA       GLY  11  -9.192   2.562   4.003
   76   2HA   GLY  11          2HA       GLY  11  -9.451   4.279   4.240
   77    H    GLN  12           H        GLN  12  -6.964   4.444   2.161
   78    HA   GLN  12           HA       GLN  12  -8.758   4.688  -0.074
   79   1HB   GLN  12          1HB       GLN  12  -5.993   5.674   0.596
   80   2HB   GLN  12          2HB       GLN  12  -6.428   5.549  -1.097
   81   1HG   GLN  12          1HG       GLN  12  -8.505   6.821   0.626
   82   2HG   GLN  12          2HG       GLN  12  -7.005   7.720   0.509
   83   1HE2  GLN  12          1HE2      GLN  12  -6.444   8.733  -1.333
   84   2HE2  GLN  12          2HE2      GLN  12  -7.415   8.810  -2.765
   85    H    CYS  13           H        CYS  13  -6.673   2.343   1.282
   86    HA   CYS  13           HA       CYS  13  -6.292   1.110  -1.348
   87   1HB   CYS  13          1HB       CYS  13  -4.664   0.947   1.182
   88   2HB   CYS  13          2HB       CYS  13  -4.542  -0.273  -0.070
   89    H    THR  14           H        THR  14  -8.713   0.577  -0.927
   90    HA   THR  14           HA       THR  14  -8.882  -1.799   0.810
   91    HB   THR  14           HB       THR  14 -10.847   0.443   0.161
   92    HG1  THR  14           1HG      THR  14 -10.338   0.820   2.292
   93   1HG2  THR  14          1HG2      THR  14 -11.604  -2.260   0.341
   94   2HG2  THR  14          2HG2      THR  14 -11.756  -1.671   2.014
   95   3HG2  THR  14          3HG2      THR  14 -12.651  -0.867   0.703
   96    H    THR  15           H        THR  15  -9.862  -0.288  -2.308
   97    HA   THR  15           HA       THR  15 -11.029  -2.735  -3.243
   98    HB   THR  15           HB       THR  15 -10.665   0.092  -4.118
   99    HG1  THR  15           1HG      THR  15 -12.867  -0.329  -4.412
  100   1HG2  THR  15          1HG2      THR  15 -11.086  -2.138  -6.173
  101   2HG2  THR  15          2HG2      THR  15 -11.083  -0.385  -6.484
  102   3HG2  THR  15          3HG2      THR  15  -9.573  -1.211  -6.028
  103    HA   PRO  16           HA       PRO  16  -6.916  -2.919  -5.537
  104   1HB   PRO  16          1HB       PRO  16  -4.830  -1.358  -4.712
  105   2HB   PRO  16          2HB       PRO  16  -5.887  -0.922  -6.040
  106   1HG   PRO  16          1HG       PRO  16  -5.816   0.169  -3.294
  107   2HG   PRO  16          2HG       PRO  16  -6.546   0.858  -4.731
  108   1HD   PRO  16          1HD       PRO  16  -7.908  -0.457  -2.576
  109   2HD   PRO  16          2HD       PRO  16  -8.622   0.129  -4.065
  110    H    CYS  17           H        CYS  17  -7.316  -2.813  -2.212
  111    HA   CYS  17           HA       CYS  17  -5.287  -4.914  -1.984
  112   1HB   CYS  17          1HB       CYS  17  -6.008  -2.795   0.048
  113   2HB   CYS  17          2HB       CYS  17  -5.031  -4.206   0.403
  114    H    GLU  18           H        GLU  18  -8.324  -4.738  -2.608
  115    HA   GLU  18           HA       GLU  18  -9.629  -5.659  -0.301
  116   1HB   GLU  18          1HB       GLU  18 -10.330  -4.890  -2.959
  117   2HB   GLU  18          2HB       GLU  18 -10.946  -6.516  -2.744
  118   1HG   GLU  18          1HG       GLU  18 -11.403  -4.736  -0.404
  119   2HG   GLU  18          2HG       GLU  18 -12.211  -4.208  -1.867
  120    HA   PRO  19           HA       PRO  19  -9.012  -9.903  -2.317
  121   1HB   PRO  19          1HB       PRO  19  -7.474 -10.162  -4.561
  122   2HB   PRO  19          2HB       PRO  19  -9.219 -10.008  -4.608
  123   1HG   PRO  19          1HG       PRO  19  -7.162  -7.989  -5.265
  124   2HG   PRO  19          2HG       PRO  19  -8.860  -8.008  -5.700
  125   1HD   PRO  19          1HD       PRO  19  -7.631  -6.421  -3.651
  126   2HD   PRO  19          2HD       PRO  19  -9.343  -6.527  -4.009
  127    H    LEU  20           H        LEU  20  -6.403  -7.693  -2.158
  128    HA   LEU  20           HA       LEU  20  -4.440  -9.712  -1.692
  129   1HB   LEU  20          1HB       LEU  20  -3.598  -7.786  -2.641
  130   2HB   LEU  20          2HB       LEU  20  -4.546  -6.726  -1.618
  131    HG   LEU  20           HG       LEU  20  -1.951  -6.988  -1.287
  132   1HD1  LEU  20          1HD1      LEU  20  -3.822  -5.765   0.107
  133   2HD1  LEU  20          2HD1      LEU  20  -3.482  -7.058   1.283
  134   3HD1  LEU  20          3HD1      LEU  20  -2.176  -5.970   0.754
  135   1HD2  LEU  20          1HD2      LEU  20  -2.684  -9.600  -0.765
  136   2HD2  LEU  20          2HD2      LEU  20  -1.142  -8.830  -0.324
  137   3HD2  LEU  20          3HD2      LEU  20  -2.470  -8.903   0.859
  138    H    THR  21           H        THR  21  -6.470  -7.509   0.312
  139    HA   THR  21           HA       THR  21  -5.285  -8.242   2.767
  140    HB   THR  21           HB       THR  21  -7.936  -6.982   1.917
  141    HG1  THR  21           1HG      THR  21  -5.473  -6.146   3.282
  142   1HG2  THR  21          1HG2      THR  21  -7.166  -6.350   4.631
  143   2HG2  THR  21          2HG2      THR  21  -8.686  -7.089   4.071
  144   3HG2  THR  21          3HG2      THR  21  -7.298  -8.120   4.494
  145    H    ALA  22           H        ALA  22  -8.087  -9.534   0.912
  146    HA   ALA  22           HA       ALA  22  -9.045 -11.243   2.856
  147   1HB   ALA  22          1HB       ALA  22  -9.727 -10.578   0.312
  148   2HB   ALA  22          2HB       ALA  22  -9.044 -12.198   0.035
  149   3HB   ALA  22          3HB       ALA  22 -10.398 -11.986   1.171
  150    H    CYS  23           H        CYS  23  -6.286 -11.562   0.585
  151    HA   CYS  23           HA       CYS  23  -5.824 -14.261   0.920
  152   1HB   CYS  23          1HB       CYS  23  -4.589 -13.398  -0.781
  153   2HB   CYS  23          2HB       CYS  23  -4.221 -11.912   0.071
  154    H    LYS  24           H        LYS  24  -3.964 -11.539   2.478
  155    HA   LYS  24           HA       LYS  24  -2.617 -12.943   4.333
  156   1HB   LYS  24          1HB       LYS  24  -3.747 -10.169   4.275
  157   2HB   LYS  24          2HB       LYS  24  -3.035 -10.748   5.767
  158   1HG   LYS  24          1HG       LYS  24  -0.891 -10.915   4.855
  159   2HG   LYS  24          2HG       LYS  24  -1.482 -11.241   3.238
  160   1HD   LYS  24          1HD       LYS  24  -0.781  -9.055   2.922
  161   2HD   LYS  24          2HD       LYS  24  -2.425  -8.735   3.438
  162   1HE   LYS  24          1HE       LYS  24  -1.710  -7.666   5.312
  163   2HE   LYS  24          2HE       LYS  24  -0.710  -9.027   5.778
  164   1HZ   LYS  24          1HZ       LYS  24   0.418  -6.849   5.228
  165   2HZ   LYS  24          2HZ       LYS  24   1.063  -8.202   4.579
  166   3HZ   LYS  24          3HZ       LYS  24   0.150  -7.210   3.658
  167    H    GLU  25           H        GLU  25  -6.000 -11.687   4.678
  168    HA   GLU  25           HA       GLU  25  -6.421 -12.528   7.228
  169   1HB   GLU  25          1HB       GLU  25  -7.987 -11.560   5.033
  170   2HB   GLU  25          2HB       GLU  25  -8.824 -12.961   5.670
  171   1HG   GLU  25          1HG       GLU  25  -7.744 -11.033   7.699
  172   2HG   GLU  25          2HG       GLU  25  -9.082 -10.458   6.724
  173    H    LYS  26           H        LYS  26  -7.601 -14.311   4.277
  174    HA   LYS  26           HA       LYS  26  -8.388 -16.602   5.411
  175   1HB   LYS  26          1HB       LYS  26  -8.165 -15.785   2.897
  176   2HB   LYS  26          2HB       LYS  26  -6.740 -16.804   2.917
  177   1HG   LYS  26          1HG       LYS  26  -7.987 -18.705   2.872
  178   2HG   LYS  26          2HG       LYS  26  -8.982 -18.169   4.211
  179   1HD   LYS  26          1HD       LYS  26 -10.555 -17.108   2.803
  180   2HD   LYS  26          2HD       LYS  26  -9.411 -16.917   1.490
  181   1HE   LYS  26          1HE       LYS  26  -9.820 -19.755   2.169
  182   2HE   LYS  26          2HE       LYS  26 -11.328 -18.966   1.750
  183   1HZ   LYS  26          1HZ       LYS  26  -9.283 -19.746   0.051
  184   2HZ   LYS  26          2HZ       LYS  26 -10.707 -19.050  -0.342
  185   3HZ   LYS  26          3HZ       LYS  26  -9.398 -18.120  -0.045
  186    H    CYS  27           H        CYS  27  -5.000 -15.573   4.825
  187    HA   CYS  27           HA       CYS  27  -3.843 -18.028   5.488
  188   1HB   CYS  27          1HB       CYS  27  -2.581 -15.315   5.886
  189   2HB   CYS  27          2HB       CYS  27  -1.774 -16.849   5.625
  190    H    ALA  28           H        ALA  28  -4.122 -14.937   7.407
  191    HA   ALA  28           HA       ALA  28  -3.201 -15.746   9.790
  192   1HB   ALA  28          1HB       ALA  28  -5.327 -13.853   8.879
  193   2HB   ALA  28          2HB       ALA  28  -5.269 -14.226  10.618
  194   3HB   ALA  28          3HB       ALA  28  -3.840 -13.542   9.807
  195    H    GLU  29           H        GLU  29  -6.552 -16.303   8.523
  196    HA   GLU  29           HA       GLU  29  -7.458 -17.598  10.790
  197   1HB   GLU  29          1HB       GLU  29  -8.299 -17.573   7.885
  198   2HB   GLU  29          2HB       GLU  29  -9.090 -18.669   9.000
  199   1HG   GLU  29          1HG       GLU  29  -8.816 -15.674   9.522
  200   2HG   GLU  29          2HG       GLU  29 -10.208 -16.382   8.728
  201    H    SER  30           H        SER  30  -5.874 -18.833   7.787
  202    HA   SER  30           HA       SER  30  -5.959 -21.497   8.882
  203   1HB   SER  30          1HB       SER  30  -5.944 -20.387   6.260
  204   2HB   SER  30          2HB       SER  30  -4.423 -21.243   6.418
  205    HG   SER  30           HG       SER  30  -5.900 -22.772   5.707
  206    H    CYS  31           H        CYS  31  -4.334 -19.250  10.106
  207    HA   CYS  31           HA       CYS  31  -1.921 -20.755  10.378
  208   1HB   CYS  31          1HB       CYS  31  -1.900 -18.092   8.972
  209   2HB   CYS  31          2HB       CYS  31  -0.514 -18.651   9.887
  210    H    GLU  32           H        GLU  32  -4.066 -20.200  12.131
  211    HA   GLU  32           HA       GLU  32  -3.322 -17.885  13.654
  212   1HB   GLU  32          1HB       GLU  32  -5.666 -19.591  13.380
  213   2HB   GLU  32          2HB       GLU  32  -5.247 -19.428  15.074
  214   1HG   GLU  32          1HG       GLU  32  -5.045 -16.873  14.604
  215   2HG   GLU  32          2HG       GLU  32  -5.852 -17.204  13.084
  216    H    THR  33           H        THR  33  -3.663 -21.460  14.258
  217    HA   THR  33           HA       THR  33  -2.338 -21.335  16.758
  218    HB   THR  33           HB       THR  33  -2.399 -23.849  16.475
  219    HG1  THR  33           1HG      THR  33  -3.170 -24.564  14.389
  220   1HG2  THR  33          1HG2      THR  33  -4.968 -23.881  15.664
  221   2HG2  THR  33          2HG2      THR  33  -4.526 -23.240  17.264
  222   3HG2  THR  33          3HG2      THR  33  -4.817 -22.124  15.909
  223    H    SER  34           H        SER  34  -1.237 -21.529  13.413
  224    HA   SER  34           HA       SER  34   1.150 -22.742  13.693
  225   1HB   SER  34          1HB       SER  34  -0.001 -20.684  11.902
  226   2HB   SER  34          2HB       SER  34   1.748 -20.623  11.987
  227    HG   SER  34           HG       SER  34   0.099 -22.882  11.252
  228    H    ALA  35           H        ALA  35   2.786 -22.415  15.151
  229    HA   ALA  35           HA       ALA  35   3.026 -20.418  16.926
  230   1HB   ALA  35          1HB       ALA  35   4.394 -22.612  16.526
  231   2HB   ALA  35          2HB       ALA  35   5.493 -21.558  15.606
  232   3HB   ALA  35          3HB       ALA  35   5.186 -21.236  17.329
  233    H    ASP  36           H        ASP  36   4.832 -20.507  13.765
  234    HA   ASP  36           HA       ASP  36   5.445 -17.738  14.098
  235   1HB   ASP  36          1HB       ASP  36   5.897 -19.356  11.569
  236   2HB   ASP  36          2HB       ASP  36   6.836 -18.003  12.168
  237    H    LYS  37           H        LYS  37   3.349 -16.684  13.932
  238    HA   LYS  37           HA       LYS  37   1.544 -17.300  11.845
  239   1HB   LYS  37          1HB       LYS  37   1.765 -15.185  13.962
  240   2HB   LYS  37          2HB       LYS  37   0.631 -14.955  12.647
  241   1HG   LYS  37          1HG       LYS  37  -0.733 -16.702  13.321
  242   2HG   LYS  37          2HG       LYS  37   0.607 -17.672  13.901
  243   1HD   LYS  37          1HD       LYS  37  -0.017 -17.063  16.000
  244   2HD   LYS  37          2HD       LYS  37   0.646 -15.482  15.639
  245   1HE   LYS  37          1HE       LYS  37  -1.523 -14.644  14.908
  246   2HE   LYS  37          2HE       LYS  37  -2.223 -16.251  14.941
  247   1HZ   LYS  37          1HZ       LYS  37  -1.162 -15.796  17.437
  248   2HZ   LYS  37          2HZ       LYS  37  -1.966 -14.431  17.039
  249   3HZ   LYS  37          3HZ       LYS  37  -2.742 -15.868  17.029
  250    H    LYS  38           H        LYS  38   3.601 -14.357  12.441
  251    HA   LYS  38           HA       LYS  38   3.179 -13.056  10.127
  252   1HB   LYS  38          1HB       LYS  38   4.996 -12.911  12.240
  253   2HB   LYS  38          2HB       LYS  38   6.015 -13.048  10.822
  254   1HG   LYS  38          1HG       LYS  38   5.678 -10.752  10.809
  255   2HG   LYS  38          2HG       LYS  38   4.316 -11.236   9.819
  256   1HD   LYS  38          1HD       LYS  38   3.387  -9.746  11.437
  257   2HD   LYS  38          2HD       LYS  38   2.932 -11.343  11.994
  258   1HE   LYS  38          1HE       LYS  38   3.917 -10.862  13.981
  259   2HE   LYS  38          2HE       LYS  38   5.468 -10.895  13.166
  260   1HZ   LYS  38          1HZ       LYS  38   3.914  -8.644  14.005
  261   2HZ   LYS  38          2HZ       LYS  38   5.529  -8.781  13.810
  262   3HZ   LYS  38          3HZ       LYS  38   4.574  -8.480  12.521
  263    H    THR  39           H        THR  39   5.676 -15.648  10.625
  264    HA   THR  39           HA       THR  39   6.581 -15.696   7.999
  265    HB   THR  39           HB       THR  39   6.399 -17.864  10.156
  266    HG1  THR  39           1HG      THR  39   7.574 -15.653  10.348
  267   1HG2  THR  39          1HG2      THR  39   8.659 -17.834   8.219
  268   2HG2  THR  39          2HG2      THR  39   7.754 -19.220   8.875
  269   3HG2  THR  39          3HG2      THR  39   7.099 -18.300   7.499
  270    H    CYS  40           H        CYS  40   4.136 -17.905   9.527
  271    HA   CYS  40           HA       CYS  40   3.462 -19.372   7.410
  272   1HB   CYS  40          1HB       CYS  40   2.461 -19.202   9.822
  273   2HB   CYS  40          2HB       CYS  40   1.250 -18.192   9.058
  274    H    ARG  41           H        ARG  41   2.092 -16.096   8.215
  275    HA   ARG  41           HA       ARG  41   0.541 -15.924   5.943
  276   1HB   ARG  41          1HB       ARG  41   1.806 -13.759   7.692
  277   2HB   ARG  41          2HB       ARG  41   0.642 -13.399   6.432
  278   1HG   ARG  41          1HG       ARG  41  -0.689 -15.400   7.774
  279   2HG   ARG  41          2HG       ARG  41   0.220 -14.689   9.093
  280   1HD   ARG  41          1HD       ARG  41  -0.833 -12.503   7.563
  281   2HD   ARG  41          2HD       ARG  41  -2.142 -13.652   7.753
  282    HE   ARG  41           HE       ARG  41  -1.139 -13.558  10.296
  283   1HH1  ARG  41          2HH2      ARG  41  -2.011 -11.012   8.029
  284   2HH1  ARG  41          1HH2      ARG  41  -2.435  -9.878   9.268
  285   1HH2  ARG  41          2HH1      ARG  41  -1.698 -12.063  11.931
  286   2HH2  ARG  41          1HH1      ARG  41  -2.255 -10.480  11.503
  287    H    ARG  42           H        ARG  42   3.764 -14.393   6.692
  288    HA   ARG  42           HA       ARG  42   4.266 -13.094   4.465
  289   1HB   ARG  42          1HB       ARG  42   5.862 -14.418   6.503
  290   2HB   ARG  42          2HB       ARG  42   6.669 -14.598   4.958
  291   1HG   ARG  42          1HG       ARG  42   7.492 -12.506   5.380
  292   2HG   ARG  42          2HG       ARG  42   5.928 -11.951   4.819
  293   1HD   ARG  42          1HD       ARG  42   5.537 -12.649   7.552
  294   2HD   ARG  42          2HD       ARG  42   7.073 -11.808   7.507
  295    HE   ARG  42           HE       ARG  42   4.453 -10.640   7.044
  296   1HH1  ARG  42          2HH2      ARG  42   7.856 -10.350   6.197
  297   2HH1  ARG  42          1HH2      ARG  42   7.751  -8.662   5.825
  298   1HH2  ARG  42          2HH1      ARG  42   4.314  -8.412   6.553
  299   2HH2  ARG  42          1HH1      ARG  42   5.723  -7.552   6.029
  300    H    ASN  43           H        ASN  43   4.720 -16.668   4.907
  301    HA   ASN  43           HA       ASN  43   5.649 -17.062   2.297
  302   1HB   ASN  43          1HB       ASN  43   5.032 -18.668   4.665
  303   2HB   ASN  43          2HB       ASN  43   4.413 -19.471   3.235
  304   1HD2  ASN  43          1HD2      ASN  43   7.002 -19.172   5.204
  305   2HD2  ASN  43          2HD2      ASN  43   8.293 -19.657   4.157
  306    H    CYS  44           H        CYS  44   2.455 -17.313   3.976
  307    HA   CYS  44           HA       CYS  44   0.994 -18.516   2.000
  308   1HB   CYS  44          1HB       CYS  44   0.245 -18.019   4.320
  309   2HB   CYS  44          2HB       CYS  44   0.040 -16.338   3.870
  310    H    LYS  45           H        LYS  45   2.193 -15.169   2.349
  311    HA   LYS  45           HA       LYS  45   0.560 -13.991   0.405
  312   1HB   LYS  45          1HB       LYS  45   1.789 -12.714   2.086
  313   2HB   LYS  45          2HB       LYS  45   3.319 -13.232   1.409
  314   1HG   LYS  45          1HG       LYS  45   1.487 -12.037  -0.599
  315   2HG   LYS  45          2HG       LYS  45   1.935 -10.928   0.682
  316   1HD   LYS  45          1HD       LYS  45   4.102 -12.588  -0.621
  317   2HD   LYS  45          2HD       LYS  45   3.468 -11.204  -1.489
  318   1HE   LYS  45          1HE       LYS  45   4.259  -9.660   0.103
  319   2HE   LYS  45          2HE       LYS  45   4.252 -10.832   1.405
  320   1HZ   LYS  45          1HZ       LYS  45   6.254 -10.370  -0.613
  321   2HZ   LYS  45          2HZ       LYS  45   6.431 -10.823   0.946
  322   3HZ   LYS  45          3HZ       LYS  45   6.023 -11.929  -0.185
  323    H    LYS  46           H        LYS  46   3.699 -15.738   0.251
  324    HA   LYS  46           HA       LYS  46   4.017 -15.194  -2.534
  325   1HB   LYS  46          1HB       LYS  46   5.968 -15.477  -1.149
  326   2HB   LYS  46          2HB       LYS  46   5.431 -17.054  -0.606
  327   1HG   LYS  46          1HG       LYS  46   6.996 -17.568  -2.310
  328   2HG   LYS  46          2HG       LYS  46   5.450 -17.742  -3.117
  329   1HD   LYS  46          1HD       LYS  46   6.771 -16.451  -4.627
  330   2HD   LYS  46          2HD       LYS  46   5.705 -15.286  -3.867
  331   1HE   LYS  46          1HE       LYS  46   7.703 -14.153  -3.570
  332   2HE   LYS  46          2HE       LYS  46   7.737 -15.111  -2.102
  333   1HZ   LYS  46          1HZ       LYS  46   9.113 -15.685  -4.626
  334   2HZ   LYS  46          2HZ       LYS  46   9.781 -15.408  -3.161
  335   3HZ   LYS  46          3HZ       LYS  46   8.967 -16.797  -3.439
  336    H    ALA  47           H        ALA  47   2.252 -17.492  -0.571
  337    HA   ALA  47           HA       ALA  47   2.172 -19.722  -2.131
  338   1HB   ALA  47          1HB       ALA  47   0.128 -20.221  -1.009
  339   2HB   ALA  47          2HB       ALA  47   1.065 -19.220   0.127
  340   3HB   ALA  47          3HB       ALA  47  -0.268 -18.498  -0.805
  341    H    ASP  48           H        ASP  48  -0.147 -16.923  -2.341
  342    HA   ASP  48           HA       ASP  48  -0.032 -17.014  -5.159
  343   1HB   ASP  48          1HB       ASP  48  -1.670 -18.928  -4.332
  344   2HB   ASP  48          2HB       ASP  48  -2.772 -17.607  -4.000
  345    H    CYS  49           H        CYS  49   0.595 -14.906  -3.588
  346    HA   CYS  49           HA       CYS  49  -1.685 -13.137  -3.929
  347   1HB   CYS  49          1HB       CYS  49  -0.065 -13.034  -1.390
  348   2HB   CYS  49          2HB       CYS  49  -1.537 -12.168  -1.777
  349    H    GLU  50           H        GLU  50   0.953 -13.822  -5.289
  350    HA   GLU  50           HA       GLU  50   2.793 -11.823  -4.639
  351   1HB   GLU  50          1HB       GLU  50   2.451 -13.891  -6.731
  352   2HB   GLU  50          2HB       GLU  50   3.313 -12.472  -7.292
  353   1HG   GLU  50          1HG       GLU  50   4.032 -13.923  -4.706
  354   2HG   GLU  50          2HG       GLU  50   4.757 -14.323  -6.250
  355    HA   PRO  51           HA       PRO  51   0.683  -9.538  -8.234
  356   1HB   PRO  51          1HB       PRO  51  -1.760 -10.389  -9.115
  357   2HB   PRO  51          2HB       PRO  51  -0.253 -10.829  -9.894
  358   1HG   PRO  51          1HG       PRO  51  -1.991 -12.474  -8.158
  359   2HG   PRO  51          2HG       PRO  51  -0.741 -12.995  -9.270
  360   1HD   PRO  51          1HD       PRO  51  -0.545 -12.852  -6.412
  361   2HD   PRO  51          2HD       PRO  51   0.739 -13.262  -7.531
  362    H    GLN  52           H        GLN  52  -1.116 -10.769  -5.593
  363    HA   GLN  52           HA       GLN  52  -2.861  -8.518  -5.553
  364   1HB   GLN  52          1HB       GLN  52  -2.380 -10.516  -3.308
  365   2HB   GLN  52          2HB       GLN  52  -3.806  -9.530  -3.569
  366   1HG   GLN  52          1HG       GLN  52  -4.357 -10.757  -5.622
  367   2HG   GLN  52          2HG       GLN  52  -2.844 -11.640  -5.555
  368   1HE2  GLN  52          1HE2      GLN  52  -5.454 -12.745  -5.648
  369   2HE2  GLN  52          2HE2      GLN  52  -5.726 -13.669  -4.208
  370    H    ASP  53           H        ASP  53  -0.249  -9.776  -3.347
  371    HA   ASP  53           HA       ASP  53  -0.180  -7.683  -1.644
  372   1HB   ASP  53          1HB       ASP  53   1.211  -9.932  -1.795
  373   2HB   ASP  53          2HB       ASP  53   2.390  -8.951  -2.641
  374    H    LYS  54           H        LYS  54   1.082  -7.996  -4.968
  375    HA   LYS  54           HA       LYS  54   2.765  -5.710  -4.855
  376   1HB   LYS  54          1HB       LYS  54   1.745  -7.537  -7.014
  377   2HB   LYS  54          2HB       LYS  54   2.526  -6.031  -7.451
  378   1HG   LYS  54          1HG       LYS  54   4.446  -6.734  -5.853
  379   2HG   LYS  54          2HG       LYS  54   3.700  -8.320  -5.819
  380   1HD   LYS  54          1HD       LYS  54   4.699  -8.840  -7.783
  381   2HD   LYS  54          2HD       LYS  54   3.831  -7.540  -8.575
  382   1HE   LYS  54          1HE       LYS  54   5.611  -6.029  -8.373
  383   2HE   LYS  54          2HE       LYS  54   6.244  -6.794  -6.928
  384   1HZ   LYS  54          1HZ       LYS  54   7.483  -7.151  -9.069
  385   2HZ   LYS  54          2HZ       LYS  54   7.178  -8.487  -8.181
  386   3HZ   LYS  54          3HZ       LYS  54   6.285  -8.170  -9.510
  387    H    VAL  55           H        VAL  55  -0.310  -6.290  -6.710
  388    HA   VAL  55           HA       VAL  55  -0.845  -3.798  -7.504
  389    HB   VAL  55           HB       VAL  55  -2.744  -5.848  -6.353
  390   1HG1  VAL  55          1HG1      VAL  55  -3.579  -3.390  -6.555
  391   2HG1  VAL  55          2HG1      VAL  55  -3.560  -3.704  -8.307
  392   3HG1  VAL  55          3HG1      VAL  55  -4.571  -4.702  -7.234
  393   1HG2  VAL  55          1HG2      VAL  55  -2.710  -6.896  -8.357
  394   2HG2  VAL  55          2HG2      VAL  55  -2.580  -5.375  -9.272
  395   3HG2  VAL  55          3HG2      VAL  55  -1.131  -6.094  -8.531
  396    H    CYS  56           H        CYS  56  -0.953  -5.023  -4.169
  397    HA   CYS  56           HA       CYS  56  -2.424  -2.881  -3.108
  398   1HB   CYS  56          1HB       CYS  56  -1.933  -5.178  -2.086
  399   2HB   CYS  56          2HB       CYS  56  -0.384  -4.514  -1.604
  400    H    ASP  57           H        ASP  57   1.124  -3.681  -2.813
  401    HA   ASP  57           HA       ASP  57   2.049  -1.488  -1.713
  402   1HB   ASP  57          1HB       ASP  57   3.429  -3.398  -2.555
  403   2HB   ASP  57          2HB       ASP  57   3.241  -2.812  -4.196
  404    H    ALA  58           H        ALA  58   1.420  -1.908  -5.277
  405    HA   ALA  58           HA       ALA  58   2.229   0.487  -6.235
  406   1HB   ALA  58          1HB       ALA  58   0.221  -1.564  -6.949
  407   2HB   ALA  58          2HB       ALA  58  -0.096   0.045  -7.643
  408   3HB   ALA  58          3HB       ALA  58   1.455  -0.770  -7.957
  409    H    CYS  59           H        CYS  59  -1.021  -0.260  -4.793
  410    HA   CYS  59           HA       CYS  59  -2.168   2.179  -5.086
  411   1HB   CYS  59          1HB       CYS  59  -3.369   0.264  -4.246
  412   2HB   CYS  59          2HB       CYS  59  -2.401   0.232  -2.785
  413    H    ARG  60           H        ARG  60  -0.365   1.008  -2.137
  414    HA   ARG  60           HA       ARG  60  -0.330   3.384  -0.835
  415   1HB   ARG  60          1HB       ARG  60   1.740   1.135  -0.878
  416   2HB   ARG  60          2HB       ARG  60   1.800   2.452   0.276
  417   1HG   ARG  60          1HG       ARG  60  -0.824   1.673   0.560
  418   2HG   ARG  60          2HG       ARG  60  -0.090   0.142   0.129
  419   1HD   ARG  60          1HD       ARG  60   1.695   0.666   1.950
  420   2HD   ARG  60          2HD       ARG  60   0.621   1.944   2.482
  421    HE   ARG  60           HE       ARG  60  -0.930  -0.434   2.244
  422   1HH1  ARG  60          2HH2      ARG  60   1.692   0.843   4.212
  423   2HH1  ARG  60          1HH2      ARG  60   1.282  -0.107   5.602
  424   1HH2  ARG  60          2HH1      ARG  60  -1.472  -1.686   4.076
  425   2HH2  ARG  60          1HH1      ARG  60  -0.530  -1.555   5.524
  426    H    MET  61           H        MET  61   1.866   2.125  -3.391
  427    HA   MET  61           HA       MET  61   3.792   4.119  -3.133
  428   1HB   MET  61          1HB       MET  61   4.432   2.183  -4.370
  429   2HB   MET  61          2HB       MET  61   2.931   2.143  -5.273
  430   1HG   MET  61          1HG       MET  61   3.702   3.598  -6.882
  431   2HG   MET  61          2HG       MET  61   4.524   4.616  -5.716
  432   1HE   MET  61          1HE       MET  61   5.599   2.297  -8.743
  433   2HE   MET  61          2HE       MET  61   5.930   0.842  -7.773
  434   3HE   MET  61          3HE       MET  61   4.320   1.597  -7.723
  435    H    LYS  62           H        LYS  62   0.776   3.856  -5.081
  436    HA   LYS  62           HA       LYS  62   1.274   6.234  -6.548
  437   1HB   LYS  62          1HB       LYS  62  -0.445   4.081  -6.762
  438   2HB   LYS  62          2HB       LYS  62  -1.524   5.376  -6.281
  439   1HG   LYS  62          1HG       LYS  62  -1.523   5.977  -8.478
  440   2HG   LYS  62          2HG       LYS  62   0.063   6.653  -8.166
  441   1HD   LYS  62          1HD       LYS  62   0.219   3.756  -8.630
  442   2HD   LYS  62          2HD       LYS  62  -0.560   4.570  -9.972
  443   1HE   LYS  62          1HE       LYS  62   1.727   6.148  -9.135
  444   2HE   LYS  62          2HE       LYS  62   2.242   4.486  -9.346
  445   1HZ   LYS  62          1HZ       LYS  62   1.814   6.292 -11.318
  446   2HZ   LYS  62          2HZ       LYS  62   2.019   4.684 -11.519
  447   3HZ   LYS  62          3HZ       LYS  62   0.514   5.309 -11.423
  448    H    CYS  63           H        CYS  63  -0.472   5.390  -3.522
  449    HA   CYS  63           HA       CYS  63  -1.782   7.780  -3.154
  450   1HB   CYS  63          1HB       CYS  63  -1.093   5.457  -1.571
  451   2HB   CYS  63          2HB       CYS  63  -0.978   6.915  -0.606
  452    H    HIS  64           H        HIS  64   1.569   6.725  -2.278
  453    HA   HIS  64           HA       HIS  64   2.403   8.804  -0.787
  454   1HB   HIS  64          1HB       HIS  64   4.020   7.226  -0.988
  455   2HB   HIS  64          2HB       HIS  64   3.685   6.924  -2.682
  456    HD1  HIS  64           1HD      HIS  64   4.699   8.745  -4.422
  457    HD2  HIS  64           2HD      HIS  64   6.173   8.890  -0.498
  458    HE1  HIS  64           1HE      HIS  64   6.857  10.104  -4.518
  459    H    LYS  65           H        LYS  65   2.506   8.663  -4.419
  460    HA   LYS  65           HA       LYS  65   3.312  11.372  -4.620
  461   1HB   LYS  65          1HB       LYS  65   2.709   9.124  -6.423
  462   2HB   LYS  65          2HB       LYS  65   2.284  10.690  -7.082
  463   1HG   LYS  65          1HG       LYS  65   4.626  11.496  -6.378
  464   2HG   LYS  65          2HG       LYS  65   5.010   9.824  -6.021
  465   1HD   LYS  65          1HD       LYS  65   4.220   9.300  -8.447
  466   2HD   LYS  65          2HD       LYS  65   4.280  11.030  -8.719
  467   1HE   LYS  65          1HE       LYS  65   6.556  11.033  -8.859
  468   2HE   LYS  65          2HE       LYS  65   6.726  10.088  -7.393
  469   1HZ   LYS  65          1HZ       LYS  65   5.717   8.620  -9.632
  470   2HZ   LYS  65          2HZ       LYS  65   7.239   9.176  -9.831
  471   3HZ   LYS  65          3HZ       LYS  65   6.880   8.216  -8.559
  472    H    ALA  66           H        ALA  66   0.183   9.616  -4.693
  473    HA   ALA  66           HA       ALA  66  -1.422  11.646  -5.636
  474   1HB   ALA  66          1HB       ALA  66  -2.577  10.053  -3.440
  475   2HB   ALA  66          2HB       ALA  66  -3.058  10.158  -5.150
  476   3HB   ALA  66          3HB       ALA  66  -1.733   9.074  -4.663
  477    H    CYS  67           H        CYS  67  -0.468  10.887  -2.214
  478    HA   CYS  67           HA       CYS  67  -1.859  12.971  -1.057
  479   1HB   CYS  67          1HB       CYS  67  -0.864  11.072   0.157
  480   2HB   CYS  67          2HB       CYS  67   0.738  11.715  -0.144
  481    H    ARG  68           H        ARG  68   1.583  12.748  -2.211
  482    HA   ARG  68           HA       ARG  68   2.471  15.160  -1.507
  483   1HB   ARG  68          1HB       ARG  68   3.773  13.384  -2.734
  484   2HB   ARG  68          2HB       ARG  68   2.948  13.820  -4.218
  485   1HG   ARG  68          1HG       ARG  68   3.871  16.140  -4.053
  486   2HG   ARG  68          2HG       ARG  68   4.690  15.710  -2.564
  487   1HD   ARG  68          1HD       ARG  68   6.444  14.897  -3.752
  488   2HD   ARG  68          2HD       ARG  68   5.397  13.712  -4.507
  489    HE   ARG  68           HE       ARG  68   6.251  16.286  -5.655
  490   1HH1  ARG  68          2HH2      ARG  68   3.980  13.606  -5.858
  491   2HH1  ARG  68          1HH2      ARG  68   3.587  13.898  -7.520
  492   1HH2  ARG  68          2HH1      ARG  68   5.734  16.671  -7.848
  493   2HH2  ARG  68          1HH1      ARG  68   4.592  15.653  -8.659
  494    H    ALA  69           H        ALA  69   0.218  14.349  -4.164
  495    HA   ALA  69           HA       ALA  69   0.263  17.085  -5.139
  496   1HB   ALA  69          1HB       ALA  69  -0.950  16.241  -6.990
  497   2HB   ALA  69          2HB       ALA  69   0.199  14.944  -6.582
  498   3HB   ALA  69          3HB       ALA  69  -1.505  14.812  -6.085
  499    H    ALA  70           H        ALA  70  -1.558  14.930  -3.022
  500    HA   ALA  70           HA       ALA  70  -3.938  16.528  -3.091
  501   1HB   ALA  70          1HB       ALA  70  -3.572  14.727  -0.800
  502   2HB   ALA  70          2HB       ALA  70  -4.830  14.729  -2.059
  503   3HB   ALA  70          3HB       ALA  70  -3.270  13.927  -2.361
  504    H    ASN  71           H        ASN  71  -1.925  15.596  -0.227
  505    HA   ASN  71           HA       ASN  71  -2.693  17.791   1.230
  506   1HB   ASN  71          1HB       ASN  71  -0.941  15.536   1.538
  507   2HB   ASN  71          2HB       ASN  71   0.007  16.948   1.960
  508   1HD2  ASN  71          1HD2      ASN  71  -2.229  14.694   2.998
  509   2HD2  ASN  71          2HD2      ASN  71  -2.770  15.439   4.465
  510    H    CYS  72           H        CYS  72   0.699  17.139   0.058
  511    HA   CYS  72           HA       CYS  72   1.342  19.896   0.148
  512   1HB   CYS  72          1HB       CYS  72   2.873  17.590  -1.076
  513   2HB   CYS  72          2HB       CYS  72   3.504  19.196  -0.770
  514    H    ALA  73           H        ALA  73   2.379  20.945  -1.930
  515    HA   ALA  73           HA       ALA  73   1.563  20.056  -4.462
  516   1HB   ALA  73          1HB       ALA  73  -0.611  20.946  -3.132
  517   2HB   ALA  73          2HB       ALA  73  -0.009  22.498  -3.762
  518   3HB   ALA  73          3HB       ALA  73  -0.395  21.172  -4.884
  519    H    SER  74           H        SER  74   2.248  22.868  -2.303
  520    HA   SER  74           HA       SER  74   3.635  24.156  -4.465
  521   1HB   SER  74          1HB       SER  74   2.171  25.368  -2.751
  522   2HB   SER  74          2HB       SER  74   3.415  25.048  -1.559
  523    HG   SER  74           HG       SER  74   4.905  26.117  -3.255
  524    H    GLU  75           H        GLU  75   4.288  22.606  -1.270
  525    HA   GLU  75           HA       GLU  75   6.960  23.216  -1.119
  526   1HB   GLU  75          1HB       GLU  75   5.265  20.954  -0.033
  527   2HB   GLU  75          2HB       GLU  75   6.995  20.960   0.248
  528   1HG   GLU  75          1HG       GLU  75   5.796  22.059   2.119
  529   2HG   GLU  75          2HG       GLU  75   6.854  23.194   1.305
  530    H    CYS  76           H        CYS  76   5.226  20.680  -2.944
  531    HA   CYS  76           HA       CYS  76   7.824  19.809  -3.985
  532   1HB   CYS  76          1HB       CYS  76   5.279  18.184  -3.995
  533   2HB   CYS  76          2HB       CYS  76   6.894  17.651  -4.415
  534    HA   PRO  77           HA       PRO  77   5.920  21.797  -7.482
  535   1HB   PRO  77          1HB       PRO  77   8.231  22.324  -8.842
  536   2HB   PRO  77          2HB       PRO  77   7.544  23.420  -7.660
  537   1HG   PRO  77          1HG       PRO  77   9.888  21.638  -7.392
  538   2HG   PRO  77          2HG       PRO  77   9.443  23.022  -6.414
  539   1HD   PRO  77          1HD       PRO  77   9.134  20.257  -5.717
  540   2HD   PRO  77          2HD       PRO  77   8.584  21.639  -4.790
  541    H    LYS  78           H        LYS  78   6.504  21.576 -10.049
  542    HA   LYS  78           HA       LYS  78   5.715  18.948 -10.582
  543   1HB   LYS  78          1HB       LYS  78   6.276  21.401 -12.065
  544   2HB   LYS  78          2HB       LYS  78   6.773  19.973 -12.949
  545   1HG   LYS  78          1HG       LYS  78   4.128  19.705 -11.612
  546   2HG   LYS  78          2HG       LYS  78   4.180  20.952 -12.842
  547   1HD   LYS  78          1HD       LYS  78   3.736  19.200 -14.261
  548   2HD   LYS  78          2HD       LYS  78   5.473  18.972 -14.195
  549   1HE   LYS  78          1HE       LYS  78   5.315  17.180 -12.640
  550   2HE   LYS  78          2HE       LYS  78   3.715  17.653 -12.104
  551   1HZ   LYS  78          1HZ       LYS  78   2.759  16.722 -13.919
  552   2HZ   LYS  78          2HZ       LYS  78   4.058  16.916 -14.890
  553   3HZ   LYS  78          3HZ       LYS  78   4.043  15.723 -13.775
  554    H    HIS  79           H        HIS  79   8.784  20.483 -11.761
  555    HA   HIS  79           HA       HIS  79  10.018  18.016 -12.145
  556   1HB   HIS  79          1HB       HIS  79  10.585  20.768 -12.587
  557   2HB   HIS  79          2HB       HIS  79  11.949  20.100 -11.713
  558    HD1  HIS  79           1HD      HIS  79  12.170  20.986 -14.700
  559    HD2  HIS  79           2HD      HIS  79  11.434  17.058 -13.424
  560    HE1  HIS  79           1HE      HIS  79  12.917  19.463 -16.606
  561    H    GLU  80           H        GLU  80  11.378  20.483  -9.890
  562    HA   GLU  80           HA       GLU  80  11.910  20.347  -7.762
  563   1HB   GLU  80          1HB       GLU  80  10.806  18.935  -6.356
  564   2HB   GLU  80          2HB       GLU  80   9.921  18.457  -7.792
  565   1HG   GLU  80          1HG       GLU  80  11.906  16.751  -8.154
  566   2HG   GLU  80          2HG       GLU  80  12.257  17.048  -6.463
  567    H    HIS  81           H        HIS  81  13.846  19.716  -6.603
  568    HA   HIS  81           HA       HIS  81  15.437  17.654  -7.900
  569   1HB   HIS  81          1HB       HIS  81  16.261  20.543  -7.554
  570   2HB   HIS  81          2HB       HIS  81  17.425  19.250  -7.763
  571    HD1  HIS  81           1HD      HIS  81  17.925  18.518 -10.129
  572    HD2  HIS  81           2HD      HIS  81  14.440  20.837  -9.857
  573    HE1  HIS  81           1HE      HIS  81  17.188  18.984 -12.527
  574    H    LYS  82           H        LYS  82  14.365  16.809  -5.751
  575    HA   LYS  82           HA       LYS  82  14.603  16.165  -3.652
