*HEADER    HORMONE                                 09-AUG-10   2L1X              
*TITLE     THE SOLUTION STRUCTURE OF HUMAN PARATHYROID HORMONE-RELATED PROTEIN   
*COMPND    MOL_ID: 1;                                                            
*COMPND   2 MOLECULE: PARATHYROID HORMONE;                                       
*COMPND   3 CHAIN: A;                                                            
*COMPND   4 FRAGMENT: UNP RRESIDUES 32-65;                                       
*COMPND   5 SYNONYM: PTH, PARATHYRIN, PARATHORMONE;                              
*COMPND   6 ENGINEERED: YES;                                                     
*COMPND   7 MUTATION: YES                                                        
*SOURCE    MOL_ID: 1;                                                            
*SOURCE   2 ORGANISM_SCIENTIFIC: HOMO SAPIENS;                                   
*SOURCE   3 ORGANISM_COMMON: HUMAN;                                              
*SOURCE   4 ORGANISM_TAXID: 9606;                                                
*SOURCE   5 GENE: PTH;                                                           
*SOURCE   6 EXPRESSION_SYSTEM: ESCHERICHIA COLI;                                 
*SOURCE   7 EXPRESSION_SYSTEM_TAXID: 562;                                        
*SOURCE   8 EXPRESSION_SYSTEM_VECTOR_TYPE: VECTOR;                               
*SOURCE   9 EXPRESSION_SYSTEM_VECTOR: PET-28A(+)                                 
*KEYWDS    PTHRP, HORMONE                                                        
*EXPDTA    SOLUTION NMR                                                          
*NUMMDL    10                                                                    
*AUTHOR    K.LIN, Q.YOU, D.LIN, J.LIU                                            
*REVDAT   1   10-AUG-11 2L1X    0                                                


      Assignment         w1         w2        Volume   Data Height 

         P1HB2-HA      2.346      4.565   1.53e+08 lo       177693 
         P2HB2-HA      2.267      4.486                     251569 
       P2HB2-S3HN      2.265      7.914   4.01e+07 lo        61320 
         P2HG2-HA      2.023      4.484                     269974 
          S3HA-HN      4.430      7.913   7.31e+07 ma       136705 
        S3HA-E6HN      4.398      8.307   2.38e+07 lo       231262 
        S3HN-P2HA      7.921      4.485   3.77e+07 lo       567796 
          S3HN-HA      7.918      4.424   6.54e+06 ma       110693 
          V4HA-HB      4.184      2.052                    2284108 
        V4HN-S3HA      8.456      4.415   1.02e+07 lo        47617 
          V4HN-HA      8.453      4.193   7.18e+06 lo        55311 
          V4HN-HB      8.444      2.047   2.94e+08 lo        61422 
         S5HA-HB1      4.504      3.918   2.01e+07 lo       222676 
         S5HA-HB2      4.496      4.005   2.68e+07 lo       223023 
        S5HA-L9HN      4.494      8.328   1.24e+07 lo       145224 
         S5HB1-HA      3.919      4.498   7.96e+07 lo       444463 
         S5HB1-HN      3.922      8.620                      38497 
         S5HB2-HA      4.011      4.499   1.10e+08 lo       509642 
         S5HB2-HN      4.016      8.624   9.75e+06 lo        54969 
        S5HN-P1HA      8.621      4.556   1.97e+07 lo       211817 
          S5HN-HA      8.630      4.497   5.38e+06 ma        80683 
         S5HN-HB1      8.620      3.922   8.06e+06 lo        75993 
          S5HN-HN      8.621      8.619   3.76e+07 lo       400986 
       S5HN-E6HB3      8.623      2.062   6.43e+06 lo        78386 
        S5HN-L9HN      8.626      8.327   1.28e+06 ma        37277 
          E6HA-HN      4.193      8.304   1.93e+08 ma       219891 
         E6HB3-HN      2.065      8.301   1.83e+08 ma       280167 
         E6HG3-HN      2.311      8.302   2.62e+08 lo        70116 
        E6HN-S3HA      8.305      4.407   6.21e+07 lo       537313 
          E6HN-HA      8.303      4.192   4.93e+07 lo       376785 
         E6HN-HB3      8.299      2.063   9.05e+07 ma       643271 
         E6HN-HG3      8.301      2.298   6.72e+08 lo       128539 
        I7HA-HG11      3.975      1.558   4.47e+07 ma       472845 
        I7HA-HG12      3.973      1.192   4.03e+07 lo       290131 
        I7HA-HG21      3.971      0.874                    1385252 
          I7HA-HN      3.972      8.074   8.06e+07 ma       575290 
          I7HB-HN      1.873      8.081   2.40e+08 ma       520384 
        I7HD11-HA      0.872      3.974   2.23e+08 lo      1164535 
        I7HD11-HN      0.878      8.073   6.48e+07 ma       343738 
      I7HG11-HG12      1.531      1.193   2.72e+08 lo      1129814 
        I7HG12-HA      1.192      3.973   2.44e+07 lo       145416 
        I7HG12-HA      1.008      3.977   3.20e+06 lo        49915 
        I7HG12-HB      1.162      1.869   1.32e+07 lo        99388 
      I7HG12-HG11      1.178      1.514                    1150674 
        I7HG12-HN      1.182      8.081   1.98e+07 lo       109040 
       I7HN-S5HB1      8.084      3.915   4.47e+06 ma       105655 
        I7HN-E6HN      8.083      8.298   9.63e+06 lo       145930 
          I7HN-HA      8.075      3.972   8.81e+07 lo       533453 
          I7HN-HB      8.083      1.872   8.27e+07 ma       755743 
        I7HN-HG12      8.083      1.184   2.39e+07 lo       237167 
        I7HN-HG21      8.083      1.001                      73019 
        Q8HA-HE21      4.209      7.476                      45431 
          Q8HA-HN      4.204      8.191   8.34e+07 ma       296484 
    Q8HE21-I7HG12      7.479      1.206   8.92e+06 lo        58437 
    Q8HE21-L9HD21      7.492      0.968   9.57e+06 lo        51950 
      Q8HE22-HE21      6.883      7.499                    7088618 
       Q8HE22-HG2      6.882      2.383   1.31e+08 lo        59841 
    Q8HE22-L9HD21      6.882      0.967   4.26e+06 lo        43649 
         Q8HG2-HN      2.393      8.193   1.81e+07 lo        84016 
     Q8HG2-L9HD21      2.388      0.965   1.31e+07 ma        63931 
       Q8HN-S5HB1      8.193      3.911   1.92e+07 lo        55864 
          Q8HN-HA      8.194      4.209   5.21e+07 lo       372131 
         Q8HN-HB2      8.194      2.076   1.06e+08 ma       693672 
         Q8HN-HG2      8.190      2.391   2.05e+07 ma       181561 
         L9HA-HB2      4.072      1.694   2.62e+07 ma       504718 
        L9HA-HD21      4.095      0.971   8.18e+07 lo       625101 
          L9HA-HN      4.093      8.327   6.69e+07 ma       379173 
      L9HD21-S5HA      0.977      4.504   4.80e+06 lo        44352 
     L9HD21-Q8HG2      0.973      2.380                     100250 
        L9HD21-HA      0.972      4.094   3.09e+07 lo       381164 
        L9HD21-HN      0.976      8.331   2.04e+07 lo       215995 
        L9HN-S5HA      8.336      4.501   5.77e+07 lo       640287 
          L9HN-HA      8.326      4.095   4.12e+07 lo       439258 
         L9HN-HB2      8.346      1.696   1.17e+07 lo        63052 
        L9HN-HD11      8.345      0.833   1.32e+07 ma       105480 
        L9HN-HD21      8.333      0.976   3.43e+07 lo       397522 
        M10HA-HB1      4.315      2.036   2.48e+07 lo       391274 
        M10HA-HG2      4.318      2.660   3.81e+08 lo       170353 
         M10HA-HN      4.339      7.907   2.02e+07 ma       133098 
        M10HB1-HA      2.042      4.318   1.10e+07 ma       793599 
       M10HB1-HB2      2.046      2.491                     463404 
        M10HB1-HN      2.027      7.918   8.49e+07 ma       149328 
       M10HB2-HE1      2.464      2.194                      63970 
        M10HG1-HN      2.576      7.916   3.77e+07 ma       102965 
        M10HG2-HN      2.676      7.914   3.44e+07 ma        81861 
   M10HG2-N12HD21      2.647      6.865   8.29e+07 lo        62655 
       M10HN-I7HA      7.919      3.975   2.72e+07 lo        61519 
         M10HN-HA      7.917      4.356   7.75e+06 ma       111895 
        M10HN-HB1      7.921      2.032   2.48e+07 ma       141073 
        M10HN-HG1      7.921      2.566   1.20e+07 lo       132909 
        M10HN-HG2      7.922      2.651   6.39e+06 lo        60704 
     M10HN-R13HD2      7.922      3.172   8.03e+06 lo        42271 
         H11HA-HA      4.862      4.853                     946476 
       H11HB1-HB2      2.896      3.149                     365765 
        H11HB1-HN      2.890      8.121   2.40e+07 lo       105475 
        H11HB2-HN      3.162      8.122   5.21e+07 lo       106964 
    H11HD1-M10HG2      7.290      2.644                      38340 
        H11HD1-HA      7.285      4.854   1.35e+07 lo       199630 
       H11HD1-HB1      7.285      2.888   5.94e+07 ma       287531 
       H11HD1-HB2      7.285      3.145   4.62e+07 lo       302255 
        H11HD1-HN      7.284      8.125                      39959 
         H11HN-HA      8.115      4.861   9.11e+06 lo       172581 
        H11HN-HB1      8.120      2.887   2.39e+07 lo       256486 
        H11HN-HB2      8.124      3.152   4.85e+07 lo       152598 
        H11HN-HD1      8.121      7.271                     157333 
        N12HA-HB1      4.655      2.786   1.06e+07 ma       106865 
        N12HB1-HA      2.800      4.664                     285031 
      N12HB1-HD22      2.807      7.618                     152729 
        N12HB2-HA      2.890      4.661                     280911 
   N12HD21-M10HG2      6.868      2.648   5.33e+07 lo        58626 
     N12HD21-HD22      6.864      7.603   4.16e+08 ma      4642946 
   N12HD21-R13HD2      6.857      3.179                      38527 
       N12HD22-HA      7.615      4.667   5.66e+06 lo        49399 
      N12HD22-HB1      7.616      2.799   1.46e+08 lo       204296 
     N12HD22-HD21      7.605      6.865   2.71e+08 ma      4450654 
         N12HN-HA      8.392      4.679   3.17e+07 lo       110169 
        N12HN-HB2      8.388      2.882   2.46e+08 lo        76431 
     N12HN-R13HB2      8.393      1.914   1.31e+06 lo        45477 
        R13HA-HB2      4.301      1.932   2.71e+07 lo       291746 
        R13HA-HB3      4.303      1.816   8.95e+07 ma       313412 
        R13HA-HD2      4.304      3.183   1.15e+08 lo       347707 
         R13HA-HN      4.307      8.340   1.88e+08 ma       284211 
     R13HB2-H11HA      1.922      4.556   1.72e+07 lo       140423 
        R13HB2-HA      1.928      4.308   8.38e+07 lo       431873 
       R13HB2-HD2      1.891      3.174                     497306 
       R13HB2-HG1      1.890      1.643   6.65e+07 ma        74125 
        R13HB3-HA      1.811      4.307   8.95e+07 ma       336398 
        R13HD2-HA      3.190      4.310                     306672 
       R13HD2-HG1      3.180      1.636                     203711 
       R13HD2-HG2      3.182      1.701   8.19e+07 ma       754852 
      R13HN-N12HA      8.296      4.669   2.41e+07 lo       211438 
         R13HN-HA      8.297      4.304   3.83e+07 lo       229427 
        R13HN-HB2      8.293      1.919   2.64e+07 lo       108283 
        R13HN-HB3      8.295      1.813   1.82e+07 ma       168909 
        R13HN-HD2      8.300      3.186   1.62e+07 lo        46518 
        R13HN-HG1      8.297      1.645   4.36e+07 lo        90164 
        R13HN-HG2      8.294      1.696   1.69e+07 lo        93219 
    G14HA2-R13HD2      3.905      3.181                     133151 
        G14HA2-HN      3.886      8.131   1.11e+07 lo        61675 
        G14HN-HA2      8.139      3.897   1.99e+07 lo        69636 
        K15HA-HE2      4.235      2.960   7.03e+06 ma       114284 
        K15HA-HG2      4.231      1.315   3.76e+07 lo       173087 
        K15HE2-HA      2.949      4.238   2.42e+07 lo       116058 
        K15HG2-HA      1.321      4.234                     112076 
     K15HN-G14HA2      8.012      3.887   5.71e+07 lo       375669 
         K15HN-HA      8.013      4.232                     959096 
        K15HN-HE2      8.023      2.962                      35026 
        K15HN-HG2      8.013      1.324   5.51e+07 lo        77991 
        H16HA-HE1      4.624      8.302   2.73e+06 lo        65047 
        H16HB1-HA      3.100      4.614                     429365 
   H16HB1-N18HD22      3.100      7.605   4.61e+07 lo        52080 
        H16HB2-HA      3.199      4.612   8.22e+07 lo       439069 
       H16HB2-HD2      3.192      7.107                     224862 
       H16HB2-HE1      3.181      8.304   7.69e+06 lo        52542 
        H16HB2-HN      3.186      8.381   8.31e+06 ma        40247 
       H16HD2-HB2      7.114      3.192                     237761 
     H16HD2-L17HA      7.109      4.316   7.66e+06 lo        59651 
         H16HN-HA      8.375      4.615                      73087 
        H16HN-HB2      8.392      3.163   2.09e+07 lo        45922 
        L17HA-HB3      4.320      1.593   2.76e+07 ma       256519 
       L17HA-HD11      4.321      0.788   1.14e+08 lo       736733 
         L17HA-HG      4.321      1.500   6.94e+07 lo       332705 
         L17HA-HN      4.311      8.102   1.04e+07 ma       178708 
      L17HA-N18HN      4.319      8.669   1.34e+07 lo        95721 
        L17HB2-HA      1.496      4.326                     445042 
      L17HB2-HD11      1.499      0.794   4.24e+08 lo      1394097 
        L17HB3-HA      1.592      4.323   1.09e+08 lo       419994 
       L17HD11-HA      0.787      4.328   9.61e+07 lo       831516 
      L17HD11-HB3      0.796      1.590   1.66e+07 ma       661212 
       L17HD11-HG      0.789      1.498   2.57e+08 lo      1083330 
       L17HD11-HN      0.791      8.131   7.37e+06 lo        60712 
   L17HD11-S19HB1      0.798      3.891   6.93e+07 ma       144367 
         L17HG-HN      1.496      8.135   1.89e+07 lo       100933 
      L17HN-H16HA      8.121      4.658   4.94e+07 lo       381495 
         L17HN-HA      8.106      4.318   3.89e+07 lo       325854 
        L17HN-HB3      8.136      1.590   9.27e+07 ma       215412 
       L17HN-HD11      8.135      0.799   5.19e+06 ma       118983 
         L17HN-HG      8.138      1.496   2.32e+07 ma       171985 
    L17HN-N18HD21      8.133      6.940   1.86e+07 lo        46675 
     N18HB2-K15HN      2.890      8.006   1.98e+07 ma        50241 
        N18HB2-HA      2.885      4.723   1.02e+08 lo       772255 
      N18HB2-HD21      2.884      6.942   3.08e+07 lo       182421 
      N18HB2-HD22      2.883      7.616   7.15e+07 lo       378293 
        N18HB2-HN      2.887      8.674   1.28e+07 lo        52009 