  576   1HB   LYS  82          1HB       LYS  82  17.033  15.837  -4.831
  577   2HB   LYS  82          2HB       LYS  82  17.482  16.848  -3.472
  578   1HG   LYS  82          1HG       LYS  82  17.240  15.120  -2.021
  579   2HG   LYS  82          2HG       LYS  82  15.601  14.825  -2.566
  580   1HD   LYS  82          1HD       LYS  82  17.905  13.914  -4.305
  581   2HD   LYS  82          2HD       LYS  82  17.493  12.973  -2.885
  582   1HE   LYS  82          1HE       LYS  82  15.226  12.596  -3.681
  583   2HE   LYS  82          2HE       LYS  82  15.409  13.778  -4.962
  584   1HZ   LYS  82          1HZ       LYS  82  17.409  11.774  -5.066
  585   2HZ   LYS  82          2HZ       LYS  82  15.909  11.135  -5.166
  586   3HZ   LYS  82          3HZ       LYS  82  16.383  12.276  -6.234
  587    H    SER  83           H        SER  83  13.334  18.451  -3.628
  588    HA   SER  83           HA       SER  83  14.772  20.482  -2.267
  589   1HB   SER  83          1HB       SER  83  12.955  21.785  -2.739
  590   2HB   SER  83          2HB       SER  83  12.535  20.475  -3.824
  591    HG   SER  83           HG       SER  83  10.761  21.096  -2.411
  592    H    ASP  84           H        ASP  84  14.902  20.848  -0.051
  593    HA   ASP  84           HA       ASP  84  14.379  18.787   1.671
  594   1HB   ASP  84          1HB       ASP  84  14.546  21.769   2.317
  595   2HB   ASP  84          2HB       ASP  84  14.770  20.472   3.474
  596    H    THR  85           H        THR  85  12.673  22.001   1.339
  597    HA   THR  85           HA       THR  85  10.672  21.743   3.113
  598    HB   THR  85           HB       THR  85  11.241  23.610   1.381
  599    HG1  THR  85           1HG      THR  85   9.412  23.619   2.893
  600   1HG2  THR  85          1HG2      THR  85   9.153  21.994  -0.177
  601   2HG2  THR  85          2HG2      THR  85   9.718  23.631  -0.589
  602   3HG2  THR  85          3HG2      THR  85  10.837  22.251  -0.694
  603    H    CYS  86           H        CYS  86  10.767  20.188  -0.140
  604    HA   CYS  86           HA       CYS  86   8.198  19.113   0.049
  605   1HB   CYS  86          1HB       CYS  86   9.374  19.328  -2.061
  606   2HB   CYS  86          2HB       CYS  86  10.608  18.201  -1.534
  607    H    ARG  87           H        ARG  87  11.426  17.437   0.335
  608    HA   ARG  87           HA       ARG  87  10.660  15.076   1.201
  609   1HB   ARG  87          1HB       ARG  87  12.957  16.766   2.306
  610   2HB   ARG  87          2HB       ARG  87  12.802  15.048   2.612
  611   1HG   ARG  87          1HG       ARG  87  12.569  14.939  -0.065
  612   2HG   ARG  87          2HG       ARG  87  13.422  16.468   0.022
  613   1HD   ARG  87          1HD       ARG  87  15.181  14.888  -0.128
  614   2HD   ARG  87          2HD       ARG  87  15.109  15.229   1.589
  615    HE   ARG  87           HE       ARG  87  14.381  13.037   1.976
  616   1HH1  ARG  87          2HH2      ARG  87  13.970  13.807  -1.433
  617   2HH1  ARG  87          1HH2      ARG  87  13.541  12.188  -1.878
  618   1HH2  ARG  87          2HH1      ARG  87  13.816  10.902   1.390
  619   2HH2  ARG  87          1HH1      ARG  87  13.453  10.525  -0.261
  620    H    ALA  88           H        ALA  88  10.468  18.124   3.012
  621    HA   ALA  88           HA       ALA  88   9.942  16.803   5.521
  622   1HB   ALA  88          1HB       ALA  88   9.451  19.272   6.159
  623   2HB   ALA  88          2HB       ALA  88  11.121  18.836   5.723
  624   3HB   ALA  88          3HB       ALA  88  10.080  19.664   4.540
  625    H    CYS  89           H        CYS  89   8.104  19.023   3.296
  626    HA   CYS  89           HA       CYS  89   5.702  18.965   4.460
  627   1HB   CYS  89          1HB       CYS  89   6.371  20.147   2.348
  628   2HB   CYS  89          2HB       CYS  89   6.096  18.650   1.479
  629    H    MET  90           H        MET  90   7.295  16.369   2.560
  630    HA   MET  90           HA       MET  90   5.011  14.740   2.426
  631   1HB   MET  90          1HB       MET  90   8.015  14.325   2.074
  632   2HB   MET  90          2HB       MET  90   6.923  12.958   1.972
  633   1HG   MET  90          1HG       MET  90   5.636  14.759   0.321
  634   2HG   MET  90          2HG       MET  90   7.307  15.222   0.064
  635   1HE   MET  90          1HE       MET  90   5.627  11.014  -0.239
  636   2HE   MET  90          2HE       MET  90   4.999  12.415   0.661
  637   3HE   MET  90          3HE       MET  90   4.668  12.255  -1.080
  638    H    LYS  91           H        LYS  91   8.091  14.362   4.339
  639    HA   LYS  91           HA       LYS  91   7.253  12.263   5.892
  640   1HB   LYS  91          1HB       LYS  91   9.507  12.685   6.038
  641   2HB   LYS  91          2HB       LYS  91   9.302  14.421   6.156
  642   1HG   LYS  91          1HG       LYS  91   8.522  14.246   8.469
  643   2HG   LYS  91          2HG       LYS  91   8.452  12.498   8.368
  644   1HD   LYS  91          1HD       LYS  91  10.681  12.276   8.796
  645   2HD   LYS  91          2HD       LYS  91  11.113  13.507   7.627
  646   1HE   LYS  91          1HE       LYS  91  10.222  15.216   9.416
  647   2HE   LYS  91          2HE       LYS  91  10.337  13.879  10.542
  648   1HZ   LYS  91          1HZ       LYS  91  12.666  14.114   8.957
  649   2HZ   LYS  91          2HZ       LYS  91  12.364  15.496   9.774
  650   3HZ   LYS  91          3HZ       LYS  91  12.521  14.087  10.584
  651    H    THR  92           H        THR  92   6.375  15.686   6.032
  652    HA   THR  92           HA       THR  92   5.483  15.817   8.666
  653    HB   THR  92           HB       THR  92   4.386  17.208   6.166
  654    HG1  THR  92           1HG      THR  92   6.141  18.742   6.914
  655   1HG2  THR  92          1HG2      THR  92   3.735  18.978   7.621
  656   2HG2  THR  92          2HG2      THR  92   3.259  17.527   8.535
  657   3HG2  THR  92          3HG2      THR  92   4.764  18.384   8.946
  658    H    ASN  93           H        ASN  93   3.546  15.095   5.681
  659    HA   ASN  93           HA       ASN  93   1.766  13.643   7.476
  660   1HB   ASN  93          1HB       ASN  93   0.034  14.272   5.518
  661   2HB   ASN  93          2HB       ASN  93   0.337  15.384   6.838
  662   1HD2  ASN  93          1HD2      ASN  93   2.087  16.973   6.537
  663   2HD2  ASN  93          2HD2      ASN  93   2.316  17.687   4.976
  664    H    CYS  94           H        CYS  94   2.587  14.202   3.960
  665    HA   CYS  94           HA       CYS  94   1.792  11.609   3.194
  666   1HB   CYS  94          1HB       CYS  94   3.622  13.483   1.689
  667   2HB   CYS  94          2HB       CYS  94   2.683  12.157   1.032
  668    H    LYS  95           H        LYS  95   3.055  10.525   5.042
  669    HA   LYS  95           HA       LYS  95   5.711  10.520   5.410
  670   1HB   LYS  95          1HB       LYS  95   3.695   9.060   6.375
  671   2HB   LYS  95          2HB       LYS  95   4.367   7.853   5.298
  672   1HG   LYS  95          1HG       LYS  95   6.584   9.088   6.640
  673   2HG   LYS  95          2HG       LYS  95   5.377   8.753   7.865
  674   1HD   LYS  95          1HD       LYS  95   5.337   6.406   7.350
  675   2HD   LYS  95          2HD       LYS  95   6.151   6.642   5.816
  676   1HE   LYS  95          1HE       LYS  95   8.222   7.363   7.026
  677   2HE   LYS  95          2HE       LYS  95   7.408   7.128   8.560
  678   1HZ   LYS  95          1HZ       LYS  95   7.296   4.877   6.793
  679   2HZ   LYS  95          2HZ       LYS  95   8.798   5.252   7.313
  680   3HZ   LYS  95          3HZ       LYS  95   7.617   4.931   8.393
  Start of MODEL   16
    1   1H    ILE   1           H        ILE   1 -15.602  22.792   9.977
    2    HA   ILE   1           HA       ILE   1 -15.163  21.757  12.189
    3    HB   ILE   1           HB       ILE   1 -15.473  19.133  11.866
    4   1HG1  ILE   1          1HG1      ILE   1 -17.924  20.207  10.456
    5   2HG1  ILE   1          2HG1      ILE   1 -16.546  19.556   9.592
    6   1HG2  ILE   1          1HG2      ILE   1 -16.682  21.189  13.364
    7   2HG2  ILE   1          2HG2      ILE   1 -18.006  20.155  12.776
    8   3HG2  ILE   1          3HG2      ILE   1 -16.668  19.443  13.708
    9   1HD1  ILE   1          1HD1      ILE   1 -17.104  17.660  11.633
   10   2HD1  ILE   1          2HD1      ILE   1 -18.683  18.131  10.958
   11   3HD1  ILE   1          3HD1      ILE   1 -17.414  17.487   9.889
   12    H    SER   2           H        SER   2 -13.456  22.835  10.634
   13    HA   SER   2           HA       SER   2 -12.093  21.223   8.848
   14   1HB   SER   2          1HB       SER   2 -10.344  22.927   8.937
   15   2HB   SER   2          2HB       SER   2 -11.912  23.709   8.972
   16    HG   SER   2           HG       SER   2 -11.283  23.249  11.538
   17    H    GLU   3           H        GLU   3 -10.374  19.761   9.074
   18    HA   GLU   3           HA       GLU   3  -9.294  19.482  11.756
   19   1HB   GLU   3          1HB       GLU   3 -11.065  17.615  10.463
   20   2HB   GLU   3          2HB       GLU   3  -9.484  16.867  10.560
   21   1HG   GLU   3          1HG       GLU   3  -9.546  16.715  12.852
   22   2HG   GLU   3          2HG       GLU   3 -10.279  18.296  13.041
   23    H    PHE   4           H        PHE   4  -7.142  18.450  11.814
   24    HA   PHE   4           HA       PHE   4  -5.830  18.594   9.190
   25   1HB   PHE   4          1HB       PHE   4  -5.453  20.084  11.577
   26   2HB   PHE   4          2HB       PHE   4  -4.193  18.870  11.665
   27    HD1  PHE   4           1HD      PHE   4  -2.565  18.681   9.726
   28    HD2  PHE   4           2HD      PHE   4  -5.223  21.959  10.173
   29    HE1  PHE   4           1HE      PHE   4  -1.139  20.049   8.178
   30    HE2  PHE   4           2HE      PHE   4  -3.797  23.327   8.625
   31    HZ   PHE   4           HZ       PHE   4  -1.772  22.355   7.646
   32    H    ALA   5           H        ALA   5  -5.127  16.643   8.477
   33    HA   ALA   5           HA       ALA   5  -3.673  14.922  10.214
   34   1HB   ALA   5          1HB       ALA   5  -6.196  14.514  10.714
   35   2HB   ALA   5          2HB       ALA   5  -6.229  13.732   9.115
   36   3HB   ALA   5          3HB       ALA   5  -5.158  13.104  10.391
   37    HA   PRO   6           HA       PRO   6  -2.155  13.800   6.324
   38   1HB   PRO   6          1HB       PRO   6  -1.006  11.370   6.819
   39   2HB   PRO   6          2HB       PRO   6  -0.245  12.893   7.234
   40   1HG   PRO   6          1HG       PRO   6  -1.567  10.937   9.013
   41   2HG   PRO   6          2HG       PRO   6  -0.450  12.221   9.431
   42   1HD   PRO   6          1HD       PRO   6  -3.295  12.234   9.797
   43   2HD   PRO   6          2HD       PRO   6  -2.192  13.560  10.107
   44    H    VAL   7           H        VAL   7  -1.897  11.703   4.762
   45    HA   VAL   7           HA       VAL   7  -4.531  10.428   4.795
   46    HB   VAL   7           HB       VAL   7  -3.244  11.886   2.481
   47   1HG1  VAL   7          1HG1      VAL   7  -5.356  11.153   1.248
   48   2HG1  VAL   7          2HG1      VAL   7  -4.117   9.904   1.522
   49   3HG1  VAL   7          3HG1      VAL   7  -5.573   9.953   2.545
   50   1HG2  VAL   7          1HG2      VAL   7  -4.769  13.530   2.764
   51   2HG2  VAL   7          2HG2      VAL   7  -6.062  12.396   3.224
   52   3HG2  VAL   7          3HG2      VAL   7  -4.855  12.907   4.429
   53    H    ASP   8           H        ASP   8  -4.365   8.252   4.573
   54    HA   ASP   8           HA       ASP   8  -1.864   7.295   3.417
   55   1HB   ASP   8          1HB       ASP   8  -2.228   5.255   4.913
   56   2HB   ASP   8          2HB       ASP   8  -1.799   6.734   5.748
   57    H    CYS   9           H        CYS   9  -2.085   5.242   2.170
   58    HA   CYS   9           HA       CYS   9  -4.612   5.104   0.844
   59   1HB   CYS   9          1HB       CYS   9  -2.047   4.688   0.051
   60   2HB   CYS   9          2HB       CYS   9  -2.571   3.035   0.301
   61    H    LYS  10           H        LYS  10  -5.366   4.580   3.330
   62    HA   LYS  10           HA       LYS  10  -5.182   1.697   3.761
   63   1HB   LYS  10          1HB       LYS  10  -5.022   3.891   5.488
   64   2HB   LYS  10          2HB       LYS  10  -6.615   3.225   5.787
   65   1HG   LYS  10          1HG       LYS  10  -5.098   0.916   5.641
   66   2HG   LYS  10          2HG       LYS  10  -3.934   2.037   6.319
   67   1HD   LYS  10          1HD       LYS  10  -5.796   2.703   8.007
   68   2HD   LYS  10          2HD       LYS  10  -6.664   1.289   7.444
   69   1HE   LYS  10          1HE       LYS  10  -5.455   0.473   9.313
   70   2HE   LYS  10          2HE       LYS  10  -4.480  -0.043   7.951
   71   1HZ   LYS  10          1HZ       LYS  10  -3.989   2.493   9.335
   72   2HZ   LYS  10          2HZ       LYS  10  -3.288   1.094   9.803
   73   3HZ   LYS  10          3HZ       LYS  10  -2.991   1.699   8.315
   74    H    GLY  11           H        GLY  11  -7.849   4.014   4.505
   75   1HA   GLY  11          1HA       GLY  11  -9.843   2.137   3.785
   76   2HA   GLY  11          2HA       GLY  11 -10.066   3.834   4.157
   77    H    GLN  12           H        GLN  12  -7.738   4.023   1.854
   78    HA   GLN  12           HA       GLN  12  -9.740   4.412  -0.196
   79   1HB   GLN  12          1HB       GLN  12  -6.965   5.465   0.316
   80   2HB   GLN  12          2HB       GLN  12  -7.534   5.428  -1.341
   81   1HG   GLN  12          1HG       GLN  12  -9.351   6.572   0.790
   82   2HG   GLN  12          2HG       GLN  12  -8.006   7.542   0.223
   83   1HE2  GLN  12          1HE2      GLN  12  -8.409   8.832  -1.391
   84   2HE2  GLN  12          2HE2      GLN  12  -9.605   8.634  -2.628
   85    H    CYS  13           H        CYS  13  -7.150   2.262   0.762
   86    HA   CYS  13           HA       CYS  13  -7.023   1.155  -1.933
   87   1HB   CYS  13          1HB       CYS  13  -5.262   0.777   0.492
   88   2HB   CYS  13          2HB       CYS  13  -5.120  -0.193  -0.961
   89    H    THR  14           H        THR  14  -9.355   0.418  -1.515
   90    HA   THR  14           HA       THR  14  -9.368  -2.009   0.156
   91    HB   THR  14           HB       THR  14 -11.445   0.125  -0.478
   92    HG1  THR  14           1HG      THR  14 -10.163   0.287   1.466
   93   1HG2  THR  14          1HG2      THR  14 -13.154  -1.380  -0.319
   94   2HG2  THR  14          2HG2      THR  14 -11.972  -2.710  -0.316
   95   3HG2  THR  14          3HG2      THR  14 -12.484  -1.972   1.220
   96    H    THR  15           H        THR  15 -10.248  -0.543  -2.996
   97    HA   THR  15           HA       THR  15 -11.305  -3.017  -3.991
   98    HB   THR  15           HB       THR  15 -10.960  -0.184  -4.846
   99    HG1  THR  15           1HG      THR  15 -12.740  -2.471  -5.318
  100   1HG2  THR  15          1HG2      THR  15 -11.157  -2.428  -6.921
  101   2HG2  THR  15          2HG2      THR  15 -11.219  -0.678  -7.238
  102   3HG2  THR  15          3HG2      THR  15  -9.704  -1.428  -6.682
  103    HA   PRO  16           HA       PRO  16  -7.052  -3.112  -6.022
  104   1HB   PRO  16          1HB       PRO  16  -5.053  -1.522  -5.052
  105   2HB   PRO  16          2HB       PRO  16  -6.027  -1.094  -6.444
  106   1HG   PRO  16          1HG       PRO  16  -6.156  -0.023  -3.692
  107   2HG   PRO  16          2HG       PRO  16  -6.802   0.665  -5.169
  108   1HD   PRO  16          1HD       PRO  16  -8.280  -0.690  -3.117
  109   2HD   PRO  16          2HD       PRO  16  -8.904  -0.105  -4.647
  110    H    CYS  17           H        CYS  17  -7.619  -2.980  -2.706
  111    HA   CYS  17           HA       CYS  17  -5.586  -5.064  -2.365
  112   1HB   CYS  17          1HB       CYS  17  -6.512  -3.028  -0.327
  113   2HB   CYS  17          2HB       CYS  17  -5.439  -4.373   0.006
  114    H    GLU  18           H        GLU  18  -8.566  -4.977  -3.202
  115    HA   GLU  18           HA       GLU  18 -10.018  -5.921  -0.996
  116   1HB   GLU  18          1HB       GLU  18 -10.524  -5.210  -3.721
  117   2HB   GLU  18          2HB       GLU  18 -11.125  -6.843  -3.512
  118   1HG   GLU  18          1HG       GLU  18 -11.971  -5.551  -1.168
  119   2HG   GLU  18          2HG       GLU  18 -12.154  -4.312  -2.393
  120    HA   PRO  19           HA       PRO  19  -9.122 -10.163  -2.908
  121   1HB   PRO  19          1HB       PRO  19  -7.411 -10.397  -5.026
  122   2HB   PRO  19          2HB       PRO  19  -9.151 -10.296  -5.207
  123   1HG   PRO  19          1HG       PRO  19  -7.109  -8.223  -5.730
  124   2HG   PRO  19          2HG       PRO  19  -8.767  -8.297  -6.292
  125   1HD   PRO  19          1HD       PRO  19  -7.746  -6.654  -4.175
  126   2HD   PRO  19          2HD       PRO  19  -9.422  -6.815  -4.661
  127    H    LEU  20           H        LEU  20  -6.521  -7.906  -2.721
  128    HA   LEU  20           HA       LEU  20  -4.556  -9.829  -2.064
  129   1HB   LEU  20          1HB       LEU  20  -3.691  -7.875  -2.887
  130   2HB   LEU  20          2HB       LEU  20  -4.808  -6.860  -1.996
  131    HG   LEU  20           HG       LEU  20  -2.291  -6.906  -1.348
  132   1HD1  LEU  20          1HD1      LEU  20  -3.780  -7.229   1.155
  133   2HD1  LEU  20          2HD1      LEU  20  -2.930  -5.812   0.492
  134   3HD1  LEU  20          3HD1      LEU  20  -4.593  -6.176  -0.028
  135   1HD2  LEU  20          1HD2      LEU  20  -3.040  -9.125   0.508
  136   2HD2  LEU  20          2HD2      LEU  20  -2.529  -9.532  -1.148
  137   3HD2  LEU  20          3HD2      LEU  20  -1.442  -8.609  -0.083
  138    H    THR  21           H        THR  21  -6.412  -7.447  -0.037
  139    HA   THR  21           HA       THR  21  -5.495  -8.326   2.413
  140    HB   THR  21           HB       THR  21  -8.122  -7.075   1.474
  141    HG1  THR  21           1HG      THR  21  -6.069  -5.889   1.286
  142   1HG2  THR  21          1HG2      THR  21  -7.627  -6.318   4.136
  143   2HG2  THR  21          2HG2      THR  21  -8.913  -7.426   3.600
  144   3HG2  THR  21          3HG2      THR  21  -7.349  -8.076   4.146
  145    H    ALA  22           H        ALA  22  -8.413  -9.456   0.587
  146    HA   ALA  22           HA       ALA  22  -9.339 -11.249   2.429
  147   1HB   ALA  22          1HB       ALA  22 -10.805 -11.301   0.720
  148   2HB   ALA  22          2HB       ALA  22  -9.577 -10.738  -0.439
  149   3HB   ALA  22          3HB       ALA  22  -9.716 -12.472  -0.063
  150    H    CYS  23           H        CYS  23  -6.642 -11.587   0.070
  151    HA   CYS  23           HA       CYS  23  -6.240 -14.319   0.520
  152   1HB   CYS  23          1HB       CYS  23  -5.346 -12.659  -1.326
  153   2HB   CYS  23          2HB       CYS  23  -3.986 -12.500  -0.233
  154    H    LYS  24           H        LYS  24  -4.667 -11.314   1.835
  155    HA   LYS  24           HA       LYS  24  -2.897 -12.597   3.538
  156   1HB   LYS  24          1HB       LYS  24  -3.830  -9.908   3.016
  157   2HB   LYS  24          2HB       LYS  24  -3.643 -10.156   4.740
  158   1HG   LYS  24          1HG       LYS  24  -1.338 -10.687   4.555
  159   2HG   LYS  24          2HG       LYS  24  -1.469 -11.117   2.861
  160   1HD   LYS  24          1HD       LYS  24  -0.431  -9.005   2.758
  161   2HD   LYS  24          2HD       LYS  24  -2.114  -8.602   2.483
  162   1HE   LYS  24          1HE       LYS  24  -1.527  -8.659   5.354
  163   2HE   LYS  24          2HE       LYS  24  -0.425  -7.580   4.522
  164   1HZ   LYS  24          1HZ       LYS  24  -3.102  -7.310   3.620
  165   2HZ   LYS  24          2HZ       LYS  24  -2.957  -7.002   5.217
  166   3HZ   LYS  24          3HZ       LYS  24  -2.061  -6.164   4.139
  167    H    GLU  25           H        GLU  25  -6.298 -11.493   4.060
  168    HA   GLU  25           HA       GLU  25  -6.417 -12.086   6.732
  169   1HB   GLU  25          1HB       GLU  25  -8.231 -11.353   4.630
  170   2HB   GLU  25          2HB       GLU  25  -8.952 -12.699   5.490
  171   1HG   GLU  25          1HG       GLU  25  -7.715 -10.563   7.193
  172   2HG   GLU  25          2HG       GLU  25  -9.162 -10.106   6.317
  173    H    LYS  26           H        LYS  26  -7.818 -14.131   4.061
  174    HA   LYS  26           HA       LYS  26  -8.426 -16.339   5.440
  175   1HB   LYS  26          1HB       LYS  26  -8.492 -15.744   2.874
  176   2HB   LYS  26          2HB       LYS  26  -7.002 -16.663   2.816
  177   1HG   LYS  26          1HG       LYS  26  -9.044 -18.042   4.421
  178   2HG   LYS  26          2HG       LYS  26  -9.627 -17.706   2.803
  179   1HD   LYS  26          1HD       LYS  26  -7.239 -18.632   2.063
  180   2HD   LYS  26          2HD       LYS  26  -7.248 -19.376   3.650
  181   1HE   LYS  26          1HE       LYS  26  -8.812 -20.931   3.041
  182   2HE   LYS  26          2HE       LYS  26  -9.816 -19.741   2.237
  183   1HZ   LYS  26          1HZ       LYS  26  -9.016 -20.438   0.327
  184   2HZ   LYS  26          2HZ       LYS  26  -7.484 -20.074   0.761
  185   3HZ   LYS  26          3HZ       LYS  26  -8.092 -21.557   1.076
  186    H    CYS  27           H        CYS  27  -5.139 -15.263   4.494
  187    HA   CYS  27           HA       CYS  27  -3.871 -17.646   5.276
  188   1HB   CYS  27          1HB       CYS  27  -2.815 -14.830   4.959
  189   2HB   CYS  27          2HB       CYS  27  -1.807 -16.227   5.280
  190    H    ALA  28           H        ALA  28  -4.036 -14.348   6.829
  191    HA   ALA  28           HA       ALA  28  -2.845 -14.861   9.183
  192   1HB   ALA  28          1HB       ALA  28  -3.502 -12.706   9.260
  193   2HB   ALA  28          2HB       ALA  28  -4.861 -13.004   8.150
  194   3HB   ALA  28          3HB       ALA  28  -5.054 -13.305   9.893
  195    H    GLU  29           H        GLU  29  -6.339 -15.482   8.411
  196    HA   GLU  29           HA       GLU  29  -7.059 -16.460  10.841
  197   1HB   GLU  29          1HB       GLU  29  -8.005 -16.926   8.020
  198   2HB   GLU  29          2HB       GLU  29  -8.659 -17.950   9.283
  199   1HG   GLU  29          1HG       GLU  29  -8.665 -14.895   9.366
  200   2HG   GLU  29          2HG       GLU  29 -10.030 -15.873   8.863
  201    H    SER  30           H        SER  30  -5.788 -18.318   7.987
  202    HA   SER  30           HA       SER  30  -5.839 -20.772   9.250
  203   1HB   SER  30          1HB       SER  30  -5.222 -19.843   6.726
  204   2HB   SER  30          2HB       SER  30  -3.638 -20.328   7.297
  205    HG   SER  30           HG       SER  30  -5.862 -22.105   7.656
  206    H    CYS  31           H        CYS  31  -3.552 -18.058   9.375
  207    HA   CYS  31           HA       CYS  31  -1.624 -19.707  10.796
  208   1HB   CYS  31          1HB       CYS  31  -1.459 -16.864   9.775
  209   2HB   CYS  31          2HB       CYS  31  -0.189 -17.670  10.674
  210    H    GLU  32           H        GLU  32  -4.035 -19.491  12.162
  211    HA   GLU  32           HA       GLU  32  -4.150 -17.201  13.776
  212   1HB   GLU  32          1HB       GLU  32  -5.656 -19.653  13.390
  213   2HB   GLU  32          2HB       GLU  32  -5.438 -19.375  15.107
  214   1HG   GLU  32          1HG       GLU  32  -6.106 -16.856  14.426
  215   2HG   GLU  32          2HG       GLU  32  -6.866 -17.668  13.071
  216    H    THR  33           H        THR  33  -3.525 -20.638  14.805
  217    HA   THR  33           HA       THR  33  -1.885 -19.579  16.984
  218    HB   THR  33           HB       THR  33  -2.115 -22.129  17.632
  219    HG1  THR  33           1HG      THR  33  -2.898 -22.720  15.478
  220   1HG2  THR  33          1HG2      THR  33  -3.656 -19.967  18.320
  221   2HG2  THR  33          2HG2      THR  33  -4.866 -20.948  17.458
  222   3HG2  THR  33          3HG2      THR  33  -4.014 -21.623  18.868
  223    H    SER  34           H        SER  34  -0.547 -19.047  14.745
  224    HA   SER  34           HA       SER  34   1.184 -21.330  14.299
  225   1HB   SER  34          1HB       SER  34   2.145 -19.617  12.519
  226   2HB   SER  34          2HB       SER  34   0.657 -20.485  12.199
  227    HG   SER  34           HG       SER  34   0.639 -17.899  13.476
  228    H    ALA  35           H        ALA  35   3.202 -21.423  15.239
  229    HA   ALA  35           HA       ALA  35   3.987 -19.650  17.190
  230   1HB   ALA  35          1HB       ALA  35   6.240 -20.766  16.881
  231   2HB   ALA  35          2HB       ALA  35   4.871 -21.887  17.075
  232   3HB   ALA  35          3HB       ALA  35   5.559 -21.594  15.460
  233    H    ASP  36           H        ASP  36   5.161 -19.895  13.758
  234    HA   ASP  36           HA       ASP  36   6.292 -17.246  14.126
  235   1HB   ASP  36          1HB       ASP  36   6.681 -19.136  11.765
  236   2HB   ASP  36          2HB       ASP  36   7.646 -17.726  12.154
  237    H    LYS  37           H        LYS  37   3.714 -16.790  14.007
  238    HA   LYS  37           HA       LYS  37   2.189 -17.092  11.814
  239   1HB   LYS  37          1HB       LYS  37   1.660 -15.953  14.034
  240   2HB   LYS  37          2HB       LYS  37   2.334 -14.489  13.349
  241   1HG   LYS  37          1HG       LYS  37   0.714 -14.624  11.450
  242   2HG   LYS  37          2HG       LYS  37   0.046 -16.099  12.120
  243   1HD   LYS  37          1HD       LYS  37   0.139 -13.502  13.712
  244   2HD   LYS  37          2HD       LYS  37  -1.202 -13.893  12.655
  245   1HE   LYS  37          1HE       LYS  37  -2.116 -15.165  14.294
  246   2HE   LYS  37          2HE       LYS  37  -0.727 -16.232  14.236
  247   1HZ   LYS  37          1HZ       LYS  37   0.154 -14.068  15.598
  248   2HZ   LYS  37          2HZ       LYS  37  -1.372 -14.253  16.150
  249   3HZ   LYS  37          3HZ       LYS  37  -0.310 -15.488  16.258
  250    H    LYS  38           H        LYS  38   4.634 -14.464  12.331
  251    HA   LYS  38           HA       LYS  38   4.293 -13.049  10.059
  252   1HB   LYS  38          1HB       LYS  38   6.141 -13.125  12.082
  253   2HB   LYS  38          2HB       LYS  38   7.121 -13.595  10.708
  254   1HG   LYS  38          1HG       LYS  38   5.933 -11.561   9.493
  255   2HG   LYS  38          2HG       LYS  38   5.552 -11.033  11.119
  256   1HD   LYS  38          1HD       LYS  38   7.736 -10.490  11.607
  257   2HD   LYS  38          2HD       LYS  38   8.384 -11.871  10.744
  258   1HE   LYS  38          1HE       LYS  38   9.094 -10.115   9.365
  259   2HE   LYS  38          2HE       LYS  38   7.596 -10.568   8.577
  260   1HZ   LYS  38          1HZ       LYS  38   7.291  -8.656  10.684
  261   2HZ   LYS  38          2HZ       LYS  38   8.166  -8.116   9.415
  262   3HZ   LYS  38          3HZ       LYS  38   6.645  -8.666   9.183
  263    H    THR  39           H        THR  39   6.660 -15.801  10.327
  264    HA   THR  39           HA       THR  39   7.122 -15.968   7.584
  265    HB   THR  39           HB       THR  39   7.273 -18.171   9.707
  266    HG1  THR  39           1HG      THR  39   9.404 -17.148  10.008
  267   1HG2  THR  39          1HG2      THR  39   7.772 -18.747   7.226
  268   2HG2  THR  39          2HG2      THR  39   9.125 -17.596   7.347
  269   3HG2  THR  39          3HG2      THR  39   9.094 -19.046   8.380
  270    H    CYS  40           H        CYS  40   4.823 -17.851   9.656
  271    HA   CYS  40           HA       CYS  40   3.842 -19.556   7.843
  272   1HB   CYS  40          1HB       CYS  40   3.125 -19.460  10.171
  273   2HB   CYS  40          2HB       CYS  40   2.251 -17.971   9.870
  274    H    ARG  41           H        ARG  41   2.362 -16.285   8.496
  275    HA   ARG  41           HA       ARG  41   0.706 -16.298   6.342
  276   1HB   ARG  41          1HB       ARG  41   1.882 -14.239   8.150
  277   2HB   ARG  41          2HB       ARG  41   1.339 -13.605   6.609
  278   1HG   ARG  41          1HG       ARG  41  -0.908 -14.586   6.955
  279   2HG   ARG  41          2HG       ARG  41  -0.379 -15.339   8.446
  280   1HD   ARG  41          1HD       ARG  41  -1.599 -13.271   8.972
  281   2HD   ARG  41          2HD       ARG  41   0.082 -13.078   9.425
  282    HE   ARG  41           HE       ARG  41  -0.291 -12.183   6.713
  283   1HH1  ARG  41          2HH2      ARG  41  -0.971 -11.237  10.033
  284   2HH1  ARG  41          1HH2      ARG  41  -0.996  -9.542   9.680
  285   1HH2  ARG  41          2HH1      ARG  41  -0.324  -9.946   6.246
  286   2HH2  ARG  41          1HH1      ARG  41  -0.626  -8.802   7.512
  287    H    ARG  42           H        ARG  42   4.084 -15.007   6.636
  288    HA   ARG  42           HA       ARG  42   4.362 -13.799   4.276
  289   1HB   ARG  42          1HB       ARG  42   6.086 -14.831   6.283
  290   2HB   ARG  42          2HB       ARG  42   6.698 -15.509   4.787
  291   1HG   ARG  42          1HG       ARG  42   7.833 -13.463   4.840
  292   2HG   ARG  42          2HG       ARG  42   6.443 -13.043   3.859
  293   1HD   ARG  42          1HD       ARG  42   5.345 -12.463   6.238
  294   2HD   ARG  42          2HD       ARG  42   7.019 -12.327   6.739
  295    HE   ARG  42           HE       ARG  42   5.582 -10.510   4.954
  296   1HH1  ARG  42          2HH2      ARG  42   8.762 -11.705   5.872
  297   2HH1  ARG  42          1HH2      ARG  42   9.596 -10.298   5.301
  298   1HH2  ARG  42          2HH1      ARG  42   6.682  -8.654   4.201
  299   2HH2  ARG  42          1HH1      ARG  42   8.405  -8.552   4.344
  300    H    ASN  43           H        ASN  43   4.805 -17.345   4.935
  301    HA   ASN  43           HA       ASN  43   5.501 -18.032   2.361
  302   1HB   ASN  43          1HB       ASN  43   5.354 -19.388   4.700
  303   2HB   ASN  43          2HB       ASN  43   3.825 -19.920   4.028
  304   1HD2  ASN  43          1HD2      ASN  43   6.637 -21.082   4.518
  305   2HD2  ASN  43          2HD2      ASN  43   7.013 -21.941   3.062
  306    H    CYS  44           H        CYS  44   2.313 -17.892   4.087
  307    HA   CYS  44           HA       CYS  44   0.767 -18.956   2.046
  308   1HB   CYS  44          1HB       CYS  44   0.098 -18.593   4.436
  309   2HB   CYS  44          2HB       CYS  44  -0.091 -16.888   4.078
  310    H    LYS  45           H        LYS  45   2.176 -15.735   2.632
  311    HA   LYS  45           HA       LYS  45   0.563 -14.313   0.823
  312   1HB   LYS  45          1HB       LYS  45   2.630 -13.762   2.652
  313   2HB   LYS  45          2HB       LYS  45   3.243 -13.237   1.097
  314   1HG   LYS  45          1HG       LYS  45   1.786 -11.486   0.991
  315   2HG   LYS  45          2HG       LYS  45   0.420 -12.485   1.446
  316   1HD   LYS  45          1HD       LYS  45   0.448 -11.358   3.424
  317   2HD   LYS  45          2HD       LYS  45   1.835 -12.348   3.834
  318   1HE   LYS  45          1HE       LYS  45   3.278 -10.550   2.631
  319   2HE   LYS  45          2HE       LYS  45   1.845  -9.542   2.645
  320   1HZ   LYS  45          1HZ       LYS  45   1.859 -10.236   5.142
  321   2HZ   LYS  45          2HZ       LYS  45   3.456 -10.443   4.873
  322   3HZ   LYS  45          3HZ       LYS  45   2.767  -8.986   4.612
  323    H    LYS  46           H        LYS  46   3.257 -16.548   0.450
  324    HA   LYS  46           HA       LYS  46   3.738 -15.662  -2.268
  325   1HB   LYS  46          1HB       LYS  46   5.627 -16.250  -0.792
  326   2HB   LYS  46          2HB       LYS  46   5.009 -17.881  -0.637
  327   1HG   LYS  46          1HG       LYS  46   6.533 -18.170  -2.384
  328   2HG   LYS  46          2HG       LYS  46   5.062 -17.872  -3.289
  329   1HD   LYS  46          1HD       LYS  46   6.326 -16.273  -4.342
  330   2HD   LYS  46          2HD       LYS  46   5.905 -15.294  -2.951
  331   1HE   LYS  46          1HE       LYS  46   8.203 -15.053  -2.834
  332   2HE   LYS  46          2HE       LYS  46   8.063 -16.523  -1.890
  333   1HZ   LYS  46          1HZ       LYS  46   8.983 -16.194  -4.616
  334   2HZ   LYS  46          2HZ       LYS  46   9.575 -17.144  -3.427
  335   3HZ   LYS  46          3HZ       LYS  46   8.232 -17.594  -4.239
  336    H    ALA  47           H        ALA  47   1.795 -17.942  -0.472
  337    HA   ALA  47           HA       ALA  47   1.531 -20.051  -2.165
  338   1HB   ALA  47          1HB       ALA  47  -0.543 -20.444  -1.080
  339   2HB   ALA  47          2HB       ALA  47   0.431 -19.549   0.111
  340   3HB   ALA  47          3HB       ALA  47  -0.831 -18.706  -0.818
  341    H    ASP  48           H        ASP  48  -0.534 -17.051  -2.233
  342    HA   ASP  48           HA       ASP  48  -0.381 -16.992  -5.052
  343   1HB   ASP  48          1HB       ASP  48  -2.831 -18.083  -3.665
  344   2HB   ASP  48          2HB       ASP  48  -3.074 -17.061  -5.067
  345    H    CYS  49           H        CYS  49   0.293 -15.172  -2.969
  346    HA   CYS  49           HA       CYS  49  -1.703 -13.097  -3.437
  347   1HB   CYS  49          1HB       CYS  49  -0.385 -13.176  -0.764
  348   2HB   CYS  49          2HB       CYS  49  -1.914 -12.468  -1.244
  349    H    GLU  50           H        GLU  50   0.944 -13.910  -4.638
  350    HA   GLU  50           HA       GLU  50   2.838 -12.082  -3.572
  351   1HB   GLU  50          1HB       GLU  50   2.766 -14.214  -5.603
  352   2HB   GLU  50          2HB       GLU  50   3.738 -12.848  -6.114
  353   1HG   GLU  50          1HG       GLU  50   4.245 -13.506  -3.297
  354   2HG   GLU  50          2HG       GLU  50   4.508 -14.900  -4.326
  355    HA   PRO  51           HA       PRO  51   1.583  -9.769  -7.526
  356   1HB   PRO  51          1HB       PRO  51  -0.653 -10.542  -8.894
  357   2HB   PRO  51          2HB       PRO  51   0.965 -11.049  -9.338
  358   1HG   PRO  51          1HG       PRO  51  -1.161 -12.602  -7.994
  359   2HG   PRO  51          2HG       PRO  51   0.272 -13.186  -8.817
  360   1HD   PRO  51          1HD       PRO  51  -0.127 -13.010  -5.982
  361   2HD   PRO  51          2HD       PRO  51   1.345 -13.483  -6.805
  362    H    GLN  52           H        GLN  52  -0.941 -10.959  -5.477
  363    HA   GLN  52           HA       GLN  52  -2.550  -8.680  -5.775
  364   1HB   GLN  52          1HB       GLN  52  -2.473 -10.600  -3.410
  365   2HB   GLN  52          2HB       GLN  52  -3.816  -9.582  -3.892
  366   1HG   GLN  52          1HG       GLN  52  -3.914 -10.825  -6.095
  367   2HG   GLN  52          2HG       GLN  52  -2.643 -11.886  -5.521
  368   1HE2  GLN  52          1HE2      GLN  52  -4.683 -13.234  -6.185
  369   2HE2  GLN  52          2HE2      GLN  52  -5.696 -13.740  -4.874
  370    H    ASP  53           H        ASP  53  -0.219  -9.760  -3.206
  371    HA   ASP  53           HA       ASP  53  -0.514  -7.630  -1.545
  372   1HB   ASP  53          1HB       ASP  53   0.910  -9.784  -1.296
  373   2HB   ASP  53          2HB       ASP  53   2.167  -8.936  -2.174
  374    H    LYS  54           H        LYS  54   1.086  -7.921  -4.693
  375    HA   LYS  54           HA       LYS  54   2.721  -5.603  -4.404
  376   1HB   LYS  54          1HB       LYS  54   1.996  -7.454  -6.666
  377   2HB   LYS  54          2HB       LYS  54   2.841  -5.953  -6.986
  378   1HG   LYS  54          1HG       LYS  54   4.515  -6.680  -5.138
  379   2HG   LYS  54          2HG       LYS  54   3.761  -8.260  -5.222
  380   1HD   LYS  54          1HD       LYS  54   4.944  -8.782  -7.084
  381   2HD   LYS  54          2HD       LYS  54   4.322  -7.374  -7.922
  382   1HE   LYS  54          1HE       LYS  54   6.192  -6.088  -7.454
  383   2HE   LYS  54          2HE       LYS  54   6.434  -6.814  -5.877
  384   1HZ   LYS  54          1HZ       LYS  54   7.801  -8.298  -6.745
  385   2HZ   LYS  54          2HZ       LYS  54   6.809  -8.671  -7.987
  386   3HZ   LYS  54          3HZ       LYS  54   7.825  -7.398  -8.107
  387    H    VAL  55           H        VAL  55  -0.149  -6.315  -6.525
  388    HA   VAL  55           HA       VAL  55  -0.645  -3.858  -7.462
  389    HB   VAL  55           HB       VAL  55  -2.619  -5.901  -6.429
  390   1HG1  VAL  55          1HG1      VAL  55  -4.345  -4.669  -7.157
  391   2HG1  VAL  55          2HG1      VAL  55  -3.215  -3.294  -7.152
  392   3HG1  VAL  55          3HG1      VAL  55  -3.497  -4.208  -8.653
  393   1HG2  VAL  55          1HG2      VAL  55  -1.767  -7.118  -8.111
  394   2HG2  VAL  55          2HG2      VAL  55  -2.610  -5.985  -9.195
  395   3HG2  VAL  55          3HG2      VAL  55  -0.895  -5.725  -8.794
  396    H    CYS  56           H        CYS  56  -1.087  -4.994  -4.118
  397    HA   CYS  56           HA       CYS  56  -2.682  -2.841  -3.283
  398   1HB   CYS  56          1HB       CYS  56  -2.339  -5.079  -2.135
  399   2HB   CYS  56          2HB       CYS  56  -0.805  -4.459  -1.558
  400    H    ASP  57           H        ASP  57   0.859  -3.591  -2.833
  401    HA   ASP  57           HA       ASP  57   1.676  -1.400  -1.601
  402   1HB   ASP  57          1HB       ASP  57   3.088  -3.330  -2.463
  403   2HB   ASP  57          2HB       ASP  57   3.075  -2.581  -4.047
  404    H    ALA  58           H        ALA  58   1.419  -1.779  -5.222
  405    HA   ALA  58           HA       ALA  58   2.195   0.638  -6.083
  406   1HB   ALA  58          1HB       ALA  58   0.283  -1.436  -6.964
  407   2HB   ALA  58          2HB       ALA  58  -0.022   0.176  -7.655
  408   3HB   ALA  58          3HB       ALA  58   1.564  -0.601  -7.874
  409    H    CYS  59           H        CYS  59  -1.180  -0.165  -4.992
  410    HA   CYS  59           HA       CYS  59  -2.294   2.281  -5.297
  411   1HB   CYS  59          1HB       CYS  59  -3.492   0.248  -4.617
  412   2HB   CYS  59          2HB       CYS  59  -2.771   0.343  -3.023
  413    H    ARG  60           H        ARG  60  -0.497   0.994  -2.408
  414    HA   ARG  60           HA       ARG  60  -0.696   3.313  -0.935
  415   1HB   ARG  60          1HB       ARG  60   1.414   1.100  -0.919
  416   2HB   ARG  60          2HB       ARG  60   1.339   2.353   0.303
  417   1HG   ARG  60          1HG       ARG  60  -1.227   1.578   0.465
  418   2HG   ARG  60          2HG       ARG  60  -0.595   0.094  -0.221
  419   1HD   ARG  60          1HD       ARG  60   1.191   0.136   1.646
  420   2HD   ARG  60          2HD       ARG  60   0.268   1.431   2.383
  421    HE   ARG  60           HE       ARG  60  -1.653  -0.504   1.961
  422   1HH1  ARG  60          2HH2      ARG  60   1.504  -0.545   3.515
  423   2HH1  ARG  60          1HH2      ARG  60   1.082  -1.804   4.627
  424   1HH2  ARG  60          2HH1      ARG  60  -2.210  -2.166   3.428
  425   2HH2  ARG  60          1HH1      ARG  60  -1.045  -2.732   4.577
  426    H    MET  61           H        MET  61   1.631   2.223  -3.435
  427    HA   MET  61           HA       MET  61   3.530   4.217  -2.931
  428   1HB   MET  61          1HB       MET  61   4.279   2.323  -4.183
  429   2HB   MET  61          2HB       MET  61   2.862   2.324  -5.215
  430   1HG   MET  61          1HG       MET  61   3.784   3.819  -6.694
  431   2HG   MET  61          2HG       MET  61   4.440   4.826  -5.419
  432   1HE   MET  61          1HE       MET  61   4.545   1.385  -6.907
  433   2HE   MET  61          2HE       MET  61   6.266   0.947  -7.027
  434   3HE   MET  61          3HE       MET  61   5.428   0.841  -5.461
  435    H    LYS  62           H        LYS  62   0.694   3.968  -5.143
  436    HA   LYS  62           HA       LYS  62   1.252   6.425  -6.450
  437   1HB   LYS  62          1HB       LYS  62  -0.854   4.346  -6.492
  438   2HB   LYS  62          2HB       LYS  62  -1.396   5.959  -6.908
  439   1HG   LYS  62          1HG       LYS  62  -0.677   4.939  -8.968
  440   2HG   LYS  62          2HG       LYS  62   0.555   6.112  -8.546
  441   1HD   LYS  62          1HD       LYS  62   1.807   4.182  -9.124
  442   2HD   LYS  62          2HD       LYS  62   1.793   4.149  -7.372
  443   1HE   LYS  62          1HE       LYS  62   1.098   1.977  -7.699
  444   2HE   LYS  62          2HE       LYS  62  -0.481   2.726  -7.827
  445   1HZ   LYS  62          1HZ       LYS  62   1.007   1.418  -9.815
  446   2HZ   LYS  62          2HZ       LYS  62  -0.552   1.903  -9.853
  447   3HZ   LYS  62          3HZ       LYS  62   0.633   2.929 -10.311
  448    H    CYS  63           H        CYS  63  -0.813   5.388  -3.686
  449    HA   CYS  63           HA       CYS  63  -2.211   7.705  -3.318
  450   1HB   CYS  63          1HB       CYS  63  -1.532   5.360  -1.752
  451   2HB   CYS  63          2HB       CYS  63  -1.605   6.790  -0.742
  452    H    HIS  64           H        HIS  64   0.925   6.716  -1.739
  453    HA   HIS  64           HA       HIS  64   1.492   8.904  -0.328
  454   1HB   HIS  64          1HB       HIS  64   2.843   6.720  -0.832
  455   2HB   HIS  64          2HB       HIS  64   3.644   7.696  -2.047
  456    HD1  HIS  64           1HD      HIS  64   5.872   8.309  -1.097
  457    HD2  HIS  64           2HD      HIS  64   2.793   8.694   1.726
  458    HE1  HIS  64           1HE      HIS  64   6.946   9.279   1.004
  459    H    LYS  65           H        LYS  65   2.686   8.524  -3.746
  460    HA   LYS  65           HA       LYS  65   3.498  11.132  -4.050
  461   1HB   LYS  65          1HB       LYS  65   3.099   8.798  -5.705
  462   2HB   LYS  65          2HB       LYS  65   2.575  10.231  -6.567
  463   1HG   LYS  65          1HG       LYS  65   4.751  10.700  -6.996
  464   2HG   LYS  65          2HG       LYS  65   4.976  11.016  -5.287
  465   1HD   LYS  65          1HD       LYS  65   4.981   8.127  -6.049
  466   2HD   LYS  65          2HD       LYS  65   6.319   9.064  -6.684
  467   1HE   LYS  65          1HE       LYS  65   6.076   9.908  -3.989
  468   2HE   LYS  65          2HE       LYS  65   5.824   8.175  -3.932
  469   1HZ   LYS  65          1HZ       LYS  65   7.950   7.853  -4.348
  470   2HZ   LYS  65          2HZ       LYS  65   7.952   8.828  -5.658
  471   3HZ   LYS  65          3HZ       LYS  65   8.209   9.456  -4.172
  472    H    ALA  66           H        ALA  66   0.245   9.683  -4.264
  473    HA   ALA  66           HA       ALA  66  -0.998  11.858  -5.528
  474   1HB   ALA  66          1HB       ALA  66  -1.695   9.317  -4.326
  475   2HB   ALA  66          2HB       ALA  66  -2.848  10.569  -3.808
  476   3HB   ALA  66          3HB       ALA  66  -2.583  10.266  -5.542
  477    H    CYS  67           H        CYS  67  -0.658  10.938  -2.031
  478    HA   CYS  67           HA       CYS  67  -2.049  13.046  -0.979
  479   1HB   CYS  67          1HB       CYS  67  -1.530  11.478   0.588
  480   2HB   CYS  67          2HB       CYS  67   0.101  11.239  -0.008
  481    H    ARG  68           H        ARG  68   1.383  12.781  -2.067
  482    HA   ARG  68           HA       ARG  68   2.268  15.176  -1.106
  483   1HB   ARG  68          1HB       ARG  68   3.873  13.637  -2.016
  484   2HB   ARG  68          2HB       ARG  68   3.024  13.519  -3.545
  485   1HG   ARG  68          1HG       ARG  68   3.856  16.287  -2.870
  486   2HG   ARG  68          2HG       ARG  68   5.202  15.178  -3.037
  487   1HD   ARG  68          1HD       ARG  68   3.061  15.033  -5.146
  488   2HD   ARG  68          2HD       ARG  68   4.089  16.452  -5.161
  489    HE   ARG  68           HE       ARG  68   5.818  14.235  -4.881
  490   1HH1  ARG  68          2HH2      ARG  68   3.522  15.451  -7.253
  491   2HH1  ARG  68          1HH2      ARG  68   4.346  14.743  -8.603
  492   1HH2  ARG  68          2HH1      ARG  68   6.905  13.301  -6.661
  493   2HH2  ARG  68          1HH1      ARG  68   6.283  13.512  -8.263
  494    H    ALA  69           H        ALA  69   0.712  14.366  -4.280
  495    HA   ALA  69           HA       ALA  69   0.769  17.121  -5.110
  496   1HB   ALA  69          1HB       ALA  69   1.020  15.058  -6.603
  497   2HB   ALA  69          2HB       ALA  69  -0.725  14.795  -6.369
  498   3HB   ALA  69          3HB       ALA  69  -0.147  16.285  -7.153
  499    H    ALA  70           H        ALA  70  -0.907  15.611  -2.734
  500    HA   ALA  70           HA       ALA  70  -3.472  16.842  -3.430
  501   1HB   ALA  70          1HB       ALA  70  -3.366  14.412  -2.774
  502   2HB   ALA  70          2HB       ALA  70  -2.783  14.922  -1.172
  503   3HB   ALA  70          3HB       ALA  70  -4.407  15.401  -1.721
  504    H    ASN  71           H        ASN  71  -1.199  16.470  -0.612
  505    HA   ASN  71           HA       ASN  71  -2.306  18.920   0.441
  506   1HB   ASN  71          1HB       ASN  71  -0.636  16.646   1.533
  507   2HB   ASN  71          2HB       ASN  71  -0.495  18.204   2.323
  508   1HD2  ASN  71          1HD2      ASN  71  -2.384  15.406   1.828
  509   2HD2  ASN  71          2HD2      ASN  71  -3.748  15.806   2.818
  510    H    CYS  72           H        CYS  72   0.944  17.352  -0.128
  511    HA   CYS  72           HA       CYS  72   2.325  19.810   0.108
  512   1HB   CYS  72          1HB       CYS  72   3.340  17.258  -1.150
  513   2HB   CYS  72          2HB       CYS  72   4.288  18.572  -0.482
  514    H    ALA  73           H        ALA  73   0.528  20.709  -1.542
  515    HA   ALA  73           HA       ALA  73   1.178  20.115  -4.298
  516   1HB   ALA  73          1HB       ALA  73  -0.797  22.058  -3.031
  517   2HB   ALA  73          2HB       ALA  73  -0.703  21.647  -4.760
  518   3HB   ALA  73          3HB       ALA  73  -1.164  20.403  -3.574
  519    H    SER  74           H        SER  74   1.425  22.830  -1.925
  520    HA   SER  74           HA       SER  74   2.562  24.581  -3.795
  521   1HB   SER  74          1HB       SER  74   2.269  24.517  -0.791
  522   2HB   SER  74          2HB       SER  74   3.351  25.700  -1.500
  523    HG   SER  74           HG       SER  74   1.564  26.471  -2.813
  524    H    GLU  75           H        GLU  75   3.975  22.732  -0.989
  525    HA   GLU  75           HA       GLU  75   6.522  23.379  -1.150
  526   1HB   GLU  75          1HB       GLU  75   5.188  20.711  -0.667
  527   2HB   GLU  75          2HB       GLU  75   6.938  20.795  -0.677
  528   1HG   GLU  75          1HG       GLU  75   6.363  21.157   1.601
  529   2HG   GLU  75          2HG       GLU  75   6.707  22.764   0.994
  530    H    CYS  76           H        CYS  76   5.477  20.343  -2.853
  531    HA   CYS  76           HA       CYS  76   7.701  20.273  -4.496
  532   1HB   CYS  76          1HB       CYS  76   5.048  18.933  -4.438
  533   2HB   CYS  76          2HB       CYS  76   5.931  18.871  -5.950
  534    HA   PRO  77           HA       PRO  77   6.368  23.579  -7.120
  535   1HB   PRO  77          1HB       PRO  77   8.763  23.990  -8.369
  536   2HB   PRO  77          2HB       PRO  77   8.329  24.756  -6.854
  537   1HG   PRO  77          1HG       PRO  77  10.187  22.507  -7.327
  538   2HG   PRO  77          2HG       PRO  77  10.059  23.549  -5.924
  539   1HD   PRO  77          1HD       PRO  77   9.100  20.855  -6.154
  540   2HD   PRO  77          2HD       PRO  77   8.871  21.937  -4.795
  541    H    LYS  78           H        LYS  78   8.838  21.855  -8.922
  542    HA   LYS  78           HA       LYS  78   6.919  20.427 -10.451
  543   1HB   LYS  78          1HB       LYS  78   6.847  22.946 -11.230
  544   2HB   LYS  78          2HB       LYS  78   8.322  22.524 -12.077
  545   1HG   LYS  78          1HG       LYS  78   6.693  20.357 -12.683
  546   2HG   LYS  78          2HG       LYS  78   5.526  21.662 -12.605
  547   1HD   LYS  78          1HD       LYS  78   6.260  22.566 -14.561
  548   2HD   LYS  78          2HD       LYS  78   7.934  22.510 -14.047
  549   1HE   LYS  78          1HE       LYS  78   8.024  20.998 -15.814
  550   2HE   LYS  78          2HE       LYS  78   7.670  19.890 -14.504
  551   1HZ   LYS  78          1HZ       LYS  78   5.986  20.740 -16.659
  552   2HZ   LYS  78          2HZ       LYS  78   5.982  19.336 -15.824
  553   3HZ   LYS  78          3HZ       LYS  78   5.235  20.653 -15.212
  554    H    HIS  79           H        HIS  79   7.935  18.871 -11.826
  555    HA   HIS  79           HA       HIS  79   9.514  17.340 -12.094
  556   1HB   HIS  79          1HB       HIS  79  10.224  19.768 -13.401
  557   2HB   HIS  79          2HB       HIS  79  11.710  19.042 -12.822
  558    HD1  HIS  79           1HD      HIS  79  10.386  19.225 -15.869
  559    HD2  HIS  79           2HD      HIS  79  10.926  15.857 -13.428
  560    HE1  HIS  79           1HE      HIS  79  10.433  17.209 -17.432
  561    H    GLU  80           H        GLU  80   9.635  16.716  -9.830
  562    HA   GLU  80           HA       GLU  80  12.242  16.748  -8.891
  563   1HB   GLU  80          1HB       GLU  80  10.775  19.079  -8.141
  564   2HB   GLU  80          2HB       GLU  80  10.868  18.079  -6.705
  565   1HG   GLU  80          1HG       GLU  80  13.163  18.286  -6.531
  566   2HG   GLU  80          2HG       GLU  80  13.406  18.279  -8.267
  567    H    HIS  81           H        HIS  81  11.639  14.481  -8.935
  568    HA   HIS  81           HA       HIS  81   9.492  13.306  -7.844
  569   1HB   HIS  81          1HB       HIS  81  12.261  12.184  -7.419
  570   2HB   HIS  81          2HB       HIS  81  10.765  11.314  -7.694
  571    HD1  HIS  81           1HD      HIS  81  10.044  10.902 -10.118
  572    HD2  HIS  81           2HD      HIS  81  13.372  13.432  -9.779
  573    HE1  HIS  81           1HE      HIS  81  10.968  11.188 -12.480
  574    H    LYS  82           H        LYS  82  12.526  14.184  -6.050
  575    HA   LYS  82           HA       LYS  82  10.877  14.248  -3.626
  576   1HB   LYS  82          1HB       LYS  82  13.670  13.084  -3.833
  577   2HB   LYS  82          2HB       LYS  82  12.735  13.262  -2.362
  578   1HG   LYS  82          1HG       LYS  82  11.000  11.734  -3.218
  579   2HG   LYS  82          2HG       LYS  82  11.798  11.642  -4.776
  580   1HD   LYS  82          1HD       LYS  82  13.690  10.986  -2.651
  581   2HD   LYS  82          2HD       LYS  82  12.255   9.992  -2.498
  582   1HE   LYS  82          1HE       LYS  82  12.621   8.894  -4.510
  583   2HE   LYS  82          2HE       LYS  82  13.323  10.303  -5.280
  584   1HZ   LYS  82          1HZ       LYS  82  15.254   9.938  -3.751
  585   2HZ   LYS  82          2HZ       LYS  82  14.615   8.480  -3.388
  586   3HZ   LYS  82          3HZ       LYS  82  15.058   8.818  -4.923
  587    H    SER  83           H        SER  83  10.933  16.199  -2.647
  588    HA   SER  83           HA       SER  83  13.225  17.877  -3.314
  589   1HB   SER  83          1HB       SER  83  11.694  19.316  -4.153
  590   2HB   SER  83          2HB       SER  83  10.361  18.360  -3.536
  591    HG   SER  83           HG       SER  83  11.571  20.658  -2.467
  592    H    ASP  84           H        ASP  84  14.144  19.148  -1.590
  593    HA   ASP  84           HA       ASP  84  14.316  17.974   0.813
  594   1HB   ASP  84          1HB       ASP  84  15.638  19.967  -0.201
  595   2HB   ASP  84          2HB       ASP  84  14.391  21.000   0.468
  596    H    THR  85           H        THR  85  12.437  21.032   0.124
  597    HA   THR  85           HA       THR  85  11.083  21.078   2.565
  598    HB   THR  85           HB       THR  85  11.435  22.923   0.774
  599    HG1  THR  85           1HG      THR  85   8.865  22.183   1.974
  600   1HG2  THR  85          1HG2      THR  85   8.863  21.644  -0.292
  601   2HG2  THR  85          2HG2      THR  85   9.583  23.176  -0.842
  602   3HG2  THR  85          3HG2      THR  85  10.418  21.636  -1.157
  603    H    CYS  86           H        CYS  86  10.038  19.777  -0.650
  604    HA   CYS  86           HA       CYS  86   7.523  19.028   0.032
  605   1HB   CYS  86          1HB       CYS  86   8.939  18.803  -2.183
  606   2HB   CYS  86          2HB       CYS  86   9.183  17.163  -1.617
  607    H    ARG  87           H        ARG  87  10.431  16.824   0.066
  608    HA   ARG  87           HA       ARG  87   9.425  14.700   1.226
  609   1HB   ARG  87          1HB       ARG  87  12.084  16.090   1.746
  610   2HB   ARG  87          2HB       ARG  87  11.724  14.550   2.501
  611   1HG   ARG  87          1HG       ARG  87  11.046  13.876  -0.018
  612   2HG   ARG  87          2HG       ARG  87  12.140  15.186  -0.418
  613   1HD   ARG  87          1HD       ARG  87  13.725  13.513  -0.294
  614   2HD   ARG  87          2HD       ARG  87  13.692  13.907   1.413
  615    HE   ARG  87           HE       ARG  87  11.639  11.966   0.785
  616   1HH1  ARG  87          2HH2      ARG  87  15.107  12.287   1.288
  617   2HH1  ARG  87          1HH2      ARG  87  15.316  10.642   1.790
  618   1HH2  ARG  87          2HH1      ARG  87  11.914   9.796   1.447
  619   2HH2  ARG  87          1HH1      ARG  87  13.487   9.216   1.881
  620    H    ALA  88           H        ALA  88  10.550  17.655   3.011
  621    HA   ALA  88           HA       ALA  88  10.108  16.770   5.578
  622   1HB   ALA  88          1HB       ALA  88  10.914  19.105   4.325
  623   2HB   ALA  88          2HB       ALA  88   9.381  19.584   5.092
  624   3HB   ALA  88          3HB       ALA  88  10.693  18.897   6.079
  625    H    CYS  89           H        CYS  89   7.827  18.407   3.283
  626    HA   CYS  89           HA       CYS  89   5.683  18.468   5.051
  627   1HB   CYS  89          1HB       CYS  89   5.555  19.863   3.181
  628   2HB   CYS  89          2HB       CYS  89   5.922  18.569   2.058
  629    H    MET  90           H        MET  90   6.491  16.169   2.341
  630    HA   MET  90           HA       MET  90   4.424  14.444   2.726
  631   1HB   MET  90          1HB       MET  90   7.301  14.093   1.767
  632   2HB   MET  90          2HB       MET  90   6.205  12.725   1.781
  633   1HG   MET  90          1HG       MET  90   4.562  14.270   0.450
  634   2HG   MET  90          2HG       MET  90   5.950  15.307   0.188
  635   1HE   MET  90          1HE       MET  90   5.068  11.680   0.498
  636   2HE   MET  90          2HE       MET  90   4.266  11.828  -1.084
  637   3HE   MET  90          3HE       MET  90   5.760  10.872  -0.929
  638    H    LYS  91           H        LYS  91   7.290  14.945   4.703
  639    HA   LYS  91           HA       LYS  91   7.613  12.498   5.889
  640   1HB   LYS  91          1HB       LYS  91   8.888  14.766   6.138
  641   2HB   LYS  91          2HB       LYS  91   7.792  15.049   7.475
  642   1HG   LYS  91          1HG       LYS  91   8.590  13.174   8.701
  643   2HG   LYS  91          2HG       LYS  91   9.266  12.406   7.279
  644   1HD   LYS  91          1HD       LYS  91  11.244  13.530   7.470
  645   2HD   LYS  91          2HD       LYS  91  10.447  15.065   7.753
  646   1HE   LYS  91          1HE       LYS  91  10.158  14.581  10.119
  647   2HE   LYS  91          2HE       LYS  91  10.632  12.908   9.903
  648   1HZ   LYS  91          1HZ       LYS  91  12.298  14.817  10.626
  649   2HZ   LYS  91          2HZ       LYS  91  12.780  13.465   9.847
  650   3HZ   LYS  91          3HZ       LYS  91  12.552  14.850   9.013
  651    H    THR  92           H        THR  92   5.346  15.164   6.839
  652    HA   THR  92           HA       THR  92   3.967  13.214   8.551
  653    HB   THR  92           HB       THR  92   4.175  16.260   8.497
  654    HG1  THR  92           1HG      THR  92   5.646  15.570   9.999
  655   1HG2  THR  92          1HG2      THR  92   2.070  14.487   9.685
  656   2HG2  THR  92          2HG2      THR  92   2.806  15.662  10.801
  657   3HG2  THR  92          3HG2      THR  92   2.004  16.227   9.316
  658    H    ASN  93           H        ASN  93   3.213  15.937   6.269
  659    HA   ASN  93           HA       ASN  93   0.619  15.619   5.986
  660   1HB   ASN  93          1HB       ASN  93   2.795  16.151   3.942
  661   2HB   ASN  93          2HB       ASN  93   1.144  16.002   3.376
  662   1HD2  ASN  93          1HD2      ASN  93   3.284  17.716   5.587
  663   2HD2  ASN  93          2HD2      ASN  93   2.368  19.181   5.715
  664    H    CYS  94           H        CYS  94   3.188  13.633   4.361
  665    HA   CYS  94           HA       CYS  94   1.093  11.749   3.566
  666   1HB   CYS  94          1HB       CYS  94   3.855  12.164   2.404
  667   2HB   CYS  94          2HB       CYS  94   2.735  10.910   1.911
  668    H    LYS  95           H        LYS  95   1.138  10.954   5.859
  669    HA   LYS  95           HA       LYS  95   1.916   9.734   7.551
  670   1HB   LYS  95          1HB       LYS  95   1.445   8.155   5.503
  671   2HB   LYS  95          2HB       LYS  95   3.178   7.898   5.534
  672   1HG   LYS  95          1HG       LYS  95   2.822   7.498   8.125
  673   2HG   LYS  95          2HG       LYS  95   1.140   7.270   7.692
  674   1HD   LYS  95          1HD       LYS  95   1.534   5.236   6.718
  675   2HD   LYS  95          2HD       LYS  95   2.983   5.797   5.908
  676   1HE   LYS  95          1HE       LYS  95   4.373   5.332   7.772
  677   2HE   LYS  95          2HE       LYS  95   3.039   5.380   8.909
  678   1HZ   LYS  95          1HZ       LYS  95   3.863   3.136   8.336
  679   2HZ   LYS  95          2HZ       LYS  95   2.258   3.329   8.105
  680   3HZ   LYS  95          3HZ       LYS  95   3.272   3.327   6.825
  Start of MODEL   17
    1   1H    ILE   1           H        ILE   1 -17.460  18.183   8.878
    2    HA   ILE   1           HA       ILE   1 -15.582  16.077   8.218
    3    HB   ILE   1           HB       ILE   1 -13.987  17.804   7.297
    4   1HG1  ILE   1          1HG1      ILE   1 -15.549  19.635   6.054
    5   2HG1  ILE   1          2HG1      ILE   1 -16.439  19.461   7.554
    6   1HG2  ILE   1          1HG2      ILE   1 -14.594  17.317   5.122
    7   2HG2  ILE   1          2HG2      ILE   1 -15.431  16.040   6.037
    8   3HG2  ILE   1          3HG2      ILE   1 -16.336  17.460   5.458
    9   1HD1  ILE   1          1HD1      ILE   1 -14.932  20.846   8.522
   10   2HD1  ILE   1          2HD1      ILE   1 -13.717  19.558   8.338
   11   3HD1  ILE   1          3HD1      ILE   1 -13.894  20.801   7.076
   12    H    SER   2           H        SER   2 -16.099  19.387   9.601
   13    HA   SER   2           HA       SER   2 -15.491  20.274  11.485
   14   1HB   SER   2          1HB       SER   2 -15.097  17.388  12.387
   15   2HB   SER   2          2HB       SER   2 -15.015  18.762  13.472
   16    HG   SER   2           HG       SER   2 -17.291  19.162  12.235
   17    H    GLU   3           H        GLU   3 -13.632  21.449  11.036
   18    HA   GLU   3           HA       GLU   3 -11.532  22.000  11.019
   19   1HB   GLU   3          1HB       GLU   3 -11.476  19.632  12.841
   20   2HB   GLU   3          2HB       GLU   3  -9.926  20.123  12.188
   21   1HG   GLU   3          1HG       GLU   3  -9.955  22.191  13.270
   22   2HG   GLU   3          2HG       GLU   3 -11.704  22.304  13.250
   23    H    PHE   4           H        PHE   4  -9.365  21.498   9.975
   24    HA   PHE   4           HA       PHE   4  -9.845  20.005   7.593
   25   1HB   PHE   4          1HB       PHE   4  -7.668  21.693   8.883
   26   2HB   PHE   4          2HB       PHE   4  -7.202  20.683   7.529
   27    HD1  PHE   4           1HD      PHE   4  -8.289  21.040   5.301
   28    HD2  PHE   4           2HD      PHE   4  -8.877  23.709   8.548
   29    HE1  PHE   4           1HE      PHE   4  -9.103  22.799   3.707
   30    HE2  PHE   4           2HE      PHE   4  -9.691  25.468   6.953
   31    HZ   PHE   4           HZ       PHE   4  -9.794  24.993   4.552
   32    H    ALA   5           H        ALA   5  -9.403  17.885   7.220
   33    HA   ALA   5           HA       ALA   5  -7.614  16.563   9.142
   34   1HB   ALA   5          1HB       ALA   5 -10.184  15.825   7.818
   35   2HB   ALA   5          2HB       ALA   5  -8.977  14.528   7.986
   36   3HB   ALA   5          3HB       ALA   5  -9.561  15.393   9.428
   37    HA   PRO   6           HA       PRO   6  -4.994  15.556   5.853
   38   1HB   PRO   6          1HB       PRO   6  -3.957  13.141   6.602
   39   2HB   PRO   6          2HB       PRO   6  -3.405  14.667   7.263
   40   1HG   PRO   6          1HG       PRO   6  -5.122  12.616   8.521
   41   2HG   PRO   6          2HG       PRO   6  -4.223  13.913   9.283
   42   1HD   PRO   6          1HD       PRO   6  -7.048  13.839   8.794
   43   2HD   PRO   6          2HD       PRO   6  -6.133  15.182   9.449
   44    H    VAL   7           H        VAL   7  -4.226  13.590   4.335
   45    HA   VAL   7           HA       VAL   7  -6.792  12.615   3.301
   46    HB   VAL   7           HB       VAL   7  -4.129  13.167   1.987
   47   1HG1  VAL   7          1HG1      VAL   7  -6.602  11.803   0.896
   48   2HG1  VAL   7          2HG1      VAL   7  -5.385  12.574  -0.149
   49   3HG1  VAL   7          3HG1      VAL   7  -4.923  11.213   0.901
   50   1HG2  VAL   7          1HG2      VAL   7  -6.741  14.581   2.159
   51   2HG2  VAL   7          2HG2      VAL   7  -5.091  15.228   1.999
   52   3HG2  VAL   7          3HG2      VAL   7  -5.935  14.579   0.572
   53    H    ASP   8           H        ASP   8  -3.757  11.734   4.790
   54    HA   ASP   8           HA       ASP   8  -2.806   9.834   5.247
   55   1HB   ASP   8          1HB       ASP   8  -5.737   9.058   5.224
   56   2HB   ASP   8          2HB       ASP   8  -4.526   7.829   5.528
   57    H    CYS   9           H        CYS   9  -2.978   7.182   4.527
   58    HA   CYS   9           HA       CYS   9  -3.634   6.968   1.734
   59   1HB   CYS   9          1HB       CYS   9  -0.814   7.098   2.713
   60   2HB   CYS   9          2HB       CYS   9  -1.201   5.958   1.440
   61    H    LYS  10           H        LYS  10  -1.960   5.575   4.637
   62    HA   LYS  10           HA       LYS  10  -2.114   2.924   4.020
   63   1HB   LYS  10          1HB       LYS  10  -1.402   4.460   6.218
   64   2HB   LYS  10          2HB       LYS  10  -2.727   3.490   6.829
   65   1HG   LYS  10          1HG       LYS  10  -0.709   2.047   5.144
   66   2HG   LYS  10          2HG       LYS  10  -0.148   2.601   6.710
   67   1HD   LYS  10          1HD       LYS  10  -1.318   0.984   7.801
   68   2HD   LYS  10          2HD       LYS  10  -2.799   1.389   6.957
   69   1HE   LYS  10          1HE       LYS  10  -2.538  -0.297   5.424
   70   2HE   LYS  10          2HE       LYS  10  -0.826   0.017   5.223
   71   1HZ   LYS  10          1HZ       LYS  10  -2.141  -1.635   7.227
   72   2HZ   LYS  10          2HZ       LYS  10  -0.862  -1.991   6.277
   73   3HZ   LYS  10          3HZ       LYS  10  -0.676  -0.995   7.558
   74    H    GLY  11           H        GLY  11  -4.662   5.042   5.459
   75   1HA   GLY  11          1HA       GLY  11  -6.564   2.939   5.732
   76   2HA   GLY  11          2HA       GLY  11  -6.855   4.664   5.838
   77    H    GLN  12           H        GLN  12  -6.006   5.583   3.307
   78    HA   GLN  12           HA       GLN  12  -8.239   4.799   1.778
   79   1HB   GLN  12          1HB       GLN  12  -6.009   6.782   1.539
   80   2HB   GLN  12          2HB       GLN  12  -6.777   6.301   0.039
   81   1HG   GLN  12          1HG       GLN  12  -8.474   7.097   2.427
   82   2HG   GLN  12          2HG       GLN  12  -7.765   8.331   1.405
   83   1HE2  GLN  12          1HE2      GLN  12 -10.155   8.718   1.199
   84   2HE2  GLN  12          2HE2      GLN  12 -10.987   7.958  -0.116
   85    H    CYS  13           H        CYS  13  -7.240   2.399   2.028
   86    HA   CYS  13           HA       CYS  13  -6.357   1.749  -0.603
   87   1HB   CYS  13          1HB       CYS  13  -4.473   1.472   1.724
   88   2HB   CYS  13          2HB       CYS  13  -4.398   0.362   0.371
   89    H    THR  14           H        THR  14  -8.719   1.033   0.112
   90    HA   THR  14           HA       THR  14  -8.522  -1.564   1.490
   91    HB   THR  14           HB       THR  14 -10.670   0.589   1.311
   92    HG1  THR  14           1HG      THR  14  -9.562  -1.109   3.429
   93   1HG2  THR  14          1HG2      THR  14 -12.344  -0.939   1.589
   94   2HG2  THR  14          2HG2      THR  14 -11.177  -2.238   1.245
   95   3HG2  THR  14          3HG2      THR  14 -11.445  -1.703   2.921
   96    H    THR  15           H        THR  15 -10.122   0.178  -1.249
   97    HA   THR  15           HA       THR  15 -11.231  -2.133  -2.383
   98    HB   THR  15           HB       THR  15 -10.742   0.727  -3.079
   99    HG1  THR  15           1HG      THR  15 -13.009   0.175  -3.861
  100   1HG2  THR  15          1HG2      THR  15  -9.832  -0.259  -5.152
  101   2HG2  THR  15          2HG2      THR  15 -11.169  -1.433  -5.209
  102   3HG2  THR  15          3HG2      THR  15 -11.494   0.299  -5.461
  103    HA   PRO  16           HA       PRO  16  -7.223  -2.357  -4.853
  104   1HB   PRO  16          1HB       PRO  16  -5.028  -0.966  -4.008
  105   2HB   PRO  16          2HB       PRO  16  -6.109  -0.383  -5.258
  106   1HG   PRO  16          1HG       PRO  16  -5.877   0.502  -2.447
  107   2HG   PRO  16          2HG       PRO  16  -6.623   1.329  -3.800
  108   1HD   PRO  16          1HD       PRO  16  -7.971  -0.069  -1.689
  109   2HD   PRO  16          2HD       PRO  16  -8.708   0.659  -3.102
  110    H    CYS  17           H        CYS  17  -7.392  -2.384  -1.480
  111    HA   CYS  17           HA       CYS  17  -5.493  -4.617  -1.493
  112   1HB   CYS  17          1HB       CYS  17  -6.097  -2.745   0.806
  113   2HB   CYS  17          2HB       CYS  17  -4.995  -4.107   0.843
  114    H    GLU  18           H        GLU  18  -8.417  -4.548  -2.142
  115    HA   GLU  18           HA       GLU  18  -9.778  -5.441   0.168
  116   1HB   GLU  18          1HB       GLU  18 -10.423  -4.715  -2.555
  117   2HB   GLU  18          2HB       GLU  18 -11.147  -6.274  -2.212
  118   1HG   GLU  18          1HG       GLU  18 -11.808  -5.019   0.098
  119   2HG   GLU  18          2HG       GLU  18 -11.680  -3.606  -0.929
  120    HA   PRO  19           HA       PRO  19  -9.173  -9.657  -1.904
  121   1HB   PRO  19          1HB       PRO  19  -7.654  -9.892  -4.164
  122   2HB   PRO  19          2HB       PRO  19  -9.399  -9.732  -4.194
  123   1HG   PRO  19          1HG       PRO  19  -7.341  -7.712  -4.843
  124   2HG   PRO  19          2HG       PRO  19  -9.042  -7.720  -5.264
  125   1HD   PRO  19          1HD       PRO  19  -7.791  -6.163  -3.205
  126   2HD   PRO  19          2HD       PRO  19  -9.506  -6.259  -3.550
  127    H    LEU  20           H        LEU  20  -6.397  -7.562  -2.121
  128    HA   LEU  20           HA       LEU  20  -4.487  -9.534  -1.607
  129   1HB   LEU  20          1HB       LEU  20  -3.687  -7.551  -2.475
  130   2HB   LEU  20          2HB       LEU  20  -4.616  -6.556  -1.370
  131    HG   LEU  20           HG       LEU  20  -1.989  -6.874  -1.142
  132   1HD1  LEU  20          1HD1      LEU  20  -2.167  -5.784   0.840
  133   2HD1  LEU  20          2HD1      LEU  20  -3.866  -5.660   0.324
  134   3HD1  LEU  20          3HD1      LEU  20  -3.378  -6.916   1.488
  135   1HD2  LEU  20          1HD2      LEU  20  -2.671  -9.456  -0.709
  136   2HD2  LEU  20          2HD2      LEU  20  -1.205  -8.685  -0.057
  137   3HD2  LEU  20          3HD2      LEU  20  -2.656  -8.843   0.962
  138    H    THR  21           H        THR  21  -6.207  -7.245   0.626
  139    HA   THR  21           HA       THR  21  -5.041  -8.236   2.965
  140    HB   THR  21           HB       THR  21  -7.659  -6.790   2.326
  141    HG1  THR  21           1HG      THR  21  -6.248  -5.078   2.589
  142   1HG2  THR  21          1HG2      THR  21  -6.795  -8.003   4.844
  143   2HG2  THR  21          2HG2      THR  21  -6.763  -6.228   4.974
  144   3HG2  THR  21          3HG2      THR  21  -8.268  -7.060   4.513
  145    H    ALA  22           H        ALA  22  -8.277  -9.019   1.518
  146    HA   ALA  22           HA       ALA  22  -9.035 -10.895   3.353
  147   1HB   ALA  22          1HB       ALA  22  -9.778 -11.751   0.698
  148   2HB   ALA  22          2HB       ALA  22 -10.776 -10.950   1.936
  149   3HB   ALA  22          3HB       ALA  22  -9.836  -9.974   0.782
  150    H    CYS  23           H        CYS  23  -6.749 -11.189   0.602
  151    HA   CYS  23           HA       CYS  23  -6.538 -13.955   0.628
  152   1HB   CYS  23          1HB       CYS  23  -5.688 -12.309  -1.107
  153   2HB   CYS  23          2HB       CYS  23  -4.314 -12.031  -0.055
  154    H    LYS  24           H        LYS  24  -4.452 -11.394   2.169
  155    HA   LYS  24           HA       LYS  24  -2.776 -13.106   3.532
  156   1HB   LYS  24          1HB       LYS  24  -3.667 -10.264   3.975
  157   2HB   LYS  24          2HB       LYS  24  -2.603 -11.048   5.125
  158   1HG   LYS  24          1HG       LYS  24  -1.071 -11.654   3.171
  159   2HG   LYS  24          2HG       LYS  24  -2.089 -10.670   2.139
  160   1HD   LYS  24          1HD       LYS  24  -0.445  -9.119   2.752
  161   2HD   LYS  24          2HD       LYS  24  -1.680  -8.786   3.950
  162   1HE   LYS  24          1HE       LYS  24  -0.475  -9.790   5.689
  163   2HE   LYS  24          2HE       LYS  24   0.357 -10.902   4.621
  164   1HZ   LYS  24          1HZ       LYS  24   1.692  -9.116   3.826
  165   2HZ   LYS  24          2HZ       LYS  24   0.855  -8.008   4.684
  166   3HZ   LYS  24          3HZ       LYS  24   1.769  -9.119   5.457
  167    H    GLU  25           H        GLU  25  -5.917 -11.637   4.579
  168    HA   GLU  25           HA       GLU  25  -5.929 -12.619   7.117
  169   1HB   GLU  25          1HB       GLU  25  -7.781 -11.382   5.319
  170   2HB   GLU  25          2HB       GLU  25  -8.604 -12.766   6.011
  171   1HG   GLU  25          1HG       GLU  25  -7.020 -11.089   7.926
  172   2HG   GLU  25          2HG       GLU  25  -8.450 -10.335   7.248
  173    H    LYS  26           H        LYS  26  -7.728 -14.106   4.317
  174    HA   LYS  26           HA       LYS  26  -8.523 -16.400   5.435
  175   1HB   LYS  26          1HB       LYS  26  -8.621 -15.443   2.966
  176   2HB   LYS  26          2HB       LYS  26  -7.292 -16.556   2.706
  177   1HG   LYS  26          1HG       LYS  26  -9.425 -17.835   4.259
  178   2HG   LYS  26          2HG       LYS  26 -10.056 -17.185   2.759
  179   1HD   LYS  26          1HD       LYS  26  -8.013 -18.329   1.608
  180   2HD   LYS  26          2HD       LYS  26  -7.802 -19.199   3.115
  181   1HE   LYS  26          1HE       LYS  26  -9.517 -20.614   2.636
  182   2HE   LYS  26          2HE       LYS  26 -10.608 -19.284   2.303
  183   1HZ   LYS  26          1HZ       LYS  26 -10.412 -20.309   0.289
  184   2HZ   LYS  26          2HZ       LYS  26  -9.285 -19.138   0.131
  185   3HZ   LYS  26          3HZ       LYS  26  -8.829 -20.671   0.462
  186    H    CYS  27           H        CYS  27  -5.200 -15.691   4.218
  187    HA   CYS  27           HA       CYS  27  -4.173 -18.229   4.616
  188   1HB   CYS  27          1HB       CYS  27  -3.049 -15.490   4.346
  189   2HB   CYS  27          2HB       CYS  27  -1.998 -16.711   5.037
  190    H    ALA  28           H        ALA  28  -4.063 -15.274   6.746
  191    HA   ALA  28           HA       ALA  28  -2.770 -16.214   8.894
  192   1HB   ALA  28          1HB       ALA  28  -5.363 -14.632   9.050
  193   2HB   ALA  28          2HB       ALA  28  -3.988 -14.578  10.179
  194   3HB   ALA  28          3HB       ALA  28  -3.811 -13.935   8.529
  195    H    GLU  29           H        GLU  29  -6.311 -16.685   8.235
  196    HA   GLU  29           HA       GLU  29  -6.841 -18.143  10.486
  197   1HB   GLU  29          1HB       GLU  29  -8.072 -18.002   7.732
  198   2HB   GLU  29          2HB       GLU  29  -8.664 -19.204   8.862
  199   1HG   GLU  29          1HG       GLU  29  -8.464 -16.219   9.483
  200   2HG   GLU  29          2HG       GLU  29  -9.929 -17.014   8.943
  201    H    SER  30           H        SER  30  -5.674 -19.231   7.242
  202    HA   SER  30           HA       SER  30  -5.744 -21.951   7.962
  203   1HB   SER  30          1HB       SER  30  -5.392 -20.463   5.604
  204   2HB   SER  30          2HB       SER  30  -3.844 -21.255   5.824
  205    HG   SER  30           HG       SER  30  -4.769 -23.016   5.052
  206    H    CYS  31           H        CYS  31  -3.722 -19.350   8.857
  207    HA   CYS  31           HA       CYS  31  -1.556 -21.224   9.482
  208   1HB   CYS  31          1HB       CYS  31  -1.402 -18.295   8.758
  209   2HB   CYS  31          2HB       CYS  31  -0.079 -19.173   9.500
  210    H    GLU  32           H        GLU  32  -3.585 -21.313  11.232
  211    HA   GLU  32           HA       GLU  32  -3.027 -19.286  13.240
  212   1HB   GLU  32          1HB       GLU  32  -5.419 -20.827  12.441
  213   2HB   GLU  32          2HB       GLU  32  -5.174 -20.800  14.176
  214   1HG   GLU  32          1HG       GLU  32  -4.805 -18.224  13.891
  215   2HG   GLU  32          2HG       GLU  32  -5.507 -18.431  12.299
  216    H    THR  33           H        THR  33  -3.608 -22.864  12.922