      N18HD21-HB2      6.945      2.882   2.91e+07 lo       268287 
     N18HD21-HD21      6.951      6.946                   12707161 
     N18HD21-HD22      6.942      7.616   4.65e+08 lo      9143957 
   N18HD21-E21HG2      6.946      2.363   1.01e+07 lo        93095 
      N18HD22-HB2      7.618      2.882   5.51e+07 lo       505952 
     N18HD22-HD21      7.617      6.941   5.04e+08 lo      8850582 
   N18HD22-M20HG2      7.606      2.616   2.01e+07 lo       152116 
   N18HD22-E21HG2      7.618      2.364   4.80e+06 lo        45307 
      N18HN-L17HA      8.673      4.328   3.04e+07 lo       290689 
    N18HN-L17HD11      8.670      0.789   6.60e+06 lo        48231 
      N18HN-L17HG      8.672      1.504   8.18e+06 lo        50469 
        N18HN-HB2      8.673      2.894   2.36e+07 lo       131192 
         N18HN-HN      8.672      8.670   2.44e+07 lo       218959 
     N18HN-E21HB2      8.674      2.038   1.09e+07 lo        95445 
        S19HA-HB1      4.308      3.904   7.54e+07 lo       609335 
        S19HA-HB2      4.309      3.968   7.38e+07 lo       608574 
     S19HA-M20HG1      4.317      2.485   7.56e+07 ma       139759 
        S19HB1-HN      3.893      8.342   1.88e+09 lo       277510 
        S19HB2-HA      3.966      4.316                    1155854 
        S19HB2-HN      4.001      8.338   5.26e+07 ma       194810 
     S19HN-N18HB2      8.339      2.891   5.92e+07 lo       125841 
    S19HN-N18HD22      8.337      7.622   9.54e+06 lo        49988 
         S19HN-HA      8.341      4.312   6.49e+07 lo       525707 
        S19HN-HB1      8.344      3.896   9.02e+07 lo       506844 
        S19HN-HB2      8.340      4.002   4.64e+07 lo       342706 
     M20HA-S19HB2      4.400      3.992   3.38e+06 lo        71480 
        M20HA-HB3      4.415      2.124   3.23e+07 lo       359068 
        M20HA-HG1      4.413      2.546   1.45e+07 lo       108017 
        M20HA-HG2      4.405      2.649   1.78e+07 ma       108089 
      M20HA-E21HN      4.413      8.387   1.86e+07 lo       145872 
      M20HA-V23HN      4.418      7.984   6.18e+06 lo        88308 
        M20HB3-HA      2.103      4.421   2.04e+07 ma       718343 
       M20HB3-HG1      2.116      2.558                     445186 
       M20HB3-HG2      2.112      2.644   6.52e+07 lo       319233 
        M20HB3-HN      2.112      8.332   8.12e+07 ma       298664 
        M20HG1-HA      2.557      4.418   5.09e+07 ma       190005 
        M20HG1-HN      2.550      8.325   1.23e+07 lo        41994 
   M20HG2-N18HD22      2.651      7.606   4.96e+07 lo       119822 
        M20HG2-HA      2.652      4.419                     202497 
       M20HG2-HB3      2.649      2.103   1.11e+08 lo       533577 
        M20HG2-HN      2.653      8.320   1.23e+07 lo        42612 
         M20HN-HA      8.337      4.427   1.51e+07 ma       400733 
        M20HN-HB3      8.336      2.108   8.09e+07 ma       652572 
        M20HN-HG1      8.340      2.550   1.04e+07 lo        93991 
        M20HN-HG2      8.340      2.647   1.26e+07 lo        92850 
     M20HN-E21HG2      8.341      2.359   7.36e+07 ma        51038 
     M20HN-R22HB2      8.344      1.925   9.12e+06 ma        71563 
        E21HA-HB2      4.190      2.055                    2179890 
        E21HA-HG1      4.185      2.273   3.18e+07 ma       590989 
        E21HA-HG2      4.192      2.360   5.13e+07 ma       340925 
         E21HA-HN      4.188      8.388   3.82e+07 ma       328524 
    E21HB2-N18HB2      2.045      2.891   8.56e+07 lo        98000 
        E21HB2-HA      2.052      4.185   3.56e+07 ma      1840302 
        E21HB2-HN      2.041      8.388   7.58e+07 ma       452991 
    E21HB2-R22HD2      2.046      3.164   6.19e+07 lo       196550 
    E21HB2-R22HG1      2.043      1.571                     386154 
        E21HG1-HA      2.272      4.187   1.44e+08 lo       466667 
        E21HG1-HN      2.262      8.389   1.99e+07 lo        93111 
        E21HG2-HN      2.360      8.387   2.57e+07 lo       130618 
      E21HN-M20HA      8.390      4.423   4.27e+07 lo       404584 
     E21HN-M20HB3      8.391      2.103   5.47e+07 ma       301106 
     E21HN-M20HG2      8.393      2.639   4.77e+06 lo        47609 
         E21HN-HA      8.392      4.189   4.38e+07 lo       444166 
        E21HN-HB2      8.390      2.040   1.42e+08 ma       881142 
        E21HN-HG1      8.391      2.272   1.76e+07 lo       174794 
        E21HN-HG2      8.390      2.359   2.34e+07 ma       272875 
        R22HA-HB2      4.193      1.891   6.24e+07 ma       397499 
        R22HA-HB3      4.200      1.802   8.80e+07 ma       520397 
        R22HA-HD2      4.205      3.151                     382467 
     R22HA-W25HB2      4.203      3.404   8.64e+07 ma       381975 
     R22HA-W25HE3      4.203      7.574   2.66e+07 ma       106246 
    R22HB2-S19HB1      1.912      3.891   8.96e+06 lo       123294 
        R22HB2-HA      1.906      4.192   3.76e+07 ma       363413 
        R22HB2-HE      1.901      7.252   9.86e+06 lo        73421 
        R22HB2-HN      1.913      8.255   2.83e+07 ma       176176 
        R22HB3-HA      1.798      4.200   9.41e+07 lo       361591 
        R22HB3-HN      1.798      8.253   4.11e+07 lo       190213 
    R22HD2-N18HB2      3.165      2.889   1.43e+07 ma      1559446 
        R22HD2-HA      3.145      4.208   6.88e+07 lo       283882 
       R22HD2-HB2      3.162      1.882   5.79e+07 ma       389556 
       R22HD2-HB3      3.147      1.804                     332212 
       R22HD2-HG1      3.157      1.581   6.66e+07 ma       781518 
       R22HD2-HG2      3.147      1.651   1.00e+07 ma       474625 
   R22HD2-V23HG11      3.165      0.891                     285444 
     R22HE-N18HB2      7.328      2.886   8.68e+08 lo        81597 
        R22HE-HD2      7.328      3.152   1.66e+08 lo        90172 
        R22HE-HG1      7.256      1.572   2.92e+07 lo        73486 
        R22HE-HG2      7.256      1.656   2.04e+07 lo       147858 
        R22HG1-HE      1.569      7.253   4.31e+07 lo        71979 
        R22HG1-HN      1.575      8.251   1.35e+07 lo        66688 
        R22HG2-HE      1.663      7.255   4.45e+07 lo        91020 
        R22HG2-HN      1.644      8.252   3.04e+07 lo        70092 
    R22HG2-W25HE3      1.657      7.569   7.71e+07 lo       168276 
      R22HN-M20HA      8.255      4.419   5.31e+06 lo       105847 
      R22HN-E21HN      8.252      8.387   1.10e+07 lo       174771 
         R22HN-HA      8.258      4.191   9.05e+07 lo       896270 
        R22HN-HB2      8.259      1.904   1.95e+07 ma       338595 
        R22HN-HB3      8.259      1.800   3.61e+07 ma       428802 
        R22HN-HD2      8.257      3.149   1.13e+07 ma        89421 
        R22HN-HG1      8.257      1.584   2.35e+07 lo       167870 
        R22HN-HG2      8.256      1.653   1.87e+07 ma       180409 
      R22HN-V23HN      8.253      7.981   1.30e+07 ma       490161 
         V23HA-HB      3.859      2.122   3.10e+07 lo       328698 
       V23HA-HG11      3.860      0.897   1.18e+07 ma      1134942 
       V23HA-HG21      3.861      1.005   8.20e+07 lo       904974 
         V23HA-HN      3.863      7.982   3.64e+07 ma       406905 
      V23HA-E24HN      3.860      8.232   3.58e+07 lo       345661 
      V23HA-W25HN      3.862      8.071   1.03e+07 ma       182608 
     V23HA-L26HB1      3.861      1.717   2.33e+07 lo       193448 
    V23HA-L26HD21      3.862      0.859   3.62e+07 lo       374545 
     V23HA-R27HG1      3.860      1.563   2.38e+07 lo       189700 
         V23HB-HA      2.121      3.865   8.65e+07 lo       361356 
       V23HB-HG21      2.126      0.999   2.28e+08 lo       739968 
         V23HB-HN      2.120      7.979   1.93e+08 ma       440978 
    V23HG11-M20HA      0.892      4.422   1.62e+07 lo       146054 
       V23HG11-HA      0.896      3.864   1.09e+08 ma       908462 
    V23HG21-S19HA      1.008      4.313   8.85e+06 lo        59158 
    V23HG21-M20HA      1.007      4.423   3.19e+07 lo       245561 
   V23HG21-R22HB3      1.007      1.804   1.49e+07 lo        67615 
   V23HG21-R22HG2      1.006      1.656   1.24e+09 ma       195281 
       V23HG21-HA      1.007      3.864   7.70e+07 lo       837058 
       V23HG21-HB      0.895      2.115   5.62e+07 ma      1038858 
       V23HG21-HB      1.005      2.117   5.87e+07 ma       860190 
       V23HG21-HN      1.007      7.976   5.04e+07 lo       644400 
    V23HG21-E24HA      1.008      4.199   9.76e+06 ma        80045 
    V23HG21-E24HN      1.005      8.233   1.34e+07 lo       114072 
    V23HG21-W25HN      1.008      8.074   3.84e+06 ma        54999 
    V23HG21-L26HG      1.008      1.565   2.15e+07 lo       139133 
      V23HN-M20HA      7.978      4.426   2.90e+07 ma       143986 
         V23HN-HA      7.977      3.863   4.58e+07 lo       444748 
         V23HN-HB      7.976      2.120   7.89e+07 ma       622828 
       V23HN-HG11      7.980      0.895   1.32e+07 ma       462319 
       V23HN-HG21      7.977      1.008   6.69e+07 ma       783216 
      V23HN-E24HN      7.977      8.241   4.09e+07 lo       356748 
         E24HA-HN      4.189      8.251   3.74e+07 ma       673009 
     E24HA-R27HD1      4.185      3.165                     343092 
     E24HA-R27HD2      4.201      3.329   3.70e+07 lo       231015 
        E24HB3-HN      2.054      8.232   9.12e+07 ma       603357 
    E24HB3-W25HD1      2.051      7.260   2.88e+07 lo       115301 
    E24HB3-W25HE1      2.060     10.218   5.11e+06 lo        64547 
        E24HG2-HN      2.298      8.230   1.29e+08 lo       117793 
     E24HG2-W25HN      2.293      8.084   5.37e+07 lo        78705 
      E24HN-V23HA      8.230      3.862   4.35e+07 lo       416210 
      E24HN-V23HB      8.229      2.115   2.38e+07 ma       332122 
    E24HN-V23HG11      8.230      0.894   1.29e+08 ma       257653 
    E24HN-V23HG21      8.235      1.006   2.19e+07 lo       155451 
        E24HN-HB3      8.232      2.054   9.12e+07 ma       923881 
        E24HN-HG2      8.229      2.292   6.98e+08 lo       214003 
        W25HA-HB1      4.431      3.328   4.76e+07 lo       295599 
        W25HA-HB2      4.428      3.407   5.25e+07 lo       308897 
        W25HA-HD1      4.424      7.256   2.49e+07 ma       215355 
        W25HA-HE3      4.429      7.571   1.96e+07 ma        99143 
         W25HA-HN      4.419      8.083   2.78e+07 lo       214645 
        W25HB1-HA      3.327      4.434   1.83e+08 lo       612677 
       W25HB1-HD1      3.325      7.254   1.24e+07 ma       275028 
       W25HB1-HE3      3.326      7.570   1.61e+08 lo       232852 
        W25HB1-HN      3.327      8.084   5.71e+07 ma       491798 
     W25HB2-R22HA      3.405      4.205   8.31e+07 lo       271950 
        W25HB2-HA      3.405      4.431   1.35e+07 ma       557266 
       W25HB2-HD1      3.407      7.254   1.22e+09 lo       256675 
       W25HB2-HE3      3.403      7.570   1.62e+08 lo       237000 
        W25HB2-HN      3.407      8.085   5.69e+07 ma       470406 
     W25HB2-R27HN      3.408      7.993   8.04e+06 ma        95539 
    W25HD1-E21HG1      7.254      2.299   1.25e+07 lo        45331 
    W25HD1-R22HB3      7.256      1.805   5.99e+06 lo        57626 
    W25HD1-E24HB3      7.255      2.049   7.83e+06 lo        99147 
        W25HD1-HA      7.257      4.436   2.59e+07 lo       421967 
       W25HD1-HB1      7.257      3.329   1.51e+07 ma       480454 
       W25HD1-HB2      7.257      3.403   1.33e+07 ma       368235 
       W25HD1-HE1      7.257     10.206   5.47e+07 lo      1449752 
        W25HD1-HN      7.257      8.086   1.23e+07 lo       185235 
    W25HD1-K28HE2      7.253      2.947   3.70e+07 ma       338823 
    W25HD1-K29HG2      7.254      1.211   7.65e+06 lo        47368 
    W25HE1-E24HB3     10.212      2.051   4.17e+06 lo        40184 
        W25HE1-HA     10.210      4.434   1.00e+06 ma        32598 
       W25HE1-HB1     10.208      3.330                      37169 
       W25HE1-HB2     10.208      3.407                      29808 
       W25HE1-HD1     10.207      7.257   4.83e+07 lo      1137569 
       W25HE1-HE1     10.198     10.199   3.65e+08 lo      5029600 
       W25HE1-HZ2     10.207      7.479   2.12e+07 lo       382426 
   W25HE1-L26HD21     10.207      0.888   7.06e+06 lo        73382 
    W25HE1-K28HG2     10.208      1.510                      39845 
     W25HE3-R22HA      7.570      4.201   8.51e+06 lo       101264 
    W25HE3-R22HD2      7.573      3.147   1.74e+07 lo        79089 
    W25HE3-R22HG2      7.569      1.659   5.61e+07 lo       310370 
        W25HE3-HA      7.569      4.434   2.00e+07 lo       210654 
       W25HE3-HB1      7.570      3.330   1.56e+07 ma       303829 
       W25HE3-HB2      7.569      3.404   1.19e+07 ma       376932 
       W25HE3-HE1      7.569     10.206                      18333 
        W25HE3-HN      7.569      8.067   1.55e+07 lo       161466 
     W25HE3-L26HA      7.569      3.977   2.12e+07 lo       252683 
   W25HE3-L26HD21      7.570      0.876   4.39e+07 lo       368308 
     W25HE3-L26HG      7.569      1.570   1.38e+07 ma       124341 
    W25HE3-K29HB2      7.567      1.799   6.70e+06 lo        53806 
    W25HE3-K29HG2      7.568      1.202   5.20e+06 lo        40288 
     W25HN-E24HG2      8.091      2.293   5.87e+07 ma       118902 
      W25HN-E24HN      8.094      8.224   3.11e+07 lo       315205 
         W25HN-HA      8.092      4.435   8.07e+07 lo       490993 
        W25HN-HB1      8.090      3.329   3.74e+07 ma       640660 
        W25HN-HB2      8.091      3.403   3.28e+07 ma       634344 
        W25HN-HD1      8.095      7.258   5.93e+07 lo       238161 
        W25HN-HE3      8.067      7.568   1.59e+07 ma       196202 
       W25HZ2-HE1      7.480     10.205   2.67e+07 lo       471767 
    W25HZ2-K28HG2      7.479      1.511   1.06e+07 lo        77937 
     L26HA-W25HB1      3.972      3.338   2.30e+07 lo        44902 
     L26HA-W25HE3      3.978      7.570   2.24e+08 lo       190385 
        L26HA-HB1      3.976      1.708   4.17e+07 ma       410114 
        L26HA-HB2      3.973      1.876   2.37e+07 lo       233527 
         L26HA-HN      3.971      8.193   3.21e+07 ma       403417 
      L26HA-R27HN      3.978      7.996   1.10e+07 ma       349031 
     L26HA-K29HG2      3.972      1.190   1.10e+07 ma       290131 
     L26HB1-V23HA      1.713      3.865   3.90e+07 lo       189525 
        L26HB1-HA      1.709      3.978   1.42e+08 lo       366697 