  217    HA   THR  33           HA       THR  33  -2.538 -23.405  15.506
  218    HB   THR  33           HB       THR  33  -2.830 -25.769  14.723
  219    HG1  THR  33           1HG      THR  33  -2.223 -25.571  12.525
  220   1HG2  THR  33          1HG2      THR  33  -4.977 -25.044  15.372
  221   2HG2  THR  33          2HG2      THR  33  -4.994 -23.719  14.183
  222   3HG2  THR  33          3HG2      THR  33  -5.257 -25.396  13.649
  223    H    SER  34           H        SER  34  -1.165 -22.903  12.316
  224    HA   SER  34           HA       SER  34   1.080 -24.417  12.473
  225   1HB   SER  34          1HB       SER  34   0.255 -21.932  11.085
  226   2HB   SER  34          2HB       SER  34   1.990 -22.072  11.287
  227    HG   SER  34           HG       SER  34   0.261 -24.074  10.101
  228    H    ALA  35           H        ALA  35   3.086 -24.272  13.524
  229    HA   ALA  35           HA       ALA  35   3.240 -22.942  15.930
  230   1HB   ALA  35          1HB       ALA  35   5.190 -24.085  16.094
  231   2HB   ALA  35          2HB       ALA  35   4.719 -24.812  14.539
  232   3HB   ALA  35          3HB       ALA  35   5.819 -23.413  14.571
  233    H    ASP  36           H        ASP  36   4.978 -22.093  12.845
  234    HA   ASP  36           HA       ASP  36   5.412 -19.468  13.948
  235   1HB   ASP  36          1HB       ASP  36   6.237 -20.374  11.172
  236   2HB   ASP  36          2HB       ASP  36   7.000 -19.167  12.189
  237    H    LYS  37           H        LYS  37   3.229 -18.580  13.807
  238    HA   LYS  37           HA       LYS  37   1.646 -18.799  11.505
  239   1HB   LYS  37          1HB       LYS  37   1.618 -16.916  13.872
  240   2HB   LYS  37          2HB       LYS  37   0.429 -16.830  12.589
  241   1HG   LYS  37          1HG       LYS  37  -0.731 -18.530  13.534
  242   2HG   LYS  37          2HG       LYS  37   0.645 -19.595  13.328
  243   1HD   LYS  37          1HD       LYS  37   0.391 -19.670  15.650
  244   2HD   LYS  37          2HD       LYS  37   1.573 -18.385  15.498
  245   1HE   LYS  37          1HE       LYS  37   0.056 -16.719  16.079
  246   2HE   LYS  37          2HE       LYS  37  -1.307 -17.552  15.357
  247   1HZ   LYS  37          1HZ       LYS  37  -1.722 -17.907  17.527
  248   2HZ   LYS  37          2HZ       LYS  37  -0.783 -19.220  17.280
  249   3HZ   LYS  37          3HZ       LYS  37  -0.155 -17.888  17.987
  250    H    LYS  38           H        LYS  38   3.622 -16.013  12.757
  251    HA   LYS  38           HA       LYS  38   3.264 -14.257  10.758
  252   1HB   LYS  38          1HB       LYS  38   5.151 -14.681  12.846
  253   2HB   LYS  38          2HB       LYS  38   6.063 -14.287  11.404
  254   1HG   LYS  38          1HG       LYS  38   5.574 -12.116  11.919
  255   2HG   LYS  38          2HG       LYS  38   4.003 -12.458  11.222
  256   1HD   LYS  38          1HD       LYS  38   3.370 -11.627  13.312
  257   2HD   LYS  38          2HD       LYS  38   3.413 -13.346  13.652
  258   1HE   LYS  38          1HE       LYS  38   6.041 -12.004  13.999
  259   2HE   LYS  38          2HE       LYS  38   4.798 -11.396  15.074
  260   1HZ   LYS  38          1HZ       LYS  38   6.020 -13.987  15.000
  261   2HZ   LYS  38          2HZ       LYS  38   5.382 -13.171  16.262
  262   3HZ   LYS  38          3HZ       LYS  38   4.407 -14.008  15.255
  263    H    THR  39           H        THR  39   6.109 -16.522  10.747
  264    HA   THR  39           HA       THR  39   6.864 -16.126   8.159
  265    HB   THR  39           HB       THR  39   6.875 -18.789   9.670
  266    HG1  THR  39           1HG      THR  39   8.673 -16.469   9.677
  267   1HG2  THR  39          1HG2      THR  39   8.553 -19.424   8.236
  268   2HG2  THR  39          2HG2      THR  39   7.959 -18.128   7.170
  269   3HG2  THR  39          3HG2      THR  39   9.306 -17.812   8.290
  270    H    CYS  40           H        CYS  40   4.492 -18.616   9.309
  271    HA   CYS  40           HA       CYS  40   3.932 -19.768   6.934
  272   1HB   CYS  40          1HB       CYS  40   3.018 -20.395   9.165
  273   2HB   CYS  40          2HB       CYS  40   1.885 -19.063   9.046
  274    H    ARG  41           H        ARG  41   1.979 -17.052   8.389
  275    HA   ARG  41           HA       ARG  41   0.488 -16.500   6.226
  276   1HB   ARG  41          1HB       ARG  41   1.673 -14.479   8.197
  277   2HB   ARG  41          2HB       ARG  41   0.286 -14.172   7.171
  278   1HG   ARG  41          1HG       ARG  41  -0.876 -16.160   8.257
  279   2HG   ARG  41          2HG       ARG  41   0.478 -16.292   9.361
  280   1HD   ARG  41          1HD       ARG  41  -0.649 -13.545   9.172
  281   2HD   ARG  41          2HD       ARG  41  -1.778 -14.731   9.794
  282    HE   ARG  41           HE       ARG  41   0.541 -15.276  11.207
  283   1HH1  ARG  41          2HH2      ARG  41  -1.363 -12.365  10.675
  284   2HH1  ARG  41          1HH2      ARG  41  -0.937 -11.654  12.196
  285   1HH2  ARG  41          2HH1      ARG  41   1.103 -14.339  13.214
  286   2HH2  ARG  41          1HH1      ARG  41   0.475 -12.784  13.650
  287    H    ARG  42           H        ARG  42   3.675 -14.978   7.110
  288    HA   ARG  42           HA       ARG  42   3.919 -13.242   5.095
  289   1HB   ARG  42          1HB       ARG  42   5.867 -14.913   6.662
  290   2HB   ARG  42          2HB       ARG  42   6.506 -14.109   5.243
  291   1HG   ARG  42          1HG       ARG  42   6.318 -12.014   6.174
  292   2HG   ARG  42          2HG       ARG  42   4.779 -12.373   6.931
  293   1HD   ARG  42          1HD       ARG  42   5.755 -13.047   8.905
  294   2HD   ARG  42          2HD       ARG  42   7.060 -13.888   8.093
  295    HE   ARG  42           HE       ARG  42   8.379 -11.995   8.400
  296   1HH1  ARG  42          2HH2      ARG  42   5.002 -11.005   8.390
  297   2HH1  ARG  42          1HH2      ARG  42   5.356  -9.343   8.727
  298   1HH2  ARG  42          2HH1      ARG  42   8.846  -9.803   8.844
  299   2HH2  ARG  42          1HH1      ARG  42   7.557  -8.655   8.987
  300    H    ASN  43           H        ASN  43   4.940 -16.734   5.047
  301    HA   ASN  43           HA       ASN  43   5.731 -16.632   2.363
  302   1HB   ASN  43          1HB       ASN  43   5.413 -18.683   4.497
  303   2HB   ASN  43          2HB       ASN  43   5.141 -19.316   2.886
  304   1HD2  ASN  43          1HD2      ASN  43   7.386 -18.974   5.166
  305   2HD2  ASN  43          2HD2      ASN  43   8.844 -18.870   4.237
  306    H    CYS  44           H        CYS  44   2.678 -16.983   4.070
  307    HA   CYS  44           HA       CYS  44   1.326 -18.380   1.990
  308   1HB   CYS  44          1HB       CYS  44   0.806 -18.237   4.549
  309   2HB   CYS  44          2HB       CYS  44  -0.061 -16.778   4.114
  310    H    LYS  45           H        LYS  45   2.266 -15.083   2.730
  311    HA   LYS  45           HA       LYS  45   0.204 -13.836   1.201
  312   1HB   LYS  45          1HB       LYS  45   1.119 -12.571   2.978
  313   2HB   LYS  45          2HB       LYS  45   2.769 -12.893   2.485
  314   1HG   LYS  45          1HG       LYS  45   1.039 -11.560   0.434
  315   2HG   LYS  45          2HG       LYS  45   1.418 -10.598   1.849
  316   1HD   LYS  45          1HD       LYS  45   3.750 -12.062   0.719
  317   2HD   LYS  45          2HD       LYS  45   3.060 -10.872  -0.366
  318   1HE   LYS  45          1HE       LYS  45   4.147  -9.249   0.785
  319   2HE   LYS  45          2HE       LYS  45   3.135  -9.596   2.173
  320   1HZ   LYS  45          1HZ       LYS  45   5.849 -10.222   1.769
  321   2HZ   LYS  45          2HZ       LYS  45   4.975 -10.276   3.147
  322   3HZ   LYS  45          3HZ       LYS  45   5.008 -11.569   2.150
  323    H    LYS  46           H        LYS  46   3.718 -14.574   0.694
  324    HA   LYS  46           HA       LYS  46   3.537 -13.704  -2.038
  325   1HB   LYS  46          1HB       LYS  46   5.704 -14.757  -0.242
  326   2HB   LYS  46          2HB       LYS  46   5.946 -14.756  -1.978
  327   1HG   LYS  46          1HG       LYS  46   4.812 -12.212  -0.967
  328   2HG   LYS  46          2HG       LYS  46   6.378 -12.585  -0.275
  329   1HD   LYS  46          1HD       LYS  46   7.478 -12.507  -2.347
  330   2HD   LYS  46          2HD       LYS  46   6.041 -12.937  -3.251
  331   1HE   LYS  46          1HE       LYS  46   5.948 -10.706  -3.756
  332   2HE   LYS  46          2HE       LYS  46   5.233 -10.541  -2.164
  333   1HZ   LYS  46          1HZ       LYS  46   7.818  -9.760  -3.061
  334   2HZ   LYS  46          2HZ       LYS  46   6.948  -9.213  -1.791
  335   3HZ   LYS  46          3HZ       LYS  46   7.859 -10.560  -1.638
  336    H    ALA  47           H        ALA  47   2.486 -16.421  -0.355
  337    HA   ALA  47           HA       ALA  47   3.310 -18.488  -2.071
  338   1HB   ALA  47          1HB       ALA  47   2.528 -19.247  -0.029
  339   2HB   ALA  47          2HB       ALA  47   1.201 -18.063   0.026
  340   3HB   ALA  47          3HB       ALA  47   1.076 -19.491  -1.029
  341    H    ASP  48           H        ASP  48   0.090 -16.808  -1.804
  342    HA   ASP  48           HA       ASP  48  -0.199 -17.366  -4.652
  343   1HB   ASP  48          1HB       ASP  48  -1.764 -18.616  -3.047
  344   2HB   ASP  48          2HB       ASP  48  -2.444 -17.062  -2.607
  345    H    CYS  49           H        CYS  49  -0.574 -15.151  -1.873
  346    HA   CYS  49           HA       CYS  49  -1.834 -13.105  -3.424
  347   1HB   CYS  49          1HB       CYS  49  -0.553 -12.519  -0.798
  348   2HB   CYS  49          2HB       CYS  49  -2.060 -11.930  -1.473
  349    H    GLU  50           H        GLU  50   0.306 -13.766  -4.923
  350    HA   GLU  50           HA       GLU  50   2.600 -12.274  -4.099
  351   1HB   GLU  50          1HB       GLU  50   2.033 -14.397  -5.947
  352   2HB   GLU  50          2HB       GLU  50   2.729 -13.080  -6.870
  353   1HG   GLU  50          1HG       GLU  50   4.300 -13.187  -4.522
  354   2HG   GLU  50          2HG       GLU  50   4.015 -14.868  -4.925
  355    HA   PRO  51           HA       PRO  51   1.051  -9.622  -7.713
  356   1HB   PRO  51          1HB       PRO  51  -1.378 -10.136  -8.854
  357   2HB   PRO  51          2HB       PRO  51   0.133 -10.735  -9.508
  358   1HG   PRO  51          1HG       PRO  51  -1.951 -12.205  -8.014
  359   2HG   PRO  51          2HG       PRO  51  -0.670 -12.842  -9.026
  360   1HD   PRO  51          1HD       PRO  51  -0.739 -12.814  -6.158
  361   2HD   PRO  51          2HD       PRO  51   0.590 -13.345  -7.170
  362    H    GLN  52           H        GLN  52  -1.429 -10.757  -5.549
  363    HA   GLN  52           HA       GLN  52  -2.843  -8.361  -5.512
  364   1HB   GLN  52          1HB       GLN  52  -2.615 -10.453  -3.303
  365   2HB   GLN  52          2HB       GLN  52  -3.895  -9.268  -3.469
  366   1HG   GLN  52          1HG       GLN  52  -4.570 -10.265  -5.644
  367   2HG   GLN  52          2HG       GLN  52  -3.251 -11.414  -5.547
  368   1HE2  GLN  52          1HE2      GLN  52  -3.953 -13.343  -5.077
  369   2HE2  GLN  52          2HE2      GLN  52  -5.168 -13.771  -3.919
  370    H    ASP  53           H        ASP  53  -0.303  -9.706  -3.291
  371    HA   ASP  53           HA       ASP  53  -0.255  -7.680  -1.498
  372   1HB   ASP  53          1HB       ASP  53   1.077  -9.869  -1.505
  373   2HB   ASP  53          2HB       ASP  53   2.212  -9.102  -2.598
  374    H    LYS  54           H        LYS  54   1.033  -7.876  -4.819
  375    HA   LYS  54           HA       LYS  54   2.730  -5.609  -4.611
  376   1HB   LYS  54          1HB       LYS  54   1.735  -7.385  -6.810
  377   2HB   LYS  54          2HB       LYS  54   2.436  -5.837  -7.237
  378   1HG   LYS  54          1HG       LYS  54   4.373  -6.556  -5.569
  379   2HG   LYS  54          2HG       LYS  54   3.738  -8.172  -5.809
  380   1HD   LYS  54          1HD       LYS  54   3.960  -7.839  -8.311
  381   2HD   LYS  54          2HD       LYS  54   4.704  -6.282  -8.006
  382   1HE   LYS  54          1HE       LYS  54   6.712  -7.220  -7.440
  383   2HE   LYS  54          2HE       LYS  54   5.961  -8.440  -6.431
  384   1HZ   LYS  54          1HZ       LYS  54   5.298  -9.509  -8.596
  385   2HZ   LYS  54          2HZ       LYS  54   6.368  -8.515  -9.326
  386   3HZ   LYS  54          3HZ       LYS  54   6.881  -9.583  -8.202
  387    H    VAL  55           H        VAL  55  -0.418  -6.128  -6.361
  388    HA   VAL  55           HA       VAL  55  -0.938  -3.625  -7.146
  389    HB   VAL  55           HB       VAL  55  -2.783  -5.687  -5.942
  390   1HG1  VAL  55          1HG1      VAL  55  -3.706  -3.313  -5.868
  391   2HG1  VAL  55          2HG1      VAL  55  -3.661  -3.343  -7.647
  392   3HG1  VAL  55          3HG1      VAL  55  -4.673  -4.510  -6.763
  393   1HG2  VAL  55          1HG2      VAL  55  -3.371  -6.013  -8.384
  394   2HG2  VAL  55          2HG2      VAL  55  -1.982  -4.972  -8.776
  395   3HG2  VAL  55          3HG2      VAL  55  -1.727  -6.509  -7.916
  396    H    CYS  56           H        CYS  56  -1.854  -4.930  -3.876
  397    HA   CYS  56           HA       CYS  56  -2.926  -2.754  -2.772
  398   1HB   CYS  56          1HB       CYS  56  -2.625  -4.932  -1.660
  399   2HB   CYS  56          2HB       CYS  56  -0.925  -4.578  -1.420
  400    H    ASP  57           H        ASP  57   0.633  -3.540  -2.597
  401    HA   ASP  57           HA       ASP  57   1.549  -1.335  -1.459
  402   1HB   ASP  57          1HB       ASP  57   2.798  -3.373  -2.515
  403   2HB   ASP  57          2HB       ASP  57   2.867  -2.416  -3.981
  404    H    ALA  58           H        ALA  58   0.787  -1.785  -4.984
  405    HA   ALA  58           HA       ALA  58   1.637   0.529  -6.059
  406   1HB   ALA  58          1HB       ALA  58   0.326  -0.080  -7.822
  407   2HB   ALA  58          2HB       ALA  58   0.075  -1.557  -6.860
  408   3HB   ALA  58          3HB       ALA  58  -1.132  -0.249  -6.814
  409    H    CYS  59           H        CYS  59  -1.626   0.066  -4.515
  410    HA   CYS  59           HA       CYS  59  -2.589   2.555  -4.731
  411   1HB   CYS  59          1HB       CYS  59  -3.859   0.769  -3.747
  412   2HB   CYS  59          2HB       CYS  59  -2.778   0.679  -2.370
  413    H    ARG  60           H        ARG  60  -0.401   1.313  -2.102
  414    HA   ARG  60           HA       ARG  60  -0.193   3.709  -0.775
  415   1HB   ARG  60          1HB       ARG  60   1.815   1.413  -1.010
  416   2HB   ARG  60          2HB       ARG  60   1.945   2.700   0.171
  417   1HG   ARG  60          1HG       ARG  60  -0.404   2.064   0.981
  418   2HG   ARG  60          2HG       ARG  60  -0.316   0.664  -0.070
  419   1HD   ARG  60          1HD       ARG  60   1.854   0.011   1.126
  420   2HD   ARG  60          2HD       ARG  60   1.548   1.309   2.263
  421    HE   ARG  60           HE       ARG  60  -0.829  -0.222   2.144
  422   1HH1  ARG  60          2HH2      ARG  60   2.522  -0.682   3.115
  423   2HH1  ARG  60          1HH2      ARG  60   2.148  -1.895   4.293
  424   1HH2  ARG  60          2HH1      ARG  60  -1.323  -1.822   3.699
  425   2HH2  ARG  60          1HH1      ARG  60  -0.054  -2.548   4.628
  426    H    MET  61           H        MET  61   1.535   2.379  -3.611
  427    HA   MET  61           HA       MET  61   3.592   4.299  -3.568
  428   1HB   MET  61          1HB       MET  61   4.054   2.288  -4.777
  429   2HB   MET  61          2HB       MET  61   2.482   2.279  -5.552
  430   1HG   MET  61          1HG       MET  61   3.183   3.624  -7.276
  431   2HG   MET  61          2HG       MET  61   4.084   4.686  -6.213
  432   1HE   MET  61          1HE       MET  61   5.092   0.630  -7.766
  433   2HE   MET  61          2HE       MET  61   3.682   1.670  -8.082
  434   3HE   MET  61          3HE       MET  61   5.147   1.829  -9.081
  435    H    LYS  62           H        LYS  62   0.431   4.000  -5.287
  436    HA   LYS  62           HA       LYS  62   0.835   6.353  -6.824
  437   1HB   LYS  62          1HB       LYS  62  -1.379   4.408  -6.347
  438   2HB   LYS  62          2HB       LYS  62  -1.815   5.990  -6.962
  439   1HG   LYS  62          1HG       LYS  62  -1.141   5.371  -9.034
  440   2HG   LYS  62          2HG       LYS  62   0.494   5.156  -8.440
  441   1HD   LYS  62          1HD       LYS  62  -0.679   2.850  -7.499
  442   2HD   LYS  62          2HD       LYS  62  -1.626   3.113  -8.950
  443   1HE   LYS  62          1HE       LYS  62   1.043   3.618  -9.751
  444   2HE   LYS  62          2HE       LYS  62   1.162   2.227  -8.691
  445   1HZ   LYS  62          1HZ       LYS  62   0.165   0.971 -10.192
  446   2HZ   LYS  62          2HZ       LYS  62  -1.038   2.040 -10.469
  447   3HZ   LYS  62          3HZ       LYS  62   0.380   2.180 -11.268
  448    H    CYS  63           H        CYS  63  -1.148   5.564  -3.886
  449    HA   CYS  63           HA       CYS  63  -2.234   8.015  -3.473
  450   1HB   CYS  63          1HB       CYS  63  -2.654   5.895  -2.193
  451   2HB   CYS  63          2HB       CYS  63  -1.189   6.208  -1.286
  452    H    HIS  64           H        HIS  64   0.926   6.738  -2.187
  453    HA   HIS  64           HA       HIS  64   1.814   8.829  -0.796
  454   1HB   HIS  64          1HB       HIS  64   3.156   6.911  -0.895
  455   2HB   HIS  64          2HB       HIS  64   3.242   6.932  -2.646
  456    HD1  HIS  64           1HD      HIS  64   4.940   8.609  -3.760
  457    HD2  HIS  64           2HD      HIS  64   5.046   8.524   0.433
  458    HE1  HIS  64           1HE      HIS  64   7.086   9.807  -3.074
  459    H    LYS  65           H        LYS  65   2.243   8.474  -4.390
  460    HA   LYS  65           HA       LYS  65   3.311  11.069  -4.672
  461   1HB   LYS  65          1HB       LYS  65   3.114   8.796  -6.234
  462   2HB   LYS  65          2HB       LYS  65   2.023   9.904  -7.042
  463   1HG   LYS  65          1HG       LYS  65   3.716  11.440  -7.545
  464   2HG   LYS  65          2HG       LYS  65   4.689  10.992  -6.158
  465   1HD   LYS  65          1HD       LYS  65   4.239   8.995  -8.398
  466   2HD   LYS  65          2HD       LYS  65   5.451  10.248  -8.576
  467   1HE   LYS  65          1HE       LYS  65   6.866   9.287  -7.036
  468   2HE   LYS  65          2HE       LYS  65   5.559   8.836  -5.960
  469   1HZ   LYS  65          1HZ       LYS  65   6.191   6.830  -6.755
  470   2HZ   LYS  65          2HZ       LYS  65   5.050   7.178  -7.871
  471   3HZ   LYS  65          3HZ       LYS  65   6.631   7.383  -8.227
  472    H    ALA  66           H        ALA  66   0.019   9.653  -5.195
  473    HA   ALA  66           HA       ALA  66  -1.261  11.830  -6.194
  474   1HB   ALA  66          1HB       ALA  66  -2.975  10.396  -5.970
  475   2HB   ALA  66          2HB       ALA  66  -1.922   9.331  -5.008
  476   3HB   ALA  66          3HB       ALA  66  -2.921  10.562  -4.198
  477    H    CYS  67           H        CYS  67  -0.969  11.001  -2.661
  478    HA   CYS  67           HA       CYS  67  -2.101  13.341  -1.748
  479   1HB   CYS  67          1HB       CYS  67  -1.510  11.182  -0.494
  480   2HB   CYS  67          2HB       CYS  67   0.091  11.866  -0.297
  481    H    ARG  68           H        ARG  68   1.342  12.455  -2.458
  482    HA   ARG  68           HA       ARG  68   2.529  14.717  -1.558
  483   1HB   ARG  68          1HB       ARG  68   3.830  12.801  -2.344
  484   2HB   ARG  68          2HB       ARG  68   3.194  12.962  -3.969
  485   1HG   ARG  68          1HG       ARG  68   4.363  15.496  -3.213
  486   2HG   ARG  68          2HG       ARG  68   5.516  14.232  -2.831
  487   1HD   ARG  68          1HD       ARG  68   6.077  14.524  -5.060
  488   2HD   ARG  68          2HD       ARG  68   4.800  13.344  -5.281
  489    HE   ARG  68           HE       ARG  68   3.556  15.892  -5.235
  490   1HH1  ARG  68          2HH2      ARG  68   5.851  14.132  -7.240
  491   2HH1  ARG  68          1HH2      ARG  68   5.411  14.963  -8.695
  492   1HH2  ARG  68          2HH1      ARG  68   2.975  16.987  -7.154
  493   2HH2  ARG  68          1HH1      ARG  68   3.765  16.598  -8.646
  494    H    ALA  69           H        ALA  69   0.998  14.059  -4.770
  495    HA   ALA  69           HA       ALA  69   1.647  16.669  -5.762
  496   1HB   ALA  69          1HB       ALA  69   0.093  14.267  -6.733
  497   2HB   ALA  69          2HB       ALA  69  -0.021  15.822  -7.591
  498   3HB   ALA  69          3HB       ALA  69   1.556  15.013  -7.419
  499    H    ALA  70           H        ALA  70  -0.783  15.257  -3.720
  500    HA   ALA  70           HA       ALA  70  -2.896  17.026  -4.416
  501   1HB   ALA  70          1HB       ALA  70  -2.512  15.546  -1.794
  502   2HB   ALA  70          2HB       ALA  70  -4.036  16.011  -2.588
  503   3HB   ALA  70          3HB       ALA  70  -3.025  14.725  -3.288
  504    H    ASN  71           H        ASN  71  -1.074  16.772  -1.283
  505    HA   ASN  71           HA       ASN  71  -1.683  19.479  -0.732
  506   1HB   ASN  71          1HB       ASN  71   0.053  17.369   0.634
  507   2HB   ASN  71          2HB       ASN  71  -0.050  19.004   1.255
  508   1HD2  ASN  71          1HD2      ASN  71  -1.980  16.197   0.295
  509   2HD2  ASN  71          2HD2      ASN  71  -3.289  16.427   1.405
  510    H    CYS  72           H        CYS  72   1.492  17.673  -0.798
  511    HA   CYS  72           HA       CYS  72   3.006  19.999  -1.148
  512   1HB   CYS  72          1HB       CYS  72   3.897  17.222  -1.911
  513   2HB   CYS  72          2HB       CYS  72   4.882  18.574  -1.388
  514    H    ALA  73           H        ALA  73   4.717  19.783  -3.235
  515    HA   ALA  73           HA       ALA  73   3.892  18.861  -5.654
  516   1HB   ALA  73          1HB       ALA  73   3.111  21.588  -6.104
  517   2HB   ALA  73          2HB       ALA  73   2.152  20.106  -6.333
  518   3HB   ALA  73          3HB       ALA  73   2.140  20.939  -4.760
  519    H    SER  74           H        SER  74   5.008  21.919  -4.053
  520    HA   SER  74           HA       SER  74   7.008  22.236  -6.067
  521   1HB   SER  74          1HB       SER  74   5.680  24.073  -4.710
  522   2HB   SER  74          2HB       SER  74   6.900  23.808  -3.481
  523    HG   SER  74           HG       SER  74   7.959  25.291  -4.643
  524    H    GLU  75           H        GLU  75   6.739  21.204  -2.634
  525    HA   GLU  75           HA       GLU  75   9.389  21.206  -1.983
  526   1HB   GLU  75          1HB       GLU  75   7.240  19.222  -1.114
  527   2HB   GLU  75          2HB       GLU  75   8.765  19.474  -0.289
  528   1HG   GLU  75          1HG       GLU  75   7.023  21.883  -0.815
  529   2HG   GLU  75          2HG       GLU  75   6.535  20.777   0.453
  530    H    CYS  76           H        CYS  76   7.625  19.139  -4.200
  531    HA   CYS  76           HA       CYS  76   9.877  17.276  -4.255
  532   1HB   CYS  76          1HB       CYS  76   6.975  17.027  -4.847
  533   2HB   CYS  76          2HB       CYS  76   8.068  16.105  -5.860
  534    HA   PRO  77           HA       PRO  77  10.738  19.643  -7.915
  535   1HB   PRO  77          1HB       PRO  77  13.371  18.944  -8.133
  536   2HB   PRO  77          2HB       PRO  77  12.818  20.310  -7.185
  537   1HG   PRO  77          1HG       PRO  77  13.756  17.667  -6.252
  538   2HG   PRO  77          2HG       PRO  77  13.609  19.161  -5.349
  539   1HD   PRO  77          1HD       PRO  77  11.835  16.910  -5.243
  540   2HD   PRO  77          2HD       PRO  77  11.626  18.447  -4.429
  541    H    LYS  78           H        LYS  78  11.928  19.114 -10.103
  542    HA   LYS  78           HA       LYS  78  10.513  16.842 -11.053
  543   1HB   LYS  78          1HB       LYS  78  10.903  18.944 -12.344
  544   2HB   LYS  78          2HB       LYS  78  12.604  18.539 -12.448
  545   1HG   LYS  78          1HG       LYS  78  11.577  17.755 -14.489
  546   2HG   LYS  78          2HG       LYS  78  11.952  16.334 -13.535
  547   1HD   LYS  78          1HD       LYS  78   9.676  15.996 -12.907
  548   2HD   LYS  78          2HD       LYS  78   9.222  17.642 -13.302
  549   1HE   LYS  78          1HE       LYS  78   9.818  17.068 -15.758
  550   2HE   LYS  78          2HE       LYS  78   9.902  15.394 -15.247
  551   1HZ   LYS  78          1HZ       LYS  78   7.724  15.318 -15.389
  552   2HZ   LYS  78          2HZ       LYS  78   7.557  16.472 -14.245
  553   3HZ   LYS  78          3HZ       LYS  78   7.642  16.891 -15.821
  554    H    HIS  79           H        HIS  79  11.290  14.815 -11.711
  555    HA   HIS  79           HA       HIS  79  12.729  13.143 -11.948
  556   1HB   HIS  79          1HB       HIS  79  14.460  15.277 -12.165
  557   2HB   HIS  79          2HB       HIS  79  15.143  14.389 -10.817
  558    HD1  HIS  79           1HD      HIS  79  17.195  13.848 -12.435
  559    HD2  HIS  79           2HD      HIS  79  13.527  12.136 -13.535
  560    HE1  HIS  79           1HE      HIS  79  17.737  12.037 -14.149
  561    H    GLU  80           H        GLU  80  13.474  15.156  -9.017
  562    HA   GLU  80           HA       GLU  80  13.869  12.842  -7.445
  563   1HB   GLU  80          1HB       GLU  80  13.919  15.795  -7.054
  564   2HB   GLU  80          2HB       GLU  80  13.500  14.871  -5.626
  565   1HG   GLU  80          1HG       GLU  80  15.854  14.961  -5.502
  566   2HG   GLU  80          2HG       GLU  80  15.572  13.385  -6.214
  567    H    HIS  81           H        HIS  81  12.560  12.517  -5.327
  568    HA   HIS  81           HA       HIS  81   9.844  13.405  -5.439
  569   1HB   HIS  81          1HB       HIS  81   8.931  11.056  -5.456
  570   2HB   HIS  81          2HB       HIS  81   9.527  11.661  -6.989
  571    HD1  HIS  81           1HD      HIS  81   9.736   8.775  -4.826
  572    HD2  HIS  81           2HD      HIS  81  12.349  10.690  -7.491
  573    HE1  HIS  81           1HE      HIS  81  11.556   7.077  -5.388
  574    H    LYS  82           H        LYS  82  12.207  11.021  -4.075
  575    HA   LYS  82           HA       LYS  82  10.904  11.198  -1.502
  576   1HB   LYS  82          1HB       LYS  82  12.720   9.372  -2.860
  577   2HB   LYS  82          2HB       LYS  82  13.290   9.752  -1.248
  578   1HG   LYS  82          1HG       LYS  82  10.606   9.390  -0.750
  579   2HG   LYS  82          2HG       LYS  82  10.828   8.288  -2.095
  580   1HD   LYS  82          1HD       LYS  82  13.014   8.089  -0.121
  581   2HD   LYS  82          2HD       LYS  82  11.447   7.766   0.595
  582   1HE   LYS  82          1HE       LYS  82  10.970   6.029  -1.075
  583   2HE   LYS  82          2HE       LYS  82  12.416   6.435  -1.978
  584   1HZ   LYS  82          1HZ       LYS  82  13.342   5.968   0.503
  585   2HZ   LYS  82          2HZ       LYS  82  12.155   4.855   0.366
  586   3HZ   LYS  82          3HZ       LYS  82  13.366   4.896  -0.728
  587    H    SER  83           H        SER  83  11.495  13.732  -2.038
  588    HA   SER  83           HA       SER  83  14.158  14.292  -1.121
  589   1HB   SER  83          1HB       SER  83  13.877  16.281  -2.177
  590   2HB   SER  83          2HB       SER  83  12.420  15.578  -2.852
  591    HG   SER  83           HG       SER  83  11.961  17.617  -1.851
  592    H    ASP  84           H        ASP  84  14.692  15.159   0.919
  593    HA   ASP  84           HA       ASP  84  13.113  14.500   3.032
  594   1HB   ASP  84          1HB       ASP  84  15.383  16.464   2.640
  595   2HB   ASP  84          2HB       ASP  84  14.568  16.418   4.190
  596    H    THR  85           H        THR  85  13.477  17.617   1.230
  597    HA   THR  85           HA       THR  85  11.850  19.163   2.933
  598    HB   THR  85           HB       THR  85  13.547  19.573   0.768
  599    HG1  THR  85           1HG      THR  85  13.235  21.457   1.883
  600   1HG2  THR  85          1HG2      THR  85  11.312  19.053  -0.629
  601   2HG2  THR  85          2HG2      THR  85  10.880  20.701  -0.111
  602   3HG2  THR  85          3HG2      THR  85  12.354  20.427  -1.071
  603    H    CYS  86           H        CYS  86  11.098  16.628   0.694
  604    HA   CYS  86           HA       CYS  86   8.392  17.623   0.359
  605   1HB   CYS  86          1HB       CYS  86   9.900  16.502  -1.462
  606   2HB   CYS  86          2HB       CYS  86   9.383  15.003  -0.715
  607    H    ARG  87           H        ARG  87  10.315  14.918   1.791
  608    HA   ARG  87           HA       ARG  87   8.184  13.435   2.682
  609   1HB   ARG  87          1HB       ARG  87  11.006  13.772   3.808
  610   2HB   ARG  87          2HB       ARG  87   9.890  12.558   4.401
  611   1HG   ARG  87          1HG       ARG  87   9.681  11.973   1.781
  612   2HG   ARG  87          2HG       ARG  87  11.260  12.732   1.719
  613   1HD   ARG  87          1HD       ARG  87  11.730  10.424   2.110
  614   2HD   ARG  87          2HD       ARG  87  11.933  11.177   3.679
  615    HE   ARG  87           HE       ARG  87   9.204  10.217   3.211
  616   1HH1  ARG  87          2HH2      ARG  87  12.416   9.328   4.342
  617   2HH1  ARG  87          1HH2      ARG  87  11.849   8.006   5.307
  618   1HH2  ARG  87          2HH1      ARG  87   8.456   8.474   4.485
  619   2HH2  ARG  87          1HH1      ARG  87   9.582   7.517   5.390
  620    H    ALA  88           H        ALA  88   9.796  16.332   4.009
  621    HA   ALA  88           HA       ALA  88   8.631  16.132   6.593
  622   1HB   ALA  88          1HB       ALA  88  10.273  17.631   6.909
  623   2HB   ALA  88          2HB       ALA  88  10.501  17.805   5.152
  624   3HB   ALA  88          3HB       ALA  88   9.312  18.823   6.000
  625    H    CYS  89           H        CYS  89   7.696  17.500   3.437
  626    HA   CYS  89           HA       CYS  89   5.603  19.089   4.483
  627   1HB   CYS  89          1HB       CYS  89   6.422  19.790   2.423
  628   2HB   CYS  89          2HB       CYS  89   6.415  18.174   1.745
  629    H    MET  90           H        MET  90   5.694  15.977   2.584
  630    HA   MET  90           HA       MET  90   3.015  15.433   2.825
  631   1HB   MET  90          1HB       MET  90   3.616  13.272   1.968
  632   2HB   MET  90          2HB       MET  90   4.901  14.313   1.390
  633   1HG   MET  90          1HG       MET  90   6.311  12.784   2.343
  634   2HG   MET  90          2HG       MET  90   5.907  13.570   3.857
  635   1HE   MET  90          1HE       MET  90   4.979  11.051   1.270
  636   2HE   MET  90          2HE       MET  90   4.191   9.709   2.132
  637   3HE   MET  90          3HE       MET  90   3.266  11.177   1.735
  638    H    LYS  91           H        LYS  91   5.603  15.181   5.184
  639    HA   LYS  91           HA       LYS  91   4.203  13.286   6.832
  640   1HB   LYS  91          1HB       LYS  91   6.537  13.096   6.932
  641   2HB   LYS  91          2HB       LYS  91   6.782  14.827   7.044
  642   1HG   LYS  91          1HG       LYS  91   6.198  14.911   9.318
  643   2HG   LYS  91          2HG       LYS  91   5.183  13.486   9.224
  644   1HD   LYS  91          1HD       LYS  91   6.905  12.212   9.959
  645   2HD   LYS  91          2HD       LYS  91   7.826  12.633   8.529
  646   1HE   LYS  91          1HE       LYS  91   8.310  14.892   9.861
  647   2HE   LYS  91          2HE       LYS  91   7.874  13.934  11.262
  648   1HZ   LYS  91          1HZ       LYS  91   9.512  12.263  10.238
  649   2HZ   LYS  91          2HZ       LYS  91  10.099  13.553   9.427
  650   3HZ   LYS  91          3HZ       LYS  91  10.096  13.547  11.061
  651    H    THR  92           H        THR  92   3.779  16.540   6.060
  652    HA   THR  92           HA       THR  92   2.984  17.337   8.745
  653    HB   THR  92           HB       THR  92   2.873  18.853   6.087
  654    HG1  THR  92           1HG      THR  92   5.063  18.586   6.392
  655   1HG2  THR  92          1HG2      THR  92   2.617  20.791   7.363
  656   2HG2  THR  92          2HG2      THR  92   1.776  19.653   8.443
  657   3HG2  THR  92          3HG2      THR  92   3.469  20.098   8.764
  658    H    ASN  93           H        ASN  93   1.531  16.618   5.531
  659    HA   ASN  93           HA       ASN  93  -1.040  16.695   6.903
  660   1HB   ASN  93          1HB       ASN  93  -1.784  16.730   4.297
  661   2HB   ASN  93          2HB       ASN  93  -1.402  18.204   5.165
  662   1HD2  ASN  93          1HD2      ASN  93   0.666  19.149   4.955
  663   2HD2  ASN  93          2HD2      ASN  93   1.656  18.880   3.559
  664    H    CYS  94           H        CYS  94   0.797  15.137   4.162
  665    HA   CYS  94           HA       CYS  94  -0.918  12.908   4.033
  666   1HB   CYS  94          1HB       CYS  94   1.913  13.195   3.008
  667   2HB   CYS  94          2HB       CYS  94   0.766  11.953   2.545
  668    H    LYS  95           H        LYS  95  -0.805  12.741   6.576
  669    HA   LYS  95           HA       LYS  95  -0.074  11.752   8.420
  670   1HB   LYS  95          1HB       LYS  95  -0.627   9.855   6.660
  671   2HB   LYS  95          2HB       LYS  95   1.089   9.522   6.788
  672   1HG   LYS  95          1HG       LYS  95  -0.212   9.955   9.417
  673   2HG   LYS  95          2HG       LYS  95  -0.877   8.594   8.536
  674   1HD   LYS  95          1HD       LYS  95   1.825   8.196   8.132
  675   2HD   LYS  95          2HD       LYS  95   1.839   8.942   9.717
  676   1HE   LYS  95          1HE       LYS  95   0.778   7.152  10.729
  677   2HE   LYS  95          2HE       LYS  95  -0.234   6.823   9.338
  678   1HZ   LYS  95          1HZ       LYS  95   2.636   6.211   9.493
  679   2HZ   LYS  95          2HZ       LYS  95   1.433   5.125   9.692
  680   3HZ   LYS  95          3HZ       LYS  95   1.648   5.849   8.244
  Start of MODEL   18
    1   1H    ILE   1           H        ILE   1 -10.505  19.550  15.278
    2    HA   ILE   1           HA       ILE   1  -8.166  18.694  14.891
    3    HB   ILE   1           HB       ILE   1  -9.725  16.189  14.254
    4   1HG1  ILE   1          1HG1      ILE   1  -9.565  16.723  16.716
    5   2HG1  ILE   1          2HG1      ILE   1  -8.880  15.189  16.221
    6   1HG2  ILE   1          1HG2      ILE   1  -6.796  16.913  14.097
    7   2HG2  ILE   1          2HG2      ILE   1  -7.379  15.232  14.124
    8   3HG2  ILE   1          3HG2      ILE   1  -7.866  16.322  12.803
    9   1HD1  ILE   1          1HD1      ILE   1  -7.120  17.653  16.352
   10   2HD1  ILE   1          2HD1      ILE   1  -7.494  16.730  17.827
   11   3HD1  ILE   1          3HD1      ILE   1  -6.653  15.940  16.472
   12    H    SER   2           H        SER   2  -7.483  19.393  12.905
   13    HA   SER   2           HA       SER   2  -9.557  19.471  10.854
   14   1HB   SER   2          1HB       SER   2  -8.996  21.720  11.890
   15   2HB   SER   2          2HB       SER   2  -7.361  21.543  11.284
   16    HG   SER   2           HG       SER   2  -8.726  22.800   9.845
   17    H    GLU   3           H        GLU   3  -5.982  19.599  11.502
   18    HA   GLU   3           HA       GLU   3  -5.630  17.732   9.340
   19   1HB   GLU   3          1HB       GLU   3  -5.205  20.488   8.901
   20   2HB   GLU   3          2HB       GLU   3  -3.598  19.836   9.150
   21   1HG   GLU   3          1HG       GLU   3  -4.637  17.904   7.503
   22   2HG   GLU   3          2HG       GLU   3  -5.550  19.293   6.947
   23    H    PHE   4           H        PHE   4  -4.567  16.098  10.378
   24    HA   PHE   4           HA       PHE   4  -2.024  16.563  11.497
   25   1HB   PHE   4          1HB       PHE   4  -4.387  16.829  13.184
   26   2HB   PHE   4          2HB       PHE   4  -3.566  15.356  13.658
   27    HD1  PHE   4           1HD      PHE   4  -1.231  15.456  14.494
   28    HD2  PHE   4           2HD      PHE   4  -3.456  18.976  13.674
   29    HE1  PHE   4           1HE      PHE   4   0.393  16.800  15.856
   30    HE2  PHE   4           2HE      PHE   4  -1.832  20.320  15.037
   31    HZ   PHE   4           HZ       PHE   4   0.074  19.216  16.111
   32    H    ALA   5           H        ALA   5  -0.893  14.580  11.902
   33    HA   ALA   5           HA       ALA   5  -0.556  12.370  11.910
   34   1HB   ALA   5          1HB       ALA   5  -3.290  11.493  11.211
   35   2HB   ALA   5          2HB       ALA   5  -2.235  10.990  12.553
   36   3HB   ALA   5          3HB       ALA   5  -3.198  12.481  12.689
   37    HA   PRO   6           HA       PRO   6  -0.143  11.721   7.655
   38   1HB   PRO   6          1HB       PRO   6   0.633   9.103   7.546
   39   2HB   PRO   6          2HB       PRO   6   1.727  10.410   7.952
   40   1HG   PRO   6          1HG       PRO   6   0.498   8.399   9.737
   41   2HG   PRO   6          2HG       PRO   6   1.891   9.422  10.030
   42   1HD   PRO   6          1HD       PRO   6  -0.756   9.786  11.074
   43   2HD   PRO   6          2HD       PRO   6   0.607  10.870  11.272
   44    H    VAL   7           H        VAL   7  -0.987  10.849   5.682
   45    HA   VAL   7           HA       VAL   7  -3.732  10.151   6.080
   46    HB   VAL   7           HB       VAL   7  -1.978  10.471   3.642
   47   1HG1  VAL   7          1HG1      VAL   7  -3.891   8.848   3.315
   48   2HG1  VAL   7          2HG1      VAL   7  -4.997  10.200   3.657
   49   3HG1  VAL   7          3HG1      VAL   7  -3.908  10.275   2.251
   50   1HG2  VAL   7          1HG2      VAL   7  -4.271  12.256   4.430
   51   2HG2  VAL   7          2HG2      VAL   7  -2.671  12.460   5.182
   52   3HG2  VAL   7          3HG2      VAL   7  -2.851  12.615   3.418
   53    H    ASP   8           H        ASP   8  -1.342   8.543   3.889
   54    HA   ASP   8           HA       ASP   8  -0.746   6.450   3.699
   55   1HB   ASP   8          1HB       ASP   8  -2.528   5.631   6.025
   56   2HB   ASP   8          2HB       ASP   8  -1.113   4.795   5.418
   57    H    CYS   9           H        CYS   9  -1.665   5.303   1.989
   58    HA   CYS   9           HA       CYS   9  -4.485   5.444   1.597
   59   1HB   CYS   9          1HB       CYS   9  -2.316   5.259  -0.064
   60   2HB   CYS   9          2HB       CYS   9  -2.932   3.619  -0.114
   61    H    LYS  10           H        LYS  10  -4.814   4.300   3.815
   62    HA   LYS  10           HA       LYS  10  -4.401   1.419   3.605
   63   1HB   LYS  10          1HB       LYS  10  -4.109   3.248   5.707
   64   2HB   LYS  10          2HB       LYS  10  -5.578   2.373   6.090
   65   1HG   LYS  10          1HG       LYS  10  -3.882   0.336   5.208
   66   2HG   LYS  10          2HG       LYS  10  -2.775   1.413   6.036
   67   1HD   LYS  10          1HD       LYS  10  -3.532  -0.014   7.767
   68   2HD   LYS  10          2HD       LYS  10  -4.512   1.424   7.980
   69   1HE   LYS  10          1HE       LYS  10  -6.025  -0.450   8.110
   70   2HE   LYS  10          2HE       LYS  10  -6.319   0.310   6.559
   71   1HZ   LYS  10          1HZ       LYS  10  -5.702  -1.532   5.549
   72   2HZ   LYS  10          2HZ       LYS  10  -4.280  -1.614   6.348
   73   3HZ   LYS  10          3HZ       LYS  10  -5.620  -2.287   6.995
   74    H    GLY  11           H        GLY  11  -7.047   3.390   5.095
   75   1HA   GLY  11          1HA       GLY  11  -9.022   1.482   4.343
   76   2HA   GLY  11          2HA       GLY  11  -9.279   3.057   5.069
   77    H    GLN  12           H        GLN  12  -7.317   3.752   2.487
   78    HA   GLN  12           HA       GLN  12  -9.635   4.414   0.884
   79   1HB   GLN  12          1HB       GLN  12  -6.871   5.531   1.211
   80   2HB   GLN  12          2HB       GLN  12  -7.604   5.699  -0.372
   81   1HG   GLN  12          1HG       GLN  12  -9.372   6.378   1.948
   82   2HG   GLN  12          2HG       GLN  12  -8.016   7.458   1.689
   83   1HE2  GLN  12          1HE2      GLN  12  -8.132   8.963   0.182
   84   2HE2  GLN  12          2HE2      GLN  12  -9.354   9.112  -1.036
   85    H    CYS  13           H        CYS  13  -6.820   2.314   1.002
   86    HA   CYS  13           HA       CYS  13  -7.199   1.651  -1.818
   87   1HB   CYS  13          1HB       CYS  13  -4.895   1.287   0.083
   88   2HB   CYS  13          2HB       CYS  13  -5.021   0.322  -1.375
   89    H    THR  14           H        THR  14  -9.341   0.702  -0.776
   90    HA   THR  14           HA       THR  14  -8.820  -1.882   0.498
   91    HB   THR  14           HB       THR  14 -11.225  -0.032   0.194
   92    HG1  THR  14           1HG      THR  14 -10.470   0.337   2.240
   93   1HG2  THR  14          1HG2      THR  14 -11.689  -2.321   1.931
   94   2HG2  THR  14          2HG2      THR  14 -12.682  -1.751   0.568
   95   3HG2  THR  14          3HG2      THR  14 -11.351  -2.896   0.280
   96    H    THR  15           H        THR  15 -10.311  -0.400  -2.420
   97    HA   THR  15           HA       THR  15 -11.267  -2.831  -3.473
   98    HB   THR  15           HB       THR  15 -10.809   0.002  -4.353
   99    HG1  THR  15           1HG      THR  15 -12.848  -2.070  -4.764
  100   1HG2  THR  15          1HG2      THR  15 -11.267  -0.465  -6.685
  101   2HG2  THR  15          2HG2      THR  15  -9.875  -1.488  -6.254
  102   3HG2  THR  15          3HG2      THR  15 -11.504  -2.199  -6.357
  103    HA   PRO  16           HA       PRO  16  -7.091  -2.973  -5.654
  104   1HB   PRO  16          1HB       PRO  16  -5.024  -1.447  -4.721
  105   2HB   PRO  16          2HB       PRO  16  -6.036  -0.969  -6.070
  106   1HG   PRO  16          1HG       PRO  16  -6.047   0.045  -3.293
  107   2HG   PRO  16          2HG       PRO  16  -6.728   0.778  -4.732
  108   1HD   PRO  16          1HD       PRO  16  -8.164  -0.588  -2.659
  109   2HD   PRO  16          2HD       PRO  16  -8.828   0.043  -4.153
  110    H    CYS  17           H        CYS  17  -7.296  -2.678  -2.243
  111    HA   CYS  17           HA       CYS  17  -5.409  -4.913  -2.051
  112   1HB   CYS  17          1HB       CYS  17  -6.149  -3.102   0.237
  113   2HB   CYS  17          2HB       CYS  17  -4.802  -4.215   0.114
  114    H    GLU  18           H        GLU  18  -8.276  -5.022  -2.824
  115    HA   GLU  18           HA       GLU  18  -9.700  -5.779  -0.489
  116   1HB   GLU  18          1HB       GLU  18 -10.325  -5.105  -3.184
  117   2HB   GLU  18          2HB       GLU  18 -10.897  -6.746  -2.960
  118   1HG   GLU  18          1HG       GLU  18 -11.778  -5.651  -0.619
  119   2HG   GLU  18          2HG       GLU  18 -11.803  -4.218  -1.626
  120    HA   PRO  19           HA       PRO  19  -8.842 -10.062  -2.353
  121   1HB   PRO  19          1HB       PRO  19  -7.002 -10.324  -4.356
  122   2HB   PRO  19          2HB       PRO  19  -8.726 -10.203  -4.648
  123   1HG   PRO  19          1HG       PRO  19  -6.631  -8.156  -5.046
  124   2HG   PRO  19          2HG       PRO  19  -8.250  -8.213  -5.712
  125   1HD   PRO  19          1HD       PRO  19  -7.345  -6.574  -3.539
  126   2HD   PRO  19          2HD       PRO  19  -8.989  -6.717  -4.130
  127    H    LEU  20           H        LEU  20  -6.048  -7.958  -2.316
  128    HA   LEU  20           HA       LEU  20  -4.210  -9.843  -1.456
  129   1HB   LEU  20          1HB       LEU  20  -3.201  -7.936  -2.110
  130   2HB   LEU  20          2HB       LEU  20  -4.460  -6.900  -1.467
  131    HG   LEU  20           HG       LEU  20  -3.519  -7.524   0.862
  132   1HD1  LEU  20          1HD1      LEU  20  -0.826  -7.826  -0.154
  133   2HD1  LEU  20          2HD1      LEU  20  -1.711  -8.800   1.044
  134   3HD1  LEU  20          3HD1      LEU  20  -1.867  -9.166  -0.691
  135   1HD2  LEU  20          1HD2      LEU  20  -3.258  -5.354  -0.614
  136   2HD2  LEU  20          2HD2      LEU  20  -2.329  -5.569   0.889
  137   3HD2  LEU  20          3HD2      LEU  20  -1.558  -5.879  -0.685
  138    H    THR  21           H        THR  21  -6.125  -7.489   0.552
  139    HA   THR  21           HA       THR  21  -5.339  -8.436   3.014
  140    HB   THR  21           HB       THR  21  -7.854  -7.099   1.930
  141    HG1  THR  21           1HG      THR  21  -5.600  -6.451   3.700
  142   1HG2  THR  21          1HG2      THR  21  -7.504  -8.385   4.549
  143   2HG2  THR  21          2HG2      THR  21  -7.645  -6.618   4.716
  144   3HG2  THR  21          3HG2      THR  21  -8.931  -7.541   3.902
  145    H    ALA  22           H        ALA  22  -8.124  -9.554   0.990
  146    HA   ALA  22           HA       ALA  22  -9.082 -11.418   2.794
  147   1HB   ALA  22          1HB       ALA  22  -9.358 -10.743  -0.044
  148   2HB   ALA  22          2HB       ALA  22  -9.526 -12.489   0.253
  149   3HB   ALA  22          3HB       ALA  22 -10.578 -11.336   1.108
  150    H    CYS  23           H        CYS  23  -6.224 -11.437   0.704
  151    HA   CYS  23           HA       CYS  23  -5.857 -14.225   0.702
  152   1HB   CYS  23          1HB       CYS  23  -4.798 -12.289  -0.745
  153   2HB   CYS  23          2HB       CYS  23  -3.559 -12.319   0.494
  154    H    LYS  24           H        LYS  24  -4.099 -11.562   2.473
  155    HA   LYS  24           HA       LYS  24  -2.665 -13.148   4.173
  156   1HB   LYS  24          1HB       LYS  24  -3.533 -10.339   4.069
  157   2HB   LYS  24          2HB       LYS  24  -3.227 -10.917   5.694
  158   1HG   LYS  24          1HG       LYS  24  -0.970 -11.124   5.339
  159   2HG   LYS  24          2HG       LYS  24  -1.181 -11.795   3.734
  160   1HD   LYS  24          1HD       LYS  24  -0.673  -9.789   2.814
  161   2HD   LYS  24          2HD       LYS  24  -2.056  -9.064   3.609
  162   1HE   LYS  24          1HE       LYS  24  -0.787  -8.186   5.339
  163   2HE   LYS  24          2HE       LYS  24   0.326  -9.539   5.359
  164   1HZ   LYS  24          1HZ       LYS  24   1.492  -8.670   3.580
  165   2HZ   LYS  24          2HZ       LYS  24   0.293  -7.663   3.117
  166   3HZ   LYS  24          3HZ       LYS  24   1.150  -7.343   4.469
  167    H    GLU  25           H        GLU  25  -6.017 -11.852   4.603
  168    HA   GLU  25           HA       GLU  25  -6.431 -12.762   7.132
  169   1HB   GLU  25          1HB       GLU  25  -8.001 -11.717   4.976
  170   2HB   GLU  25          2HB       GLU  25  -8.845 -13.131   5.573
  171   1HG   GLU  25          1HG       GLU  25  -7.743 -11.278   7.658
  172   2HG   GLU  25          2HG       GLU  25  -9.077 -10.658   6.706
  173    H    LYS  26           H        LYS  26  -7.635 -14.453   4.137
  174    HA   LYS  26           HA       LYS  26  -8.441 -16.767   5.208
  175   1HB   LYS  26          1HB       LYS  26  -8.139 -15.858   2.701
  176   2HB   LYS  26          2HB       LYS  26  -6.802 -16.991   2.725
  177   1HG   LYS  26          1HG       LYS  26  -8.249 -18.710   2.445
  178   2HG   LYS  26          2HG       LYS  26  -9.014 -18.320   3.972
  179   1HD   LYS  26          1HD       LYS  26 -10.779 -17.222   2.971
  180   2HD   LYS  26          2HD       LYS  26  -9.775 -16.527   1.714
  181   1HE   LYS  26          1HE       LYS  26  -9.734 -18.657   0.486
  182   2HE   LYS  26          2HE       LYS  26 -10.561 -19.478   1.795
  183   1HZ   LYS  26          1HZ       LYS  26 -12.503 -18.669   1.131
  184   2HZ   LYS  26          2HZ       LYS  26 -11.934 -17.166   0.839
  185   3HZ   LYS  26          3HZ       LYS  26 -11.768 -18.335  -0.289
  186    H    CYS  27           H        CYS  27  -5.040 -15.765   4.625
  187    HA   CYS  27           HA       CYS  27  -3.924 -18.253   5.257
  188   1HB   CYS  27          1HB       CYS  27  -2.653 -15.527   5.561
  189   2HB   CYS  27          2HB       CYS  27  -1.823 -17.066   5.448
  190    H    ALA  28           H        ALA  28  -4.234 -15.165   7.172
  191    HA   ALA  28           HA       ALA  28  -3.246 -15.936   9.544
  192   1HB   ALA  28          1HB       ALA  28  -4.002 -13.856   9.929
  193   2HB   ALA  28          2HB       ALA  28  -5.115 -13.963   8.543
  194   3HB   ALA  28          3HB       ALA  28  -5.634 -14.532  10.148
  195    H    GLU  29           H        GLU  29  -6.650 -16.516   8.414
  196    HA   GLU  29           HA       GLU  29  -7.541 -17.796  10.633
  197   1HB   GLU  29          1HB       GLU  29  -8.228 -17.919   7.708
  198   2HB   GLU  29          2HB       GLU  29  -8.937 -19.133   8.754
  199   1HG   GLU  29          1HG       GLU  29  -9.131 -16.108   9.144
  200   2HG   GLU  29          2HG       GLU  29 -10.416 -17.150   8.567
  201    H    SER  30           H        SER  30  -6.078 -19.333   7.674
  202    HA   SER  30           HA       SER  30  -6.105 -21.890   8.727
  203   1HB   SER  30          1HB       SER  30  -5.164 -20.556   6.351
  204   2HB   SER  30          2HB       SER  30  -3.874 -21.592   6.928
  205    HG   SER  30           HG       SER  30  -6.036 -22.332   5.548
  206    H    CYS  31           H        CYS  31  -4.006 -19.121   9.274
  207    HA   CYS  31           HA       CYS  31  -2.064 -20.859  10.601
  208   1HB   CYS  31          1HB       CYS  31  -1.760 -17.959   9.799
  209   2HB   CYS  31          2HB       CYS  31  -0.524 -18.979  10.507
  210    H    GLU  32           H        GLU  32  -4.393 -20.759  11.984
  211    HA   GLU  32           HA       GLU  32  -4.533 -18.456  13.634
  212   1HB   GLU  32          1HB       GLU  32  -6.151 -20.787  13.069
  213   2HB   GLU  32          2HB       GLU  32  -5.966 -20.644  14.806
  214   1HG   GLU  32          1HG       GLU  32  -6.727 -18.256  13.075
  215   2HG   GLU  32          2HG       GLU  32  -7.934 -19.356  13.709
  216    H    THR  33           H        THR  33  -3.363 -21.857  13.968
  217    HA   THR  33           HA       THR  33  -1.847 -20.976  16.323
  218    HB   THR  33           HB       THR  33  -2.503 -23.033  17.491
  219    HG1  THR  33           1HG      THR  33  -3.992 -23.446  14.993
  220   1HG2  THR  33          1HG2      THR  33  -4.224 -21.165  17.565
  221   2HG2  THR  33          2HG2      THR  33  -5.007 -21.895  16.142
  222   3HG2  THR  33          3HG2      THR  33  -4.947 -22.787  17.681
  223    H    SER  34           H        SER  34  -0.348 -20.698  14.344
  224    HA   SER  34           HA       SER  34   0.846 -23.297  13.783
  225   1HB   SER  34          1HB       SER  34   0.059 -21.250  12.029
  226   2HB   SER  34          2HB       SER  34   1.796 -21.047  12.139
  227    HG   SER  34           HG       SER  34   2.118 -22.885  11.063
  228    H    ALA  35           H        ALA  35   3.215 -23.460  13.871
  229    HA   ALA  35           HA       ALA  35   4.396 -22.493  16.082
  230   1HB   ALA  35          1HB       ALA  35   6.449 -23.225  15.134
  231   2HB   ALA  35          2HB       ALA  35   5.199 -24.227  14.358
  232   3HB   ALA  35          3HB       ALA  35   5.911 -22.854  13.478
  233    H    ASP  36           H        ASP  36   5.162 -21.113  12.804
  234    HA   ASP  36           HA       ASP  36   5.639 -18.601  14.191
  235   1HB   ASP  36          1HB       ASP  36   6.576 -19.621  11.468
  236   2HB   ASP  36          2HB       ASP  36   6.901 -18.004  12.063
  237    H    LYS  37           H        LYS  37   3.450 -17.779  14.160
  238    HA   LYS  37           HA       LYS  37   1.695 -18.000  12.039
  239   1HB   LYS  37          1HB       LYS  37   1.829 -16.672  14.578
  240   2HB   LYS  37          2HB       LYS  37   1.229 -15.532  13.390
  241   1HG   LYS  37          1HG       LYS  37  -0.500 -17.159  12.660
  242   2HG   LYS  37          2HG       LYS  37   0.127 -18.356  13.775
  243   1HD   LYS  37          1HD       LYS  37  -1.648 -17.444  15.013
  244   2HD   LYS  37          2HD       LYS  37  -0.285 -16.526  15.623
  245   1HE   LYS  37          1HE       LYS  37  -1.233 -15.156  13.280
  246   2HE   LYS  37          2HE       LYS  37  -2.643 -15.556  14.241
  247   1HZ   LYS  37          1HZ       LYS  37  -0.752 -13.592  14.728
  248   2HZ   LYS  37          2HZ       LYS  37  -2.085 -13.942  15.603
  249   3HZ   LYS  37          3HZ       LYS  37  -0.662 -14.661  15.958
  250    H    LYS  38           H        LYS  38   4.154 -15.458  12.783
  251    HA   LYS  38           HA       LYS  38   3.511 -13.727  10.735
  252   1HB   LYS  38          1HB       LYS  38   5.304 -13.733  12.750
  253   2HB   LYS  38          2HB       LYS  38   6.385 -14.090  11.419
  254   1HG   LYS  38          1HG       LYS  38   6.413 -11.797  11.207
  255   2HG   LYS  38          2HG       LYS  38   4.972 -12.087  10.255
  256   1HD   LYS  38          1HD       LYS  38   3.529 -11.651  12.199
  257   2HD   LYS  38          2HD       LYS  38   4.920 -11.536  13.258
  258   1HE   LYS  38          1HE       LYS  38   5.104  -9.719  10.927
  259   2HE   LYS  38          2HE       LYS  38   3.700  -9.399  11.925
  260   1HZ   LYS  38          1HZ       LYS  38   6.490  -9.138  12.578
  261   2HZ   LYS  38          2HZ       LYS  38   5.213  -8.252  13.082
  262   3HZ   LYS  38          3HZ       LYS  38   5.534  -9.693  13.780
  263    H    THR  39           H        THR  39   6.160 -16.222  10.692
  264    HA   THR  39           HA       THR  39   6.735 -16.014   8.007
  265    HB   THR  39           HB       THR  39   6.794 -18.582   9.664
  266    HG1  THR  39           1HG      THR  39   8.662 -16.326   9.527
  267   1HG2  THR  39          1HG2      THR  39   8.947 -17.411   7.854
  268   2HG2  THR  39          2HG2      THR  39   8.774 -19.090   8.421
  269   3HG2  THR  39          3HG2      THR  39   7.663 -18.448   7.186
  270    H    CYS  40           H        CYS  40   4.274 -18.115   9.613
  271    HA   CYS  40           HA       CYS  40   3.477 -19.573   7.489
  272   1HB   CYS  40          1HB       CYS  40   2.636 -19.586   9.900
  273   2HB   CYS  40          2HB       CYS  40   1.512 -18.333   9.412
  274    H    ARG  41           H        ARG  41   1.917 -16.443   8.531
  275    HA   ARG  41           HA       ARG  41   0.451 -16.154   6.233
  276   1HB   ARG  41          1HB       ARG  41   1.470 -14.193   8.323
  277   2HB   ARG  41          2HB       ARG  41   0.540 -13.612   6.956
  278   1HG   ARG  41          1HG       ARG  41  -1.322 -15.166   7.548
  279   2HG   ARG  41          2HG       ARG  41  -0.390 -15.780   8.900
  280   1HD   ARG  41          1HD       ARG  41  -2.019 -14.070   9.663
  281   2HD   ARG  41          2HD       ARG  41  -0.377 -13.531   9.953
  282    HE   ARG  41           HE       ARG  41  -1.254 -12.639   7.353
  283   1HH1  ARG  41          2HH2      ARG  41  -1.676 -11.979  10.784
  284   2HH1  ARG  41          1HH2      ARG  41  -2.088 -10.314  10.544
  285   1HH2  ARG  41          2HH1      ARG  41  -1.797 -10.442   7.036
  286   2HH2  ARG  41          1HH1      ARG  41  -2.157  -9.433   8.397
  287    H    ARG  42           H        ARG  42   3.619 -14.640   7.191
  288    HA   ARG  42           HA       ARG  42   4.077 -13.059   5.118
  289   1HB   ARG  42          1HB       ARG  42   5.736 -14.608   6.991
  290   2HB   ARG  42          2HB       ARG  42   6.563 -14.379   5.463
  291   1HG   ARG  42          1HG       ARG  42   7.173 -12.375   6.416
  292   2HG   ARG  42          2HG       ARG  42   5.620 -11.853   5.795
  293   1HD   ARG  42          1HD       ARG  42   4.542 -12.292   7.969
  294   2HD   ARG  42          2HD       ARG  42   6.017 -12.995   8.602
  295    HE   ARG  42           HE       ARG  42   5.406 -10.180   8.445
  296   1HH1  ARG  42          2HH2      ARG  42   8.084 -12.443   8.144
  297   2HH1  ARG  42          1HH2      ARG  42   9.285 -11.280   8.594
  298   1HH2  ARG  42          2HH1      ARG  42   6.991  -8.644   9.038
  299   2HH2  ARG  42          1HH1      ARG  42   8.660  -9.104   9.106
  300    H    ASN  43           H        ASN  43   5.147 -16.547   5.222
  301    HA   ASN  43           HA       ASN  43   5.998 -16.663   2.631
  302   1HB   ASN  43          1HB       ASN  43   6.080 -18.407   4.650
  303   2HB   ASN  43          2HB       ASN  43   4.610 -19.035   3.932
  304   1HD2  ASN  43          1HD2      ASN  43   7.491 -19.966   4.196
  305   2HD2  ASN  43          2HD2      ASN  43   7.946 -20.497   2.612
  306    H    CYS  44           H        CYS  44   2.747 -16.804   4.073
  307    HA   CYS  44           HA       CYS  44   1.439 -17.999   1.893
  308   1HB   CYS  44          1HB       CYS  44   0.667 -17.686   4.341
  309   2HB   CYS  44          2HB       CYS  44   0.132 -16.099   3.825
  310    H    LYS  45           H        LYS  45   2.727 -14.804   2.588
  311    HA   LYS  45           HA       LYS  45   1.038 -13.297   0.929
  312   1HB   LYS  45          1HB       LYS  45   2.580 -12.459   2.749
  313   2HB   LYS  45          2HB       LYS  45   3.921 -12.708   1.649
  314   1HG   LYS  45          1HG       LYS  45   3.160 -11.045   0.130
  315   2HG   LYS  45          2HG       LYS  45   1.517 -11.100   0.738
  316   1HD   LYS  45          1HD       LYS  45   2.204  -9.161   1.799
  317   2HD   LYS  45          2HD       LYS  45   2.706 -10.312   3.021
  318   1HE   LYS  45          1HE       LYS  45   4.727  -9.883   0.883
  319   2HE   LYS  45          2HE       LYS  45   4.368  -8.441   1.813
  320   1HZ   LYS  45          1HZ       LYS  45   5.943  -9.433   3.084
  321   2HZ   LYS  45          2HZ       LYS  45   4.614 -10.076   3.783
  322   3HZ   LYS  45          3HZ       LYS  45   5.488 -10.960   2.723
  323    H    LYS  46           H        LYS  46   4.048 -15.174   0.358
  324    HA   LYS  46           HA       LYS  46   3.992 -14.377  -2.437
  325   1HB   LYS  46          1HB       LYS  46   5.988 -15.663  -0.612
  326   2HB   LYS  46          2HB       LYS  46   6.104 -15.985  -2.330
  327   1HG   LYS  46          1HG       LYS  46   5.637 -13.181  -2.105
  328   2HG   LYS  46          2HG       LYS  46   6.815 -13.563  -0.865
  329   1HD   LYS  46          1HD       LYS  46   8.113 -14.862  -2.684
  330   2HD   LYS  46          2HD       LYS  46   7.030 -14.133  -3.853
  331   1HE   LYS  46          1HE       LYS  46   7.777 -11.898  -2.441
  332   2HE   LYS  46          2HE       LYS  46   9.221 -12.873  -2.251
  333   1HZ   LYS  46          1HZ       LYS  46   9.037 -11.424  -4.288
  334   2HZ   LYS  46          2HZ       LYS  46   9.515 -12.967  -4.529
  335   3HZ   LYS  46          3HZ       LYS  46   7.982 -12.524  -4.877
  336    H    ALA  47           H        ALA  47   2.674 -16.762  -0.362
  337    HA   ALA  47           HA       ALA  47   2.856 -19.050  -1.925
  338   1HB   ALA  47          1HB       ALA  47   0.775 -19.703  -0.648
  339   2HB   ALA  47          2HB       ALA  47   2.115 -19.129   0.372
  340   3HB   ALA  47          3HB       ALA  47   0.741 -18.054   0.021
  341    H    ASP  48           H        ASP  48   0.166 -16.605  -1.738
  342    HA   ASP  48           HA       ASP  48  -0.189 -16.864  -4.554
  343   1HB   ASP  48          1HB       ASP  48  -1.569 -18.723  -3.226
  344   2HB   ASP  48          2HB       ASP  48  -2.648 -17.389  -2.867
  345    H    CYS  49           H        CYS  49   0.636 -14.682  -2.966
  346    HA   CYS  49           HA       CYS  49  -1.645 -12.915  -3.282
  347   1HB   CYS  49          1HB       CYS  49  -0.017 -12.539  -0.811
  348   2HB   CYS  49          2HB       CYS  49  -1.661 -12.045  -1.161
  349    H    GLU  50           H        GLU  50   1.069 -13.689  -4.560
  350    HA   GLU  50           HA       GLU  50   2.832 -11.587  -4.003
  351   1HB   GLU  50          1HB       GLU  50   2.660 -13.867  -5.861
  352   2HB   GLU  50          2HB       GLU  50   3.433 -12.475  -6.593
  353   1HG   GLU  50          1HG       GLU  50   4.591 -12.523  -4.057
  354   2HG   GLU  50          2HG       GLU  50   4.395 -14.229  -4.405
  355    HA   PRO  51           HA       PRO  51   0.845  -9.687  -7.876
  356   1HB   PRO  51          1HB       PRO  51  -1.486 -10.728  -8.851
  357   2HB   PRO  51          2HB       PRO  51   0.091 -11.144  -9.492
  358   1HG   PRO  51          1HG       PRO  51  -1.686 -12.746  -7.754
  359   2HG   PRO  51          2HG       PRO  51  -0.337 -13.281  -8.737
  360   1HD   PRO  51          1HD       PRO  51  -0.351 -12.918  -5.891
  361   2HD   PRO  51          2HD       PRO  51   1.028 -13.341  -6.887
  362    H    GLN  52           H        GLN  52  -1.480 -10.983  -5.604
  363    HA   GLN  52           HA       GLN  52  -3.230  -8.853  -5.756
  364   1HB   GLN  52          1HB       GLN  52  -2.600 -10.721  -3.429
  365   2HB   GLN  52          2HB       GLN  52  -3.983  -9.645  -3.476
  366   1HG   GLN  52          1HG       GLN  52  -4.767 -10.765  -5.584
  367   2HG   GLN  52          2HG       GLN  52  -3.398 -11.857  -5.502
  368   1HE2  GLN  52          1HE2      GLN  52  -4.630 -13.679  -5.309
  369   2HE2  GLN  52          2HE2      GLN  52  -5.523 -14.102  -3.887
  370    H    ASP  53           H        ASP  53  -0.359  -9.440  -3.634
  371    HA   ASP  53           HA       ASP  53  -0.681  -7.210  -2.058
  372   1HB   ASP  53          1HB       ASP  53   0.958  -9.193  -1.815
  373   2HB   ASP  53          2HB       ASP  53   1.990  -8.367  -2.965
  374    H    LYS  54           H        LYS  54   0.797  -7.739  -5.288
  375    HA   LYS  54           HA       LYS  54   2.148  -5.290  -5.473
  376   1HB   LYS  54          1HB       LYS  54   1.177  -7.331  -7.468
  377   2HB   LYS  54          2HB       LYS  54   1.907  -5.831  -8.002
  378   1HG   LYS  54          1HG       LYS  54   3.913  -6.331  -6.548
  379   2HG   LYS  54          2HG       LYS  54   3.188  -7.868  -6.119
  380   1HD   LYS  54          1HD       LYS  54   4.031  -8.803  -8.001
  381   2HD   LYS  54          2HD       LYS  54   3.099  -7.688  -8.981
  382   1HE   LYS  54          1HE       LYS  54   5.290  -7.185  -9.662
  383   2HE   LYS  54          2HE       LYS  54   5.021  -5.964  -8.434
  384   1HZ   LYS  54          1HZ       LYS  54   6.955  -7.925  -8.457
  385   2HZ   LYS  54          2HZ       LYS  54   6.675  -6.818  -7.290
  386   3HZ   LYS  54          3HZ       LYS  54   5.961  -8.285  -7.212
  387    H    VAL  55           H        VAL  55  -1.021  -6.324  -6.933
  388    HA   VAL  55           HA       VAL  55  -1.792  -3.964  -7.989
  389    HB   VAL  55           HB       VAL  55  -3.439  -6.024  -6.512
  390   1HG1  VAL  55          1HG1      VAL  55  -4.546  -4.203  -8.638
  391   2HG1  VAL  55          2HG1      VAL  55  -5.399  -5.124  -7.376
  392   3HG1  VAL  55          3HG1      VAL  55  -4.476  -3.665  -6.943
  393   1HG2  VAL  55          1HG2      VAL  55  -2.758  -7.303  -8.232
  394   2HG2  VAL  55          2HG2      VAL  55  -3.894  -6.340  -9.208
  395   3HG2  VAL  55          3HG2      VAL  55  -2.168  -5.906  -9.163
  396    H    CYS  56           H        CYS  56  -1.467  -4.802  -4.572
  397    HA   CYS  56           HA       CYS  56  -2.972  -2.486  -3.750
  398   1HB   CYS  56          1HB       CYS  56  -3.191  -4.478  -2.425
  399   2HB   CYS  56          2HB       CYS  56  -1.456  -4.599  -2.213
  400    H    ASP  57           H        ASP  57   0.413  -3.774  -3.315
  401    HA   ASP  57           HA       ASP  57   1.614  -1.732  -2.180
  402   1HB   ASP  57          1HB       ASP  57   2.425  -3.944  -3.680
  403   2HB   ASP  57          2HB       ASP  57   3.113  -2.610  -4.586
  404    H    ALA  58           H        ALA  58   0.414  -1.909  -5.547
  405    HA   ALA  58           HA       ALA  58   1.757   0.364  -6.525
  406   1HB   ALA  58          1HB       ALA  58   0.903  -0.538  -8.395
  407   2HB   ALA  58          2HB       ALA  58  -0.122  -1.625  -7.427
  408   3HB   ALA  58          3HB       ALA  58  -0.720  -0.012  -7.886
  409    H    CYS  59           H        CYS  59  -1.644  -0.137  -5.337
  410    HA   CYS  59           HA       CYS  59  -2.495   2.437  -5.577
  411   1HB   CYS  59          1HB       CYS  59  -3.823   0.396  -4.924
  412   2HB   CYS  59          2HB       CYS  59  -3.221   0.600  -3.291
  413    H    ARG  60           H        ARG  60  -0.218   0.967  -3.299
  414    HA   ARG  60           HA       ARG  60  -0.377   3.145  -1.477
  415   1HB   ARG  60          1HB       ARG  60   1.391   0.682  -1.732
  416   2HB   ARG  60          2HB       ARG  60   1.783   1.929  -0.565
  417   1HG   ARG  60          1HG       ARG  60  -0.901   1.596  -0.048
  418   2HG   ARG  60          2HG       ARG  60  -0.479  -0.023  -0.571
  419   1HD   ARG  60          1HD       ARG  60   0.021  -0.187   1.705
  420   2HD   ARG  60          2HD       ARG  60   1.589   0.291   1.084
  421    HE   ARG  60           HE       ARG  60  -0.138   2.559   1.793
  422   1HH1  ARG  60          2HH2      ARG  60   2.268   0.271   2.959
  423   2HH1  ARG  60          1HH2      ARG  60   2.772   1.276   4.277
  424   1HH2  ARG  60          2HH1      ARG  60   0.526   3.885   3.531
  425   2HH2  ARG  60          1HH1      ARG  60   1.774   3.346   4.604
  426    H    MET  61           H        MET  61   1.450   2.231  -4.356
  427    HA   MET  61           HA       MET  61   3.572   4.065  -3.807
  428   1HB   MET  61          1HB       MET  61   4.594   3.064  -5.675
  429   2HB   MET  61          2HB       MET  61   3.483   1.783  -5.235
  430   1HG   MET  61          1HG       MET  61   2.774   1.935  -7.409
  431   2HG   MET  61          2HG       MET  61   1.856   3.318  -6.848
  432   1HE   MET  61          1HE       MET  61   1.855   3.482  -9.262
  433   2HE   MET  61          2HE       MET  61   2.282   5.207  -9.370
  434   3HE   MET  61          3HE       MET  61   3.189   4.004 -10.318
  435    H    LYS  62           H        LYS  62   0.369   4.292  -4.985
  436    HA   LYS  62           HA       LYS  62   0.997   6.564  -6.704
  437   1HB   LYS  62          1HB       LYS  62  -1.411   4.793  -6.338
  438   2HB   LYS  62          2HB       LYS  62  -1.580   6.372  -7.078
  439   1HG   LYS  62          1HG       LYS  62  -0.032   5.816  -8.855
  440   2HG   LYS  62          2HG       LYS  62   0.514   4.372  -8.026
  441   1HD   LYS  62          1HD       LYS  62  -1.739   3.346  -8.285
  442   2HD   LYS  62          2HD       LYS  62  -2.330   4.803  -9.059
  443   1HE   LYS  62          1HE       LYS  62  -0.241   4.376 -10.697
  444   2HE   LYS  62          2HE       LYS  62  -0.414   2.728 -10.128
  445   1HZ   LYS  62          1HZ       LYS  62  -1.772   2.972 -12.002
  446   2HZ   LYS  62          2HZ       LYS  62  -2.800   2.938 -10.733
  447   3HZ   LYS  62          3HZ       LYS  62  -2.453   4.356 -11.465
  448    H    CYS  63           H        CYS  63  -1.292   5.719  -4.005
  449    HA   CYS  63           HA       CYS  63  -2.189   8.195  -3.442
  450   1HB   CYS  63          1HB       CYS  63  -2.101   5.675  -2.128
  451   2HB   CYS  63          2HB       CYS  63  -1.649   6.891  -0.950
  452    H    HIS  64           H        HIS  64   0.943   6.666  -2.519
  453    HA   HIS  64           HA       HIS  64   1.866   8.483  -0.722
  454   1HB   HIS  64          1HB       HIS  64   2.879   6.311  -2.129
  455   2HB   HIS  64          2HB       HIS  64   3.921   7.630  -2.625
  456    HD1  HIS  64           1HD      HIS  64   5.970   6.819  -1.295
  457    HD2  HIS  64           2HD      HIS  64   2.571   7.456   1.078
  458    HE1  HIS  64           1HE      HIS  64   6.760   6.709   1.129
  459    H    LYS  65           H        LYS  65   2.525   8.566  -4.302
  460    HA   LYS  65           HA       LYS  65   3.621  11.143  -4.214
  461   1HB   LYS  65          1HB       LYS  65   3.358   9.089  -6.080
  462   2HB   LYS  65          2HB       LYS  65   2.423  10.399  -6.772
  463   1HG   LYS  65          1HG       LYS  65   4.277  11.860  -6.871
  464   2HG   LYS  65          2HG       LYS  65   5.145  11.015  -5.605
  465   1HD   LYS  65          1HD       LYS  65   4.943   9.013  -7.483
  466   2HD   LYS  65          2HD       LYS  65   4.995  10.418  -8.529
  467   1HE   LYS  65          1HE       LYS  65   7.003  11.010  -6.701
  468   2HE   LYS  65          2HE       LYS  65   7.128   9.266  -6.807
  469   1HZ   LYS  65          1HZ       LYS  65   7.298  11.194  -9.007
  470   2HZ   LYS  65          2HZ       LYS  65   8.442  10.142  -8.504
  471   3HZ   LYS  65          3HZ       LYS  65   7.107   9.593  -9.267
  472    H    ALA  66           H        ALA  66   0.292   9.894  -4.613
  473    HA   ALA  66           HA       ALA  66  -0.906  12.217  -5.526
  474   1HB   ALA  66          1HB       ALA  66  -2.539  10.708  -3.625
  475   2HB   ALA  66          2HB       ALA  66  -2.735  10.909  -5.382
  476   3HB   ALA  66          3HB       ALA  66  -1.665   9.637  -4.746
  477    H    CYS  67           H        CYS  67  -0.673  11.002  -2.101
  478    HA   CYS  67           HA       CYS  67  -1.768  13.153  -0.871
  479   1HB   CYS  67          1HB       CYS  67  -1.071  11.012   0.190
  480   2HB   CYS  67          2HB       CYS  67   0.593  11.558   0.147
  481    H    ARG  68           H        ARG  68   1.653  12.634  -1.946
  482    HA   ARG  68           HA       ARG  68   2.700  14.922  -0.886
  483   1HB   ARG  68          1HB       ARG  68   4.108  13.158  -1.851
  484   2HB   ARG  68          2HB       ARG  68   3.417  13.406  -3.442
  485   1HG   ARG  68          1HG       ARG  68   4.505  15.906  -2.329
  486   2HG   ARG  68          2HG       ARG  68   5.724  14.650  -2.407
  487   1HD   ARG  68          1HD       ARG  68   4.202  14.562  -4.865
  488   2HD   ARG  68          2HD       ARG  68   4.655  16.229  -4.571
  489    HE   ARG  68           HE       ARG  68   6.986  14.779  -4.051
  490   1HH1  ARG  68          2HH2      ARG  68   4.813  15.129  -6.797
  491   2HH1  ARG  68          1HH2      ARG  68   6.049  14.834  -7.975
  492   1HH2  ARG  68          2HH1      ARG  68   8.616  14.389  -5.604
  493   2HH2  ARG  68          1HH1      ARG  68   8.226  14.410  -7.292
  494    H    ALA  69           H        ALA  69   1.154  14.325  -4.108
  495    HA   ALA  69           HA       ALA  69   1.477  17.080  -4.875
  496   1HB   ALA  69          1HB       ALA  69  -0.277  15.885  -6.661
  497   2HB   ALA  69          2HB       ALA  69   1.495  15.936  -6.825
  498   3HB   ALA  69          3HB       ALA  69   0.709  14.515  -6.097
  499    H    ALA  70           H        ALA  70  -0.375  15.682  -2.566
  500    HA   ALA  70           HA       ALA  70  -2.871  16.978  -3.307
  501   1HB   ALA  70          1HB       ALA  70  -2.433  14.607  -2.154
  502   2HB   ALA  70          2HB       ALA  70  -2.430  15.602  -0.678
  503   3HB   ALA  70          3HB       ALA  70  -3.856  15.595  -1.744
  504    H    ASN  71           H        ASN  71  -0.912  16.828  -0.248
  505    HA   ASN  71           HA       ASN  71  -1.795  19.499   0.317
  506   1HB   ASN  71          1HB       ASN  71  -0.068  17.516   1.888
  507   2HB   ASN  71          2HB       ASN  71  -0.525  19.093   2.500
  508   1HD2  ASN  71          1HD2      ASN  71  -1.794  16.042   1.243
  509   2HD2  ASN  71          2HD2      ASN  71  -3.287  16.033   2.120
  510    H    CYS  72           H        CYS  72   1.327  17.621   0.116
  511    HA   CYS  72           HA       CYS  72   2.929  19.943   0.211
  512   1HB   CYS  72          1HB       CYS  72   3.612  17.140  -0.704
  513   2HB   CYS  72          2HB       CYS  72   4.769  18.419  -0.395
  514    H    ALA  73           H        ALA  73   1.310  20.914  -1.559
  515    HA   ALA  73           HA       ALA  73   1.999  20.062  -4.243
  516   1HB   ALA  73          1HB       ALA  73   0.218  21.538  -4.921
  517   2HB   ALA  73          2HB       ALA  73  -0.349  20.640  -3.491
  518   3HB   ALA  73          3HB       ALA  73   0.190  22.328  -3.326
  519    H    SER  74           H        SER  74   2.707  22.616  -1.871
  520    HA   SER  74           HA       SER  74   4.092  24.124  -3.906
  521   1HB   SER  74          1HB       SER  74   2.631  24.894  -1.696
  522   2HB   SER  74          2HB       SER  74   4.264  25.001  -1.067
  523    HG   SER  74           HG       SER  74   3.559  27.001  -2.065
  524    H    GLU  75           H        GLU  75   4.708  22.501  -0.715
  525    HA   GLU  75           HA       GLU  75   7.342  22.992  -0.472
  526   1HB   GLU  75          1HB       GLU  75   5.605  20.645   0.293
  527   2HB   GLU  75          2HB       GLU  75   7.332  20.538   0.569
  528   1HG   GLU  75          1HG       GLU  75   6.185  21.431   2.572
  529   2HG   GLU  75          2HG       GLU  75   7.280  22.627   1.906
  530    H    CYS  76           H        CYS  76   5.730  20.970  -2.855
  531    HA   CYS  76           HA       CYS  76   8.362  20.032  -3.742
  532   1HB   CYS  76          1HB       CYS  76   5.711  18.715  -4.343
  533   2HB   CYS  76          2HB       CYS  76   7.313  18.109  -4.712
  534    HA   PRO  77           HA       PRO  77   7.079  22.840  -6.954
  535   1HB   PRO  77          1HB       PRO  77   9.583  23.426  -7.878
  536   2HB   PRO  77          2HB       PRO  77   8.802  24.324  -6.592
  537   1HG   PRO  77          1HG       PRO  77  10.980  22.334  -6.405
  538   2HG   PRO  77          2HG       PRO  77  10.484  23.532  -5.226