        L26HB2-HA      1.883      3.974   3.83e+07 lo       217665 
      L26HB2-HD21      1.876      0.880                     987831 
        L26HB2-HN      1.875      8.196   5.98e+07 ma       130803 
     L26HB2-R27HN      1.879      7.996                     418994 
   L26HD21-W25HE3      0.871      7.569   3.45e+07 lo       213799 
   L26HD21-W25HZ2      0.886      7.482   3.99e+07 ma        73817 
      L26HD21-HB2      0.878      1.871   1.30e+07 ma      1200137 
       L26HD21-HN      0.885      8.201   4.46e+07 lo       149514 
   L26HD21-R27HD1      0.895      3.163   1.76e+07 ma       327651 
    L26HD21-R27HE      0.874      7.102                     265107 
     L26HG-W25HE3      1.564      7.571   1.32e+07 ma        89360 
         L26HG-HA      1.556      3.976   1.07e+07 ma       409293 
      L26HN-W25HA      8.192      4.402   9.74e+06 lo        74240 
         L26HN-HA      8.194      3.972   4.93e+07 lo       519515 
        L26HN-HB1      8.191      1.696   2.10e+07 ma        81809 
        L26HN-HB2      8.193      1.872   2.15e+07 ma       245248 
       L26HN-HD21      8.194      0.878   1.15e+09 lo       225431 
        R27HA-HB1      4.063      1.864   8.99e+07 ma       570622 
        R27HA-HD1      4.062      3.175   5.92e+07 lo       222359 
         R27HA-HN      4.080      7.993                     688300 
      R27HA-K28HN      4.067      7.921   1.95e+07 ma       370363 
        R27HB1-HA      1.871      4.067                     407801 
   R27HD1-V23HG21      3.152      1.010   7.48e+06 lo        68157 
        R27HD1-HN      3.169      7.995   9.87e+08 lo       111510 
     R27HD2-E24HA      3.327      4.205   6.61e+07 lo       258835 
        R27HD2-HN      3.325      7.992   3.43e+07 ma       106026 
      R27HE-L26HA      7.102      3.977   6.58e+06 lo        55109 
        R27HE-HG1      7.103      1.567   1.17e+07 ma        71618 
        R27HE-HG2      7.104      1.697   7.69e+07 lo       132894 
     R27HG1-V23HA      1.557      3.862   2.53e+07 ma       153856 
       R27HG1-HD1      1.571      3.159                     727241 
        R27HG1-HN      1.559      7.999   1.08e+08 ma       574607 
   R27HG1-L30HD21      1.556      0.890   6.02e+07 ma      1766335 
        R27HG2-HA      1.693      4.079   1.50e+08 lo       404198 
       R27HG2-HD1      1.694      3.178   2.17e+08 lo       763181 
        R27HG2-HN      1.696      8.000   2.40e+08 ma       902765 
     R27HN-W25HB2      7.994      3.393   9.72e+06 lo        43802 
      R27HN-L26HA      8.000      3.978   4.79e+07 lo       403176 
         R27HN-HA      7.999      4.088   1.61e+08 lo       803669 
        R27HN-HB1      8.001      1.864   1.92e+08 ma       698583 
        R27HN-HD1      8.001      3.170   2.84e+07 lo       117113 
        R27HN-HD2      7.995      3.325   1.92e+07 lo        50030 
        R27HN-HG1      8.001      1.571   6.67e+07 ma       813548 
        R27HN-HG2      8.003      1.693   1.52e+08 ma      1463167 
        K28HA-HB2      4.117      1.797   1.75e+08 ma       823194 
        K28HA-HG1      4.114      1.392   3.78e+07 lo       267145 
        K28HA-HG2      4.100      1.511   7.81e+07 ma       462680 
         K28HA-HN      4.114      7.918   2.13e+07 ma       400108 
        K28HB2-HA      1.801      4.116   1.38e+08 lo       538132 
        K28HB2-HN      1.804      7.920   2.29e+07 ma       368478 
       K28HD2-HE2      1.644      2.954   9.01e+07 lo       740247 
       K28HE1-HG2      2.866      1.513   1.48e+08 lo       208838 
    K28HE1-K29HG2      2.867      1.208   1.12e+08 lo       125688 
     K28HE1-Q31HA      2.871      4.241                     149693 
     K28HE2-W25HA      2.940      4.433                     274930 
    K28HE2-W25HD1      2.945      7.251   1.02e+07 ma       258761 
       K28HE2-HD2      2.950      1.640   6.24e+07 lo       886591 
       K28HE2-HG1      2.955      1.372   1.59e+08 lo       162907 
       K28HE2-HG2      2.953      1.486   1.69e+08 lo       133771 
        K28HE2-HN      2.961      7.910   1.76e+07 lo        61248 
        K28HG1-HA      1.390      4.115   2.37e+07 lo       137339 
       K28HG1-HB2      1.399      1.799   9.40e+07 lo       243442 
       K28HG1-HD2      1.404      1.658   5.22e+07 ma        56004 
       K28HG1-HE2      1.374      2.957   4.25e+07 ma       169151 
        K28HG1-HN      1.398      7.915   2.49e+07 lo        72086 
        K28HG2-HA      1.512      4.099   8.57e+07 lo       313264 
       K28HG2-HE1      1.519      2.868   4.30e+08 lo       174508 
       K28HG2-HE2      1.497      2.958   4.19e+07 lo       172985 
        K28HG2-HN      1.498      7.916   2.01e+07 ma       102516 
      K28HN-R27HA      7.920      4.063   4.18e+07 lo       355000 
         K28HN-HA      7.922      4.113   4.32e+07 lo       409318 
        K28HN-HB2      7.921      1.798   5.92e+07 ma       651907 
        K28HN-HD2      7.923      1.650   3.04e+07 ma       105927 
        K28HN-HE1      7.923      2.857                       5252 
        K28HN-HE2      7.932      2.952                      31542 
        K28HN-HG1      7.922      1.391   1.21e+07 lo        97730 
        K28HN-HG2      7.921      1.500   2.96e+07 ma       188061 
    K28HN-Q31HE22      7.924      6.863                      38640 
        K29HA-HB2      4.100      1.688   2.57e+07 ma       424614 
        K29HA-HB3      4.104      2.111   3.98e+07 ma       279829 
        K29HA-HD2      4.093      1.598   6.41e+07 ma       528109 
        K29HA-HG2      4.096      1.208   5.09e+07 lo       386749 
         K29HA-HN      4.100      7.987                     745099 
      K29HA-L30HN      4.088      8.082                     153804 
     K29HA-Q31HG2      4.109      2.378   6.98e+06 lo        56197 
     K29HA-D32HB3      4.106      2.635   4.67e+07 ma       123531 
       K29HB2-HG2      1.686      1.208   1.49e+08 lo       563186 
        K29HB3-HA      2.110      4.098   3.07e+07 lo       220632 
        K29HD2-HA      1.594      4.092   8.06e+07 ma       350671 
    K29HG2-K28HE1      1.204      2.860   5.11e+07 lo        78316 
        K29HG2-HA      1.207      4.095   2.68e+07 lo       201754 
       K29HG2-HB2      1.208      1.683   1.32e+08 lo       451513 
       K29HG2-HB2      1.203      1.808   2.57e+06 ma        44708 
       K29HG2-HD2      1.212      1.605   1.42e+08 lo       371925 
        K29HG2-HN      1.209      7.978   2.98e+07 lo       137806 
     K29HG2-L30HA      1.210      4.228                      37849 
         K29HN-HA      7.978      4.102   1.46e+08 lo       732756 
        K29HN-HB2      7.978      1.804   2.59e+07 ma       487303 
        K29HN-HD2      7.979      1.593   2.20e+07 ma       541023 
        K29HN-HG2      7.972      1.206   4.26e+07 lo       264489 
     L30HA-K29HB3      4.244      2.111   5.29e+07 ma       416155 
        L30HA-HB2      4.232      1.698   5.79e+08 ma       986860 
       L30HA-HD11      4.237      0.845   3.12e+07 ma      1466846 
         L30HA-HG      4.234      1.562   2.51e+08 ma       753206 
     L30HA-Q31HG2      4.247      2.378   1.57e+07 ma       289119 
        L30HB2-HA      1.701      4.235   2.28e+08 lo       914043 
        L30HB2-HN      1.704      8.058   2.27e+08 ma       650871 
     L30HB2-D32HA      1.694      4.616   4.22e+06 lo        59218 
       L30HD11-HA      0.846      4.235   1.83e+08 lo      1270020 
    L30HD21-R27HA      0.889      4.063   1.70e+07 ma       224683 
       L30HD21-HA      0.895      4.236   4.45e+07 ma       393663 
         L30HG-HA      1.558      4.236   1.87e+08 lo       711528 
         L30HG-HN      1.555      8.061   1.93e+08 ma       490001 
      L30HG-D32HA      1.568      4.616   5.11e+06 lo        45587 
      L30HN-K29HA      8.084      4.092   1.44e+07 lo       114039 
         L30HN-HA      8.056      4.243   2.58e+08 lo       596187 
        L30HN-HB2      8.060      1.699   2.04e+08 ma      1189672 
       L30HN-HD21      8.072      0.884   8.83e+07 ma       454613 
         L30HN-HG      8.061      1.564   2.52e+07 ma       675200 
    L30HN-Q31HE21      8.068      7.498   1.29e+07 ma        58750 
      L30HN-D32HA      8.057      4.616   9.64e+06 lo        41919 
         Q31HA-HN      4.233      8.009                     767575 
    Q31HB1-L30HB2      2.046      1.701                     351179 
        Q31HB1-HA      2.050      4.247                     490576 
        Q31HB1-HN      2.046      8.010   1.93e+07 ma       290548 
      Q31HB2-HE21      2.097      7.477   2.08e+06 ma        64895 
   Q31HE21-K28HE1      7.478      2.865   1.57e+07 lo        76240 
   Q31HE21-L30HB2      7.479      1.705                      35790 
  Q31HE21-L30HD21      7.486      0.891   5.37e+07 lo       118134 
     Q31HE21-HE21      7.706      7.704   1.44e+08 lo      2991558 
     Q31HE21-HE22      7.508      6.867   7.28e+08 lo      4501992 
     Q31HE21-HE22      7.706      6.883   7.93e+07 ma      1730799 
      Q31HE21-HG2      7.501      2.382   2.13e+07 lo       171283 
  Q31HE21-V33HG11      7.487      0.845   2.44e+07 ma        86785 
  Q31HE21-N35HD21      7.487      7.203   5.20e+07 ma      1044530 
     Q31HE22-HE21      6.869      7.502                    4263982 
     Q31HE22-HE21      6.884      7.704   6.95e+07 lo      1458517 
      Q31HE22-HG2      6.851      2.375   6.77e+07 lo        81978 
  Q31HE22-V33HG11      6.868      0.835   1.19e+07 lo        50350 
     Q31HG2-L30HG      2.375      1.563                      79040 
        Q31HG2-HA      2.387      4.242   1.11e+08 lo       262344 
      Q31HG2-HE21      2.385      7.498   2.16e+07 lo       116253 
      Q31HG2-HE22      2.385      6.855   7.33e+06 ma        61145 
        Q31HG2-HN      2.385      8.015   9.76e+07 lo       138573 
         Q31HN-HA      8.014      4.238                    1035535 
        Q31HN-HB1      8.014      2.043   1.25e+08 ma       408768 
        Q31HN-HB2      8.013      2.109   2.29e+07 ma       316658 
       Q31HN-HE21      8.002      7.495   2.13e+07 lo        80497 
       Q31HN-HE22      8.003      6.860   6.27e+06 lo        42405 
        Q31HN-HG2      8.016      2.382   4.11e+07 ma       188791 
      Q31HN-D32HA      8.012      4.616   4.60e+07 lo        72658 
        D32HA-HB2      4.599      2.752   8.82e+07 lo       119127 
        D32HA-HB3      4.610      2.632   8.13e+06 ma        82426 
      D32HA-V33HN      4.604      7.881   1.48e+07 lo       141652 
     D32HB2-Q31HN      2.746      8.004   3.88e+07 lo        53849 
        D32HB2-HA      2.749      4.611   5.36e+07 lo       289908 
        D32HB2-HN      2.758      8.164   2.46e+07 lo        71147 
     D32HB2-V33HN      2.765      7.882   5.40e+07 lo        94023 
     D32HB3-Q31HN      2.620      8.005   1.04e+07 ma        64143 
        D32HB3-HA      2.622      4.614   5.25e+07 lo       385317 
       D32HB3-HB2      2.617      2.746                    3147218 
        D32HB3-HN      2.617      8.152   8.88e+07 lo       108126 
     D32HB3-V33HN      2.618      7.882   2.74e+07 ma       111362 
      D32HN-K29HA      8.163      4.094   3.86e+07 lo        74155 
      D32HN-Q31HA      8.165      4.247   8.40e+07 lo       443822 
         D32HN-HA      8.163      4.614   5.43e+07 lo       405498 
        D32HN-HB2      8.166      2.747   2.28e+07 lo       185627 
        D32HN-HB3      8.164      2.631   6.70e+07 lo       285651 
     V33HA-D32HB2      3.995      2.753                      38695 
         V33HA-HB      3.992      2.057   4.38e+07 lo       380186 
       V33HA-HG11      3.994      0.832   1.46e+07 ma      1127819 
         V33HA-HN      3.996      7.879   3.73e+07 ma       294110 
    V33HB-Q31HE21      2.062      7.490   8.77e+07 lo        61720 
      V33HB-D32HA      2.051      4.615   2.08e+07 ma       204897 
         V33HB-HA      2.052      3.988   5.30e+07 lo       369327 
         V33HB-HN      2.059      7.882   7.71e+09 ma       273860 
    V33HG11-D32HA      0.833      4.620   2.29e+07 lo        77599 
       V33HG11-HA      0.830      3.992   1.58e+08 ma       698351 
       V33HG11-HB      0.835      2.055   1.61e+08 ma      1128647 
       V33HG11-HN      0.834      7.878   1.25e+08 ma       527934 
    V33HN-Q31HE22      7.874      6.868                      31095 
      V33HN-D32HA      7.881      4.616   5.12e+07 lo       730183 
     V33HN-D32HB2      7.880      2.747   1.18e+07 lo       102420 
     V33HN-D32HB3      7.880      2.628   1.40e+07 lo       129976 
      V33HN-D32HN      7.881      8.167   9.87e+06 lo        94518 
         V33HN-HA      7.880      3.995   2.04e+07 lo       227080 
         V33HN-HB      7.880      2.061   3.79e+07 lo       347167 
       V33HN-HG11      7.880      0.833   7.29e+07 lo       760372 
         V33HN-HN      7.888      7.884                   12542483 
      H34HN-R27HA      8.463      4.069   9.59e+06 lo        52591 
      H34HN-V33HA      8.442      4.005   4.74e+06 ma        46638 
        H34HN-HB2      8.463      3.121   7.34e+06 ma        41860 
         H34HN-HN      8.452      8.451   1.14e+08 lo      1866935 
        N35HA-HB1      4.605      3.034                     101908 
      N35HB1-HD22      3.023      7.102   1.18e+07 ma       141683 
      N35HB2-HD22      3.107      7.103   1.14e+07 ma       245164 
  N35HD21-Q31HE21      7.194      7.477   5.64e+07 lo       904584 
     N35HD21-HD22      7.205      7.107                    2584428 
    N35HD22-Q31HA      7.103      4.237   6.58e+06 lo        50005 
       N35HD22-HA      7.113      4.605   2.43e+07 lo       154019 
      N35HD22-HB1      7.098      3.038   4.82e+07 ma       121811 
      N35HD22-HB2      7.103      3.103   2.39e+07 ma       356397 
     N35HD22-HD21      7.100      7.195   6.36e+07 lo      1126866 
   N35HD22-F36HB2      7.102      2.952   5.27e+06 lo        41371 
   N35HD22-P38HB3      7.115      2.042   6.12e+06 lo        72316 
      N35HN-H34HA      8.343      4.711   8.27e+07 lo       278118 
         N35HN-HA      8.341      4.603                     103988 
        N35HN-HB1      8.346      3.030   1.07e+07 lo        77492 
        N35HN-HB2      8.344      3.109   6.59e+06 ma        69930 
       N35HN-HD22      8.341      7.107   9.91e+07 lo        94842 
        F36HA-HD2      4.209      7.107                     167347 
         F36HA-HN      4.194      8.080   2.32e+07 ma       916254 