  539   1HD   PRO  77          1HD       PRO  77   9.923  20.720  -5.156
  540   2HD   PRO  77          2HD       PRO  77   9.330  21.936  -4.041
  541    H    LYS  78           H        LYS  78   7.303  22.984  -9.358
  542    HA   LYS  78           HA       LYS  78   7.464  20.226 -10.281
  543   1HB   LYS  78          1HB       LYS  78   5.632  22.252 -10.731
  544   2HB   LYS  78          2HB       LYS  78   6.596  22.277 -12.194
  545   1HG   LYS  78          1HG       LYS  78   5.836  19.556 -11.210
  546   2HG   LYS  78          2HG       LYS  78   4.505  20.550 -11.766
  547   1HD   LYS  78          1HD       LYS  78   5.076  19.748 -13.836
  548   2HD   LYS  78          2HD       LYS  78   6.295  21.007 -13.789
  549   1HE   LYS  78          1HE       LYS  78   7.926  19.435 -13.882
  550   2HE   LYS  78          2HE       LYS  78   7.378  18.770 -12.356
  551   1HZ   LYS  78          1HZ       LYS  78   7.226  17.083 -13.949
  552   2HZ   LYS  78          2HZ       LYS  78   5.684  17.552 -13.681
  553   3HZ   LYS  78          3HZ       LYS  78   6.459  18.027 -15.038
  554    H    HIS  79           H        HIS  79   9.950  20.801  -9.684
  555    HA   HIS  79           HA       HIS  79  11.240  20.815 -12.176
  556   1HB   HIS  79          1HB       HIS  79  10.754  23.395 -11.116
  557   2HB   HIS  79          2HB       HIS  79  12.455  23.071 -10.846
  558    HD1  HIS  79           1HD      HIS  79  12.751  25.056 -12.680
  559    HD2  HIS  79           2HD      HIS  79  11.225  21.413 -14.093
  560    HE1  HIS  79           1HE      HIS  79  13.021  25.103 -15.217
  561    H    GLU  80           H        GLU  80  11.013  19.077  -9.927
  562    HA   GLU  80           HA       GLU  80  13.797  18.827  -9.355
  563   1HB   GLU  80          1HB       GLU  80  12.069  20.071  -7.421
  564   2HB   GLU  80          2HB       GLU  80  12.500  18.489  -6.801
  565   1HG   GLU  80          1HG       GLU  80  14.330  19.702  -6.042
  566   2HG   GLU  80          2HG       GLU  80  14.955  19.189  -7.597
  567    H    HIS  81           H        HIS  81  13.863  16.782  -7.558
  568    HA   HIS  81           HA       HIS  81  12.003  14.827  -8.703
  569   1HB   HIS  81          1HB       HIS  81  13.888  13.169  -8.292
  570   2HB   HIS  81          2HB       HIS  81  14.073  14.278  -9.636
  571    HD1  HIS  81           1HD      HIS  81  16.034  12.867  -7.072
  572    HD2  HIS  81           2HD      HIS  81  15.607  16.774  -8.537
  573    HE1  HIS  81           1HE      HIS  81  18.136  14.128  -6.367
  574    H    LYS  82           H        LYS  82  14.069  15.705  -5.860
  575    HA   LYS  82           HA       LYS  82  11.930  14.976  -4.104
  576   1HB   LYS  82          1HB       LYS  82  13.171  13.265  -2.856
  577   2HB   LYS  82          2HB       LYS  82  12.822  12.755  -4.496
  578   1HG   LYS  82          1HG       LYS  82  15.232  13.847  -4.981
  579   2HG   LYS  82          2HG       LYS  82  15.466  13.537  -3.272
  580   1HD   LYS  82          1HD       LYS  82  14.307  11.154  -4.205
  581   2HD   LYS  82          2HD       LYS  82  15.359  11.631  -5.523
  582   1HE   LYS  82          1HE       LYS  82  16.669  11.988  -2.908
  583   2HE   LYS  82          2HE       LYS  82  16.141  10.334  -3.145
  584   1HZ   LYS  82          1HZ       LYS  82  17.498  11.665  -5.339
  585   2HZ   LYS  82          2HZ       LYS  82  18.394  11.152  -4.073
  586   3HZ   LYS  82          3HZ       LYS  82  17.499  10.085  -4.925
  587    H    SER  83           H        SER  83  12.202  17.310  -3.795
  588    HA   SER  83           HA       SER  83  14.661  18.311  -2.900
  589   1HB   SER  83          1HB       SER  83  13.546  20.203  -3.419
  590   2HB   SER  83          2HB       SER  83  12.036  19.320  -3.533
  591    HG   SER  83           HG       SER  83  13.197  20.439  -1.125
  592    H    ASP  84           H        ASP  84  15.135  19.164  -0.694
  593    HA   ASP  84           HA       ASP  84  14.750  17.272   1.235
  594   1HB   ASP  84          1HB       ASP  84  16.547  18.868   1.440
  595   2HB   ASP  84          2HB       ASP  84  15.448  20.230   1.367
  596    H    THR  85           H        THR  85  13.364  20.653   1.149
  597    HA   THR  85           HA       THR  85  11.586  20.406   3.218
  598    HB   THR  85           HB       THR  85  12.325  22.400   1.602
  599    HG1  THR  85           1HG      THR  85   9.702  21.861   2.797
  600   1HG2  THR  85          1HG2      THR  85   9.637  21.469   0.460
  601   2HG2  THR  85          2HG2      THR  85  10.373  23.061   0.159
  602   3HG2  THR  85          3HG2      THR  85  11.166  21.586  -0.444
  603    H    CYS  86           H        CYS  86  11.354  19.075  -0.062
  604    HA   CYS  86           HA       CYS  86   8.582  18.553   0.105
  605   1HB   CYS  86          1HB       CYS  86   9.755  18.765  -2.027
  606   2HB   CYS  86          2HB       CYS  86  10.720  17.348  -1.664
  607    H    ARG  87           H        ARG  87  11.504  16.369   0.168
  608    HA   ARG  87           HA       ARG  87  10.308  14.092   0.850
  609   1HB   ARG  87          1HB       ARG  87  12.964  15.220   1.858
  610   2HB   ARG  87          2HB       ARG  87  12.492  13.552   2.115
  611   1HG   ARG  87          1HG       ARG  87  12.074  13.545  -0.506
  612   2HG   ARG  87          2HG       ARG  87  13.108  14.960  -0.497
  613   1HD   ARG  87          1HD       ARG  87  14.451  12.916  -0.883
  614   2HD   ARG  87          2HD       ARG  87  14.910  13.667   0.632
  615    HE   ARG  87           HE       ARG  87  12.841  11.790   1.196
  616   1HH1  ARG  87          2HH2      ARG  87  16.182  11.815   0.093
  617   2HH1  ARG  87          1HH2      ARG  87  16.542  10.249   0.741
  618   1HH2  ARG  87          2HH1      ARG  87  13.315   9.725   2.052
  619   2HH2  ARG  87          1HH1      ARG  87  14.900   9.052   1.863
  620    H    ALA  88           H        ALA  88  11.139  16.845   3.012
  621    HA   ALA  88           HA       ALA  88  10.459  15.480   5.407
  622   1HB   ALA  88          1HB       ALA  88  10.555  17.823   6.343
  623   2HB   ALA  88          2HB       ALA  88  12.014  17.330   5.449
  624   3HB   ALA  88          3HB       ALA  88  10.825  18.413   4.685
  625    H    CYS  89           H        CYS  89   8.808  18.011   3.386
  626    HA   CYS  89           HA       CYS  89   6.551  18.338   4.793
  627   1HB   CYS  89          1HB       CYS  89   7.139  19.491   2.687
  628   2HB   CYS  89          2HB       CYS  89   6.704  18.053   1.784
  629    H    MET  90           H        MET  90   7.443  15.598   2.623
  630    HA   MET  90           HA       MET  90   4.928  14.357   2.822
  631   1HB   MET  90          1HB       MET  90   7.728  13.447   1.989
  632   2HB   MET  90          2HB       MET  90   6.370  12.340   1.955
  633   1HG   MET  90          1HG       MET  90   5.188  14.288   0.568
  634   2HG   MET  90          2HG       MET  90   6.832  14.820   0.278
  635   1HE   MET  90          1HE       MET  90   4.772  11.008  -1.109
  636   2HE   MET  90          2HE       MET  90   5.485  10.890   0.518
  637   3HE   MET  90          3HE       MET  90   4.271  12.144   0.166
  638    H    LYS  91           H        LYS  91   8.178  13.455   4.204
  639    HA   LYS  91           HA       LYS  91   7.312  11.393   5.787
  640   1HB   LYS  91          1HB       LYS  91   9.676  12.038   5.266
  641   2HB   LYS  91          2HB       LYS  91   9.542  13.344   6.427
  642   1HG   LYS  91          1HG       LYS  91   9.482  11.905   8.265
  643   2HG   LYS  91          2HG       LYS  91   8.734  10.601   7.363
  644   1HD   LYS  91          1HD       LYS  91  11.520  11.426   6.560
  645   2HD   LYS  91          2HD       LYS  91  11.341  10.548   8.066
  646   1HE   LYS  91          1HE       LYS  91  10.011   8.780   6.796
  647   2HE   LYS  91          2HE       LYS  91  10.395   9.627   5.311
  648   1HZ   LYS  91          1HZ       LYS  91  12.624   9.027   7.035
  649   2HZ   LYS  91          2HZ       LYS  91  11.915   7.745   6.313
  650   3HZ   LYS  91          3HZ       LYS  91  12.518   8.962   5.406
  651    H    THR  92           H        THR  92   6.806  14.854   6.135
  652    HA   THR  92           HA       THR  92   6.302  14.860   8.920
  653    HB   THR  92           HB       THR  92   5.384  16.710   6.654
  654    HG1  THR  92           1HG      THR  92   7.374  17.811   7.439
  655   1HG2  THR  92          1HG2      THR  92   5.285  18.435   8.416
  656   2HG2  THR  92          2HG2      THR  92   4.198  17.099   8.862
  657   3HG2  THR  92          3HG2      THR  92   5.791  17.249   9.643
  658    H    ASN  93           H        ASN  93   4.024  14.887   6.091
  659    HA   ASN  93           HA       ASN  93   2.134  13.611   7.908
  660   1HB   ASN  93          1HB       ASN  93   1.401  15.424   5.555
  661   2HB   ASN  93          2HB       ASN  93   0.312  14.808   6.782
  662   1HD2  ASN  93          1HD2      ASN  93   2.968  16.985   6.096
  663   2HD2  ASN  93          2HD2      ASN  93   2.787  18.031   7.464
  664    H    CYS  94           H        CYS  94   2.595  14.379   4.364
  665    HA   CYS  94           HA       CYS  94   1.350  12.005   3.524
  666   1HB   CYS  94          1HB       CYS  94   3.081  14.031   2.109
  667   2HB   CYS  94          2HB       CYS  94   2.425  12.624   1.296
  668    H    LYS  95           H        LYS  95   2.640  10.567   5.080
  669    HA   LYS  95           HA       LYS  95   5.285  10.146   5.103
  670   1HB   LYS  95          1HB       LYS  95   3.334   8.922   6.296
  671   2HB   LYS  95          2HB       LYS  95   3.379   7.814   4.940
  672   1HG   LYS  95          1HG       LYS  95   6.069   8.397   6.031
  673   2HG   LYS  95          2HG       LYS  95   4.998   7.677   7.217
  674   1HD   LYS  95          1HD       LYS  95   4.412   5.964   5.294
  675   2HD   LYS  95          2HD       LYS  95   5.890   6.540   4.548
  676   1HE   LYS  95          1HE       LYS  95   7.258   5.624   6.201
  677   2HE   LYS  95          2HE       LYS  95   6.049   5.800   7.458
  678   1HZ   LYS  95          1HZ       LYS  95   4.942   4.058   5.711
  679   2HZ   LYS  95          2HZ       LYS  95   6.512   3.610   5.730
  680   3HZ   LYS  95          3HZ       LYS  95   5.662   3.667   7.124
  Start of MODEL   19
    1   1H    ILE   1           H        ILE   1 -11.738  18.595   0.405
    2    HA   ILE   1           HA       ILE   1 -13.535  17.524   1.119
    3    HB   ILE   1           HB       ILE   1 -12.003  15.192  -0.026
    4   1HG1  ILE   1          1HG1      ILE   1 -14.280  15.982  -1.558
    5   2HG1  ILE   1          2HG1      ILE   1 -13.360  17.427  -1.191
    6   1HG2  ILE   1          1HG2      ILE   1 -13.498  13.910   1.049
    7   2HG2  ILE   1          2HG2      ILE   1 -14.591  15.275   1.382
    8   3HG2  ILE   1          3HG2      ILE   1 -14.625  14.474  -0.207
    9   1HD1  ILE   1          1HD1      ILE   1 -12.572  15.030  -2.809
   10   2HD1  ILE   1          2HD1      ILE   1 -12.186  16.750  -3.062
   11   3HD1  ILE   1          3HD1      ILE   1 -11.292  15.806  -1.846
   12    H    SER   2           H        SER   2 -10.821  15.246   1.950
   13    HA   SER   2           HA       SER   2 -11.906  14.274   4.220
   14   1HB   SER   2          1HB       SER   2  -8.963  14.903   3.713
   15   2HB   SER   2          2HB       SER   2  -9.554  13.798   4.937
   16    HG   SER   2           HG       SER   2 -10.084  12.305   3.425
   17    H    GLU   3           H        GLU   3 -12.619  15.253   6.075
   18    HA   GLU   3           HA       GLU   3 -11.889  17.936   6.589
   19   1HB   GLU   3          1HB       GLU   3 -13.941  16.087   7.413
   20   2HB   GLU   3          2HB       GLU   3 -13.203  16.749   8.858
   21   1HG   GLU   3          1HG       GLU   3 -13.863  18.938   8.374
   22   2HG   GLU   3          2HG       GLU   3 -13.837  18.682   6.640
   23    H    PHE   4           H        PHE   4  -9.945  18.499   7.466
   24    HA   PHE   4           HA       PHE   4  -8.105  18.439   8.681
   25   1HB   PHE   4          1HB       PHE   4 -10.119  17.007  10.506
   26   2HB   PHE   4          2HB       PHE   4  -8.517  17.434  11.072
   27    HD1  PHE   4           1HD      PHE   4 -11.843  18.640  10.351
   28    HD2  PHE   4           2HD      PHE   4  -7.869  19.840  11.231
   29    HE1  PHE   4           1HE      PHE   4 -12.671  20.927  10.972
   30    HE2  PHE   4           2HE      PHE   4  -8.697  22.127  11.852
   31    HZ   PHE   4           HZ       PHE   4 -11.088  22.643  11.715
   32    H    ALA   5           H        ALA   5  -6.546  16.903  10.060
   33    HA   ALA   5           HA       ALA   5  -5.255  15.107  10.073
   34   1HB   ALA   5          1HB       ALA   5  -7.207  13.944  10.954
   35   2HB   ALA   5          2HB       ALA   5  -7.844  13.697   9.310
   36   3HB   ALA   5          3HB       ALA   5  -6.352  12.871   9.820
   37    HA   PRO   6           HA       PRO   6  -3.923  14.724   5.972
   38   1HB   PRO   6          1HB       PRO   6  -1.897  12.913   6.268
   39   2HB   PRO   6          2HB       PRO   6  -1.718  14.619   6.627
   40   1HG   PRO   6          1HG       PRO   6  -1.989  12.349   8.501
   41   2HG   PRO   6          2HG       PRO   6  -1.393  13.967   8.815
   42   1HD   PRO   6          1HD       PRO   6  -3.970  12.920   9.516
   43   2HD   PRO   6          2HD       PRO   6  -3.417  14.569   9.726
   44    H    VAL   7           H        VAL   7  -4.115  13.578   4.039
   45    HA   VAL   7           HA       VAL   7  -6.139  11.735   4.002
   46    HB   VAL   7           HB       VAL   7  -3.867  12.372   2.141
   47   1HG1  VAL   7          1HG1      VAL   7  -5.458  11.020   0.477
   48   2HG1  VAL   7          2HG1      VAL   7  -4.135  10.234   1.371
   49   3HG1  VAL   7          3HG1      VAL   7  -5.808  10.107   1.965
   50   1HG2  VAL   7          1HG2      VAL   7  -6.864  12.788   1.892
   51   2HG2  VAL   7          2HG2      VAL   7  -5.708  14.013   2.465
   52   3HG2  VAL   7          3HG2      VAL   7  -5.603  13.401   0.797
   53    H    ASP   8           H        ASP   8  -6.220   9.422   3.762
   54    HA   ASP   8           HA       ASP   8  -3.988   8.182   5.134
   55   1HB   ASP   8          1HB       ASP   8  -5.607   6.257   5.409
   56   2HB   ASP   8          2HB       ASP   8  -6.135   7.748   6.165
   57    H    CYS   9           H        CYS   9  -3.520   5.807   4.330
   58    HA   CYS   9           HA       CYS   9  -3.972   5.590   1.454
   59   1HB   CYS   9          1HB       CYS   9  -1.322   5.510   2.879
   60   2HB   CYS   9          2HB       CYS   9  -1.564   4.654   1.369
   61    H    LYS  10           H        LYS  10  -2.760   4.073   4.522
   62    HA   LYS  10           HA       LYS  10  -2.852   1.445   3.749
   63   1HB   LYS  10          1HB       LYS  10  -2.958   2.938   6.308
   64   2HB   LYS  10          2HB       LYS  10  -3.567   1.296   6.369
   65   1HG   LYS  10          1HG       LYS  10  -1.210   1.114   4.813
   66   2HG   LYS  10          2HG       LYS  10  -0.800   2.239   6.092
   67   1HD   LYS  10          1HD       LYS  10  -1.693   0.575   7.781
   68   2HD   LYS  10          2HD       LYS  10  -1.970  -0.558   6.473
   69   1HE   LYS  10          1HE       LYS  10   0.621  -0.004   5.937
   70   2HE   LYS  10          2HE       LYS  10   0.640   0.391   7.645
   71   1HZ   LYS  10          1HZ       LYS  10   1.136  -1.932   7.197
   72   2HZ   LYS  10          2HZ       LYS  10  -0.194  -1.778   8.133
   73   3HZ   LYS  10          3HZ       LYS  10  -0.348  -2.151   6.550
   74    H    GLY  11           H        GLY  11  -5.498   3.372   5.329
   75   1HA   GLY  11          1HA       GLY  11  -7.431   1.323   5.108
   76   2HA   GLY  11          2HA       GLY  11  -7.720   3.025   5.411
   77    H    GLN  12           H        GLN  12  -6.912   4.382   3.198
   78    HA   GLN  12           HA       GLN  12  -8.930   4.151   1.466
   79   1HB   GLN  12          1HB       GLN  12  -6.316   5.452   1.504
   80   2HB   GLN  12          2HB       GLN  12  -6.738   4.983  -0.131
   81   1HG   GLN  12          1HG       GLN  12  -8.774   6.386   1.633
   82   2HG   GLN  12          2HG       GLN  12  -7.556   7.313   0.780
   83   1HE2  GLN  12          1HE2      GLN  12  -7.911   7.882  -1.236
   84   2HE2  GLN  12          2HE2      GLN  12  -9.134   7.258  -2.292
   85    H    CYS  13           H        CYS  13  -5.826   2.346   1.415
   86    HA   CYS  13           HA       CYS  13  -6.353   1.167  -1.116
   87   1HB   CYS  13          1HB       CYS  13  -4.085   1.570   0.011
   88   2HB   CYS  13          2HB       CYS  13  -4.425   0.135   0.957
   89    H    THR  14           H        THR  14  -8.616   0.446  -0.622
   90    HA   THR  14           HA       THR  14  -8.619  -2.015   1.001
   91    HB   THR  14           HB       THR  14 -10.683   0.194   0.581
   92    HG1  THR  14           1HG      THR  14  -9.572  -1.281   2.863
   93   1HG2  THR  14          1HG2      THR  14 -12.408  -1.190   1.200
   94   2HG2  THR  14          2HG2      THR  14 -11.357  -2.527   0.674
   95   3HG2  THR  14          3HG2      THR  14 -11.392  -2.043   2.387
   96    H    THR  15           H        THR  15  -9.845  -0.379  -1.965
   97    HA   THR  15           HA       THR  15 -11.018  -2.791  -2.956
   98    HB   THR  15           HB       THR  15 -10.704   0.072  -3.727
   99    HG1  THR  15           1HG      THR  15 -12.681  -0.922  -2.943
  100   1HG2  THR  15          1HG2      THR  15  -9.712  -1.032  -5.758
  101   2HG2  THR  15          2HG2      THR  15 -11.121  -2.118  -5.830
  102   3HG2  THR  15          3HG2      THR  15 -11.330  -0.370  -6.093
  103    HA   PRO  16           HA       PRO  16  -7.013  -2.855  -5.442
  104   1HB   PRO  16          1HB       PRO  16  -4.888  -1.346  -4.621
  105   2HB   PRO  16          2HB       PRO  16  -5.997  -0.835  -5.878
  106   1HG   PRO  16          1HG       PRO  16  -5.806   0.102  -3.080
  107   2HG   PRO  16          2HG       PRO  16  -6.592   0.871  -4.445
  108   1HD   PRO  16          1HD       PRO  16  -7.869  -0.558  -2.311
  109   2HD   PRO  16          2HD       PRO  16  -8.642   0.111  -3.734
  110    H    CYS  17           H        CYS  17  -6.893  -2.597  -2.009
  111    HA   CYS  17           HA       CYS  17  -4.976  -4.807  -2.010
  112   1HB   CYS  17          1HB       CYS  17  -5.701  -2.977   0.285
  113   2HB   CYS  17          2HB       CYS  17  -4.457  -4.211   0.278
  114    H    GLU  18           H        GLU  18  -8.025  -4.721  -2.520
  115    HA   GLU  18           HA       GLU  18  -9.191  -5.805  -0.193
  116   1HB   GLU  18          1HB       GLU  18 -10.127  -4.720  -2.573
  117   2HB   GLU  18          2HB       GLU  18 -10.508  -6.418  -2.776
  118   1HG   GLU  18          1HG       GLU  18 -11.383  -6.158  -0.239
  119   2HG   GLU  18          2HG       GLU  18 -11.526  -4.475  -0.707
  120    HA   PRO  19           HA       PRO  19  -8.513  -9.842  -2.604
  121   1HB   PRO  19          1HB       PRO  19  -6.841  -9.859  -4.766
  122   2HB   PRO  19          2HB       PRO  19  -8.583  -9.716  -4.902
  123   1HG   PRO  19          1HG       PRO  19  -6.520  -7.624  -5.228
  124   2HG   PRO  19          2HG       PRO  19  -8.189  -7.614  -5.764
  125   1HD   PRO  19          1HD       PRO  19  -7.107  -6.231  -3.496
  126   2HD   PRO  19          2HD       PRO  19  -8.793  -6.316  -3.965
  127    H    LEU  20           H        LEU  20  -6.292  -7.705  -1.485
  128    HA   LEU  20           HA       LEU  20  -4.200  -9.721  -1.289
  129   1HB   LEU  20          1HB       LEU  20  -3.153  -7.807  -1.860
  130   2HB   LEU  20          2HB       LEU  20  -4.365  -6.776  -1.125
  131    HG   LEU  20           HG       LEU  20  -3.402  -7.471   1.135
  132   1HD1  LEU  20          1HD1      LEU  20  -1.636  -8.824   1.326
  133   2HD1  LEU  20          2HD1      LEU  20  -1.997  -9.317  -0.346
  134   3HD1  LEU  20          3HD1      LEU  20  -0.781  -8.056  -0.033
  135   1HD2  LEU  20          1HD2      LEU  20  -2.052  -5.630   1.159
  136   2HD2  LEU  20          2HD2      LEU  20  -1.294  -6.019  -0.404
  137   3HD2  LEU  20          3HD2      LEU  20  -2.937  -5.334  -0.357
  138    H    THR  21           H        THR  21  -5.869  -7.382   0.945
  139    HA   THR  21           HA       THR  21  -5.084  -8.502   3.307
  140    HB   THR  21           HB       THR  21  -7.635  -7.090   2.405
  141    HG1  THR  21           1HG      THR  21  -6.391  -5.358   3.193
  142   1HG2  THR  21          1HG2      THR  21  -8.547  -7.276   4.493
  143   2HG2  THR  21          2HG2      THR  21  -7.351  -8.548   4.835
  144   3HG2  THR  21          3HG2      THR  21  -6.992  -6.855   5.250
  145    H    ALA  22           H        ALA  22  -8.048  -9.393   1.416
  146    HA   ALA  22           HA       ALA  22  -8.976 -11.332   3.110
  147   1HB   ALA  22          1HB       ALA  22  -9.537 -10.349   0.543
  148   2HB   ALA  22          2HB       ALA  22  -9.233 -12.086   0.299
  149   3HB   ALA  22          3HB       ALA  22 -10.482 -11.553   1.450
  150    H    CYS  23           H        CYS  23  -6.290 -11.447   0.743
  151    HA   CYS  23           HA       CYS  23  -5.967 -14.215   0.760
  152   1HB   CYS  23          1HB       CYS  23  -4.936 -12.300  -0.731
  153   2HB   CYS  23          2HB       CYS  23  -3.630 -12.374   0.434
  154    H    LYS  24           H        LYS  24  -4.128 -11.592   2.505
  155    HA   LYS  24           HA       LYS  24  -2.622 -13.263   4.096
  156   1HB   LYS  24          1HB       LYS  24  -3.333 -10.423   3.998
  157   2HB   LYS  24          2HB       LYS  24  -3.045 -10.988   5.632
  158   1HG   LYS  24          1HG       LYS  24  -0.807 -11.329   5.262
  159   2HG   LYS  24          2HG       LYS  24  -1.070 -12.019   3.673
  160   1HD   LYS  24          1HD       LYS  24  -0.466 -10.063   2.705
  161   2HD   LYS  24          2HD       LYS  24  -1.788  -9.241   3.508
  162   1HE   LYS  24          1HE       LYS  24   0.521  -9.813   5.291
  163   2HE   LYS  24          2HE       LYS  24   0.908  -8.743   3.959
  164   1HZ   LYS  24          1HZ       LYS  24  -0.188  -7.138   4.962
  165   2HZ   LYS  24          2HZ       LYS  24  -1.557  -8.022   5.074
  166   3HZ   LYS  24          3HZ       LYS  24  -0.434  -8.102   6.258
  167    H    GLU  25           H        GLU  25  -5.886 -11.822   4.700
  168    HA   GLU  25           HA       GLU  25  -6.186 -12.755   7.251
  169   1HB   GLU  25          1HB       GLU  25  -7.813 -11.534   5.233
  170   2HB   GLU  25          2HB       GLU  25  -8.717 -12.901   5.855
  171   1HG   GLU  25          1HG       GLU  25  -7.344 -11.203   7.907
  172   2HG   GLU  25          2HG       GLU  25  -8.676 -10.445   7.058
  173    H    LYS  26           H        LYS  26  -7.708 -14.256   4.300
  174    HA   LYS  26           HA       LYS  26  -8.605 -16.542   5.360
  175   1HB   LYS  26          1HB       LYS  26  -8.445 -15.580   2.874
  176   2HB   LYS  26          2HB       LYS  26  -7.160 -16.765   2.753
  177   1HG   LYS  26          1HG       LYS  26  -8.621 -18.518   2.770
  178   2HG   LYS  26          2HG       LYS  26  -9.526 -17.864   4.120
  179   1HD   LYS  26          1HD       LYS  26 -10.994 -16.661   2.745
  180   2HD   LYS  26          2HD       LYS  26  -9.824 -16.494   1.452
  181   1HE   LYS  26          1HE       LYS  26 -10.448 -19.321   1.933
  182   2HE   LYS  26          2HE       LYS  26 -11.909 -18.405   1.620
  183   1HZ   LYS  26          1HZ       LYS  26 -10.041 -17.519  -0.182
  184   2HZ   LYS  26          2HZ       LYS  26  -9.903 -19.147  -0.179
  185   3HZ   LYS  26          3HZ       LYS  26 -11.346 -18.451  -0.492
  186    H    CYS  27           H        CYS  27  -5.193 -15.882   4.365
  187    HA   CYS  27           HA       CYS  27  -4.263 -18.441   4.971
  188   1HB   CYS  27          1HB       CYS  27  -2.876 -15.766   4.794
  189   2HB   CYS  27          2HB       CYS  27  -2.017 -17.259   5.117
  190    H    ALA  28           H        ALA  28  -4.252 -15.310   6.825
  191    HA   ALA  28           HA       ALA  28  -2.998 -16.071   9.091
  192   1HB   ALA  28          1HB       ALA  28  -5.094 -14.119   8.336
  193   2HB   ALA  28          2HB       ALA  28  -5.039 -14.516  10.070
  194   3HB   ALA  28          3HB       ALA  28  -3.588 -13.884   9.255
  195    H    GLU  29           H        GLU  29  -6.497 -16.584   8.288
  196    HA   GLU  29           HA       GLU  29  -7.209 -17.747  10.650
  197   1HB   GLU  29          1HB       GLU  29  -8.214 -17.886   7.822
  198   2HB   GLU  29          2HB       GLU  29  -8.849 -19.063   8.955
  199   1HG   GLU  29          1HG       GLU  29  -8.856 -16.039   9.398
  200   2HG   GLU  29          2HG       GLU  29 -10.235 -16.971   8.850
  201    H    SER  30           H        SER  30  -6.174 -19.422   7.586
  202    HA   SER  30           HA       SER  30  -6.177 -21.946   8.713
  203   1HB   SER  30          1HB       SER  30  -5.779 -20.882   6.192
  204   2HB   SER  30          2HB       SER  30  -4.169 -21.455   6.576
  205    HG   SER  30           HG       SER  30  -5.592 -23.483   7.324
  206    H    CYS  31           H        CYS  31  -3.997 -19.250   9.066
  207    HA   CYS  31           HA       CYS  31  -1.924 -21.035  10.102
  208   1HB   CYS  31          1HB       CYS  31  -1.723 -18.131   9.275
  209   2HB   CYS  31          2HB       CYS  31  -0.412 -19.102   9.916
  210    H    GLU  32           H        GLU  32  -4.091 -20.940  11.740
  211    HA   GLU  32           HA       GLU  32  -3.743 -18.713  13.539
  212   1HB   GLU  32          1HB       GLU  32  -5.894 -20.569  12.864
  213   2HB   GLU  32          2HB       GLU  32  -5.655 -20.519  14.600
  214   1HG   GLU  32          1HG       GLU  32  -5.642 -17.928  14.360
  215   2HG   GLU  32          2HG       GLU  32  -6.254 -18.184  12.738
  216    H    THR  33           H        THR  33  -3.816 -22.349  13.700
  217    HA   THR  33           HA       THR  33  -2.653 -22.352  16.315
  218    HB   THR  33           HB       THR  33  -2.726 -24.827  15.937
  219    HG1  THR  33           1HG      THR  33  -2.718 -25.442  13.806
  220   1HG2  THR  33          1HG2      THR  33  -5.142 -23.238  14.946
  221   2HG2  THR  33          2HG2      THR  33  -5.174 -25.008  15.130
  222   3HG2  THR  33          3HG2      THR  33  -4.910 -23.970  16.552
  223    H    SER  34           H        SER  34  -1.448 -22.312  13.006
  224    HA   SER  34           HA       SER  34   0.937 -23.532  13.273
  225   1HB   SER  34          1HB       SER  34  -0.114 -21.268  11.634
  226   2HB   SER  34          2HB       SER  34   1.633 -21.387  11.709
  227    HG   SER  34           HG       SER  34   1.051 -23.845  11.252
  228    H    ALA  35           H        ALA  35   2.578 -23.287  14.741
  229    HA   ALA  35           HA       ALA  35   2.721 -21.377  16.661
  230   1HB   ALA  35          1HB       ALA  35   5.274 -21.986  16.557
  231   2HB   ALA  35          2HB       ALA  35   4.085 -23.252  16.948
  232   3HB   ALA  35          3HB       ALA  35   4.759 -23.141  15.305
  233    H    ASP  36           H        ASP  36   4.898 -21.402  13.745
  234    HA   ASP  36           HA       ASP  36   5.535 -18.692  14.171
  235   1HB   ASP  36          1HB       ASP  36   5.943 -20.148  11.542
  236   2HB   ASP  36          2HB       ASP  36   6.963 -18.926  12.275
  237    H    LYS  37           H        LYS  37   3.307 -17.741  14.115
  238    HA   LYS  37           HA       LYS  37   1.623 -18.040  11.895
  239   1HB   LYS  37          1HB       LYS  37   1.797 -16.189  14.243
  240   2HB   LYS  37          2HB       LYS  37   0.746 -15.749  12.912
  241   1HG   LYS  37          1HG       LYS  37  -0.045 -18.307  13.132
  242   2HG   LYS  37          2HG       LYS  37   0.574 -18.129  14.762
  243   1HD   LYS  37          1HD       LYS  37  -1.152 -15.882  13.808
  244   2HD   LYS  37          2HD       LYS  37  -1.970 -17.421  13.995
  245   1HE   LYS  37          1HE       LYS  37  -1.835 -17.355  16.281
  246   2HE   LYS  37          2HE       LYS  37  -0.170 -16.810  16.263
  247   1HZ   LYS  37          1HZ       LYS  37  -0.997 -14.861  16.836
  248   2HZ   LYS  37          2HZ       LYS  37  -1.571 -14.699  15.316
  249   3HZ   LYS  37          3HZ       LYS  37  -2.537 -15.283  16.496
  250    H    LYS  38           H        LYS  38   3.799 -15.286  12.849
  251    HA   LYS  38           HA       LYS  38   3.464 -13.687  10.713
  252   1HB   LYS  38          1HB       LYS  38   5.021 -13.542  12.817
  253   2HB   LYS  38          2HB       LYS  38   6.242 -14.200  11.747
  254   1HG   LYS  38          1HG       LYS  38   6.490 -12.218  10.661
  255   2HG   LYS  38          2HG       LYS  38   4.764 -12.061  10.405
  256   1HD   LYS  38          1HD       LYS  38   4.436 -11.051  12.586
  257   2HD   LYS  38          2HD       LYS  38   6.058 -11.470  13.101
  258   1HE   LYS  38          1HE       LYS  38   6.270  -9.186  12.530
  259   2HE   LYS  38          2HE       LYS  38   6.870  -9.996  11.096
  260   1HZ   LYS  38          1HZ       LYS  38   4.084  -9.123  11.408
  261   2HZ   LYS  38          2HZ       LYS  38   5.234  -8.235  10.664
  262   3HZ   LYS  38          3HZ       LYS  38   4.790  -9.679  10.045
  263    H    THR  39           H        THR  39   5.969 -16.322  10.877
  264    HA   THR  39           HA       THR  39   6.863 -16.151   8.300
  265    HB   THR  39           HB       THR  39   6.399 -18.750   9.842
  266    HG1  THR  39           1HG      THR  39   8.264 -16.501  10.085
  267   1HG2  THR  39          1HG2      THR  39   7.647 -19.394   7.971
  268   2HG2  THR  39          2HG2      THR  39   8.296 -17.756   7.718
  269   3HG2  THR  39          3HG2      THR  39   8.974 -18.795   8.995
  270    H    CYS  40           H        CYS  40   3.977 -17.967   9.494
  271    HA   CYS  40           HA       CYS  40   3.357 -19.076   7.019
  272   1HB   CYS  40          1HB       CYS  40   2.457 -19.532   9.444
  273   2HB   CYS  40          2HB       CYS  40   1.229 -18.362   9.003
  274    H    ARG  41           H        ARG  41   2.168 -16.096   8.732
  275    HA   ARG  41           HA       ARG  41   0.415 -15.264   6.843
  276   1HB   ARG  41          1HB       ARG  41   2.195 -13.761   8.799
  277   2HB   ARG  41          2HB       ARG  41   1.123 -12.875   7.733
  278   1HG   ARG  41          1HG       ARG  41  -0.788 -14.368   8.594
  279   2HG   ARG  41          2HG       ARG  41   0.330 -14.975   9.799
  280   1HD   ARG  41          1HD       ARG  41   0.126 -11.986   9.549
  281   2HD   ARG  41          2HD       ARG  41  -1.266 -12.810  10.223
  282    HE   ARG  41           HE       ARG  41   1.186 -13.764  11.443
  283   1HH1  ARG  41          2HH2      ARG  41  -1.100 -11.088  11.476
  284   2HH1  ARG  41          1HH2      ARG  41  -0.743 -10.636  13.109
  285   1HH2  ARG  41          2HH1      ARG  41   1.657 -13.168  13.598
  286   2HH2  ARG  41          1HH1      ARG  41   0.836 -11.827  14.325
  287    H    ARG  42           H        ARG  42   3.962 -15.169   6.851
  288    HA   ARG  42           HA       ARG  42   4.112 -13.250   4.773
  289   1HB   ARG  42          1HB       ARG  42   6.000 -14.870   6.415
  290   2HB   ARG  42          2HB       ARG  42   6.573 -14.544   4.792
  291   1HG   ARG  42          1HG       ARG  42   7.329 -12.604   5.794
  292   2HG   ARG  42          2HG       ARG  42   5.717 -12.052   5.383
  293   1HD   ARG  42          1HD       ARG  42   4.913 -12.316   7.604
  294   2HD   ARG  42          2HD       ARG  42   6.180 -13.447   8.036
  295    HE   ARG  42           HE       ARG  42   6.324 -10.584   8.259
  296   1HH1  ARG  42          2HH2      ARG  42   8.303 -13.359   7.382
  297   2HH1  ARG  42          1HH2      ARG  42   9.794 -12.597   7.824
  298   1HH2  ARG  42          2HH1      ARG  42   8.291  -9.578   8.842
  299   2HH2  ARG  42          1HH1      ARG  42   9.788 -10.431   8.660
  300    H    ASN  43           H        ASN  43   4.716 -16.826   5.072
  301    HA   ASN  43           HA       ASN  43   5.446 -17.385   2.560
  302   1HB   ASN  43          1HB       ASN  43   4.182 -18.824   4.782
  303   2HB   ASN  43          2HB       ASN  43   3.590 -19.444   3.254
  304   1HD2  ASN  43          1HD2      ASN  43   5.347 -20.635   5.272
  305   2HD2  ASN  43          2HD2      ASN  43   6.811 -21.096   4.470
  306    H    CYS  44           H        CYS  44   2.186 -16.629   3.848
  307    HA   CYS  44           HA       CYS  44   0.576 -17.533   1.856
  308   1HB   CYS  44          1HB       CYS  44  -0.268 -16.566   3.906
  309   2HB   CYS  44          2HB       CYS  44   0.348 -14.985   3.469
  310    H    LYS  45           H        LYS  45   2.524 -14.490   2.049
  311    HA   LYS  45           HA       LYS  45   1.625 -13.227  -0.204
  312   1HB   LYS  45          1HB       LYS  45   3.373 -12.567   1.638
  313   2HB   LYS  45          2HB       LYS  45   4.546 -13.220   0.512
  314   1HG   LYS  45          1HG       LYS  45   2.726 -11.576  -1.000
  315   2HG   LYS  45          2HG       LYS  45   3.199 -10.664   0.420
  316   1HD   LYS  45          1HD       LYS  45   5.631 -11.251  -0.123
  317   2HD   LYS  45          2HD       LYS  45   5.065 -11.937  -1.633
  318   1HE   LYS  45          1HE       LYS  45   4.045  -9.720  -2.241
  319   2HE   LYS  45          2HE       LYS  45   4.655  -9.041  -0.746
  320   1HZ   LYS  45          1HZ       LYS  45   5.994  -9.109  -3.056
  321   2HZ   LYS  45          2HZ       LYS  45   6.686  -8.904  -1.591
  322   3HZ   LYS  45          3HZ       LYS  45   6.648 -10.386  -2.276
  323    H    LYS  46           H        LYS  46   3.675 -16.109   0.112
  324    HA   LYS  46           HA       LYS  46   4.254 -16.038  -2.739
  325   1HB   LYS  46          1HB       LYS  46   5.275 -17.658  -0.410
  326   2HB   LYS  46          2HB       LYS  46   5.547 -18.184  -2.059
  327   1HG   LYS  46          1HG       LYS  46   6.225 -15.354  -1.161
  328   2HG   LYS  46          2HG       LYS  46   7.360 -16.674  -0.959
  329   1HD   LYS  46          1HD       LYS  46   7.742 -16.895  -3.244
  330   2HD   LYS  46          2HD       LYS  46   6.121 -16.390  -3.678
  331   1HE   LYS  46          1HE       LYS  46   6.999 -14.356  -4.186
  332   2HE   LYS  46          2HE       LYS  46   7.198 -14.098  -2.464
  333   1HZ   LYS  46          1HZ       LYS  46   9.243 -15.673  -3.737
  334   2HZ   LYS  46          2HZ       LYS  46   9.201 -14.096  -4.159
  335   3HZ   LYS  46          3HZ       LYS  46   9.379 -14.518  -2.591
  336    H    ALA  47           H        ALA  47   2.089 -17.481  -0.373
  337    HA   ALA  47           HA       ALA  47   1.402 -19.826  -1.645
  338   1HB   ALA  47          1HB       ALA  47  -0.715 -19.603  -0.388
  339   2HB   ALA  47          2HB       ALA  47   0.684 -19.162   0.620
  340   3HB   ALA  47          3HB       ALA  47  -0.349 -17.890  -0.075
  341    H    ASP  48           H        ASP  48  -0.244 -16.590  -1.932
  342    HA   ASP  48           HA       ASP  48  -0.414 -16.730  -4.680
  343   1HB   ASP  48          1HB       ASP  48  -2.126 -18.575  -3.785
  344   2HB   ASP  48          2HB       ASP  48  -3.150 -17.188  -3.468
  345    H    CYS  49           H        CYS  49   0.368 -14.686  -3.097
  346    HA   CYS  49           HA       CYS  49  -1.835 -12.806  -3.319
  347   1HB   CYS  49          1HB       CYS  49  -0.151 -12.596  -0.867
  348   2HB   CYS  49          2HB       CYS  49  -1.780 -12.022  -1.167
  349    H    GLU  50           H        GLU  50   0.817 -13.646  -4.679
  350    HA   GLU  50           HA       GLU  50   2.665 -11.622  -4.073
  351   1HB   GLU  50          1HB       GLU  50   2.419 -13.869  -5.957
  352   2HB   GLU  50          2HB       GLU  50   3.214 -12.489  -6.688
  353   1HG   GLU  50          1HG       GLU  50   4.413 -12.578  -4.177
  354   2HG   GLU  50          2HG       GLU  50   4.160 -14.278  -4.517
  355    HA   PRO  51           HA       PRO  51   0.730  -9.588  -7.904
  356   1HB   PRO  51          1HB       PRO  51  -1.632 -10.541  -8.897
  357   2HB   PRO  51          2HB       PRO  51  -0.068 -10.991  -9.547
  358   1HG   PRO  51          1HG       PRO  51  -1.890 -12.573  -7.839
  359   2HG   PRO  51          2HG       PRO  51  -0.558 -13.129  -8.832