         F36HA-HZ      4.204      7.256                     152556 
        F36HB2-HN      2.945      8.071   2.40e+07 ma        75115 
       F36HD2-HD1      7.204      7.565   1.60e+07 lo       148348 
       F36HE1-HD1      7.101      7.567   8.53e+07 lo      1128625 
       F36HE2-HE1      7.569      7.100   1.26e+07 ma      1471707 
        F36HE2-HZ      7.567      7.261   2.54e+08 lo       311350 
         F36HN-HA      8.086      4.191   1.45e+08 lo       944049 
        F36HN-HB2      8.071      2.949   1.22e+07 lo       103662 
      F36HZ-V33HA      7.259      3.977   3.25e+06 lo        47929 
         F36HZ-HA      7.255      4.199   6.33e+06 lo        79195 
        P37HA-HD2      4.722      3.792                     525867 
        P37HB3-HA      2.352      4.713   3.29e+07 lo       219516 
       P37HB3-HD2      2.350      3.786   4.13e+07 ma        84186 
       P37HB3-HD3      2.345      3.691   3.35e+07 lo        79364 
        P37HD2-HA      3.794      4.720                     545069 
       P37HD2-HD3      3.799      3.685                    1482842 
       P37HD2-HG2      3.786      2.021   6.60e+07 ma       392319 
        P37HD3-HA      3.680      4.719   3.87e+07 ma       459957 
       P37HD3-HD2      3.678      3.793                    2310498 
       P37HD3-HG2      3.677      2.024   4.30e+08 lo       399895 
       P37HG2-HD2      2.026      3.790   1.06e+08 lo       584648 
       P37HG2-HD3      2.023      3.689                     479988 
        P38HB2-HA      2.578      4.649   2.63e+07 lo       249821 
       P38HB2-HD2      2.574      3.714   2.09e+07 lo        66249 
       P38HB2-HD3      2.573      3.586                     162697 
       P38HB2-HG2      2.579      2.055                    1240326 
        P38HD2-HA      3.720      4.643   4.72e+07 lo       363284 
       P38HD2-HB2      3.723      2.562   1.01e+07 lo        55428 
       P38HD2-HB3      3.712      2.036   5.47e+07 ma       444340 
        P38HD3-HA      3.582      4.642   3.26e+07 lo       199973 
       P38HD3-HB2      3.586      2.565   1.57e+07 lo       101969 
       P38HD3-HG2      3.582      2.049   6.27e+08 lo       369751 
       P38HG2-HB2      2.057      2.572                    1054583 
       P38HG2-HD3      2.063      3.579   1.41e+08 lo       344261 
       P38HG3-HD2      1.996      3.579   1.37e+08 lo       260552 
        D39HB2-HN      2.601      8.108   4.93e+07 ma        92874 
        D39HB2-HN      8.096      2.053   8.85e+08 lo      1036180 
        D39HB2-HN      2.051      8.092   8.83e+08 ma       623557 
        D39HB3-HA      2.605      4.241                      83346 
        D39HB3-HA      2.482      4.243                      74795 
        D39HB3-HN      2.488      8.095   1.63e+07 lo        51731 
         D39HN-HA      8.105      4.245   8.29e+07 lo       530599 
        D39HN-HB2      8.108      2.601   5.99e+08 lo       165121 
        D39HN-HB3      8.105      2.491   9.21e+06 lo       103812 

  Entry H atom name         Submitted Coord H atom name
  Start of MODEL    1
    1    H2   PRO   1           1HT      PRO   1  -3.843  14.594  14.189
    2    H3   PRO   1           2HT      PRO   1  -5.473  14.537  14.313
    3    HA   PRO   1           HA       PRO   1  -5.711  13.045  12.822
    4    HB2  PRO   1           2HB      PRO   1  -3.682  13.368  10.881
    5    HB3  PRO   1           1HB      PRO   1  -5.395  13.781  10.722
    6    HG2  PRO   1           2HG      PRO   1  -3.092  15.507  11.448
    7    HG3  PRO   1           1HG      PRO   1  -4.583  15.924  10.585
    8    HD2  PRO   1           2HD      PRO   1  -4.213  16.685  13.112
    9    HD3  PRO   1           1HD      PRO   1  -5.806  16.148  12.557
   10    HA   PRO   2           HA       PRO   2  -2.097  10.899  14.606
   11    HB2  PRO   2           2HB      PRO   2  -3.748   9.303  16.242
   12    HB3  PRO   2           1HB      PRO   2  -2.834  10.725  16.743
   13    HG2  PRO   2           2HG      PRO   2  -5.632  10.495  16.650
   14    HG3  PRO   2           1HG      PRO   2  -4.704  11.987  16.854
   15    HD2  PRO   2           2HD      PRO   2  -5.962  10.861  14.402
   16    HD3  PRO   2           1HD      PRO   2  -5.739  12.556  14.885
   17    H    SER   3           H        SER   3  -2.804   8.181  15.399
   18    HA   SER   3           HA       SER   3  -2.316   6.946  12.915
   19    HB2  SER   3           2HB      SER   3  -3.156   5.648  15.515
   20    HB3  SER   3           1HB      SER   3  -2.319   4.866  14.170
   21    HG   SER   3           HG       SER   3  -0.852   6.942  14.741
   22    H    VAL   4           H        VAL   4  -5.265   7.648  14.602
   23    HA   VAL   4           HA       VAL   4  -6.899   5.687  13.349
   24    HB   VAL   4           HB       VAL   4  -7.522   6.867  15.436
   25   HG11  VAL   4          1HG1      VAL   4  -6.799   9.102  14.922
   26   HG12  VAL   4          2HG1      VAL   4  -8.523   9.112  15.297
   27   HG13  VAL   4          3HG1      VAL   4  -7.984   9.222  13.621
   28   HG21  VAL   4          3HG2      VAL   4  -9.229   5.698  14.170
   29   HG22  VAL   4          1HG2      VAL   4  -9.512   7.136  13.188
   30   HG23  VAL   4          2HG2      VAL   4  -9.901   7.152  14.907
   31    H    SER   5           H        SER   5  -5.611   8.706  12.264
   32    HA   SER   5           HA       SER   5  -7.326   8.530   9.879
   33    HB2  SER   5           2HB      SER   5  -7.026  11.098   9.818
   34    HB3  SER   5           1HB      SER   5  -8.203  10.405  10.934
   35    HG   SER   5           HG       SER   5  -7.093  11.745  12.192
   36    H    GLU   6           H        GLU   6  -4.485   7.635  10.553
   37    HA   GLU   6           HA       GLU   6  -2.836   9.252   8.891
   38    HB2  GLU   6           2HB      GLU   6  -1.173   7.479   9.117
   39    HB3  GLU   6           1HB      GLU   6  -1.866   7.902  10.676
   40    HG2  GLU   6           2HG      GLU   6  -3.145   5.933  10.755
   41    HG3  GLU   6           1HG      GLU   6  -2.847   5.577   9.053
   42    H    ILE   7           H        ILE   7  -5.370   7.429   8.089
   43    HA   ILE   7           HA       ILE   7  -4.234   6.320   5.632
   44    HB   ILE   7           HB       ILE   7  -7.067   6.056   6.632
   45   HG12  ILE   7          2HG1      ILE   7  -5.579   5.101   8.298
   46   HG13  ILE   7          1HG1      ILE   7  -6.410   3.819   7.431
   47   HG21  ILE   7          1HG2      ILE   7  -7.161   4.144   5.109
   48   HG22  ILE   7          2HG2      ILE   7  -5.503   4.461   4.600
   49   HG23  ILE   7          3HG2      ILE   7  -6.773   5.635   4.248
   50   HD11  ILE   7          3HD1      ILE   7  -4.081   3.265   7.822
   51   HD12  ILE   7          1HD1      ILE   7  -3.584   4.715   6.952
   52   HD13  ILE   7          2HD1      ILE   7  -4.414   3.415   6.096
   53    H    GLN   8           H        GLN   8  -7.043   8.225   6.663
   54    HA   GLN   8           HA       GLN   8  -7.490   9.143   3.963
   55    HB2  GLN   8           2HB      GLN   8  -9.514  10.182   4.848
   56    HB3  GLN   8           1HB      GLN   8  -9.408   8.494   5.314
   57    HG2  GLN   8           2HG      GLN   8  -8.494  10.641   7.181
   58    HG3  GLN   8           1HG      GLN   8 -10.203  10.262   7.021
   59   HE21  GLN   8          1HE2      GLN   8 -10.347   9.575   9.145
   60   HE22  GLN   8          2HE2      GLN   8  -9.648   8.079   9.685
   61    H    LEU   9           H        LEU   9  -6.258  10.466   6.991
   62    HA   LEU   9           HA       LEU   9  -6.095  13.130   5.824
   63    HB2  LEU   9           2HB      LEU   9  -5.496  11.992   8.517
   64    HB3  LEU   9           1HB      LEU   9  -4.708  13.483   8.050
   65    HG   LEU   9           HG       LEU   9  -6.672  13.975   9.360
   66   HD11  LEU   9          1HD1      LEU   9  -7.070  14.621   6.448
   67   HD12  LEU   9          2HD1      LEU   9  -6.128  15.552   7.613
   68   HD13  LEU   9          3HD1      LEU   9  -7.878  15.428   7.789
   69   HD21  LEU   9          3HD2      LEU   9  -7.975  11.982   8.977
   70   HD22  LEU   9          1HD2      LEU   9  -8.191  12.411   7.279
   71   HD23  LEU   9          2HD2      LEU   9  -8.926  13.403   8.540
   72    H    MET  10           H        MET  10  -4.038  10.373   6.380
   73    HA   MET  10           HA       MET  10  -1.765  11.890   5.299
   74    HB2  MET  10           2HB      MET  10  -1.842   9.350   6.922
   75    HB3  MET  10           1HB      MET  10  -0.383  10.008   6.191
   76    HG2  MET  10           2HG      MET  10  -0.597  12.017   7.497
   77    HG3  MET  10           1HG      MET  10  -2.102  11.428   8.206
   78    HE1  MET  10           3HE      MET  10   0.161  12.459  10.087
   79    HE2  MET  10           1HE      MET  10   0.249  11.175  11.293
   80    HE3  MET  10           2HE      MET  10  -1.318  11.712  10.690
   81    H    HIS  11           H        HIS  11  -1.849  11.687   3.131
   82    HA   HIS  11           HA       HIS  11  -2.213   8.988   2.021
   83    HB2  HIS  11           2HB      HIS  11  -2.344  11.714   0.727
   84    HB3  HIS  11           1HB      HIS  11  -2.296  10.223  -0.206
   85    HD1  HIS  11           1HD      HIS  11  -4.645  12.559   0.922
   86    HD2  HIS  11           2HD      HIS  11  -4.515   8.399   0.916
   87    HE1  HIS  11           1HE      HIS  11  -7.037  11.802   1.138
   88    HE2  HIS  11           2HE      HIS  11  -6.942   9.278   1.113
   89    H    ASN  12           H        ASN  12   0.063  11.371   2.737
   90    HA   ASN  12           HA       ASN  12   2.216  10.654   1.108
   91    HB2  ASN  12           2HB      ASN  12   3.628  11.465   3.027
   92    HB3  ASN  12           1HB      ASN  12   2.375  12.593   2.531
   93   HD21  ASN  12          1HD2      ASN  12   3.724  12.544   5.051
   94   HD22  ASN  12          2HD2      ASN  12   2.497  12.296   6.258
   95    H    ARG  13           H        ARG  13   0.975   9.289   4.105
   96    HA   ARG  13           HA       ARG  13   1.151   7.247   5.068
   97    HB2  ARG  13           2HB      ARG  13   1.628   6.508   2.182
   98    HB3  ARG  13           1HB      ARG  13   1.391   5.319   3.458
   99    HG2  ARG  13           2HG      ARG  13  -0.578   7.454   2.657
  100    HG3  ARG  13           1HG      ARG  13  -0.659   5.754   2.194
  101    HD2  ARG  13           2HD      ARG  13  -0.690   6.743   5.041
  102    HD3  ARG  13           1HD      ARG  13  -2.139   6.371   4.106
  103    HE   ARG  13           HE       ARG  13  -0.894   4.075   3.898
  104   HH11  ARG  13          1HH1      ARG  13  -1.153   6.136   6.712
  105   HH12  ARG  13          2HH1      ARG  13  -1.082   4.814   7.849
  106   HH21  ARG  13          1HH2      ARG  13  -0.872   2.334   5.385
  107   HH22  ARG  13          2HH2      ARG  13  -0.970   2.657   7.091
  108    H    GLY  14           H        GLY  14   2.854   5.031   4.143
  109    HA2  GLY  14           2HA      GLY  14   4.911   4.172   4.718
  110    HA3  GLY  14           1HA      GLY  14   5.582   5.750   4.309
  111    H    LYS  15           H        LYS  15   3.406   4.484   6.817
  112    HA   LYS  15           HA       LYS  15   4.660   6.434   8.625
  113    HB2  LYS  15           2HB      LYS  15   1.935   5.171   8.616
  114    HB3  LYS  15           1HB      LYS  15   2.549   6.065  10.001
  115    HG2  LYS  15           2HG      LYS  15   2.152   7.133   7.213
  116    HG3  LYS  15           1HG      LYS  15   1.192   7.519   8.645
  117    HD2  LYS  15           2HD      LYS  15   3.121   8.538   9.700
  118    HD3  LYS  15           1HD      LYS  15   4.143   8.069   8.344
  119    HE2  LYS  15           2HE      LYS  15   2.848   9.522   6.866
  120    HE3  LYS  15           1HE      LYS  15   1.814   9.983   8.220
  121    HZ1  LYS  15           3HZ      LYS  15   3.465  11.665   7.904
  122    HZ2  LYS  15           1HZ      LYS  15   4.720  10.523   7.930
  123    HZ3  LYS  15           2HZ      LYS  15   3.832  10.843   9.336
  124    H    HIS  16           H        HIS  16   4.544   3.111   8.133
  125    HA   HIS  16           HA       HIS  16   6.058   2.709  10.582
  126    HB2  HIS  16           2HB      HIS  16   4.211   0.459  10.085
  127    HB3  HIS  16           1HB      HIS  16   4.755   1.140  11.610
  128    HD1  HIS  16           1HD      HIS  16   2.999   2.317  12.918
  129    HD2  HIS  16           2HD      HIS  16   2.092   2.068   8.866
  130    HE1  HIS  16           1HE      HIS  16   0.694   3.293  12.685
  131    HE2  HIS  16           2HE      HIS  16   0.260   3.351  10.200
  132    H    LEU  17           H        LEU  17   4.519   0.307   8.562
  133    HA   LEU  17           HA       LEU  17   6.985   0.062   7.022
  134    HB2  LEU  17           2HB      LEU  17   7.000  -1.899   8.249
  135    HB3  LEU  17           1HB      LEU  17   5.253  -2.074   8.204
  136    HG   LEU  17           HG       LEU  17   5.549  -2.571   5.714
  137   HD11  LEU  17          1HD1      LEU  17   7.921  -1.620   5.854
  138   HD12  LEU  17          2HD1      LEU  17   7.654  -3.060   4.876
  139   HD13  LEU  17          3HD1      LEU  17   8.372  -3.203   6.482
  140   HD21  LEU  17          3HD2      LEU  17   5.038  -4.290   7.385
  141   HD22  LEU  17          1HD2      LEU  17   6.760  -4.467   7.728
  142   HD23  LEU  17          2HD2      LEU  17   6.126  -4.904   6.140
  143    H    ASN  18           H        ASN  18   3.512  -0.505   7.055
  144    HA   ASN  18           HA       ASN  18   1.888  -0.049   5.583
  145    HB2  ASN  18           2HB      ASN  18   4.073   1.627   4.423
  146    HB3  ASN  18           1HB      ASN  18   2.602   1.381   3.490
  147   HD21  ASN  18          1HD2      ASN  18   2.479   1.374   6.935
  148   HD22  ASN  18          2HD2      ASN  18   1.672   2.896   7.101
  149    H    SER  19           H        SER  19   4.779  -1.567   4.445
  150    HA   SER  19           HA       SER  19   3.880  -2.612   2.010
  151    HB2  SER  19           2HB      SER  19   6.225  -2.746   3.036
  152    HB3  SER  19           1HB      SER  19   5.616  -4.089   4.002
  153    HG   SER  19           HG       SER  19   5.440  -5.326   2.245
  154    H    MET  20           H        MET  20   2.868  -3.256   5.208
  155    HA   MET  20           HA       MET  20   1.633  -5.779   4.564
  156    HB2  MET  20           2HB      MET  20   0.586  -5.241   6.915
  157    HB3  MET  20           1HB      MET  20   2.235  -5.822   6.792
  158    HG2  MET  20           2HG      MET  20   3.085  -3.603   7.070
  159    HG3  MET  20           1HG      MET  20   1.463  -2.916   6.993
  160    HE1  MET  20           3HE      MET  20   2.958  -5.573  10.466
  161    HE2  MET  20           1HE      MET  20   3.931  -5.175   9.053
  162    HE3  MET  20           2HE      MET  20   2.519  -6.218   8.884
  163    H    GLU  21           H        GLU  21   0.924  -2.437   4.658
  164    HA   GLU  21           HA       GLU  21  -1.924  -2.632   4.546
  165    HB2  GLU  21           2HB      GLU  21  -0.173  -0.366   3.574
  166    HB3  GLU  21           1HB      GLU  21  -1.865  -0.272   4.050
  167    HG2  GLU  21           2HG      GLU  21   0.457  -0.867   5.864
  168    HG3  GLU  21           1HG      GLU  21  -0.371   0.686   5.694
  169    H    ARG  22           H        ARG  22   0.657  -1.957   2.221
  170    HA   ARG  22           HA       ARG  22  -0.800  -1.433  -0.061
  171    HB2  ARG  22           2HB      ARG  22   1.881  -2.734   0.322
  172    HB3  ARG  22           1HB      ARG  22   1.168  -2.577  -1.268
  173    HG2  ARG  22           2HG      ARG  22   2.413  -0.680  -1.244
  174    HG3  ARG  22           1HG      ARG  22   0.938  -0.047  -0.513
  175    HD2  ARG  22           2HD      ARG  22   1.961  -0.608   1.720
  176    HD3  ARG  22           1HD      ARG  22   3.470  -0.901   0.860
  177    HE   ARG  22           HE       ARG  22   2.169   1.672   1.313
  178   HH11  ARG  22          1HH1      ARG  22   4.804  -0.162  -0.092
  179   HH12  ARG  22          2HH1      ARG  22   5.762   1.251  -0.432
  180   HH21  ARG  22          1HH2      ARG  22   3.415   3.524   0.825
  181   HH22  ARG  22          2HH2      ARG  22   4.985   3.338   0.090
  182    H    VAL  23           H        VAL  23   0.624  -4.599   0.701
  183    HA   VAL  23           HA       VAL  23  -0.353  -5.984  -1.468
  184    HB   VAL  23           HB       VAL  23  -0.055  -7.974   0.055
  185   HG11  VAL  23          1HG1      VAL  23   2.182  -5.954   0.011
  186   HG12  VAL  23          2HG1      VAL  23   1.823  -7.112  -1.275
  187   HG13  VAL  23          3HG1      VAL  23   2.368  -7.682   0.305
  188   HG21  VAL  23          3HG2      VAL  23  -0.212  -7.607   2.223
  189   HG22  VAL  23          1HG2      VAL  23  -0.402  -5.891   1.838
  190   HG23  VAL  23          2HG2      VAL  23   1.214  -6.556   2.143
  191    H    GLU  24           H        GLU  24  -2.064  -4.907   1.335
  192    HA   GLU  24           HA       GLU  24  -4.273  -6.766   0.973
  193    HB2  GLU  24           2HB      GLU  24  -4.155  -4.318   2.744
  194    HB3  GLU  24           1HB      GLU  24  -5.261  -5.690   2.879
  195    HG2  GLU  24           2HG      GLU  24  -2.303  -5.824   3.228
  196    HG3  GLU  24           1HG      GLU  24  -3.457  -5.678   4.554
  197    H    TRP  25           H        TRP  25  -3.660  -3.260   0.722
  198    HA   TRP  25           HA       TRP  25  -6.270  -2.883  -0.298
  199    HB2  TRP  25           2HB      TRP  25  -5.547  -0.668  -1.073
  200    HB3  TRP  25           1HB      TRP  25  -5.537  -0.961   0.646
  201    HD1  TRP  25           HD       TRP  25  -3.343  -0.447   1.866
  202    HE1  TRP  25           1HE      TRP  25  -1.119   0.619   1.162
  203    HE3  TRP  25           3HE      TRP  25  -3.850  -0.835  -3.150
  204    HZ2  TRP  25           2HZ      TRP  25   0.236   1.230  -1.246
  205    HZ3  TRP  25           3HZ      TRP  25  -2.070   0.014  -4.615
  206    HH2  TRP  25           HH       TRP  25  -0.056   1.017  -3.675
  207    H    LEU  26           H        LEU  26  -3.383  -3.899  -1.798
  208    HA   LEU  26           HA       LEU  26  -3.717  -3.176  -4.344
  209    HB2  LEU  26           2HB      LEU  26  -3.291  -6.039  -3.546
  210    HB3  LEU  26           1HB      LEU  26  -2.820  -5.305  -5.058
  211    HG   LEU  26           HG       LEU  26  -1.561  -5.042  -2.362
  212   HD11  LEU  26          1HD1      LEU  26  -0.689  -6.738  -3.865
  213   HD12  LEU  26          2HD1      LEU  26   0.484  -5.434  -3.675
  214   HD13  LEU  26          3HD1      LEU  26  -0.490  -5.538  -5.140
  215   HD21  LEU  26          3HD2      LEU  26  -0.269  -3.144  -3.229
  216   HD22  LEU  26          1HD2      LEU  26  -1.996  -2.822  -3.019
  217   HD23  LEU  26          2HD2      LEU  26  -1.334  -3.097  -4.640
  218    H    ARG  27           H        ARG  27  -5.737  -5.300  -2.533
  219    HA   ARG  27           HA       ARG  27  -7.047  -6.259  -4.959
  220    HB2  ARG  27           2HB      ARG  27  -7.373  -7.179  -2.109
  221    HB3  ARG  27           1HB      ARG  27  -7.962  -7.995  -3.554
  222    HG2  ARG  27           2HG      ARG  27  -6.061  -9.193  -3.247
  223    HG3  ARG  27           1HG      ARG  27  -5.393  -7.869  -4.213
  224    HD2  ARG  27           2HD      ARG  27  -4.124  -8.554  -2.080
  225    HD3  ARG  27           1HD      ARG  27  -4.412  -6.817  -2.298
  226    HE   ARG  27           HE       ARG  27  -6.205  -7.012  -0.715
  227   HH11  ARG  27          1HH1      ARG  27  -4.041  -9.761  -0.907
  228   HH12  ARG  27          2HH1      ARG  27  -4.365 -10.297   0.720
  229   HH21  ARG  27          1HH2      ARG  27  -6.660  -7.756   1.429
  230   HH22  ARG  27          2HH2      ARG  27  -5.850  -9.167   2.031
  231    H    LYS  28           H        LYS  28  -7.480  -3.913  -2.604
  232    HA   LYS  28           HA       LYS  28 -10.297  -3.681  -3.380
  233    HB2  LYS  28           2HB      LYS  28 -10.679  -2.431  -1.367
  234    HB3  LYS  28           1HB      LYS  28  -9.892  -3.954  -0.955
  235    HG2  LYS  28           2HG      LYS  28  -7.742  -2.794  -0.868
  236    HG3  LYS  28           1HG      LYS  28  -8.578  -1.287  -1.216
  237    HD2  LYS  28           2HD      LYS  28  -9.938  -1.654   0.838
  238    HD3  LYS  28           1HD      LYS  28  -8.895  -3.039   1.189
  239    HE2  LYS  28           2HE      LYS  28  -6.947  -1.562   1.156
  240    HE3  LYS  28           1HE      LYS  28  -7.999  -0.186   0.850
  241    HZ1  LYS  28           3HZ      LYS  28  -8.133  -1.918   3.272
  242    HZ2  LYS  28           1HZ      LYS  28  -9.018  -0.496   3.000
  243    HZ3  LYS  28           2HZ      LYS  28  -7.339  -0.421   3.207
  244    H    LYS  29           H        LYS  29  -7.453  -2.625  -4.413
  245    HA   LYS  29           HA       LYS  29  -8.551   0.010  -5.046
  246    HB2  LYS  29           2HB      LYS  29  -5.710  -0.497  -4.126
  247    HB3  LYS  29           1HB      LYS  29  -6.263   1.013  -4.817
  248    HG2  LYS  29           2HG      LYS  29  -7.108  -0.195  -2.176
  249    HG3  LYS  29           1HG      LYS  29  -6.112   1.233  -2.446
  250    HD2  LYS  29           2HD      LYS  29  -8.061   2.285  -3.618
  251    HD3  LYS  29           1HD      LYS  29  -9.039   0.918  -3.080
  252    HE2  LYS  29           2HE      LYS  29  -9.356   2.718  -1.533
  253    HE3  LYS  29           1HE      LYS  29  -8.401   1.468  -0.736
  254    HZ1  LYS  29           3HZ      LYS  29  -7.471   3.617  -0.263
  255    HZ2  LYS  29           1HZ      LYS  29  -7.372   3.997  -1.914
  256    HZ3  LYS  29           2HZ      LYS  29  -6.394   2.775  -1.262
  257    H    LEU  30           H        LEU  30  -6.279  -2.580  -6.083
  258    HA   LEU  30           HA       LEU  30  -4.999  -1.301  -8.149
  259    HB2  LEU  30           2HB      LEU  30  -4.218  -3.312  -8.822
  260    HB3  LEU  30           1HB      LEU  30  -4.811  -3.768  -7.243
  261    HG   LEU  30           HG       LEU  30  -6.662  -4.097  -9.553
  262   HD11  LEU  30          1HD1      LEU  30  -4.384  -4.845 -10.262
  263   HD12  LEU  30          2HD1      LEU  30  -5.634  -6.094 -10.295
  264   HD13  LEU  30          3HD1      LEU  30  -4.456  -6.056  -8.980
  265   HD21  LEU  30          3HD2      LEU  30  -7.492  -4.716  -7.390
  266   HD22  LEU  30          1HD2      LEU  30  -6.052  -5.680  -7.045
  267   HD23  LEU  30          2HD2      LEU  30  -7.188  -6.196  -8.297
  268    H    GLN  31           H        GLN  31  -7.920  -3.184  -8.384
  269    HA   GLN  31           HA       GLN  31  -9.231  -1.041  -9.740
  270    HB2  GLN  31           2HB      GLN  31 -10.181  -2.718 -11.474
  271    HB3  GLN  31           1HB      GLN  31  -8.592  -2.035 -11.769
  272    HG2  GLN  31           2HG      GLN  31  -8.219  -4.224 -12.274
  273    HG3  GLN  31           1HG      GLN  31  -7.757  -4.190 -10.572
  274   HE21  GLN  31          1HE2      GLN  31  -8.935  -5.346  -9.099
  275   HE22  GLN  31          2HE2      GLN  31 -10.190  -6.430  -9.558
  276    H    ASP  32           H        ASP  32  -8.954  -2.498  -7.325
  277    HA   ASP  32           HA       ASP  32  -9.723  -4.080  -5.926
  278    HB2  ASP  32           2HB      ASP  32 -10.863  -2.527  -4.889
  279    HB3  ASP  32           1HB      ASP  32 -11.749  -2.024  -6.306
  280    H    VAL  33           H        VAL  33  -9.923  -5.991  -6.103
  281    HA   VAL  33           HA       VAL  33 -10.820  -7.138  -8.571
  282    HB   VAL  33           HB       VAL  33  -8.778  -7.946  -7.605
  283   HG11  VAL  33          1HG1      VAL  33  -9.203  -7.498  -5.307
  284   HG12  VAL  33          2HG1      VAL  33  -8.735  -9.192  -5.494
  285   HG13  VAL  33          3HG1      VAL  33 -10.430  -8.765  -5.235
  286   HG21  VAL  33          3HG2      VAL  33  -9.163 -10.374  -7.554
  287   HG22  VAL  33          1HG2      VAL  33 -10.004  -9.592  -8.895
  288   HG23  VAL  33          2HG2      VAL  33 -10.900 -10.084  -7.455
  289    H    HIS  34           H        HIS  34 -12.346  -6.487  -5.663
  290    HA   HIS  34           HA       HIS  34 -14.165  -8.658  -5.543
  291    HB2  HIS  34           2HB      HIS  34 -14.461  -5.813  -4.584
  292    HB3  HIS  34           1HB      HIS  34 -15.631  -7.084  -4.251
  293    HD1  HIS  34           1HD      HIS  34 -12.436  -5.674  -3.134
  294    HD2  HIS  34           2HD      HIS  34 -14.635  -9.148  -2.484
  295    HE1  HIS  34           1HE      HIS  34 -11.455  -6.728  -1.063
  296    HE2  HIS  34           2HE      HIS  34 -12.837  -8.802  -0.652
  297    H    ASN  35           H        ASN  35 -13.824  -6.352  -7.922
  298    HA   ASN  35           HA       ASN  35 -16.601  -5.842  -8.481
  299    HB2  ASN  35           2HB      ASN  35 -15.889  -4.472 -10.255
  300    HB3  ASN  35           1HB      ASN  35 -14.648  -4.282  -9.023
  301   HD21  ASN  35          1HD2      ASN  35 -12.669  -5.281  -9.308
  302   HD22  ASN  35          2HD2      ASN  35 -12.075  -5.722 -10.882
  303    H    PHE  36           H        PHE  36 -14.996  -8.625  -8.842
  304    HA   PHE  36           HA       PHE  36 -15.412  -9.372 -11.492
  305    HB2  PHE  36           2HB      PHE  36 -14.905 -10.763  -8.972
  306    HB3  PHE  36           1HB      PHE  36 -15.794 -11.734 -10.146
  307    HD1  PHE  36           1HD      PHE  36 -12.660  -9.926  -9.492
  308    HD2  PHE  36           2HD      PHE  36 -14.746 -12.526 -12.130
  309    HE1  PHE  36           1HE      PHE  36 -10.552 -10.424 -10.661
  310    HE2  PHE  36           2HE      PHE  36 -12.645 -13.028 -13.305
  311    HZ   PHE  36           HZ       PHE  36 -10.543 -11.975 -12.573
  312    HA   PRO  37           HA       PRO  37 -19.950 -10.677 -10.390
  313    HB2  PRO  37           2HB      PRO  37 -20.320  -9.470  -7.716
  314    HB3  PRO  37           1HB      PRO  37 -20.891 -11.020  -8.343
  315    HG2  PRO  37           2HG      PRO  37 -18.881 -10.892  -6.580
  316    HG3  PRO  37           1HG      PRO  37 -18.887 -12.091  -7.888
  317    HD2  PRO  37           2HD      PRO  37 -17.373  -9.512  -7.682
  318    HD3  PRO  37           1HD      PRO  37 -16.834 -11.089  -8.300
  319    HA   PRO  38           HA       PRO  38 -21.109  -5.927  -9.744
  320    HB2  PRO  38           2HB      PRO  38 -18.452  -4.845  -8.958
  321    HB3  PRO  38           1HB      PRO  38 -20.074  -4.393  -8.388
  322    HG2  PRO  38           2HG      PRO  38 -18.502  -5.829  -6.833
  323    HG3  PRO  38           1HG      PRO  38 -20.218  -6.258  -6.976
  324    HD2  PRO  38           2HD      PRO  38 -17.864  -7.483  -8.343
  325    HD3  PRO  38           1HD      PRO  38 -19.210  -8.272  -7.500
  326    H    ASP  39           H        ASP  39 -19.780  -7.382 -11.949
  327    HA   ASP  39           HA       ASP  39 -18.318  -5.285 -13.327
  328    HB2  ASP  39           2HB      ASP  39 -17.426  -7.478 -13.587
  329    HB3  ASP  39           1HB      ASP  39 -19.014  -8.136 -13.973
  Start of MODEL    2
    1    H2   PRO   1           1HT      PRO   1   5.350  22.230   4.329
    2    H3   PRO   1           2HT      PRO   1   5.323  23.640   3.493
    3    HA   PRO   1           HA       PRO   1   3.928  22.972   2.028
    4    HB2  PRO   1           2HB      PRO   1   4.229  20.163   1.744
    5    HB3  PRO   1           1HB      PRO   1   4.694  21.424   0.592
    6    HG2  PRO   1           2HG      PRO   1   6.334  20.041   2.638
    7    HG3  PRO   1           1HG      PRO   1   6.815  20.706   1.066
    8    HD2  PRO   1           2HD      PRO   1   7.493  21.952   3.314
    9    HD3  PRO   1           1HD      PRO   1   6.972  22.885   1.898
   10    HA   PRO   2           HA       PRO   2   1.575  21.359   5.666
   11    HB2  PRO   2           2HB      PRO   2  -0.245  23.563   5.072
   12    HB3  PRO   2           1HB      PRO   2   0.635  23.218   6.562
   13    HG2  PRO   2           2HG      PRO   2   1.238  25.319   4.966
   14    HG3  PRO   2           1HG      PRO   2   2.459  24.470   5.933
   15    HD2  PRO   2           2HD      PRO   2   1.834  24.216   3.012
   16    HD3  PRO   2           1HD      PRO   2   3.414  24.261   3.826
   17    H    SER   3           H        SER   3  -0.258  23.023   3.094
   18    HA   SER   3           HA       SER   3  -1.627  20.474   2.544
   19    HB2  SER   3           2HB      SER   3  -2.768  23.279   2.467
   20    HB3  SER   3           1HB      SER   3  -3.633  21.827   1.964
   21    HG   SER   3           HG       SER   3  -3.836  21.201   4.000
   22    H    VAL   4           H        VAL   4   0.772  21.648   1.330
   23    HA   VAL   4           HA       VAL   4  -0.005  22.623  -1.264
   24    HB   VAL   4           HB       VAL   4   2.711  21.727  -0.282
   25   HG11  VAL   4          1HG1      VAL   4   1.931  23.348  -2.703