  360   1HD   PRO  51          1HD       PRO  51  -0.560 -12.821  -5.981
  361   2HD   PRO  51          2HD       PRO  51   0.805 -13.265  -6.986
  362    H    GLN  52           H        GLN  52  -1.316 -10.751  -5.390
  363    HA   GLN  52           HA       GLN  52  -3.100  -8.571  -5.577
  364   1HB   GLN  52          1HB       GLN  52  -2.578 -10.493  -3.266
  365   2HB   GLN  52          2HB       GLN  52  -3.956  -9.418  -3.394
  366   1HG   GLN  52          1HG       GLN  52  -4.785 -10.572  -5.369
  367   2HG   GLN  52          2HG       GLN  52  -3.303 -11.492  -5.532
  368   1HE2  GLN  52          1HE2      GLN  52  -5.854 -12.613  -5.398
  369   2HE2  GLN  52          2HE2      GLN  52  -6.001 -13.570  -3.962
  370    H    ASP  53           H        ASP  53  -0.321  -9.429  -3.412
  371    HA   ASP  53           HA       ASP  53  -0.507  -7.198  -1.812
  372   1HB   ASP  53          1HB       ASP  53   0.967  -9.354  -1.622
  373   2HB   ASP  53          2HB       ASP  53   2.124  -8.495  -2.619
  374    H    LYS  54           H        LYS  54   1.263  -7.867  -4.898
  375    HA   LYS  54           HA       LYS  54   2.779  -5.573  -5.043
  376   1HB   LYS  54          1HB       LYS  54   1.585  -7.411  -7.113
  377   2HB   LYS  54          2HB       LYS  54   2.500  -5.996  -7.594
  378   1HG   LYS  54          1HG       LYS  54   4.455  -6.763  -6.290
  379   2HG   LYS  54          2HG       LYS  54   3.543  -8.124  -5.666
  380   1HD   LYS  54          1HD       LYS  54   4.123  -9.352  -7.478
  381   2HD   LYS  54          2HD       LYS  54   3.295  -8.214  -8.522
  382   1HE   LYS  54          1HE       LYS  54   5.295  -6.857  -8.783
  383   2HE   LYS  54          2HE       LYS  54   6.125  -7.716  -7.501
  384   1HZ   LYS  54          1HZ       LYS  54   5.764  -8.463 -10.225
  385   2HZ   LYS  54          2HZ       LYS  54   6.904  -8.941  -9.157
  386   3HZ   LYS  54          3HZ       LYS  54   5.449  -9.682  -9.185
  387    H    VAL  55           H        VAL  55  -0.570  -6.161  -6.319
  388    HA   VAL  55           HA       VAL  55  -0.998  -3.678  -7.389
  389    HB   VAL  55           HB       VAL  55  -2.757  -5.753  -6.124
  390   1HG1  VAL  55          1HG1      VAL  55  -3.805  -3.565  -5.636
  391   2HG1  VAL  55          2HG1      VAL  55  -3.753  -3.168  -7.370
  392   3HG1  VAL  55          3HG1      VAL  55  -4.752  -4.525  -6.798
  393   1HG2  VAL  55          1HG2      VAL  55  -1.815  -6.252  -8.313
  394   2HG2  VAL  55          2HG2      VAL  55  -3.570  -5.988  -8.452
  395   3HG2  VAL  55          3HG2      VAL  55  -2.435  -4.714  -8.960
  396    H    CYS  56           H        CYS  56  -0.872  -4.701  -3.993
  397    HA   CYS  56           HA       CYS  56  -2.166  -2.402  -2.982
  398   1HB   CYS  56          1HB       CYS  56  -1.798  -4.695  -1.869
  399   2HB   CYS  56          2HB       CYS  56  -0.200  -4.102  -1.460
  400    H    ASP  57           H        ASP  57   1.173  -3.353  -3.859
  401    HA   ASP  57           HA       ASP  57   2.506  -1.334  -2.549
  402   1HB   ASP  57          1HB       ASP  57   3.523  -3.341  -3.703
  403   2HB   ASP  57          2HB       ASP  57   3.181  -2.592  -5.249
  404    H    ALA  58           H        ALA  58   1.322  -1.587  -5.989
  405    HA   ALA  58           HA       ALA  58   2.101   0.942  -6.809
  406   1HB   ALA  58          1HB       ALA  58   0.710  -1.297  -7.836
  407   2HB   ALA  58          2HB       ALA  58  -0.381   0.093  -8.049
  408   3HB   ALA  58          3HB       ALA  58   1.262   0.138  -8.733
  409    H    CYS  59           H        CYS  59  -0.573  -0.147  -4.767
  410    HA   CYS  59           HA       CYS  59  -2.141   2.181  -5.108
  411   1HB   CYS  59          1HB       CYS  59  -3.240   0.209  -4.403
  412   2HB   CYS  59          2HB       CYS  59  -2.124  -0.043  -3.075
  413    H    ARG  60           H        ARG  60  -0.009   0.934  -2.427
  414    HA   ARG  60           HA       ARG  60  -0.150   3.224  -0.918
  415   1HB   ARG  60          1HB       ARG  60   2.124   1.186  -1.131
  416   2HB   ARG  60          2HB       ARG  60   1.957   2.346   0.172
  417   1HG   ARG  60          1HG       ARG  60  -0.435   1.328   0.506
  418   2HG   ARG  60          2HG       ARG  60   0.131   0.008  -0.497
  419   1HD   ARG  60          1HD       ARG  60   2.222   0.380   1.360
  420   2HD   ARG  60          2HD       ARG  60   0.771   0.617   2.313
  421    HE   ARG  60           HE       ARG  60   0.185  -1.645   1.985
  422   1HH1  ARG  60          2HH2      ARG  60   2.857  -0.769  -0.130
  423   2HH1  ARG  60          1HH2      ARG  60   3.190  -2.403  -0.599
  424   1HH2  ARG  60          2HH1      ARG  60   0.624  -3.801   1.368
  425   2HH2  ARG  60          1HH1      ARG  60   1.911  -4.139   0.260
  426    H    MET  61           H        MET  61   1.647   2.465  -3.845
  427    HA   MET  61           HA       MET  61   3.630   4.458  -3.439
  428   1HB   MET  61          1HB       MET  61   4.271   2.626  -4.847
  429   2HB   MET  61          2HB       MET  61   2.746   2.635  -5.712
  430   1HG   MET  61          1HG       MET  61   3.477   4.194  -7.222
  431   2HG   MET  61          2HG       MET  61   4.197   5.197  -5.979
  432   1HE   MET  61          1HE       MET  61   4.472   2.948  -8.709
  433   2HE   MET  61          2HE       MET  61   6.163   2.405  -8.827
  434   3HE   MET  61          3HE       MET  61   5.016   1.526  -7.787
  435    H    LYS  62           H        LYS  62   0.680   4.108  -5.524
  436    HA   LYS  62           HA       LYS  62   0.929   6.661  -6.679
  437   1HB   LYS  62          1HB       LYS  62  -1.017   4.446  -6.656
  438   2HB   LYS  62          2HB       LYS  62  -1.736   6.028  -6.875
  439   1HG   LYS  62          1HG       LYS  62  -1.035   6.063  -9.029
  440   2HG   LYS  62          2HG       LYS  62   0.632   5.964  -8.498
  441   1HD   LYS  62          1HD       LYS  62  -0.696   3.356  -8.275
  442   2HD   LYS  62          2HD       LYS  62  -0.820   3.984  -9.906
  443   1HE   LYS  62          1HE       LYS  62   1.777   4.539  -9.551
  444   2HE   LYS  62          2HE       LYS  62   1.662   3.294  -8.323
  445   1HZ   LYS  62          1HZ       LYS  62   2.173   2.667 -10.744
  446   2HZ   LYS  62          2HZ       LYS  62   1.166   1.719  -9.875
  447   3HZ   LYS  62          3HZ       LYS  62   0.558   2.773 -10.965
  448    H    CYS  63           H        CYS  63  -1.170   5.400  -3.995
  449    HA   CYS  63           HA       CYS  63  -2.514   7.612  -3.344
  450   1HB   CYS  63          1HB       CYS  63  -2.674   5.414  -2.218
  451   2HB   CYS  63          2HB       CYS  63  -1.188   5.758  -1.354
  452    H    HIS  64           H        HIS  64   0.756   6.727  -1.992
  453    HA   HIS  64           HA       HIS  64   1.275   8.925  -0.550
  454   1HB   HIS  64          1HB       HIS  64   2.696   6.753  -1.390
  455   2HB   HIS  64          2HB       HIS  64   3.540   8.036  -2.234
  456    HD1  HIS  64           1HD      HIS  64   5.204   6.700  -0.185
  457    HD2  HIS  64           2HD      HIS  64   2.618   9.848   0.817
  458    HE1  HIS  64           1HE      HIS  64   6.078   7.673   2.006
  459    H    LYS  65           H        LYS  65   2.459   8.612  -3.977
  460    HA   LYS  65           HA       LYS  65   3.159  11.230  -4.306
  461   1HB   LYS  65          1HB       LYS  65   2.380   8.999  -6.130
  462   2HB   LYS  65          2HB       LYS  65   2.451  10.610  -6.814
  463   1HG   LYS  65          1HG       LYS  65   4.785  10.672  -5.441
  464   2HG   LYS  65          2HG       LYS  65   4.668   8.937  -5.656
  465   1HD   LYS  65          1HD       LYS  65   4.037   9.781  -8.195
  466   2HD   LYS  65          2HD       LYS  65   5.105  11.078  -7.696
  467   1HE   LYS  65          1HE       LYS  65   6.858   9.725  -8.196
  468   2HE   LYS  65          2HE       LYS  65   6.421   8.742  -6.812
  469   1HZ   LYS  65          1HZ       LYS  65   6.161   7.194  -8.373
  470   2HZ   LYS  65          2HZ       LYS  65   4.699   7.877  -8.627
  471   3HZ   LYS  65          3HZ       LYS  65   5.957   8.255  -9.597
  472    H    ALA  66           H        ALA  66  -0.074   9.690  -4.628
  473    HA   ALA  66           HA       ALA  66  -1.388  11.877  -5.738
  474   1HB   ALA  66          1HB       ALA  66  -3.190  10.517  -4.036
  475   2HB   ALA  66          2HB       ALA  66  -2.921  10.234  -5.773
  476   3HB   ALA  66          3HB       ALA  66  -2.009   9.295  -4.567
  477    H    CYS  67           H        CYS  67  -0.737  10.948  -2.306
  478    HA   CYS  67           HA       CYS  67  -2.201  13.087  -1.228
  479   1HB   CYS  67          1HB       CYS  67  -1.882  11.390   0.277
  480   2HB   CYS  67          2HB       CYS  67  -0.221  11.107  -0.204
  481    H    ARG  68           H        ARG  68   1.275  12.535  -2.074
  482    HA   ARG  68           HA       ARG  68   2.306  14.815  -1.028
  483   1HB   ARG  68          1HB       ARG  68   3.677  13.001  -2.016
  484   2HB   ARG  68          2HB       ARG  68   3.067  13.372  -3.617
  485   1HG   ARG  68          1HG       ARG  68   4.198  15.500  -3.674
  486   2HG   ARG  68          2HG       ARG  68   4.513  15.469  -1.950
  487   1HD   ARG  68          1HD       ARG  68   6.483  14.395  -2.296
  488   2HD   ARG  68          2HD       ARG  68   5.654  13.074  -3.095
  489    HE   ARG  68           HE       ARG  68   5.999  15.455  -4.783
  490   1HH1  ARG  68          2HH2      ARG  68   7.407  12.405  -3.738
  491   2HH1  ARG  68          1HH2      ARG  68   8.426  12.252  -5.130
  492   1HH2  ARG  68          2HH1      ARG  68   7.343  15.254  -6.620
  493   2HH2  ARG  68          1HH1      ARG  68   8.390  13.883  -6.780
  494    H    ALA  69           H        ALA  69   1.255  14.285  -4.482
  495    HA   ALA  69           HA       ALA  69   1.531  16.959  -5.235
  496   1HB   ALA  69          1HB       ALA  69   1.317  14.811  -6.654
  497   2HB   ALA  69          2HB       ALA  69  -0.440  14.993  -6.434
  498   3HB   ALA  69          3HB       ALA  69   0.492  16.272  -7.250
  499    H    ALA  70           H        ALA  70  -1.184  15.088  -3.803
  500    HA   ALA  70           HA       ALA  70  -3.105  17.124  -4.138
  501   1HB   ALA  70          1HB       ALA  70  -2.887  14.738  -2.263
  502   2HB   ALA  70          2HB       ALA  70  -4.335  15.763  -2.401
  503   3HB   ALA  70          3HB       ALA  70  -3.771  14.827  -3.805
  504    H    ASN  71           H        ASN  71  -2.179  15.936  -0.879
  505    HA   ASN  71           HA       ASN  71  -2.737  18.143   0.470
  506   1HB   ASN  71          1HB       ASN  71  -0.998  15.818   0.868
  507   2HB   ASN  71          2HB       ASN  71  -0.295  17.223   1.645
  508   1HD2  ASN  71          1HD2      ASN  71  -3.238  15.300   1.324
  509   2HD2  ASN  71          2HD2      ASN  71  -3.908  15.635   2.886
  510    H    CYS  72           H        CYS  72   0.700  17.289  -0.424
  511    HA   CYS  72           HA       CYS  72   1.494  20.015  -0.128
  512   1HB   CYS  72          1HB       CYS  72   3.083  17.684  -1.219
  513   2HB   CYS  72          2HB       CYS  72   3.716  19.226  -0.677
  514    H    ALA  73           H        ALA  73   0.006  20.958  -1.764
  515    HA   ALA  73           HA       ALA  73   0.604  20.217  -4.520
  516   1HB   ALA  73          1HB       ALA  73  -1.382  22.340  -3.841
  517   2HB   ALA  73          2HB       ALA  73  -1.487  21.010  -5.019
  518   3HB   ALA  73          3HB       ALA  73  -1.757  20.689  -3.289
  519    H    SER  74           H        SER  74   0.485  23.120  -2.342
  520    HA   SER  74           HA       SER  74   2.079  24.514  -4.317
  521   1HB   SER  74          1HB       SER  74   0.244  25.306  -2.099
  522   2HB   SER  74          2HB       SER  74   1.626  26.357  -2.337
  523    HG   SER  74           HG       SER  74  -0.501  25.731  -4.165
  524    H    GLU  75           H        GLU  75   3.271  22.318  -2.806
  525    HA   GLU  75           HA       GLU  75   5.167  23.874  -1.226
  526   1HB   GLU  75          1HB       GLU  75   3.865  21.212  -0.646
  527   2HB   GLU  75          2HB       GLU  75   5.486  21.507  -0.047
  528   1HG   GLU  75          1HG       GLU  75   3.243  23.512   0.416
  529   2HG   GLU  75          2HG       GLU  75   3.481  22.149   1.492
  530    H    CYS  76           H        CYS  76   4.552  21.093  -3.417
  531    HA   CYS  76           HA       CYS  76   7.424  20.816  -3.804
  532   1HB   CYS  76          1HB       CYS  76   5.438  19.056  -5.172
  533   2HB   CYS  76          2HB       CYS  76   7.057  18.696  -4.607
  534    HA   PRO  77           HA       PRO  77   6.638  23.309  -7.380
  535   1HB   PRO  77          1HB       PRO  77   9.242  23.953  -7.906
  536   2HB   PRO  77          2HB       PRO  77   8.229  24.872  -6.810
  537   1HG   PRO  77          1HG       PRO  77  10.407  22.978  -6.172
  538   2HG   PRO  77          2HG       PRO  77   9.684  24.204  -5.150
  539   1HD   PRO  77          1HD       PRO  77   9.207  21.378  -5.039
  540   2HD   PRO  77          2HD       PRO  77   8.399  22.614  -4.097
  541    H    LYS  78           H        LYS  78   8.334  23.462  -9.572
  542    HA   LYS  78           HA       LYS  78   8.076  20.685 -10.480
  543   1HB   LYS  78          1HB       LYS  78   7.009  23.030 -11.534
  544   2HB   LYS  78          2HB       LYS  78   8.400  22.721 -12.554
  545   1HG   LYS  78          1HG       LYS  78   7.293  20.173 -12.274
  546   2HG   LYS  78          2HG       LYS  78   5.871  21.196 -12.306
  547   1HD   LYS  78          1HD       LYS  78   6.121  21.657 -14.525
  548   2HD   LYS  78          2HD       LYS  78   7.824  22.028 -14.339
  549   1HE   LYS  78          1HE       LYS  78   8.275  20.077 -15.412
  550   2HE   LYS  78          2HE       LYS  78   7.718  19.238 -13.978
  551   1HZ   LYS  78          1HZ       LYS  78   6.598  18.983 -16.352
  552   2HZ   LYS  78          2HZ       LYS  78   5.791  18.732 -14.954
  553   3HZ   LYS  78          3HZ       LYS  78   5.643  20.157 -15.737
  554    H    HIS  79           H        HIS  79   9.755  19.940 -12.062
  555    HA   HIS  79           HA       HIS  79  11.876  19.396 -12.340
  556   1HB   HIS  79          1HB       HIS  79  11.574  22.228 -13.034
  557   2HB   HIS  79          2HB       HIS  79  13.234  21.791 -12.681
  558    HD1  HIS  79           1HD      HIS  79  12.572  22.561 -15.540
  559    HD2  HIS  79           2HD      HIS  79  12.330  18.617 -14.132
  560    HE1  HIS  79           1HE      HIS  79  12.760  21.057 -17.592
  561    H    GLU  80           H        GLU  80  11.628  18.821  -9.878
  562    HA   GLU  80           HA       GLU  80  14.011  19.834  -8.663
  563   1HB   GLU  80          1HB       GLU  80  11.283  20.546  -7.677
  564   2HB   GLU  80          2HB       GLU  80  12.416  20.020  -6.448
  565   1HG   GLU  80          1HG       GLU  80  13.821  21.818  -8.211
  566   2HG   GLU  80          2HG       GLU  80  12.293  22.571  -7.800
  567    H    HIS  81           H        HIS  81  14.720  18.458  -6.824
  568    HA   HIS  81           HA       HIS  81  13.574  15.792  -7.111
  569   1HB   HIS  81          1HB       HIS  81  16.243  16.640  -5.953
  570   2HB   HIS  81          2HB       HIS  81  15.700  14.992  -6.198
  571    HD1  HIS  81           1HD      HIS  81  16.568  13.947  -8.286
  572    HD2  HIS  81           2HD      HIS  81  16.223  18.112  -8.644
  573    HE1  HIS  81           1HE      HIS  81  17.450  14.541 -10.605
  574    H    LYS  82           H        LYS  82  11.699  16.364  -5.758
  575    HA   LYS  82           HA       LYS  82  10.622  16.675  -3.834
  576   1HB   LYS  82          1HB       LYS  82  12.709  14.611  -3.112
  577   2HB   LYS  82          2HB       LYS  82  11.427  15.067  -2.009
  578   1HG   LYS  82          1HG       LYS  82   9.714  14.262  -3.460
  579   2HG   LYS  82          2HG       LYS  82  10.763  14.280  -4.864
  580   1HD   LYS  82          1HD       LYS  82  11.763  12.540  -2.680
  581   2HD   LYS  82          2HD       LYS  82  10.200  12.045  -3.297
  582   1HE   LYS  82          1HE       LYS  82  11.787  10.908  -4.678
  583   2HE   LYS  82          2HE       LYS  82  11.208  12.236  -5.665
  584   1HZ   LYS  82          1HZ       LYS  82  13.611  12.043  -5.670
  585   2HZ   LYS  82          2HZ       LYS  82  13.144  13.486  -5.062
  586   3HZ   LYS  82          3HZ       LYS  82  13.669  12.309  -4.059
  587    H    SER  83           H        SER  83  10.988  18.907  -3.483
  588    HA   SER  83           HA       SER  83  13.327  19.863  -2.335
  589   1HB   SER  83          1HB       SER  83  12.065  21.946  -1.993
  590   2HB   SER  83          2HB       SER  83  11.710  21.276  -3.573
  591    HG   SER  83           HG       SER  83   9.878  20.171  -2.036
  592    H    ASP  84           H        ASP  84  13.374  21.030  -0.107
  593    HA   ASP  84           HA       ASP  84  12.917  19.128   1.848
  594   1HB   ASP  84          1HB       ASP  84  13.315  21.190   3.409
  595   2HB   ASP  84          2HB       ASP  84  14.612  20.684   2.345
  596    H    THR  85           H        THR  85  11.254  22.249   0.997
  597    HA   THR  85           HA       THR  85   9.368  22.275   3.021
  598    HB   THR  85           HB       THR  85  10.068  23.939   1.018
  599    HG1  THR  85           1HG      THR  85   7.400  23.520   2.175
  600   1HG2  THR  85          1HG2      THR  85   8.797  22.303  -0.632
  601   2HG2  THR  85          2HG2      THR  85   7.328  22.993   0.100
  602   3HG2  THR  85          3HG2      THR  85   8.481  24.051  -0.749
  603    H    CYS  86           H        CYS  86   9.367  20.496  -0.095
  604    HA   CYS  86           HA       CYS  86   6.702  19.665   0.105
  605   1HB   CYS  86          1HB       CYS  86   7.951  19.635  -1.987
  606   2HB   CYS  86          2HB       CYS  86   9.043  18.421  -1.352
  607    H    ARG  87           H        ARG  87   9.779  17.762   0.580
  608    HA   ARG  87           HA       ARG  87   8.632  15.594   1.711
  609   1HB   ARG  87          1HB       ARG  87  11.351  16.845   2.350
  610   2HB   ARG  87          2HB       ARG  87  10.903  15.207   2.780
  611   1HG   ARG  87          1HG       ARG  87  10.309  15.010   0.184
  612   2HG   ARG  87          2HG       ARG  87  11.391  16.380   0.034
  613   1HD   ARG  87          1HD       ARG  87  12.740  14.392  -0.261
  614   2HD   ARG  87          2HD       ARG  87  13.149  15.048   1.312
  615    HE   ARG  87           HE       ARG  87  11.084  13.277   1.870
  616   1HH1  ARG  87          2HH2      ARG  87  14.181  13.002   0.222
  617   2HH1  ARG  87          1HH2      ARG  87  14.399  11.335   0.639
  618   1HH2  ARG  87          2HH1      ARG  87  11.372  11.078   2.420
  619   2HH2  ARG  87          1HH1      ARG  87  12.791  10.233   1.898
  620    H    ALA  88           H        ALA  88   9.235  18.791   3.098
  621    HA   ALA  88           HA       ALA  88   9.006  17.933   5.820
  622   1HB   ALA  88          1HB       ALA  88   8.871  20.689   4.529
  623   2HB   ALA  88          2HB       ALA  88   9.040  20.362   6.270
  624   3HB   ALA  88          3HB       ALA  88  10.340  19.898   5.147
  625    H    CYS  89           H        CYS  89   6.890  19.462   3.325
  626    HA   CYS  89           HA       CYS  89   4.725  19.935   4.979
  627   1HB   CYS  89          1HB       CYS  89   4.531  20.991   2.968
  628   2HB   CYS  89          2HB       CYS  89   5.145  19.630   2.051
  629    H    MET  90           H        MET  90   5.300  17.172   2.666
  630    HA   MET  90           HA       MET  90   3.169  15.667   3.295
  631   1HB   MET  90          1HB       MET  90   6.060  14.889   2.655
  632   2HB   MET  90          2HB       MET  90   4.789  13.686   2.745
  633   1HG   MET  90          1HG       MET  90   3.489  15.132   1.031
  634   2HG   MET  90          2HG       MET  90   4.973  16.038   0.812
  635   1HE   MET  90          1HE       MET  90   2.989  12.877   0.083
  636   2HE   MET  90          2HE       MET  90   4.215  11.651  -0.318
  637   3HE   MET  90          3HE       MET  90   4.044  12.223   1.359
  638    H    LYS  91           H        LYS  91   5.983  16.328   5.307
  639    HA   LYS  91           HA       LYS  91   6.082  14.151   6.945
  640   1HB   LYS  91          1HB       LYS  91   7.494  16.319   6.881
  641   2HB   LYS  91          2HB       LYS  91   6.312  16.969   7.998
  642   1HG   LYS  91          1HG       LYS  91   6.881  15.458   9.708
  643   2HG   LYS  91          2HG       LYS  91   7.477  14.247   8.591
  644   1HD   LYS  91          1HD       LYS  91   9.170  16.444   8.129
  645   2HD   LYS  91          2HD       LYS  91   8.914  16.489   9.862
  646   1HE   LYS  91          1HE       LYS  91   9.570  14.073  10.018
  647   2HE   LYS  91          2HE       LYS  91   9.837  14.037   8.286
  648   1HZ   LYS  91          1HZ       LYS  91  11.196  16.166   9.616
  649   2HZ   LYS  91          2HZ       LYS  91  11.683  14.683  10.096
  650   3HZ   LYS  91          3HZ       LYS  91  11.759  15.097   8.518
  651    H    THR  92           H        THR  92   4.086  17.136   7.537
  652    HA   THR  92           HA       THR  92   2.414  15.515   9.317
  653    HB   THR  92           HB       THR  92   2.787  18.526   8.902
  654    HG1  THR  92           1HG      THR  92   3.224  16.677  11.136
  655   1HG2  THR  92          1HG2      THR  92   1.555  18.093  11.370
  656   2HG2  THR  92          2HG2      THR  92   0.729  18.708   9.918
  657   3HG2  THR  92          3HG2      THR  92   0.678  16.971  10.302
  658    H    ASN  93           H        ASN  93   2.543  16.736   6.100
  659    HA   ASN  93           HA       ASN  93  -0.351  16.714   5.946
  660   1HB   ASN  93          1HB       ASN  93   1.819  17.608   3.981
  661   2HB   ASN  93          2HB       ASN  93   0.116  17.580   3.566
  662   1HD2  ASN  93          1HD2      ASN  93   2.646  19.197   5.211
  663   2HD2  ASN  93          2HD2      ASN  93   1.759  20.554   5.821
  664    H    CYS  94           H        CYS  94   1.266  14.245   6.344
  665    HA   CYS  94           HA       CYS  94   0.079  12.584   4.509
  666   1HB   CYS  94          1HB       CYS  94   2.068  13.888   3.180
  667   2HB   CYS  94          2HB       CYS  94   2.933  12.479   3.760
  668    H    LYS  95           H        LYS  95  -0.254  11.325   6.383
  669    HA   LYS  95           HA       LYS  95   1.398  10.865   8.445
  670   1HB   LYS  95          1HB       LYS  95  -0.954   9.698   7.372
  671   2HB   LYS  95          2HB       LYS  95   0.133   8.374   7.738
  672   1HG   LYS  95          1HG       LYS  95  -0.018  10.526   9.813
  673   2HG   LYS  95          2HG       LYS  95  -1.479   9.583   9.598
  674   1HD   LYS  95          1HD       LYS  95   0.801   7.785   9.606
  675   2HD   LYS  95          2HD       LYS  95   0.907   8.836  11.003
  676   1HE   LYS  95          1HE       LYS  95  -0.416   6.999  11.750
  677   2HE   LYS  95          2HE       LYS  95  -1.581   8.273  11.446
  678   1HZ   LYS  95          1HZ       LYS  95  -0.946   6.514   9.240
  679   2HZ   LYS  95          2HZ       LYS  95  -1.851   5.893  10.449
  680   3HZ   LYS  95          3HZ       LYS  95  -2.368   7.212   9.637
  Start of MODEL   20
    1   1H    ILE   1           H        ILE   1 -16.326  20.206  13.498
    2    HA   ILE   1           HA       ILE   1 -14.912  18.748  15.318
    3    HB   ILE   1           HB       ILE   1 -16.709  17.051  15.000
    4   1HG1  ILE   1          1HG1      ILE   1 -14.411  16.527  15.817
    5   2HG1  ILE   1          2HG1      ILE   1 -15.222  15.184  15.036
    6   1HG2  ILE   1          1HG2      ILE   1 -17.400  16.465  12.978
    7   2HG2  ILE   1          2HG2      ILE   1 -16.195  17.551  12.245
    8   3HG2  ILE   1          3HG2      ILE   1 -15.774  15.856  12.586
    9   1HD1  ILE   1          1HD1      ILE   1 -12.739  16.527  14.283
   10   2HD1  ILE   1          2HD1      ILE   1 -13.407  14.987  13.693
   11   3HD1  ILE   1          3HD1      ILE   1 -13.893  16.519  12.928
   12    H    SER   2           H        SER   2 -12.778  18.552  14.621
   13    HA   SER   2           HA       SER   2 -12.372  19.013  11.779
   14   1HB   SER   2          1HB       SER   2 -11.914  20.944  13.777
   15   2HB   SER   2          2HB       SER   2 -10.321  20.291  13.450
   16    HG   SER   2           HG       SER   2 -12.107  21.134  11.340
   17    H    GLU   3           H        GLU   3 -11.404  17.121  11.116
   18    HA   GLU   3           HA       GLU   3  -9.932  15.544  12.920
   19   1HB   GLU   3          1HB       GLU   3 -10.584  15.436   9.978
   20   2HB   GLU   3          2HB       GLU   3  -9.310  14.397  10.584
   21   1HG   GLU   3          1HG       GLU   3 -10.818  13.340  12.183
   22   2HG   GLU   3          2HG       GLU   3 -12.076  14.518  11.864
   23    H    PHE   4           H        PHE   4  -7.623  14.690  12.147
   24    HA   PHE   4           HA       PHE   4  -5.981  16.477  10.737
   25   1HB   PHE   4          1HB       PHE   4  -4.724  17.372  12.694
   26   2HB   PHE   4          2HB       PHE   4  -6.414  17.808  12.855
   27    HD1  PHE   4           1HD      PHE   4  -3.641  16.280  14.440
   28    HD2  PHE   4           2HD      PHE   4  -7.882  16.231  14.304
   29    HE1  PHE   4           1HE      PHE   4  -3.701  15.208  16.709
   30    HE2  PHE   4           2HE      PHE   4  -7.942  15.160  16.573
   31    HZ   PHE   4           HZ       PHE   4  -5.851  14.661  17.748
   32    H    ALA   5           H        ALA   5  -4.845  14.848   9.761
   33    HA   ALA   5           HA       ALA   5  -2.916  13.438  11.183
   34   1HB   ALA   5          1HB       ALA   5  -4.151  11.780  12.094
   35   2HB   ALA   5          2HB       ALA   5  -5.582  12.200  11.122
   36   3HB   ALA   5          3HB       ALA   5  -4.314  11.155  10.435
   37    HA   PRO   6           HA       PRO   6  -1.684  13.025   7.057
   38   1HB   PRO   6          1HB       PRO   6   0.319  11.177   7.267
   39   2HB   PRO   6          2HB       PRO   6   0.534  12.872   7.656
   40   1HG   PRO   6          1HG       PRO   6   0.273  10.570   9.491
   41   2HG   PRO   6          2HG       PRO   6   0.902  12.171   9.822
   42   1HD   PRO   6          1HD       PRO   6  -1.674  11.152  10.565
   43   2HD   PRO   6          2HD       PRO   6  -1.089  12.788  10.793
   44    H    VAL   7           H        VAL   7  -1.346  11.542   5.156
   45    HA   VAL   7           HA       VAL   7  -3.352   9.426   5.463
   46    HB   VAL   7           HB       VAL   7  -2.320  10.780   2.964
   47   1HG1  VAL   7          1HG1      VAL   7  -4.373   8.659   3.507
   48   2HG1  VAL   7          2HG1      VAL   7  -4.640   9.804   2.170
   49   3HG1  VAL   7          3HG1      VAL   7  -3.181   8.784   2.191
   50   1HG2  VAL   7          1HG2      VAL   7  -3.843  11.996   4.882
   51   2HG2  VAL   7          2HG2      VAL   7  -3.877  12.401   3.149
   52   3HG2  VAL   7          3HG2      VAL   7  -5.096  11.296   3.829
   53    H    ASP   8           H        ASP   8  -2.944   7.386   4.216
   54    HA   ASP   8           HA       ASP   8  -0.241   6.897   3.480
   55   1HB   ASP   8          1HB       ASP   8  -0.461   6.599   6.075
   56   2HB   ASP   8          2HB       ASP   8  -1.398   5.167   5.699
   57    H    CYS   9           H        CYS   9  -2.851   6.871   2.176
   58    HA   CYS   9           HA       CYS   9  -4.268   5.611   1.047
   59   1HB   CYS   9          1HB       CYS   9  -1.751   5.059   0.207
   60   2HB   CYS   9          2HB       CYS   9  -2.304   3.443   0.599
   61    H    LYS  10           H        LYS  10  -4.486   5.249   3.857
   62    HA   LYS  10           HA       LYS  10  -4.535   2.420   4.387
   63   1HB   LYS  10          1HB       LYS  10  -4.818   2.992   6.592
   64   2HB   LYS  10          2HB       LYS  10  -3.966   4.403   5.999
   65   1HG   LYS  10          1HG       LYS  10  -6.117   5.614   5.712
   66   2HG   LYS  10          2HG       LYS  10  -7.007   4.193   6.224
   67   1HD   LYS  10          1HD       LYS  10  -5.558   4.326   8.408
   68   2HD   LYS  10          2HD       LYS  10  -5.169   5.954   7.886
   69   1HE   LYS  10          1HE       LYS  10  -7.069   6.458   9.101
   70   2HE   LYS  10          2HE       LYS  10  -7.852   6.094   7.576
   71   1HZ   LYS  10          1HZ       LYS  10  -7.406   4.122   9.709
   72   2HZ   LYS  10          2HZ       LYS  10  -8.813   4.913   9.457
   73   3HZ   LYS  10          3HZ       LYS  10  -8.244   3.879   8.328
   74    H    GLY  11           H        GLY  11  -6.926   5.118   4.009
   75   1HA   GLY  11          1HA       GLY  11  -9.098   3.160   3.938
   76   2HA   GLY  11          2HA       GLY  11  -9.237   4.904   4.024
   77    H    GLN  12           H        GLN  12  -6.828   4.307   1.757
   78    HA   GLN  12           HA       GLN  12  -8.806   4.459  -0.377
   79   1HB   GLN  12          1HB       GLN  12  -6.025   5.617  -0.057
   80   2HB   GLN  12          2HB       GLN  12  -6.701   5.396  -1.658
   81   1HG   GLN  12          1HG       GLN  12  -7.467   7.546  -1.216
   82   2HG   GLN  12          2HG       GLN  12  -8.824   6.626  -0.598
   83   1HE2  GLN  12          1HE2      GLN  12  -5.964   8.459   0.190
   84   2HE2  GLN  12          2HE2      GLN  12  -6.293   8.731   1.868
   85    H    CYS  13           H        CYS  13  -6.956   2.223   1.167
   86    HA   CYS  13           HA       CYS  13  -6.271   0.862  -1.336
   87   1HB   CYS  13          1HB       CYS  13  -4.943   0.818   1.366
   88   2HB   CYS  13          2HB       CYS  13  -4.724  -0.491   0.222
   89    H    THR  14           H        THR  14  -8.778   0.469  -1.093
   90    HA   THR  14           HA       THR  14  -9.170  -1.870   0.658
   91    HB   THR  14           HB       THR  14 -10.941   0.483  -0.106
   92    HG1  THR  14           1HG      THR  14 -10.400  -1.091   2.311
   93   1HG2  THR  14          1HG2      THR  14 -11.775  -2.320   0.218
   94   2HG2  THR  14          2HG2      THR  14 -12.427  -1.295   1.519
   95   3HG2  THR  14          3HG2      THR  14 -12.767  -0.897  -0.182
   96    H    THR  15           H        THR  15 -10.004  -0.348  -2.511
   97    HA   THR  15           HA       THR  15 -11.107  -2.805  -3.492
   98    HB   THR  15           HB       THR  15 -10.755   0.028  -4.339
   99    HG1  THR  15           1HG      THR  15 -12.881  -0.806  -5.337
  100   1HG2  THR  15          1HG2      THR  15  -9.555  -1.283  -6.201
  101   2HG2  THR  15          2HG2      THR  15 -11.081  -2.167  -6.443
  102   3HG2  THR  15          3HG2      THR  15 -11.018  -0.410  -6.719
  103    HA   PRO  16           HA       PRO  16  -6.920  -2.941  -5.649
  104   1HB   PRO  16          1HB       PRO  16  -4.882  -1.348  -4.766
  105   2HB   PRO  16          2HB       PRO  16  -5.903  -0.932  -6.129
  106   1HG   PRO  16          1HG       PRO  16  -5.933   0.169  -3.385
  107   2HG   PRO  16          2HG       PRO  16  -6.626   0.844  -4.847
  108   1HD   PRO  16          1HD       PRO  16  -8.037  -0.482  -2.730
  109   2HD   PRO  16          2HD       PRO  16  -8.712   0.088  -4.243
  110    H    CYS  17           H        CYS  17  -7.512  -2.932  -2.384
  111    HA   CYS  17           HA       CYS  17  -5.426  -4.963  -2.068
  112   1HB   CYS  17          1HB       CYS  17  -6.241  -2.823  -0.098
  113   2HB   CYS  17          2HB       CYS  17  -5.333  -4.252   0.355
  114    H    GLU  18           H        GLU  18  -8.511  -4.687  -2.723
  115    HA   GLU  18           HA       GLU  18  -9.844  -5.706  -0.494
  116   1HB   GLU  18          1HB       GLU  18 -10.510  -4.820  -3.095
  117   2HB   GLU  18          2HB       GLU  18 -11.053  -6.485  -3.043
  118   1HG   GLU  18          1HG       GLU  18 -11.967  -5.688  -0.613
  119   2HG   GLU  18          2HG       GLU  18 -11.977  -4.131  -1.418
  120    HA   PRO  19           HA       PRO  19  -9.151  -9.896  -2.602
  121   1HB   PRO  19          1HB       PRO  19  -7.502 -10.092  -4.773
  122   2HB   PRO  19          2HB       PRO  19  -9.243  -9.935  -4.902
  123   1HG   PRO  19          1HG       PRO  19  -7.157  -7.900  -5.398
  124   2HG   PRO  19          2HG       PRO  19  -8.831  -7.906  -5.917
  125   1HD   PRO  19          1HD       PRO  19  -7.707  -6.378  -3.765
  126   2HD   PRO  19          2HD       PRO  19  -9.399  -6.473  -4.211
  127    H    LEU  20           H        LEU  20  -6.409  -7.764  -2.548
  128    HA   LEU  20           HA       LEU  20  -4.514  -9.753  -1.973
  129   1HB   LEU  20          1HB       LEU  20  -3.621  -7.790  -2.752
  130   2HB   LEU  20          2HB       LEU  20  -4.669  -6.782  -1.774
  131    HG   LEU  20           HG       LEU  20  -2.097  -7.012  -1.254
  132   1HD1  LEU  20          1HD1      LEU  20  -4.037  -5.802  -0.001
  133   2HD1  LEU  20          2HD1      LEU  20  -3.885  -7.148   1.154
  134   3HD1  LEU  20          3HD1      LEU  20  -2.489  -6.093   0.828
  135   1HD2  LEU  20          1HD2      LEU  20  -2.785  -8.996   0.791
  136   2HD2  LEU  20          2HD2      LEU  20  -2.799  -9.641  -0.868
  137   3HD2  LEU  20          3HD2      LEU  20  -1.337  -8.848  -0.234
  138    H    THR  21           H        THR  21  -6.179  -7.377   0.223
  139    HA   THR  21           HA       THR  21  -5.220  -8.391   2.596
  140    HB   THR  21           HB       THR  21  -7.840  -7.025   1.810
  141    HG1  THR  21           1HG      THR  21  -6.556  -5.228   2.526
  142   1HG2  THR  21          1HG2      THR  21  -8.561  -7.333   3.959
  143   2HG2  THR  21          2HG2      THR  21  -7.065  -8.199   4.381
  144   3HG2  THR  21          3HG2      THR  21  -7.129  -6.424   4.498
  145    H    ALA  22           H        ALA  22  -8.233  -9.359   0.833
  146    HA   ALA  22           HA       ALA  22  -9.155 -11.191   2.639
  147   1HB   ALA  22          1HB       ALA  22  -9.300 -11.941  -0.241
  148   2HB   ALA  22          2HB       ALA  22 -10.600 -11.752   0.960
  149   3HB   ALA  22          3HB       ALA  22  -9.895 -10.316   0.178
  150    H    CYS  23           H        CYS  23  -6.502 -11.486   0.240
  151    HA   CYS  23           HA       CYS  23  -6.183 -14.254   0.529
  152   1HB   CYS  23          1HB       CYS  23  -5.256 -12.525  -1.235
  153   2HB   CYS  23          2HB       CYS  23  -3.883 -12.461  -0.148
  154    H    LYS  24           H        LYS  24  -4.481 -11.380   1.973
  155    HA   LYS  24           HA       LYS  24  -2.759 -12.826   3.599
  156   1HB   LYS  24          1HB       LYS  24  -3.658 -10.048   3.304
  157   2HB   LYS  24          2HB       LYS  24  -3.231 -10.457   4.953
  158   1HG   LYS  24          1HG       LYS  24  -1.020 -11.253   4.255
  159   2HG   LYS  24          2HG       LYS  24  -1.443 -11.092   2.562
  160   1HD   LYS  24          1HD       LYS  24  -0.537  -9.008   2.671
  161   2HD   LYS  24          2HD       LYS  24  -1.978  -8.538   3.550
  162   1HE   LYS  24          1HE       LYS  24   0.109  -9.868   5.216
  163   2HE   LYS  24          2HE       LYS  24   0.591  -8.325   4.539
  164   1HZ   LYS  24          1HZ       LYS  24  -0.509  -7.536   6.285
  165   2HZ   LYS  24          2HZ       LYS  24  -1.861  -7.790   5.405
  166   3HZ   LYS  24          3HZ       LYS  24  -1.393  -8.889   6.519
  167    H    GLU  25           H        GLU  25  -6.092 -11.562   4.203
  168    HA   GLU  25           HA       GLU  25  -6.223 -12.254   6.848
  169   1HB   GLU  25          1HB       GLU  25  -8.012 -11.350   4.793
  170   2HB   GLU  25          2HB       GLU  25  -8.794 -12.694   5.601
  171   1HG   GLU  25          1HG       GLU  25  -7.445 -10.692   7.381
  172   2HG   GLU  25          2HG       GLU  25  -8.875 -10.131   6.537
  173    H    LYS  26           H        LYS  26  -7.707 -14.128   4.096
  174    HA   LYS  26           HA       LYS  26  -8.439 -16.352   5.386
  175   1HB   LYS  26          1HB       LYS  26  -8.474 -15.676   2.854
  176   2HB   LYS  26          2HB       LYS  26  -6.999 -16.615   2.759
  177   1HG   LYS  26          1HG       LYS  26  -9.108 -18.004   4.289
  178   2HG   LYS  26          2HG       LYS  26  -9.614 -17.630   2.653
  179   1HD   LYS  26          1HD       LYS  26  -7.264 -18.597   1.951
  180   2HD   LYS  26          2HD       LYS  26  -7.247 -19.307   3.553
  181   1HE   LYS  26          1HE       LYS  26  -9.363 -20.494   3.105
  182   2HE   LYS  26          2HE       LYS  26  -9.527 -19.691   1.556
  183   1HZ   LYS  26          1HZ       LYS  26  -8.438 -22.023   1.756
  184   2HZ   LYS  26          2HZ       LYS  26  -7.893 -20.946   0.657
  185   3HZ   LYS  26          3HZ       LYS  26  -7.082 -21.164   2.057
  186    H    CYS  27           H        CYS  27  -5.091 -15.412   4.506
  187    HA   CYS  27           HA       CYS  27  -3.956 -17.881   5.228
  188   1HB   CYS  27          1HB       CYS  27  -2.730 -15.122   5.028
  189   2HB   CYS  27          2HB       CYS  27  -1.820 -16.602   5.260
  190    H    ALA  28           H        ALA  28  -3.989 -14.624   6.871
  191    HA   ALA  28           HA       ALA  28  -2.834 -15.245   9.215
  192   1HB   ALA  28          1HB       ALA  28  -3.547 -13.004   8.699
  193   2HB   ALA  28          2HB       ALA  28  -5.256 -13.498   8.644
  194   3HB   ALA  28          3HB       ALA  28  -4.382 -13.491  10.194
  195    H    GLU  29           H        GLU  29  -6.297 -15.828   8.324
  196    HA   GLU  29           HA       GLU  29  -7.075 -16.823  10.757
  197   1HB   GLU  29          1HB       GLU  29  -8.033 -17.137   7.921
  198   2HB   GLU  29          2HB       GLU  29  -8.720 -18.197   9.136
  199   1HG   GLU  29          1HG       GLU  29  -8.660 -15.145   9.288
  200   2HG   GLU  29          2HG       GLU  29 -10.060 -16.109   8.860
  201    H    SER  30           H        SER  30  -5.892 -18.620   7.826
  202    HA   SER  30           HA       SER  30  -5.988 -21.104   9.070
  203   1HB   SER  30          1HB       SER  30  -5.493 -20.156   6.511
  204   2HB   SER  30          2HB       SER  30  -3.914 -20.756   6.976
  205    HG   SER  30           HG       SER  30  -5.744 -22.600   7.760
  206    H    CYS  31           H        CYS  31  -3.820 -18.404   9.383
  207    HA   CYS  31           HA       CYS  31  -1.872 -20.154  10.701
  208   1HB   CYS  31          1HB       CYS  31  -1.422 -17.542   9.246
  209   2HB   CYS  31          2HB       CYS  31  -0.222 -18.310  10.266
  210    H    GLU  32           H        GLU  32  -3.878 -19.724  12.329
  211    HA   GLU  32           HA       GLU  32  -3.521 -17.158  13.618
  212   1HB   GLU  32          1HB       GLU  32  -5.717 -19.050  13.304
  213   2HB   GLU  32          2HB       GLU  32  -5.476 -18.688  15.002
  214   1HG   GLU  32          1HG       GLU  32  -5.392 -16.186  14.285
  215   2HG   GLU  32          2HG       GLU  32  -6.022 -16.724  12.741
  216    H    THR  33           H        THR  33  -3.764 -20.667  14.569
  217    HA   THR  33           HA       THR  33  -2.477 -20.125  17.082
  218    HB   THR  33           HB       THR  33  -4.341 -21.848  16.574
  219    HG1  THR  33           1HG      THR  33  -3.014 -21.898  18.511
  220   1HG2  THR  33          1HG2      THR  33  -3.246 -24.140  16.008
  221   2HG2  THR  33          2HG2      THR  33  -3.540 -23.042  14.639
  222   3HG2  THR  33          3HG2      THR  33  -1.904 -23.194  15.322
  223    H    SER  34           H        SER  34  -1.356 -20.386  13.911
  224    HA   SER  34           HA       SER  34   0.870 -22.000  14.286
  225   1HB   SER  34          1HB       SER  34  -0.120 -20.070  12.273
  226   2HB   SER  34          2HB       SER  34   1.629 -20.146  12.349
  227    HG   SER  34           HG       SER  34   0.162 -21.788  10.994
  228    H    ALA  35           H        ALA  35   2.574 -21.657  15.660
  229    HA   ALA  35           HA       ALA  35   3.004 -19.512  17.216
  230   1HB   ALA  35          1HB       ALA  35   5.432 -20.839  16.073
  231   2HB   ALA  35          2HB       ALA  35   4.979 -20.552  17.770
  232   3HB   ALA  35          3HB       ALA  35   4.222 -21.881  16.859
  233    H    ASP  36           H        ASP  36   4.961 -20.078  14.200
  234    HA   ASP  36           HA       ASP  36   5.666 -17.326  14.187
  235   1HB   ASP  36          1HB       ASP  36   6.105 -19.238  11.874
  236   2HB   ASP  36          2HB       ASP  36   7.115 -17.898  12.380
  237    H    LYS  37           H        LYS  37   3.503 -16.333  13.898
  238    HA   LYS  37           HA       LYS  37   1.844 -17.064  11.730
  239   1HB   LYS  37          1HB       LYS  37   1.923 -14.735  13.648
  240   2HB   LYS  37          2HB       LYS  37   0.772 -14.790  12.329
  241   1HG   LYS  37          1HG       LYS  37   0.493 -17.336  13.366
  242   2HG   LYS  37          2HG       LYS  37   0.884 -16.431  14.815
  243   1HD   LYS  37          1HD       LYS  37  -1.223 -15.396  12.889
  244   2HD   LYS  37          2HD       LYS  37  -1.634 -16.626  14.068
  245   1HE   LYS  37          1HE       LYS  37  -0.224 -14.064  14.910
  246   2HE   LYS  37          2HE       LYS  37  -1.967 -14.114  14.729
  247   1HZ   LYS  37          1HZ       LYS  37  -0.797 -16.254  16.262
  248   2HZ   LYS  37          2HZ       LYS  37  -0.740 -14.773  16.948
  249   3HZ   LYS  37          3HZ       LYS  37  -2.178 -15.419  16.520
  250    H    LYS  38           H        LYS  38   4.117 -14.294  12.302
  251    HA   LYS  38           HA       LYS  38   3.785 -12.953   9.976
  252   1HB   LYS  38          1HB       LYS  38   5.442 -12.726  12.082
  253   2HB   LYS  38          2HB       LYS  38   6.589 -13.337  10.907
  254   1HG   LYS  38          1HG       LYS  38   6.291 -11.490   9.450
  255   2HG   LYS  38          2HG       LYS  38   4.725 -11.082  10.121
  256   1HD   LYS  38          1HD       LYS  38   5.720  -9.598  11.512
  257   2HD   LYS  38          2HD       LYS  38   6.571 -10.915  12.294
  258   1HE   LYS  38          1HE       LYS  38   7.617  -9.797   9.674
  259   2HE   LYS  38          2HE       LYS  38   7.945  -8.948  11.172
  260   1HZ   LYS  38          1HZ       LYS  38   9.319 -11.067  10.212
  261   2HZ   LYS  38          2HZ       LYS  38   9.422 -10.472  11.729
  262   3HZ   LYS  38          3HZ       LYS  38   8.425 -11.726  11.409
  263    H    THR  39           H        THR  39   5.961 -15.804  10.518
  264    HA   THR  39           HA       THR  39   6.751 -15.921   7.795
  265    HB   THR  39           HB       THR  39   6.836 -17.982  10.062
  266    HG1  THR  39           1HG      THR  39   7.865 -15.699  10.164
  267   1HG2  THR  39          1HG2      THR  39   7.330 -18.721   7.569
  268   2HG2  THR  39          2HG2      THR  39   8.789 -17.717   7.746
  269   3HG2  THR  39          3HG2      THR  39   8.529 -19.107   8.827
  270    H    CYS  40           H        CYS  40   4.511 -18.015   9.741
  271    HA   CYS  40           HA       CYS  40   3.678 -19.683   7.835
  272   1HB   CYS  40          1HB       CYS  40   2.927 -19.565  10.229
  273   2HB   CYS  40          2HB       CYS  40   1.788 -18.319   9.759
  274    H    ARG  41           H        ARG  41   2.271 -16.389   8.499
  275    HA   ARG  41           HA       ARG  41   0.506 -16.426   6.402
  276   1HB   ARG  41          1HB       ARG  41   1.913 -14.169   7.888
  277   2HB   ARG  41          2HB       ARG  41   0.772 -13.818   6.605
  278   1HG   ARG  41          1HG       ARG  41  -0.940 -15.256   7.833
  279   2HG   ARG  41          2HG       ARG  41   0.199 -15.394   9.157
  280   1HD   ARG  41          1HD       ARG  41  -0.507 -12.637   8.121
  281   2HD   ARG  41          2HD       ARG  41  -1.650 -13.469   9.156
  282    HE   ARG  41           HE       ARG  41   0.894 -13.681  10.399
  283   1HH1  ARG  41          2HH2      ARG  41  -1.413 -11.166   9.541
  284   2HH1  ARG  41          1HH2      ARG  41  -0.939 -10.113  10.832
  285   1HH2  ARG  41          2HH1      ARG  41   1.519 -12.293  12.103
  286   2HH2  ARG  41          1HH1      ARG  41   0.740 -10.758  12.299
  287    H    ARG  42           H        ARG  42   3.825 -14.943   6.620
  288    HA   ARG  42           HA       ARG  42   4.037 -13.840   4.221
  289   1HB   ARG  42          1HB       ARG  42   5.839 -14.802   6.228
  290   2HB   ARG  42          2HB       ARG  42   6.469 -15.383   4.699
  291   1HG   ARG  42          1HG       ARG  42   7.377 -13.314   4.433
  292   2HG   ARG  42          2HG       ARG  42   5.753 -12.754   4.088
  293   1HD   ARG  42          1HD       ARG  42   5.584 -12.650   6.772
  294   2HD   ARG  42          2HD       ARG  42   7.329 -12.538   6.654
  295    HE   ARG  42           HE       ARG  42   7.111 -10.376   5.781
  296   1HH1  ARG  42          2HH2      ARG  42   4.018 -12.036   5.537
  297   2HH1  ARG  42          1HH2      ARG  42   3.156 -10.624   5.024
  298   1HH2  ARG  42          2HH1      ARG  42   5.975  -8.513   5.104
  299   2HH2  ARG  42          1HH1      ARG  42   4.277  -8.606   4.776
  300    H    ASN  43           H        ASN  43   4.931 -17.303   4.939
  301    HA   ASN  43           HA       ASN  43   5.548 -18.049   2.415
  302   1HB   ASN  43          1HB       ASN  43   5.394 -19.337   4.809
  303   2HB   ASN  43          2HB       ASN  43   3.938 -19.985   4.080
  304   1HD2  ASN  43          1HD2      ASN  43   6.775 -20.966   4.738
  305   2HD2  ASN  43          2HD2      ASN  43   7.283 -21.824   3.321
  306    H    CYS  44           H        CYS  44   2.373 -17.557   3.983
  307    HA   CYS  44           HA       CYS  44   0.889 -18.873   1.945
  308   1HB   CYS  44          1HB       CYS  44   0.196 -18.551   4.360
  309   2HB   CYS  44          2HB       CYS  44  -0.134 -16.876   3.967
  310    H    LYS  45           H        LYS  45   2.228 -15.649   2.579
  311    HA   LYS  45           HA       LYS  45   0.562 -14.227   0.804
  312   1HB   LYS  45          1HB       LYS  45   1.928 -13.268   2.684
  313   2HB   LYS  45          2HB       LYS  45   3.367 -13.535   1.720
  314   1HG   LYS  45          1HG       LYS  45   1.103 -12.086   0.377
  315   2HG   LYS  45          2HG       LYS  45   1.947 -11.216   1.643
  316   1HD   LYS  45          1HD       LYS  45   3.629 -12.650  -0.404
  317   2HD   LYS  45          2HD       LYS  45   2.793 -11.200  -0.924
  318   1HE   LYS  45          1HE       LYS  45   4.465  -9.981   0.010
  319   2HE   LYS  45          2HE       LYS  45   3.898 -10.501   1.584
  320   1HZ   LYS  45          1HZ       LYS  45   6.196 -11.062   1.244
  321   2HZ   LYS  45          2HZ       LYS  45   5.315 -12.429   1.395
  322   3HZ   LYS  45          3HZ       LYS  45   5.839 -11.954  -0.077
  323    H    LYS  46           H        LYS  46   3.420 -16.284   0.429
  324    HA   LYS  46           HA       LYS  46   3.773 -15.382  -2.310
  325   1HB   LYS  46          1HB       LYS  46   5.332 -17.208  -0.476
  326   2HB   LYS  46          2HB       LYS  46   5.672 -17.111  -2.192
  327   1HG   LYS  46          1HG       LYS  46   5.454 -14.538  -0.620
  328   2HG   LYS  46          2HG       LYS  46   6.907 -15.502  -0.445
  329   1HD   LYS  46          1HD       LYS  46   5.839 -14.809  -3.205
  330   2HD   LYS  46          2HD       LYS  46   6.826 -13.663  -2.321
  331   1HE   LYS  46          1HE       LYS  46   7.793 -16.520  -2.600
  332   2HE   LYS  46          2HE       LYS  46   7.954 -15.433  -3.965
  333   1HZ   LYS  46          1HZ       LYS  46   8.943 -13.879  -2.179
  334   2HZ   LYS  46          2HZ       LYS  46   9.206 -15.261  -1.350
  335   3HZ   LYS  46          3HZ       LYS  46   9.868 -15.057  -2.829
  336    H    ALA  47           H        ALA  47   1.931 -17.652  -0.512
  337    HA   ALA  47           HA       ALA  47   1.952 -19.865  -2.188
  338   1HB   ALA  47          1HB       ALA  47  -0.170 -20.409  -1.095
  339   2HB   ALA  47          2HB       ALA  47   0.971 -19.744   0.098
  340   3HB   ALA  47          3HB       ALA  47  -0.342 -18.726  -0.540
  341    H    ASP  48           H        ASP  48  -0.446 -17.126  -2.090
  342    HA   ASP  48           HA       ASP  48  -0.495 -17.123  -4.937
  343   1HB   ASP  48          1HB       ASP  48  -2.186 -18.938  -3.943
  344   2HB   ASP  48          2HB       ASP  48  -3.177 -17.535  -3.594
  345    H    CYS  49           H        CYS  49   0.375 -15.103  -3.311
  346    HA   CYS  49           HA       CYS  49  -1.703 -13.129  -3.629
  347   1HB   CYS  49          1HB       CYS  49  -0.346 -13.085  -0.975
  348   2HB   CYS  49          2HB       CYS  49  -1.889 -12.412  -1.461
  349    H    GLU  50           H        GLU  50   0.845 -13.877  -4.940
  350    HA   GLU  50           HA       GLU  50   2.810 -12.085  -3.942
  351   1HB   GLU  50          1HB       GLU  50   2.608 -14.167  -6.019
  352   2HB   GLU  50          2HB       GLU  50   3.569 -12.798  -6.541
  353   1HG   GLU  50          1HG       GLU  50   4.214 -13.527  -3.774
  354   2HG   GLU  50          2HG       GLU  50   4.396 -14.907  -4.838
  355    HA   PRO  51           HA       PRO  51   1.340  -9.685  -7.770
  356   1HB   PRO  51          1HB       PRO  51  -0.992 -10.404  -9.000
  357   2HB   PRO  51          2HB       PRO  51   0.586 -10.923  -9.559
  358   1HG   PRO  51          1HG       PRO  51  -1.467 -12.474  -8.105
  359   2HG   PRO  51          2HG       PRO  51  -0.100 -13.060  -9.031
  360   1HD   PRO  51          1HD       PRO  51  -0.309 -12.932  -6.173
  361   2HD   PRO  51          2HD       PRO  51   1.100 -13.408  -7.100
  362    H    GLN  52           H        GLN  52  -0.918 -10.835  -5.455
  363    HA   GLN  52           HA       GLN  52  -2.546  -8.523  -5.642
  364   1HB   GLN  52          1HB       GLN  52  -2.415 -10.461  -3.301
  365   2HB   GLN  52          2HB       GLN  52  -3.774  -9.471  -3.797
  366   1HG   GLN  52          1HG       GLN  52  -3.830 -10.762  -5.991
  367   2HG   GLN  52          2HG       GLN  52  -2.585 -11.816  -5.351
  368   1HE2  GLN  52          1HE2      GLN  52  -4.534 -13.238  -5.970
  369   2HE2  GLN  52          2HE2      GLN  52  -5.614 -13.664  -4.684
  370    H    ASP  53           H        ASP  53  -0.186  -9.787  -3.176
  371    HA   ASP  53           HA       ASP  53  -0.290  -7.691  -1.470
  372   1HB   ASP  53          1HB       ASP  53   1.060  -9.926  -1.386
  373   2HB   ASP  53          2HB       ASP  53   2.322  -9.055  -2.235
  374    H    LYS  54           H        LYS  54   1.251  -8.001  -4.664
  375    HA   LYS  54           HA       LYS  54   2.969  -5.756  -4.393
  376   1HB   LYS  54          1HB       LYS  54   2.067  -7.516  -6.662
  377   2HB   LYS  54          2HB       LYS  54   2.946  -6.037  -6.994
  378   1HG   LYS  54          1HG       LYS  54   4.700  -6.845  -5.278
  379   2HG   LYS  54          2HG       LYS  54   3.876  -8.391  -5.294
  380   1HD   LYS  54          1HD       LYS  54   4.943  -8.978  -7.204
  381   2HD   LYS  54          2HD       LYS  54   4.274  -7.588  -8.036
  382   1HE   LYS  54          1HE       LYS  54   6.590  -7.100  -6.171
  383   2HE   LYS  54          2HE       LYS  54   6.934  -7.909  -7.687
  384   1HZ   LYS  54          1HZ       LYS  54   6.719  -5.999  -8.732
  385   2HZ   LYS  54          2HZ       LYS  54   5.227  -5.729  -8.125
  386   3HZ   LYS  54          3HZ       LYS  54   6.546  -5.230  -7.302
  387    H    VAL  55           H        VAL  55  -0.019  -6.262  -6.408
  388    HA   VAL  55           HA       VAL  55  -0.424  -3.749  -7.246
  389    HB   VAL  55           HB       VAL  55  -2.451  -5.744  -6.222
  390   1HG1  VAL  55          1HG1      VAL  55  -3.240  -3.808  -8.324
  391   2HG1  VAL  55          2HG1      VAL  55  -4.171  -4.469  -6.959
  392   3HG1  VAL  55          3HG1      VAL  55  -3.029  -3.131  -6.691
  393   1HG2  VAL  55          1HG2      VAL  55  -2.045  -6.904  -8.082
  394   2HG2  VAL  55          2HG2      VAL  55  -2.331  -5.463  -9.087
  395   3HG2  VAL  55          3HG2      VAL  55  -0.702  -5.795  -8.449
  396    H    CYS  56           H        CYS  56  -0.856  -5.003  -3.935
  397    HA   CYS  56           HA       CYS  56  -2.350  -2.905  -2.919
  398   1HB   CYS  56          1HB       CYS  56  -1.523  -5.222  -1.918
  399   2HB   CYS  56          2HB       CYS  56  -0.271  -4.214  -1.222
  400    H    ASP  57           H        ASP  57   1.248  -3.476  -2.938
  401    HA   ASP  57           HA       ASP  57   2.023  -1.204  -1.719
  402   1HB   ASP  57          1HB       ASP  57   3.316  -3.253  -2.913
  403   2HB   ASP  57          2HB       ASP  57   3.532  -2.067  -4.185
  404    H    ALA  58           H        ALA  58   1.172  -1.774  -5.191
  405    HA   ALA  58           HA       ALA  58   1.952   0.615  -6.282
  406   1HB   ALA  58          1HB       ALA  58  -0.585  -0.929  -6.944
  407   2HB   ALA  58          2HB       ALA  58   0.367   0.106  -8.036
  408   3HB   ALA  58          3HB       ALA  58   1.047  -1.431  -7.449
  409    H    CYS  59           H        CYS  59  -1.146  -0.214  -4.598
  410    HA   CYS  59           HA       CYS  59  -2.430   2.171  -4.991
  411   1HB   CYS  59          1HB       CYS  59  -3.620   0.335  -4.089
  412   2HB   CYS  59          2HB       CYS  59  -2.532   0.188  -2.724
  413    H    ARG  60           H        ARG  60  -0.367   1.137  -2.169
  414    HA   ARG  60           HA       ARG  60  -0.430   3.568  -0.902
  415   1HB   ARG  60          1HB       ARG  60   1.782   1.452  -0.909
  416   2HB   ARG  60          2HB       ARG  60   1.653   2.741   0.272
  417   1HG   ARG  60          1HG       ARG  60  -0.616   1.886   0.934
  418   2HG   ARG  60          2HG       ARG  60  -0.452   0.580  -0.223
  419   1HD   ARG  60          1HD       ARG  60   1.582  -0.241   0.982
  420   2HD   ARG  60          2HD       ARG  60   1.435   1.072   2.133
  421    HE   ARG  60           HE       ARG  60  -1.042  -0.421   1.972
  422   1HH1  ARG  60          2HH2      ARG  60   2.206  -0.543   3.321
  423   2HH1  ARG  60          1HH2      ARG  60   1.760  -1.581   4.634
  424   1HH2  ARG  60          2HH1      ARG  60  -1.631  -1.791   3.703
  425   2HH2  ARG  60          1HH1      ARG  60  -0.438  -2.296   4.853
  426    H    MET  61           H        MET  61   1.606   2.320  -3.562
  427    HA   MET  61           HA       MET  61   3.590   4.262  -3.413
  428   1HB   MET  61          1HB       MET  61   4.076   2.348  -4.749
  429   2HB   MET  61          2HB       MET  61   2.508   2.373  -5.531
  430   1HG   MET  61          1HG       MET  61   3.191   3.854  -7.155
  431   2HG   MET  61          2HG       MET  61   4.129   4.816  -6.030
  432   1HE   MET  61          1HE       MET  61   3.926   1.167  -7.234
  433   2HE   MET  61          2HE       MET  61   4.282   2.010  -8.760
  434   3HE   MET  61          3HE       MET  61   5.488   0.912  -8.048
  435    H    LYS  62           H        LYS  62   0.555   4.056  -5.391
  436    HA   LYS  62           HA       LYS  62   0.975   6.504  -6.705
  437   1HB   LYS  62          1HB       LYS  62  -1.245   4.547  -6.390
  438   2HB   LYS  62          2HB       LYS  62  -1.698   6.172  -6.860
  439   1HG   LYS  62          1HG       LYS  62  -1.124   5.619  -8.986
  440   2HG   LYS  62          2HG       LYS  62   0.549   5.638  -8.463
  441   1HD   LYS  62          1HD       LYS  62  -0.558   3.126  -7.617
  442   2HD   LYS  62          2HD       LYS  62  -1.067   3.371  -9.276
  443   1HE   LYS  62          1HE       LYS  62   1.792   4.046  -8.728
  444   2HE   LYS  62          2HE       LYS  62   1.386   2.351  -8.544
  445   1HZ   LYS  62          1HZ       LYS  62   1.267   2.162 -10.720
  446   2HZ   LYS  62          2HZ       LYS  62   0.195   3.385 -10.863
  447   3HZ   LYS  62          3HZ       LYS  62   1.797   3.698 -10.885
  448    H    CYS  63           H        CYS  63  -0.710   5.571  -3.664
  449    HA   CYS  63           HA       CYS  63  -1.891   8.030  -3.182
  450   1HB   CYS  63          1HB       CYS  63  -1.285   5.595  -1.653
  451   2HB   CYS  63          2HB       CYS  63  -1.341   7.048  -0.674
  452    H    HIS  64           H        HIS  64   1.434   6.852  -2.932
  453    HA   HIS  64           HA       HIS  64   2.387   8.719  -1.088
  454   1HB   HIS  64          1HB       HIS  64   3.398   6.574  -2.605
  455   2HB   HIS  64          2HB       HIS  64   4.358   7.962  -3.076
  456    HD1  HIS  64           1HD      HIS  64   6.504   7.625  -1.808
  457    HD2  HIS  64           2HD      HIS  64   3.118   7.149   0.622
  458    HE1  HIS  64           1HE      HIS  64   7.369   7.343   0.576
  459    H    LYS  65           H        LYS  65   2.071   8.764  -4.682
  460    HA   LYS  65           HA       LYS  65   3.177  11.432  -4.770
  461   1HB   LYS  65          1HB       LYS  65   2.620   9.261  -6.669
  462   2HB   LYS  65          2HB       LYS  65   2.208  10.846  -7.291
  463   1HG   LYS  65          1HG       LYS  65   4.396  11.488  -7.440
  464   2HG   LYS  65          2HG       LYS  65   4.786  10.854  -5.853
  465   1HD   LYS  65          1HD       LYS  65   5.602   8.900  -6.707
  466   2HD   LYS  65          2HD       LYS  65   4.236   8.698  -7.786
  467   1HE   LYS  65          1HE       LYS  65   6.445  10.722  -8.347
  468   2HE   LYS  65          2HE       LYS  65   6.555   9.058  -8.884
  469   1HZ   LYS  65          1HZ       LYS  65   5.592  10.402 -10.578
  470   2HZ   LYS  65          2HZ       LYS  65   4.441   9.382 -10.029
  471   3HZ   LYS  65          3HZ       LYS  65   4.421  10.953  -9.582
  472    H    ALA  66           H        ALA  66   0.029   9.758  -4.853
  473    HA   ALA  66           HA       ALA  66  -1.436  12.019  -5.728
  474   1HB   ALA  66          1HB       ALA  66  -1.945   9.268  -4.737
  475   2HB   ALA  66          2HB       ALA  66  -3.241  10.442  -4.408
  476   3HB   ALA  66          3HB       ALA  66  -2.700  10.160  -6.080
  477    H    CYS  67           H        CYS  67  -0.124  10.898  -2.640
  478    HA   CYS  67           HA       CYS  67  -1.830  12.653  -1.131
  479   1HB   CYS  67          1HB       CYS  67  -1.176  10.500  -0.201
  480   2HB   CYS  67          2HB       CYS  67   0.519  10.933  -0.308
  481    H    ARG  68           H        ARG  68   1.102  12.781  -2.970
  482    HA   ARG  68           HA       ARG  68   2.368  14.759  -1.399
  483   1HB   ARG  68          1HB       ARG  68   3.570  13.165  -2.959
  484   2HB   ARG  68          2HB       ARG  68   2.846  13.993  -4.324
  485   1HG   ARG  68          1HG       ARG  68   4.301  15.697  -2.317
  486   2HG   ARG  68          2HG       ARG  68   5.282  14.661  -3.335
  487   1HD   ARG  68          1HD       ARG  68   3.292  15.926  -5.010
  488   2HD   ARG  68          2HD       ARG  68   4.036  17.169  -4.024
  489    HE   ARG  68           HE       ARG  68   6.108  16.785  -5.098
  490   1HH1  ARG  68          2HH2      ARG  68   3.777  14.312  -6.010
  491   2HH1  ARG  68          1HH2      ARG  68   4.753  13.686  -7.297
  492   1HH2  ARG  68          2HH1      ARG  68   7.395  15.961  -6.796
  493   2HH2  ARG  68          1HH1      ARG  68   6.825  14.631  -7.748
  494    H    ALA  69           H        ALA  69   0.122  14.644  -4.175
  495    HA   ALA  69           HA       ALA  69   0.385  17.497  -4.628
  496   1HB   ALA  69          1HB       ALA  69  -1.140  15.228  -5.946
  497   2HB   ALA  69          2HB       ALA  69  -1.403  16.932  -6.388
  498   3HB   ALA  69          3HB       ALA  69   0.201  16.193  -6.609
  499    H    ALA  70           H        ALA  70  -1.542  15.195  -2.815
  500    HA   ALA  70           HA       ALA  70  -3.847  16.873  -2.617
  501   1HB   ALA  70          1HB       ALA  70  -4.552  14.763  -2.185
  502   2HB   ALA  70          2HB       ALA  70  -2.929  14.222  -1.695
  503   3HB   ALA  70          3HB       ALA  70  -3.973  15.072  -0.531
  504    H    ASN  71           H        ASN  71  -2.114  15.567   0.237
  505    HA   ASN  71           HA       ASN  71  -2.654  17.702   1.812
  506   1HB   ASN  71          1HB       ASN  71  -0.891  15.356   1.888
  507   2HB   ASN  71          2HB       ASN  71  -0.118  16.715   2.679
  508   1HD2  ASN  71          1HD2      ASN  71  -2.626  14.374   2.772
  509   2HD2  ASN  71          2HD2      ASN  71  -3.299  14.753   4.323
  510    H    CYS  72           H        CYS  72   0.684  16.884   0.581
  511    HA   CYS  72           HA       CYS  72   1.582  19.536   0.963
  512   1HB   CYS  72          1HB       CYS  72   2.847  17.238  -0.546
  513   2HB   CYS  72          2HB       CYS  72   3.644  18.745  -0.141
  514    H    ALA  73           H        ALA  73   2.424  20.943  -0.845
  515    HA   ALA  73           HA       ALA  73   1.739  20.434  -3.518
  516   1HB   ALA  73          1HB       ALA  73  -0.260  21.545  -3.835
  517   2HB   ALA  73          2HB       ALA  73  -0.535  20.910  -2.196
  518   3HB   ALA  73          3HB       ALA  73  -0.024  22.600  -2.421
  519    H    SER  74           H        SER  74   1.978  23.036  -0.998
  520    HA   SER  74           HA       SER  74   3.299  24.761  -2.804
  521   1HB   SER  74          1HB       SER  74   2.001  25.023  -0.340
  522   2HB   SER  74          2HB       SER  74   3.678  25.327   0.068
  523    HG   SER  74           HG       SER  74   2.963  27.320  -0.555
  524    H    GLU  75           H        GLU  75   4.242  22.441  -0.235
  525    HA   GLU  75           HA       GLU  75   6.905  23.255  -0.084
  526   1HB   GLU  75          1HB       GLU  75   5.267  20.942   0.839
  527   2HB   GLU  75          2HB       GLU  75   6.979  20.610   0.666
  528   1HG   GLU  75          1HG       GLU  75   7.062  21.466   2.804
  529   2HG   GLU  75          2HG       GLU  75   7.169  22.992   1.949
  530    H    CYS  76           H        CYS  76   5.113  21.062  -2.249
  531    HA   CYS  76           HA       CYS  76   7.650  20.425  -3.566
  532   1HB   CYS  76          1HB       CYS  76   5.149  18.913  -4.167
  533   2HB   CYS  76          2HB       CYS  76   6.821  18.391  -4.229
  534    HA   PRO  77           HA       PRO  77   5.778  23.228  -6.471
  535   1HB   PRO  77          1HB       PRO  77   8.087  23.953  -7.741
  536   2HB   PRO  77          2HB       PRO  77   7.473  24.779  -6.323
  537   1HG   PRO  77          1HG       PRO  77   9.735  22.888  -6.532
  538   2HG   PRO  77          2HG       PRO  77   9.374  24.030  -5.253
  539   1HD   PRO  77          1HD       PRO  77   8.948  21.195  -5.192
  540   2HD   PRO  77          2HD       PRO  77   8.481  22.352  -3.961
  541    H    LYS  78           H        LYS  78   6.343  23.573  -9.042
  542    HA   LYS  78           HA       LYS  78   5.923  20.853 -10.014
  543   1HB   LYS  78          1HB       LYS  78   4.521  23.165 -10.463
  544   2HB   LYS  78          2HB       LYS  78   5.570  23.126 -11.866
  545   1HG   LYS  78          1HG       LYS  78   4.288  20.520 -11.128
  546   2HG   LYS  78          2HG       LYS  78   3.201  21.765 -11.710
  547   1HD   LYS  78          1HD       LYS  78   3.802  21.134 -13.810
  548   2HD   LYS  78          2HD       LYS  78   5.331  21.937 -13.511
  549   1HE   LYS  78          1HE       LYS  78   6.238  19.782 -12.553
  550   2HE   LYS  78          2HE       LYS  78   4.724  18.994 -12.950
  551   1HZ   LYS  78          1HZ       LYS  78   6.757  20.028 -14.757
  552   2HZ   LYS  78          2HZ       LYS  78   6.003  18.579 -14.774
  553   3HZ   LYS  78          3HZ       LYS  78   5.214  19.917 -15.280
  554    H    HIS  79           H        HIS  79   8.416  20.776  -9.374
  555    HA   HIS  79           HA       HIS  79   9.799  20.466 -11.727
  556   1HB   HIS  79          1HB       HIS  79   9.698  23.198 -10.991
  557   2HB   HIS  79          2HB       HIS  79  11.319  22.652 -10.609
  558    HD1  HIS  79           1HD      HIS  79  12.868  23.104 -12.501
  559    HD2  HIS  79           2HD      HIS  79   9.034  22.052 -13.840
  560    HE1  HIS  79           1HE      HIS  79  12.967  23.137 -15.051
  561    H    GLU  80           H        GLU  80   9.393  18.826  -9.616
  562    HA   GLU  80           HA       GLU  80  11.995  18.212  -8.859
  563   1HB   GLU  80          1HB       GLU  80  10.682  20.095  -7.116
  564   2HB   GLU  80          2HB       GLU  80  10.820  18.574  -6.256
  565   1HG   GLU  80          1HG       GLU  80  13.139  19.952  -7.692
  566   2HG   GLU  80          2HG       GLU  80  12.827  20.084  -5.972
  567    H    HIS  81           H        HIS  81  12.091  16.135  -7.702
  568    HA   HIS  81           HA       HIS  81   9.532  14.739  -7.914
  569   1HB   HIS  81          1HB       HIS  81  10.935  12.685  -8.057
  570   2HB   HIS  81          2HB       HIS  81  11.153  13.808  -9.385
  571    HD1  HIS  81           1HD      HIS  81  12.980  12.089  -6.656
  572    HD2  HIS  81           2HD      HIS  81  13.664  15.274  -9.298
  573    HE1  HIS  81           1HE      HIS  81  15.491  12.539  -6.598
  574    H    LYS  82           H        LYS  82  12.564  14.827  -5.907
  575    HA   LYS  82           HA       LYS  82  10.844  14.339  -3.583
  576   1HB   LYS  82          1HB       LYS  82  12.564  12.444  -4.651
  577   2HB   LYS  82          2HB       LYS  82  13.524  13.168  -3.376
  578   1HG   LYS  82          1HG       LYS  82  12.370  11.929  -1.870
  579   2HG   LYS  82          2HG       LYS  82  10.940  12.869  -2.247
  580   1HD   LYS  82          1HD       LYS  82  11.670  10.638  -4.136
  581   2HD   LYS  82          2HD       LYS  82  11.022  10.189  -2.571
  582   1HE   LYS  82          1HE       LYS  82   8.954  10.542  -3.448
  583   2HE   LYS  82          2HE       LYS  82   9.311  12.256  -3.385
  584   1HZ   LYS  82          1HZ       LYS  82   8.670  11.318  -5.596
  585   2HZ   LYS  82          2HZ       LYS  82  10.027  12.226  -5.585
  586   3HZ   LYS  82          3HZ       LYS  82  10.134  10.598  -5.655
  587    H    SER  83           H        SER  83  11.018  16.818  -3.776
  588    HA   SER  83           HA       SER  83  13.487  18.018  -3.331
  589   1HB   SER  83          1HB       SER  83  11.701  19.358  -4.203
  590   2HB   SER  83          2HB       SER  83  10.615  18.909  -2.904
  591    HG   SER  83           HG       SER  83  11.789  21.114  -2.869
  592    H    ASP  84           H        ASP  84  14.310  19.044  -1.341
  593    HA   ASP  84           HA       ASP  84  14.289  17.362   0.808
  594   1HB   ASP  84          1HB       ASP  84  16.023  19.075   0.407
  595   2HB   ASP  84          2HB       ASP  84  14.859  20.359   0.668
  596    H    THR  85           H        THR  85  12.834  20.709   0.604
  597    HA   THR  85           HA       THR  85  11.412  20.615   2.967
  598    HB   THR  85           HB       THR  85  11.918  22.582   1.366
  599    HG1  THR  85           1HG      THR  85  10.419  23.343   2.803
  600   1HG2  THR  85          1HG2      THR  85   9.258  21.679   0.153
  601   2HG2  THR  85          2HG2      THR  85  10.220  23.104  -0.305
  602   3HG2  THR  85          3HG2      THR  85  10.820  21.470  -0.674
  603    H    CYS  86           H        CYS  86  10.525  19.364  -0.277
  604    HA   CYS  86           HA       CYS  86   7.866  18.862   0.274
  605   1HB   CYS  86          1HB       CYS  86   8.828  18.780  -1.964
  606   2HB   CYS  86          2HB       CYS  86   9.771  17.365  -1.538
  607    H    ARG  87           H        ARG  87  10.679  16.539   0.332
  608    HA   ARG  87           HA       ARG  87   9.438  14.417   1.360
  609   1HB   ARG  87          1HB       ARG  87  12.234  15.501   1.921
  610   2HB   ARG  87          2HB       ARG  87  11.724  13.937   2.523
  611   1HG   ARG  87          1HG       ARG  87  10.977  13.566  -0.027
  612   2HG   ARG  87          2HG       ARG  87  12.159  14.823  -0.332
  613   1HD   ARG  87          1HD       ARG  87  13.465  12.861  -0.480
  614   2HD   ARG  87          2HD       ARG  87  13.770  13.384   1.164
  615    HE   ARG  87           HE       ARG  87  11.467  11.648   1.105
  616   1HH1  ARG  87          2HH2      ARG  87  14.977  11.579   0.861
  617   2HH1  ARG  87          1HH2      ARG  87  15.113   9.953   1.442
  618   1HH2  ARG  87          2HH1      ARG  87  11.646   9.503   1.871
  619   2HH2  ARG  87          1HH1      ARG  87  13.205   8.764   2.020
  620    H    ALA  88           H        ALA  88  10.691  17.289   3.149
  621    HA   ALA  88           HA       ALA  88  10.283  16.303   5.727
  622   1HB   ALA  88          1HB       ALA  88  10.609  18.987   4.421
  623   2HB   ALA  88          2HB       ALA  88  10.048  18.932   6.109
  624   3HB   ALA  88          3HB       ALA  88  11.607  18.197   5.665
  625    H    CYS  89           H        CYS  89   8.139  18.088   3.434
  626    HA   CYS  89           HA       CYS  89   6.034  18.367   5.265
  627   1HB   CYS  89          1HB       CYS  89   6.098  19.817   3.400
  628   2HB   CYS  89          2HB       CYS  89   6.198  18.491   2.259
  629    H    MET  90           H        MET  90   6.525  16.127   2.428
  630    HA   MET  90           HA       MET  90   4.314  14.576   2.930
  631   1HB   MET  90          1HB       MET  90   6.969  14.190   1.507
  632   2HB   MET  90          2HB       MET  90   5.920  12.798   1.685
  633   1HG   MET  90          1HG       MET  90   4.097  14.653   0.797
  634   2HG   MET  90          2HG       MET  90   5.546  15.257   0.018
  635   1HE   MET  90          1HE       MET  90   3.880  10.996  -0.382
  636   2HE   MET  90          2HE       MET  90   3.988  11.976   1.100
  637   3HE   MET  90          3HE       MET  90   2.783  12.378  -0.147
  638    H    LYS  91           H        LYS  91   7.308  14.804   4.676
  639    HA   LYS  91           HA       LYS  91   7.364  12.136   5.649
  640   1HB   LYS  91          1HB       LYS  91   9.414  13.312   5.607
  641   2HB   LYS  91          2HB       LYS  91   8.741  14.709   6.421
  642   1HG   LYS  91          1HG       LYS  91   9.289  13.831   8.435
  643   2HG   LYS  91          2HG       LYS  91   8.284  12.430   8.120
  644   1HD   LYS  91          1HD       LYS  91  10.919  12.460   6.704
  645   2HD   LYS  91          2HD       LYS  91  11.007  12.318   8.449
  646   1HE   LYS  91          1HE       LYS  91   8.940  10.539   7.748
  647   2HE   LYS  91          2HE       LYS  91  10.107  10.338   6.457
  648   1HZ   LYS  91          1HZ       LYS  91  11.399   9.242   7.839
  649   2HZ   LYS  91          2HZ       LYS  91  11.439  10.473   8.911
  650   3HZ   LYS  91          3HZ       LYS  91  10.265   9.343   9.009
  651    H    THR  92           H        THR  92   5.876  15.228   6.674
  652    HA   THR  92           HA       THR  92   4.755  13.832   9.006
  653    HB   THR  92           HB       THR  92   5.323  16.741   8.294
  654    HG1  THR  92           1HG      THR  92   6.881  15.231   9.374
  655   1HG2  THR  92          1HG2      THR  92   4.347  16.614  10.941
  656   2HG2  THR  92          2HG2      THR  92   3.521  17.375   9.560
  657   3HG2  THR  92          3HG2      THR  92   3.158  15.687   9.994
  658    H    ASN  93           H        ASN  93   3.758  16.220   6.456
  659    HA   ASN  93           HA       ASN  93   1.115  16.110   6.871
  660   1HB   ASN  93          1HB       ASN  93   2.859  16.527   4.462
  661   2HB   ASN  93          2HB       ASN  93   1.172  16.201   4.119
  662   1HD2  ASN  93          1HD2      ASN  93   3.126  18.071   6.443
  663   2HD2  ASN  93          2HD2      ASN  93   2.202  19.535   6.378
  664    H    CYS  94           H        CYS  94   3.227  13.797   5.081
  665    HA   CYS  94           HA       CYS  94   0.979  11.927   5.058
  666   1HB   CYS  94          1HB       CYS  94   1.637  13.066   2.783
  667   2HB   CYS  94          2HB       CYS  94   2.965  11.923   2.814
  668    H    LYS  95           H        LYS  95   3.104  10.142   3.549
  669    HA   LYS  95           HA       LYS  95   4.781   9.600   5.898
  670   1HB   LYS  95          1HB       LYS  95   2.713   7.958   4.812
  671   2HB   LYS  95          2HB       LYS  95   4.243   7.181   4.460
  672   1HG   LYS  95          1HG       LYS  95   3.959   8.317   7.219
  673   2HG   LYS  95          2HG       LYS  95   2.944   6.937   6.853
  674   1HD   LYS  95          1HD       LYS  95   4.740   5.482   6.646
  675   2HD   LYS  95          2HD       LYS  95   5.805   6.710   5.994
  676   1HE   LYS  95          1HE       LYS  95   6.569   7.339   8.069
  677   2HE   LYS  95          2HE       LYS  95   4.980   7.233   8.799
  678   1HZ   LYS  95          1HZ       LYS  95   6.953   5.462   9.147
  679   2HZ   LYS  95          2HZ       LYS  95   5.376   5.166   9.450
  680   3HZ   LYS  95          3HZ       LYS  95   6.036   4.702   8.030