   26   HG12  VAL   4          2HG1      VAL   4   2.566  21.702  -2.707
   27   HG13  VAL   4          3HG1      VAL   4   3.579  23.039  -2.166
   28   HG21  VAL   4          3HG2      VAL   4   1.836  23.586   1.034
   29   HG22  VAL   4          1HG2      VAL   4   1.518  24.495  -0.444
   30   HG23  VAL   4          2HG2      VAL   4   3.176  24.111   0.016
   31    H    SER   5           H        SER   5   1.952  19.793  -0.309
   32    HA   SER   5           HA       SER   5   1.208  18.521  -2.813
   33    HB2  SER   5           2HB      SER   5   2.880  16.792  -2.040
   34    HB3  SER   5           1HB      SER   5   3.526  18.405  -2.366
   35    HG   SER   5           HG       SER   5   3.337  17.021   0.018
   36    H    GLU   6           H        GLU   6   0.216  18.453   0.428
   37    HA   GLU   6           HA       GLU   6  -0.293  15.722   0.777
   38    HB2  GLU   6           2HB      GLU   6  -1.482  18.152   2.089
   39    HB3  GLU   6           1HB      GLU   6  -1.769  16.503   2.634
   40    HG2  GLU   6           2HG      GLU   6   0.908  17.851   2.451
   41    HG3  GLU   6           1HG      GLU   6  -0.023  17.601   3.931
   42    H    ILE   7           H        ILE   7  -1.535  17.218  -1.660
   43    HA   ILE   7           HA       ILE   7  -4.216  16.117  -1.332
   44    HB   ILE   7           HB       ILE   7  -3.265  17.926  -3.545
   45   HG12  ILE   7          2HG1      ILE   7  -3.059  19.158  -1.475
   46   HG13  ILE   7          1HG1      ILE   7  -4.464  19.741  -2.353
   47   HG21  ILE   7          1HG2      ILE   7  -6.044  17.188  -2.632
   48   HG22  ILE   7          2HG2      ILE   7  -5.234  16.597  -4.082
   49   HG23  ILE   7          3HG2      ILE   7  -5.648  18.305  -3.938
   50   HD11  ILE   7          3HD1      ILE   7  -4.901  19.562   0.026
   51   HD12  ILE   7          1HD1      ILE   7  -4.518  17.840  -0.029
   52   HD13  ILE   7          2HD1      ILE   7  -5.926  18.460  -0.896
   53    H    GLN   8           H        GLN   8  -1.441  16.189  -3.554
   54    HA   GLN   8           HA       GLN   8  -2.589  13.779  -4.814
   55    HB2  GLN   8           2HB      GLN   8  -1.542  14.347  -6.876
   56    HB3  GLN   8           1HB      GLN   8  -2.361  15.790  -6.310
   57    HG2  GLN   8           2HG      GLN   8   0.591  15.267  -6.030
   58    HG3  GLN   8           1HG      GLN   8  -0.150  16.230  -7.304
   59   HE21  GLN   8          1HE2      GLN   8   1.818  17.022  -5.364
   60   HE22  GLN   8          2HE2      GLN   8   1.129  18.330  -4.467
   61    H    LEU   9           H        LEU   9   0.048  15.186  -3.166
   62    HA   LEU   9           HA       LEU   9   1.593  12.706  -3.454
   63    HB2  LEU   9           2HB      LEU   9   2.548  15.389  -2.455
   64    HB3  LEU   9           1HB      LEU   9   3.535  13.964  -2.709
   65    HG   LEU   9           HG       LEU   9   2.199  15.647  -4.824
   66   HD11  LEU   9          1HD1      LEU   9   4.206  16.632  -3.907
   67   HD12  LEU   9          2HD1      LEU   9   4.501  16.055  -5.548
   68   HD13  LEU   9          3HD1      LEU   9   5.089  15.129  -4.166
   69   HD21  LEU   9          3HD2      LEU   9   3.319  14.156  -6.441
   70   HD22  LEU   9          1HD2      LEU   9   2.063  13.343  -5.507
   71   HD23  LEU   9          2HD2      LEU   9   3.763  13.084  -5.110
   72    H    MET  10           H        MET  10  -0.784  13.371  -1.666
   73    HA   MET  10           HA       MET  10  -0.449  13.439   0.959
   74    HB2  MET  10           2HB      MET  10  -1.740  11.191  -0.583
   75    HB3  MET  10           1HB      MET  10  -1.871  11.351   1.162
   76    HG2  MET  10           2HG      MET  10  -2.908  13.546   0.863
   77    HG3  MET  10           1HG      MET  10  -2.831  13.329  -0.885
   78    HE1  MET  10           3HE      MET  10  -6.653  12.914  -0.127
   79    HE2  MET  10           1HE      MET  10  -5.428  13.826  -1.006
   80    HE3  MET  10           2HE      MET  10  -5.547  13.973   0.747
   81    H    HIS  11           H        HIS  11   1.319  12.899   2.164
   82    HA   HIS  11           HA       HIS  11   2.918  10.624   1.426
   83    HB2  HIS  11           2HB      HIS  11   4.468  11.314   3.103
   84    HB3  HIS  11           1HB      HIS  11   3.923  12.751   2.264
   85    HD1  HIS  11           1HD      HIS  11   2.643  14.501   3.619
   86    HD2  HIS  11           2HD      HIS  11   3.712  11.131   5.812
   87    HE1  HIS  11           1HE      HIS  11   2.342  15.135   6.033
   88    HE2  HIS  11           2HE      HIS  11   3.241  13.175   7.333
   89    H    ASN  12           H        ASN  12   0.074  10.631   2.716
   90    HA   ASN  12           HA       ASN  12   0.372   8.924   4.977
   91    HB2  ASN  12           2HB      ASN  12  -2.073   8.551   4.713
   92    HB3  ASN  12           1HB      ASN  12  -1.631  10.252   4.746
   93   HD21  ASN  12          1HD2      ASN  12  -3.498  10.887   3.735
   94   HD22  ASN  12          2HD2      ASN  12  -3.782  10.616   2.049
   95    H    ARG  13           H        ARG  13   0.695   8.443   1.636
   96    HA   ARG  13           HA       ARG  13  -0.074   5.745   1.423
   97    HB2  ARG  13           2HB      ARG  13   1.779   7.498  -0.142
   98    HB3  ARG  13           1HB      ARG  13   1.805   5.765  -0.425
   99    HG2  ARG  13           2HG      ARG  13   0.347   6.534  -2.037
  100    HG3  ARG  13           1HG      ARG  13  -0.741   6.004  -0.756
  101    HD2  ARG  13           2HD      ARG  13  -1.021   8.283   0.000
  102    HD3  ARG  13           1HD      ARG  13   0.164   8.849  -1.176
  103    HE   ARG  13           HE       ARG  13  -2.386   7.590  -1.985
  104   HH11  ARG  13          1HH1      ARG  13   0.003  10.146  -2.257
  105   HH12  ARG  13          2HH1      ARG  13  -0.806  10.940  -3.569
  106   HH21  ARG  13          1HH2      ARG  13  -3.464   8.639  -3.717
  107   HH22  ARG  13          2HH2      ARG  13  -2.785  10.090  -4.388
  108    H    GLY  14           H        GLY  14   2.769   7.302   2.690
  109    HA2  GLY  14           2HA      GLY  14   3.751   4.746   3.662
  110    HA3  GLY  14           1HA      GLY  14   4.809   5.602   2.549
  111    H    LYS  15           H        LYS  15   3.659   5.354   5.748
  112    HA   LYS  15           HA       LYS  15   5.446   7.580   6.498
  113    HB2  LYS  15           2HB      LYS  15   4.011   8.153   8.359
  114    HB3  LYS  15           1HB      LYS  15   3.095   8.219   6.863
  115    HG2  LYS  15           2HG      LYS  15   2.119   6.027   7.379
  116    HG3  LYS  15           1HG      LYS  15   3.020   6.001   8.897
  117    HD2  LYS  15           2HD      LYS  15   0.936   8.030   8.095
  118    HD3  LYS  15           1HD      LYS  15   0.726   6.731   9.269
  119    HE2  LYS  15           2HE      LYS  15   2.815   8.880   9.541
  120    HE3  LYS  15           1HE      LYS  15   1.196   9.023  10.223
  121    HZ1  LYS  15           3HZ      LYS  15   1.586   7.159  11.621
  122    HZ2  LYS  15           1HZ      LYS  15   2.908   8.201  11.801
  123    HZ3  LYS  15           2HZ      LYS  15   3.055   6.797  10.860
  124    H    HIS  16           H        HIS  16   5.051   4.367   6.517
  125    HA   HIS  16           HA       HIS  16   7.102   3.995   8.495
  126    HB2  HIS  16           2HB      HIS  16   4.792   3.950   9.719
  127    HB3  HIS  16           1HB      HIS  16   4.588   2.384   8.938
  128    HD1  HIS  16           1HD      HIS  16   4.593   1.317  11.361
  129    HD2  HIS  16           2HD      HIS  16   8.153   3.151  10.234
  130    HE1  HIS  16           1HE      HIS  16   6.321   0.505  12.992
  131    HE2  HIS  16           2HE      HIS  16   8.429   1.757  12.399
  132    H    LEU  17           H        LEU  17   5.879   1.040   8.481
  133    HA   LEU  17           HA       LEU  17   7.391   0.143   6.235
  134    HB2  LEU  17           2HB      LEU  17   6.138  -1.028   8.512
  135    HB3  LEU  17           1HB      LEU  17   5.621  -1.883   7.069
  136    HG   LEU  17           HG       LEU  17   7.585  -2.909   8.044
  137   HD11  LEU  17          1HD1      LEU  17   7.167  -2.858   5.574
  138   HD12  LEU  17          2HD1      LEU  17   8.843  -3.142   6.045
  139   HD13  LEU  17          3HD1      LEU  17   8.340  -1.547   5.480
  140   HD21  LEU  17          3HD2      LEU  17   8.571  -0.933   9.086
  141   HD22  LEU  17          1HD2      LEU  17   8.957  -0.291   7.488
  142   HD23  LEU  17          2HD2      LEU  17   9.736  -1.766   8.058
  143    H    ASN  18           H        ASN  18   3.950  -0.368   6.990
  144    HA   ASN  18           HA       ASN  18   2.072   0.006   5.847
  145    HB2  ASN  18           2HB      ASN  18   3.913   1.672   4.147
  146    HB3  ASN  18           1HB      ASN  18   2.178   1.584   3.844
  147   HD21  ASN  18          1HD2      ASN  18   1.773   1.240   6.818
  148   HD22  ASN  18          2HD2      ASN  18   1.909   2.842   7.452
  149    H    SER  19           H        SER  19   4.717  -1.520   4.289
  150    HA   SER  19           HA       SER  19   3.307  -2.400   1.990
  151    HB2  SER  19           2HB      SER  19   5.793  -3.462   3.339
  152    HB3  SER  19           1HB      SER  19   5.170  -4.067   1.805
  153    HG   SER  19           HG       SER  19   6.663  -1.879   2.271
  154    H    MET  20           H        MET  20   2.662  -3.071   5.119
  155    HA   MET  20           HA       MET  20   1.642  -5.744   4.492
  156    HB2  MET  20           2HB      MET  20   0.801  -5.057   7.053
  157    HB3  MET  20           1HB      MET  20   2.129  -6.134   6.660
  158    HG2  MET  20           2HG      MET  20   3.666  -4.212   6.745
  159    HG3  MET  20           1HG      MET  20   2.312  -3.169   7.191
  160    HE1  MET  20           3HE      MET  20   4.465  -3.565  10.507
  161    HE2  MET  20           1HE      MET  20   3.808  -2.410   9.346
  162    HE3  MET  20           2HE      MET  20   5.078  -3.532   8.854
  163    H    GLU  21           H        GLU  21   0.911  -2.562   4.393
  164    HA   GLU  21           HA       GLU  21  -1.983  -2.901   4.518
  165    HB2  GLU  21           2HB      GLU  21  -0.262  -0.467   3.971
  166    HB3  GLU  21           1HB      GLU  21  -2.020  -0.452   4.127
  167    HG2  GLU  21           2HG      GLU  21   0.033  -1.059   6.228
  168    HG3  GLU  21           1HG      GLU  21  -1.059   0.331   6.127
  169    H    ARG  22           H        ARG  22   0.611  -1.952   2.316
  170    HA   ARG  22           HA       ARG  22  -0.752  -1.330   0.016
  171    HB2  ARG  22           2HB      ARG  22   1.882  -2.699   0.447
  172    HB3  ARG  22           1HB      ARG  22   1.236  -2.500  -1.165
  173    HG2  ARG  22           2HG      ARG  22   2.439  -0.586  -1.085
  174    HG3  ARG  22           1HG      ARG  22   0.987   0.020  -0.288
  175    HD2  ARG  22           2HD      ARG  22   2.072  -0.741   1.874
  176    HD3  ARG  22           1HD      ARG  22   3.558  -0.888   0.949
  177    HE   ARG  22           HE       ARG  22   2.150   1.593   1.619
  178   HH11  ARG  22          1HH1      ARG  22   4.932  -0.032   0.246
  179   HH12  ARG  22          2HH1      ARG  22   5.885   1.411   0.141
  180   HH21  ARG  22          1HH2      ARG  22   3.402   3.500   1.477
  181   HH22  ARG  22          2HH2      ARG  22   5.022   3.421   0.830
  182    H    VAL  23           H        VAL  23   0.556  -4.585   0.654
  183    HA   VAL  23           HA       VAL  23  -0.538  -5.779  -1.597
  184    HB   VAL  23           HB       VAL  23  -0.145  -7.887  -0.294
  185   HG11  VAL  23          1HG1      VAL  23   2.136  -5.929  -0.103
  186   HG12  VAL  23          2HG1      VAL  23   1.654  -6.721  -1.607
  187   HG13  VAL  23          3HG1      VAL  23   2.249  -7.683  -0.251
  188   HG21  VAL  23          3HG2      VAL  23  -0.123  -7.785   1.912
  189   HG22  VAL  23          1HG2      VAL  23  -0.472  -6.063   1.732
  190   HG23  VAL  23          2HG2      VAL  23   1.208  -6.617   1.872
  191    H    GLU  24           H        GLU  24  -2.098  -4.731   1.238
  192    HA   GLU  24           HA       GLU  24  -4.323  -6.599   1.028
  193    HB2  GLU  24           2HB      GLU  24  -4.091  -4.224   2.866
  194    HB3  GLU  24           1HB      GLU  24  -5.109  -5.655   3.061
  195    HG2  GLU  24           2HG      GLU  24  -2.125  -5.626   3.091
  196    HG3  GLU  24           1HG      GLU  24  -3.145  -5.647   4.535
  197    H    TRP  25           H        TRP  25  -3.534  -3.199   0.468
  198    HA   TRP  25           HA       TRP  25  -6.210  -2.844  -0.511
  199    HB2  TRP  25           2HB      TRP  25  -5.413  -0.657  -1.400
  200    HB3  TRP  25           1HB      TRP  25  -5.559  -0.846   0.329
  201    HD1  TRP  25           HD       TRP  25  -3.401  -0.409   1.740
  202    HE1  TRP  25           1HE      TRP  25  -1.158   0.694   1.158
  203    HE3  TRP  25           3HE      TRP  25  -3.618  -0.781  -3.324
  204    HZ2  TRP  25           2HZ      TRP  25   0.323   1.342  -1.167
  205    HZ3  TRP  25           3HZ      TRP  25  -1.771   0.123  -4.675
  206    HH2  TRP  25           HH       TRP  25   0.172   1.146  -3.612
  207    H    LEU  26           H        LEU  26  -3.360  -4.074  -1.781
  208    HA   LEU  26           HA       LEU  26  -3.642  -3.398  -4.432
  209    HB2  LEU  26           2HB      LEU  26  -2.702  -6.090  -3.397
  210    HB3  LEU  26           1HB      LEU  26  -2.390  -5.451  -4.994
  211    HG   LEU  26           HG       LEU  26  -1.116  -4.800  -2.406
  212   HD11  LEU  26          1HD1      LEU  26  -0.093  -4.942  -5.240
  213   HD12  LEU  26          2HD1      LEU  26   0.012  -6.225  -4.034
  214   HD13  LEU  26          3HD1      LEU  26   0.886  -4.713  -3.791
  215   HD21  LEU  26          3HD2      LEU  26  -0.403  -2.632  -3.198
  216   HD22  LEU  26          1HD2      LEU  26  -2.166  -2.758  -3.035
  217   HD23  LEU  26          2HD2      LEU  26  -1.406  -2.823  -4.643
  218    H    ARG  27           H        ARG  27  -5.808  -5.098  -2.604
  219    HA   ARG  27           HA       ARG  27  -7.044  -6.353  -4.946
  220    HB2  ARG  27           2HB      ARG  27  -7.632  -6.804  -2.026
  221    HB3  ARG  27           1HB      ARG  27  -8.230  -7.745  -3.388
  222    HG2  ARG  27           2HG      ARG  27  -6.527  -9.096  -2.730
  223    HG3  ARG  27           1HG      ARG  27  -5.657  -8.046  -3.856
  224    HD2  ARG  27           2HD      ARG  27  -4.544  -8.488  -1.611
  225    HD3  ARG  27           1HD      ARG  27  -4.677  -6.774  -2.082
  226    HE   ARG  27           HE       ARG  27  -6.457  -6.549  -0.536
  227   HH11  ARG  27          1HH1      ARG  27  -4.793  -9.631  -0.274
  228   HH12  ARG  27          2HH1      ARG  27  -5.352  -9.922   1.348
  229   HH21  ARG  27          1HH2      ARG  27  -7.169  -6.938   1.599
  230   HH22  ARG  27          2HH2      ARG  27  -6.702  -8.407   2.403
  231    H    LYS  28           H        LYS  28  -7.683  -4.180  -2.208
  232    HA   LYS  28           HA       LYS  28 -10.408  -3.795  -3.023
  233    HB2  LYS  28           2HB      LYS  28 -10.632  -2.371  -1.111
  234    HB3  LYS  28           1HB      LYS  28  -9.761  -3.830  -0.653
  235    HG2  LYS  28           2HG      LYS  28  -7.666  -2.636  -0.785
  236    HG3  LYS  28           1HG      LYS  28  -8.533  -1.193  -1.296
  237    HD2  LYS  28           2HD      LYS  28  -9.794  -1.290   0.861
  238    HD3  LYS  28           1HD      LYS  28  -8.697  -2.584   1.362
  239    HE2  LYS  28           2HE      LYS  28  -6.802  -1.073   0.969
  240    HE3  LYS  28           1HE      LYS  28  -7.937   0.216   0.578
  241    HZ1  LYS  28           3HZ      LYS  28  -7.240   0.446   2.842
  242    HZ2  LYS  28           1HZ      LYS  28  -7.637  -1.162   3.195
  243    HZ3  LYS  28           2HZ      LYS  28  -8.863  -0.046   2.847
  244    H    LYS  29           H        LYS  29  -7.408  -2.211  -3.649
  245    HA   LYS  29           HA       LYS  29  -8.847   0.043  -4.823
  246    HB2  LYS  29           2HB      LYS  29  -5.858  -0.393  -4.542
  247    HB3  LYS  29           1HB      LYS  29  -6.638   1.089  -5.072
  248    HG2  LYS  29           2HG      LYS  29  -6.963  -0.126  -2.335
  249    HG3  LYS  29           1HG      LYS  29  -5.813   1.150  -2.745
  250    HD2  LYS  29           2HD      LYS  29  -7.449   2.575  -2.203
  251    HD3  LYS  29           1HD      LYS  29  -8.145   2.133  -3.761
  252    HE2  LYS  29           2HE      LYS  29  -9.516   0.439  -2.701
  253    HE3  LYS  29           1HE      LYS  29  -8.784   0.801  -1.138
  254    HZ1  LYS  29           3HZ      LYS  29 -10.385   2.702  -2.768
  255    HZ2  LYS  29           1HZ      LYS  29  -9.698   3.026  -1.251
  256    HZ3  LYS  29           2HZ      LYS  29 -10.940   1.880  -1.391
  257    H    LEU  30           H        LEU  30  -7.189  -2.842  -5.629
  258    HA   LEU  30           HA       LEU  30  -6.171  -2.452  -8.116
  259    HB2  LEU  30           2HB      LEU  30  -5.812  -4.437  -6.894
  260    HB3  LEU  30           1HB      LEU  30  -7.523  -4.753  -6.765
  261    HG   LEU  30           HG       LEU  30  -7.587  -5.239  -9.171
  262   HD11  LEU  30          1HD1      LEU  30  -4.586  -4.988  -8.979
  263   HD12  LEU  30          2HD1      LEU  30  -5.657  -3.923  -9.887
  264   HD13  LEU  30          3HD1      LEU  30  -5.478  -5.610 -10.369
  265   HD21  LEU  30          3HD2      LEU  30  -7.280  -7.357  -8.574
  266   HD22  LEU  30          1HD2      LEU  30  -6.657  -6.745  -7.035
  267   HD23  LEU  30          2HD2      LEU  30  -5.545  -7.111  -8.366
  268    H    GLN  31           H        GLN  31  -9.338  -3.772  -7.361
  269    HA   GLN  31           HA       GLN  31 -10.707  -2.274  -9.349
  270    HB2  GLN  31           2HB      GLN  31 -11.502  -4.495 -10.495
  271    HB3  GLN  31           1HB      GLN  31 -10.000  -3.741 -11.006
  272    HG2  GLN  31           2HG      GLN  31  -9.365  -5.932 -10.840
  273    HG3  GLN  31           1HG      GLN  31  -8.926  -5.331  -9.247
  274   HE21  GLN  31          1HE2      GLN  31 -10.121  -5.984  -7.439
  275   HE22  GLN  31          2HE2      GLN  31 -11.175  -7.341  -7.515
  276    H    ASP  32           H        ASP  32 -10.634  -2.943  -6.561
  277    HA   ASP  32           HA       ASP  32 -11.683  -4.355  -4.984
  278    HB2  ASP  32           2HB      ASP  32 -13.566  -2.947  -4.173
  279    HB3  ASP  32           1HB      ASP  32 -12.038  -2.107  -4.438
  280    H    VAL  33           H        VAL  33 -12.324  -6.237  -5.336
  281    HA   VAL  33           HA       VAL  33 -15.071  -6.715  -6.171
  282    HB   VAL  33           HB       VAL  33 -12.635  -8.049  -7.333
  283   HG11  VAL  33          1HG1      VAL  33 -14.277  -9.782  -6.769
  284   HG12  VAL  33          2HG1      VAL  33 -14.156  -9.571  -8.516
  285   HG13  VAL  33          3HG1      VAL  33 -15.527  -8.890  -7.638
  286   HG21  VAL  33          3HG2      VAL  33 -13.531  -7.307  -9.447
  287   HG22  VAL  33          1HG2      VAL  33 -13.375  -5.945  -8.332
  288   HG23  VAL  33          2HG2      VAL  33 -14.964  -6.658  -8.647
  289    H    HIS  34           H        HIS  34 -12.090  -8.362  -4.961
  290    HA   HIS  34           HA       HIS  34 -13.863 -10.246  -3.557
  291    HB2  HIS  34           2HB      HIS  34 -11.825 -10.976  -4.960
  292    HB3  HIS  34           1HB      HIS  34 -10.848 -10.367  -3.629
  293    HD1  HIS  34           1HD      HIS  34  -9.976 -12.463  -2.581
  294    HD2  HIS  34           2HD      HIS  34 -14.071 -12.637  -3.315
  295    HE1  HIS  34           1HE      HIS  34 -10.768 -14.616  -1.545
  296    HE2  HIS  34           2HE      HIS  34 -13.199 -14.797  -2.201
  297    H    ASN  35           H        ASN  35 -13.872  -7.620  -2.676
  298    HA   ASN  35           HA       ASN  35 -12.968  -7.649   0.007
  299    HB2  ASN  35           2HB      ASN  35 -11.307  -5.666  -0.536
  300    HB3  ASN  35           1HB      ASN  35 -10.765  -7.341  -0.638
  301   HD21  ASN  35          1HD2      ASN  35 -12.265  -4.816  -2.639
  302   HD22  ASN  35          2HD2      ASN  35 -11.372  -5.209  -4.079
  303    H    PHE  36           H        PHE  36 -15.391  -7.045  -0.610
  304    HA   PHE  36           HA       PHE  36 -15.718  -4.254  -1.271
  305    HB2  PHE  36           2HB      PHE  36 -17.612  -6.471  -0.627
  306    HB3  PHE  36           1HB      PHE  36 -18.175  -4.800  -0.658
  307    HD1  PHE  36           1HD      PHE  36 -17.264  -3.476  -2.830
  308    HD2  PHE  36           2HD      PHE  36 -17.888  -7.672  -2.536
  309    HE1  PHE  36           1HE      PHE  36 -17.507  -3.604  -5.274
  310    HE2  PHE  36           2HE      PHE  36 -18.128  -7.811  -4.981
  311    HZ   PHE  36           HZ       PHE  36 -17.849  -5.746  -6.355
  312    HA   PRO  37           HA       PRO  37 -17.099  -4.398   3.592
  313    HB2  PRO  37           2HB      PRO  37 -14.795  -5.903   4.522
  314    HB3  PRO  37           1HB      PRO  37 -16.494  -6.093   4.935
  315    HG2  PRO  37           2HG      PRO  37 -14.894  -7.623   3.089
  316    HG3  PRO  37           1HG      PRO  37 -16.559  -7.910   3.613
  317    HD2  PRO  37           2HD      PRO  37 -15.795  -7.143   1.075
  318    HD3  PRO  37           1HD      PRO  37 -17.417  -6.937   1.755
  319    HA   PRO  38           HA       PRO  38 -12.471  -2.640   4.243
  320    HB2  PRO  38           2HB      PRO  38 -11.824  -2.783   1.332
  321    HB3  PRO  38           1HB      PRO  38 -10.739  -2.816   2.729
  322    HG2  PRO  38           2HG      PRO  38 -11.343  -5.067   1.483
  323    HG3  PRO  38           1HG      PRO  38 -11.277  -5.021   3.255
  324    HD2  PRO  38           2HD      PRO  38 -13.639  -5.078   1.460
  325    HD3  PRO  38           1HD      PRO  38 -13.400  -5.831   3.044
  326    H    ASP  39           H        ASP  39 -13.536  -0.781   4.692
  327    HA   ASP  39           HA       ASP  39 -14.891   0.847   2.827
  328    HB2  ASP  39           2HB      ASP  39 -15.094   0.689   5.385
  329    HB3  ASP  39           1HB      ASP  39 -13.700   1.760   5.432
  Start of MODEL    3
    1    H2   PRO   1           1HT      PRO   1 -10.351   6.681  17.172
    2    H3   PRO   1           2HT      PRO   1 -10.577   7.227  18.694
    3    HA   PRO   1           HA       PRO   1 -11.999   5.706  19.247
    4    HB2  PRO   1           2HB      PRO   1 -12.721   5.024  16.442
    5    HB3  PRO   1           1HB      PRO   1 -13.690   4.877  17.920
    6    HG2  PRO   1           2HG      PRO   1 -13.904   7.004  16.268
    7    HG3  PRO   1           1HG      PRO   1 -14.136   7.122  18.020
    8    HD2  PRO   1           2HD      PRO   1 -11.958   8.173  16.362
    9    HD3  PRO   1           1HD      PRO   1 -12.404   8.590  18.023
   10    HA   PRO   2           HA       PRO   2  -9.644   2.332  20.042
   11    HB2  PRO   2           2HB      PRO   2 -11.030   0.694  17.972
   12    HB3  PRO   2           1HB      PRO   2 -10.650   0.302  19.651
   13    HG2  PRO   2           2HG      PRO   2 -13.096   1.326  18.673
   14    HG3  PRO   2           1HG      PRO   2 -12.614   1.161  20.369
   15    HD2  PRO   2           2HD      PRO   2 -13.082   3.578  19.050
   16    HD3  PRO   2           1HD      PRO   2 -12.177   3.390  20.566
   17    H    SER   3           H        SER   3 -10.120   1.265  16.709
   18    HA   SER   3           HA       SER   3  -7.345   2.077  16.154
   19    HB2  SER   3           2HB      SER   3  -7.763  -0.445  16.634
   20    HB3  SER   3           1HB      SER   3  -8.524  -0.464  15.041
   21    HG   SER   3           HG       SER   3  -5.845  -0.049  15.748
   22    H    VAL   4           H        VAL   4 -10.533   2.353  15.338
   23    HA   VAL   4           HA       VAL   4 -10.342   2.309  12.511
   24    HB   VAL   4           HB       VAL   4 -12.447   1.884  13.657
   25   HG11  VAL   4          1HG1      VAL   4 -13.753   3.712  14.620
   26   HG12  VAL   4          2HG1      VAL   4 -12.378   4.794  14.405
   27   HG13  VAL   4          3HG1      VAL   4 -12.258   3.423  15.507
   28   HG21  VAL   4          3HG2      VAL   4 -13.901   3.260  12.231
   29   HG22  VAL   4          1HG2      VAL   4 -12.522   2.609  11.347
   30   HG23  VAL   4          2HG2      VAL   4 -12.527   4.298  11.854
   31    H    SER   5           H        SER   5 -10.183   4.974  14.934
   32    HA   SER   5           HA       SER   5 -10.123   6.999  12.916
   33    HB2  SER   5           2HB      SER   5  -9.194   8.435  14.728
   34    HB3  SER   5           1HB      SER   5 -10.720   7.646  15.134
   35    HG   SER   5           HG       SER   5  -8.107   6.807  15.927
   36    H    GLU   6           H        GLU   6  -7.748   4.809  14.042
   37    HA   GLU   6           HA       GLU   6  -5.453   6.383  13.706
   38    HB2  GLU   6           2HB      GLU   6  -5.617   3.390  13.378
   39    HB3  GLU   6           1HB      GLU   6  -4.206   4.336  13.835
   40    HG2  GLU   6           2HG      GLU   6  -6.688   3.838  15.454
   41    HG3  GLU   6           1HG      GLU   6  -5.048   3.289  15.793
   42    H    ILE   7           H        ILE   7  -7.606   5.212  11.436
   43    HA   ILE   7           HA       ILE   7  -5.687   5.061   9.268
   44    HB   ILE   7           HB       ILE   7  -8.662   4.639   9.418
   45   HG12  ILE   7          2HG1      ILE   7  -8.080   2.426   8.476
   46   HG13  ILE   7          1HG1      ILE   7  -6.379   2.879   8.485
   47   HG21  ILE   7          1HG2      ILE   7  -8.302   5.900   7.382
   48   HG22  ILE   7          2HG2      ILE   7  -8.687   4.222   7.000
   49   HG23  ILE   7          3HG2      ILE   7  -7.023   4.793   6.893
   50   HD11  ILE   7          3HD1      ILE   7  -8.154   2.563  10.894
   51   HD12  ILE   7          1HD1      ILE   7  -6.460   3.059  10.921
   52   HD13  ILE   7          2HD1      ILE   7  -6.898   1.446  10.353
   53    H    GLN   8           H        GLN   8  -8.278   7.220  10.424
   54    HA   GLN   8           HA       GLN   8  -7.891   8.943   8.097
   55    HB2  GLN   8           2HB      GLN   8  -9.823   9.203  10.410
   56    HB3  GLN   8           1HB      GLN   8  -9.752  10.290   9.033
   57    HG2  GLN   8           2HG      GLN   8 -11.524   8.864   8.566
   58    HG3  GLN   8           1HG      GLN   8 -10.192   8.233   7.600
   59   HE21  GLN   8          1HE2      GLN   8 -10.538   7.859  11.059
   60   HE22  GLN   8          2HE2      GLN   8 -10.749   6.139  11.035
   61    H    LEU   9           H        LEU   9  -7.437   8.974  11.598
   62    HA   LEU   9           HA       LEU   9  -6.569  11.708  11.641
   63    HB2  LEU   9           2HB      LEU   9  -5.977   9.632  13.746
   64    HB3  LEU   9           1HB      LEU   9  -6.045  11.369  13.946
   65    HG   LEU   9           HG       LEU   9  -8.297   9.414  13.697
   66   HD11  LEU   9          1HD1      LEU   9  -7.482   9.917  15.909
   67   HD12  LEU   9          2HD1      LEU   9  -9.095  10.595  15.683
   68   HD13  LEU   9          3HD1      LEU   9  -7.680  11.646  15.617
   69   HD21  LEU   9          3HD2      LEU   9  -9.780  11.505  13.659
   70   HD22  LEU   9          1HD2      LEU   9  -9.057  10.963  12.141
   71   HD23  LEU   9          2HD2      LEU   9  -8.359  12.331  13.016
   72    H    MET  10           H        MET  10  -5.047   8.631  11.123
   73    HA   MET  10           HA       MET  10  -2.437   9.981  11.072
   74    HB2  MET  10           2HB      MET  10  -3.028   7.151  11.936
   75    HB3  MET  10           1HB      MET  10  -1.418   7.836  11.760
   76    HG2  MET  10           2HG      MET  10  -2.012   9.529  13.460
   77    HG3  MET  10           1HG      MET  10  -3.545   8.693  13.702
   78    HE1  MET  10           3HE      MET  10  -3.155   8.373  16.269
   79    HE2  MET  10           1HE      MET  10  -1.653   9.286  16.123
   80    HE3  MET  10           2HE      MET  10  -1.660   7.737  16.965
   81    H    HIS  11           H        HIS  11  -2.757  10.357   8.794
   82    HA   HIS  11           HA       HIS  11  -2.584   7.962   7.114
   83    HB2  HIS  11           2HB      HIS  11  -2.850  10.895   6.486
   84    HB3  HIS  11           1HB      HIS  11  -2.361   9.746   5.248
   85    HD1  HIS  11           1HD      HIS  11  -4.127   7.947   4.552
   86    HD2  HIS  11           2HD      HIS  11  -5.548  10.896   7.110
   87    HE1  HIS  11           1HE      HIS  11  -6.633   7.791   4.440
   88    HE2  HIS  11           2HE      HIS  11  -7.475   9.685   5.876
   89    H    ASN  12           H        ASN  12  -0.627   9.950   8.885
   90    HA   ASN  12           HA       ASN  12   1.800   9.672   7.397
   91    HB2  ASN  12           2HB      ASN  12   2.854  10.312   9.584
   92    HB3  ASN  12           1HB      ASN  12   1.612  11.431   9.035
   93   HD21  ASN  12          1HD2      ASN  12   1.270  12.224  11.094
   94   HD22  ASN  12          2HD2      ASN  12   0.440  11.316  12.316
   95    H    ARG  13           H        ARG  13   0.469   7.301   7.392
   96    HA   ARG  13           HA       ARG  13   0.644   5.475   9.403
   97    HB2  ARG  13           2HB      ARG  13   0.908   5.031   6.429
   98    HB3  ARG  13           1HB      ARG  13   0.546   3.765   7.597
   99    HG2  ARG  13           2HG      ARG  13  -1.162   6.209   7.196
  100    HG3  ARG  13           1HG      ARG  13  -1.418   4.683   6.350
  101    HD2  ARG  13           2HD      ARG  13  -1.442   5.059   9.344
  102    HD3  ARG  13           1HD      ARG  13  -2.868   4.905   8.316
  103    HE   ARG  13           HE       ARG  13  -1.540   2.667   7.702
  104   HH11  ARG  13          1HH1      ARG  13  -2.268   4.114  10.809
  105   HH12  ARG  13          2HH1      ARG  13  -2.363   2.597  11.649
  106   HH21  ARG  13          1HH2      ARG  13  -1.713   0.667   8.787
  107   HH22  ARG  13          2HH2      ARG  13  -2.021   0.628  10.501
  108    H    GLY  14           H        GLY  14   3.043   5.797   6.769
  109    HA2  GLY  14           2HA      GLY  14   5.209   5.311   8.572
  110    HA3  GLY  14           1HA      GLY  14   4.847   3.901   7.586
  111    H    LYS  15           H        LYS  15   4.238   4.930   5.184
  112    HA   LYS  15           HA       LYS  15   4.991   5.914   3.274
  113    HB2  LYS  15           2HB      LYS  15   6.866   7.447   5.073
  114    HB3  LYS  15           1HB      LYS  15   6.701   7.712   3.346
  115    HG2  LYS  15           2HG      LYS  15   4.381   8.375   3.651
  116    HG3  LYS  15           1HG      LYS  15   4.512   8.067   5.384
  117    HD2  LYS  15           2HD      LYS  15   4.740  10.447   4.913
  118    HD3  LYS  15           1HD      LYS  15   6.255   9.795   5.544
  119    HE2  LYS  15           2HE      LYS  15   7.087   9.594   3.224
  120    HE3  LYS  15           1HE      LYS  15   5.602  10.353   2.652
  121    HZ1  LYS  15           3HZ      LYS  15   6.180  12.316   4.004
  122    HZ2  LYS  15           1HZ      LYS  15   7.324  11.990   2.794
  123    HZ3  LYS  15           2HZ      LYS  15   7.661  11.589   4.408
  124    H    HIS  16           H        HIS  16   7.449   4.855   5.541
  125    HA   HIS  16           HA       HIS  16   9.633   4.427   3.941
  126    HB2  HIS  16           2HB      HIS  16   9.504   4.098   6.418
  127    HB3  HIS  16           1HB      HIS  16   8.656   2.571   6.131
  128    HD1  HIS  16           1HD      HIS  16  12.037   4.205   5.600
  129    HD2  HIS  16           2HD      HIS  16  10.310   0.421   5.648
  130    HE1  HIS  16           1HE      HIS  16  13.954   2.579   5.491
  131    HE2  HIS  16           2HE      HIS  16  12.898   0.309   5.754
  132    H    LEU  17           H        LEU  17   7.912   1.586   5.008
  133    HA   LEU  17           HA       LEU  17   7.341   0.687   2.337
  134    HB2  LEU  17           2HB      LEU  17   9.559  -0.120   2.421
  135    HB3  LEU  17           1HB      LEU  17   9.408  -0.638   4.091
  136    HG   LEU  17           HG       LEU  17   7.710  -2.333   3.222
  137   HD11  LEU  17          1HD1      LEU  17   7.645  -1.009   1.004
  138   HD12  LEU  17          2HD1      LEU  17   7.538  -2.766   0.967
  139   HD13  LEU  17          3HD1      LEU  17   9.064  -1.967   0.587
  140   HD21  LEU  17          3HD2      LEU  17   9.462  -3.899   2.560
  141   HD22  LEU  17          1HD2      LEU  17   9.968  -2.930   3.943
  142   HD23  LEU  17          2HD2      LEU  17  10.584  -2.557   2.334
  143    H    ASN  18           H        ASN  18   5.239   0.910   3.173
  144    HA   ASN  18           HA       ASN  18   4.551  -0.694   5.499
  145    HB2  ASN  18           2HB      ASN  18   2.874   1.169   3.820
  146    HB3  ASN  18           1HB      ASN  18   2.349   0.391   5.304
  147   HD21  ASN  18          1HD2      ASN  18   5.169   0.814   6.356
  148   HD22  ASN  18          2HD2      ASN  18   5.134   2.446   6.895
  149    H    SER  19           H        SER  19   5.344  -2.424   3.882
  150    HA   SER  19           HA       SER  19   3.764  -3.164   1.682
  151    HB2  SER  19           2HB      SER  19   5.022  -5.380   2.005
  152    HB3  SER  19           1HB      SER  19   5.995  -3.928   1.735
  153    HG   SER  19           HG       SER  19   5.565  -5.375   4.126
  154    H    MET  20           H        MET  20   2.934  -3.246   4.891
  155    HA   MET  20           HA       MET  20   1.480  -5.741   4.763
  156    HB2  MET  20           2HB      MET  20   0.856  -5.051   7.117
  157    HB3  MET  20           1HB      MET  20   2.547  -5.417   6.860
  158    HG2  MET  20           2HG      MET  20   3.054  -3.051   6.773
  159    HG3  MET  20           1HG      MET  20   1.341  -2.670   6.910
  160    HE1  MET  20           3HE      MET  20   3.620  -1.419   8.783
  161    HE2  MET  20           1HE      MET  20   2.836  -1.504  10.361
  162    HE3  MET  20           2HE      MET  20   1.912  -1.011   8.943
  163    H    GLU  21           H        GLU  21   1.090  -2.328   4.707
  164    HA   GLU  21           HA       GLU  21  -1.746  -2.239   4.650
  165    HB2  GLU  21           2HB      GLU  21   0.239  -0.361   3.338
  166    HB3  GLU  21           1HB      GLU  21  -1.444  -0.006   3.736
  167    HG2  GLU  21           2HG      GLU  21  -0.789  -0.419   6.146
  168    HG3  GLU  21           1HG      GLU  21   0.901  -0.345   5.582
  169    H    ARG  22           H        ARG  22   0.768  -2.088   2.261
  170    HA   ARG  22           HA       ARG  22  -0.583  -1.545  -0.051
  171    HB2  ARG  22           2HB      ARG  22   1.706  -3.493   0.135
  172    HB3  ARG  22           1HB      ARG  22   1.283  -2.445  -1.182
  173    HG2  ARG  22           2HG      ARG  22   2.390  -1.621   1.488
  174    HG3  ARG  22           1HG      ARG  22   3.245  -1.603  -0.051
  175    HD2  ARG  22           2HD      ARG  22   2.390   0.374  -0.616
  176    HD3  ARG  22           1HD      ARG  22   0.769  -0.103  -0.118
  177    HE   ARG  22           HE       ARG  22   1.805   0.367   2.247
  178   HH11  ARG  22          1HH1      ARG  22   2.448   2.164  -0.679
  179   HH12  ARG  22          2HH1      ARG  22   2.426   3.713   0.108
  180   HH21  ARG  22          1HH2      ARG  22   1.789   2.419   3.312
  181   HH22  ARG  22          2HH2      ARG  22   2.118   3.855   2.377
  182    H    VAL  23           H        VAL  23   0.504  -4.822   0.792
  183    HA   VAL  23           HA       VAL  23  -0.495  -6.023  -1.493
  184    HB   VAL  23           HB       VAL  23  -0.238  -8.113  -0.123
  185   HG11  VAL  23          1HG1      VAL  23   2.072  -6.210   0.193
  186   HG12  VAL  23          2HG1      VAL  23   1.676  -6.999  -1.336
  187   HG13  VAL  23          3HG1      VAL  23   2.152  -7.968   0.062
  188   HG21  VAL  23          3HG2      VAL  23  -0.523  -7.868   2.053
  189   HG22  VAL  23          1HG2      VAL  23  -0.543  -6.119   1.792
  190   HG23  VAL  23          2HG2      VAL  23   0.995  -6.952   2.112
  191    H    GLU  24           H        GLU  24  -2.195  -4.999   1.325
  192    HA   GLU  24           HA       GLU  24  -4.408  -6.832   0.892
  193    HB2  GLU  24           2HB      GLU  24  -4.446  -4.442   2.722
  194    HB3  GLU  24           1HB      GLU  24  -5.351  -5.953   2.867
  195    HG2  GLU  24           2HG      GLU  24  -3.048  -7.043   3.163
  196    HG3  GLU  24           1HG      GLU  24  -2.487  -5.394   3.449
  197    H    TRP  25           H        TRP  25  -3.725  -3.328   0.658
  198    HA   TRP  25           HA       TRP  25  -6.331  -2.912  -0.391
  199    HB2  TRP  25           2HB      TRP  25  -5.544  -0.676  -1.090
  200    HB3  TRP  25           1HB      TRP  25  -5.613  -1.010   0.620
  201    HD1  TRP  25           HD       TRP  25  -3.435  -0.639   1.945
  202    HE1  TRP  25           1HE      TRP  25  -1.192   0.445   1.374
  203    HE3  TRP  25           3HE      TRP  25  -3.788  -0.754  -3.089
  204    HZ2  TRP  25           2HZ      TRP  25   0.245   1.174  -0.964
  205    HZ3  TRP  25           3HZ      TRP  25  -1.970   0.160  -4.457
  206    HH2  TRP  25           HH       TRP  25   0.024   1.095  -3.407
  207    H    LEU  26           H        LEU  26  -3.374  -3.887  -1.809
  208    HA   LEU  26           HA       LEU  26  -3.583  -3.086  -4.351
  209    HB2  LEU  26           2HB      LEU  26  -3.109  -5.957  -3.614
  210    HB3  LEU  26           1HB      LEU  26  -2.595  -5.168  -5.080
  211    HG   LEU  26           HG       LEU  26  -1.462  -4.954  -2.336
  212   HD11  LEU  26          1HD1      LEU  26  -0.255  -5.288  -5.078
  213   HD12  LEU  26          2HD1      LEU  26  -0.477  -6.555  -3.873
  214   HD13  LEU  26          3HD1      LEU  26   0.645  -5.229  -3.564
  215   HD21  LEU  26          3HD2      LEU  26  -0.218  -2.975  -3.041
  216   HD22  LEU  26          1HD2      LEU  26  -1.965  -2.724  -2.942
  217   HD23  LEU  26          2HD2      LEU  26  -1.182  -2.912  -4.523
  218    H    ARG  27           H        ARG  27  -5.743  -5.147  -2.696
  219    HA   ARG  27           HA       ARG  27  -6.935  -6.040  -5.199
  220    HB2  ARG  27           2HB      ARG  27  -7.434  -7.054  -2.410
  221    HB3  ARG  27           1HB      ARG  27  -7.945  -7.807  -3.918
  222    HG2  ARG  27           2HG      ARG  27  -6.085  -9.049  -3.489
  223    HG3  ARG  27           1HG      ARG  27  -5.359  -7.738  -4.424
  224    HD2  ARG  27           2HD      ARG  27  -4.149  -8.404  -2.294
  225    HD3  ARG  27           1HD      ARG  27  -4.493  -6.675  -2.441
  226    HE   ARG  27           HE       ARG  27  -6.237  -6.952  -0.865
  227   HH11  ARG  27          1HH1      ARG  27  -4.195  -9.767  -1.287
  228   HH12  ARG  27          2HH1      ARG  27  -4.674 -10.509   0.213
  229   HH21  ARG  27          1HH2      ARG  27  -6.881  -7.928   1.123
  230   HH22  ARG  27          2HH2      ARG  27  -6.171  -9.448   1.599
  231    H    LYS  28           H        LYS  28  -7.680  -4.229  -2.270
  232    HA   LYS  28           HA       LYS  28 -10.447  -3.926  -3.084
  233    HB2  LYS  28           2HB      LYS  28 -10.771  -2.769  -1.033
  234    HB3  LYS  28           1HB      LYS  28  -9.754  -4.169  -0.693
  235    HG2  LYS  28           2HG      LYS  28  -7.787  -2.786  -0.721
  236    HG3  LYS  28           1HG      LYS  28  -8.763  -1.393  -1.165
  237    HD2  LYS  28           2HD      LYS  28 -10.014  -1.714   0.989
  238    HD3  LYS  28           1HD      LYS  28  -8.788  -2.916   1.417
  239    HE2  LYS  28           2HE      LYS  28  -7.051  -1.232   1.114
  240    HE3  LYS  28           1HE      LYS  28  -8.280  -0.032   0.727
  241    HZ1  LYS  28           3HZ      LYS  28  -9.221  -0.444   2.980
  242    HZ2  LYS  28           1HZ      LYS  28  -7.662   0.221   3.002
  243    HZ3  LYS  28           2HZ      LYS  28  -7.879  -1.428   3.321
  244    H    LYS  29           H        LYS  29  -7.626  -2.572  -4.057
  245    HA   LYS  29           HA       LYS  29  -8.923   0.010  -4.586
  246    HB2  LYS  29           2HB      LYS  29  -5.984  -0.618  -4.296
  247    HB3  LYS  29           1HB      LYS  29  -6.604   0.932  -4.839
  248    HG2  LYS  29           2HG      LYS  29  -7.074  -0.323  -2.127
  249    HG3  LYS  29           1HG      LYS  29  -5.989   1.018  -2.497
  250    HD2  LYS  29           2HD      LYS  29  -8.985   1.038  -2.844
  251    HD3  LYS  29           1HD      LYS  29  -8.093   1.806  -1.532
  252    HE2  LYS  29           2HE      LYS  29  -6.944   3.239  -3.148
  253    HE3  LYS  29           1HE      LYS  29  -7.836   2.473  -4.462
  254    HZ1  LYS  29           3HZ      LYS  29  -9.902   3.266  -3.381
  255    HZ2  LYS  29           1HZ      LYS  29  -8.891   4.518  -3.914
  256    HZ3  LYS  29           2HZ      LYS  29  -8.958   4.128  -2.267
  257    H    LEU  30           H        LEU  30  -7.306  -2.723  -6.080
  258    HA   LEU  30           HA       LEU  30  -6.596  -1.389  -8.452
  259    HB2  LEU  30           2HB      LEU  30  -5.613  -3.312  -9.076
  260    HB3  LEU  30           1HB      LEU  30  -5.850  -3.720  -7.394
  261    HG   LEU  30           HG       LEU  30  -8.192  -4.589  -8.622
  262   HD11  LEU  30          1HD1      LEU  30  -7.202  -4.249 -10.814
  263   HD12  LEU  30          2HD1      LEU  30  -7.410  -5.969 -10.489
  264   HD13  LEU  30          3HD1      LEU  30  -5.812  -5.232 -10.359
  265   HD21  LEU  30          3HD2      LEU  30  -7.197  -6.861  -8.280
  266   HD22  LEU  30          1HD2      LEU  30  -7.122  -5.812  -6.859
  267   HD23  LEU  30          2HD2      LEU  30  -5.682  -6.069  -7.849
  268    H    GLN  31           H        GLN  31  -9.358  -3.199  -7.418
  269    HA   GLN  31           HA       GLN  31 -11.039  -1.907  -9.326
  270    HB2  GLN  31           2HB      GLN  31 -12.031  -4.184 -10.069
  271    HB3  GLN  31           1HB      GLN  31 -10.604  -3.566 -10.880
  272    HG2  GLN  31           2HG      GLN  31 -10.283  -5.881 -10.527
  273    HG3  GLN  31           1HG      GLN  31  -9.223  -5.025  -9.414
  274   HE21  GLN  31          1HE2      GLN  31  -9.615  -5.145  -7.208
  275   HE22  GLN  31          2HE2      GLN  31 -10.710  -6.275  -6.531
  276    H    ASP  32           H        ASP  32 -10.521  -2.317  -6.479
  277    HA   ASP  32           HA       ASP  32 -11.220  -3.244  -4.544
  278    HB2  ASP  32           2HB      ASP  32 -13.352  -2.388  -3.784
  279    HB3  ASP  32           1HB      ASP  32 -12.434  -1.167  -4.641
  280    H    VAL  33           H        VAL  33 -11.475  -5.134  -3.842
  281    HA   VAL  33           HA       VAL  33 -12.548  -7.142  -5.559
  282    HB   VAL  33           HB       VAL  33 -10.515  -7.575  -4.375
  283   HG11  VAL  33          1HG1      VAL  33 -10.772  -6.215  -2.449
  284   HG12  VAL  33          2HG1      VAL  33 -10.478  -7.875  -1.919
  285   HG13  VAL  33          3HG1      VAL  33 -12.109  -7.203  -1.858
  286   HG21  VAL  33          3HG2      VAL  33 -11.024  -9.743  -3.326
  287   HG22  VAL  33          1HG2      VAL  33 -11.858  -9.522  -4.866
  288   HG23  VAL  33          2HG2      VAL  33 -12.740  -9.330  -3.350
  289    H    HIS  34           H        HIS  34 -14.599  -5.734  -5.222
  290    HA   HIS  34           HA       HIS  34 -16.411  -7.365  -3.573
  291    HB2  HIS  34           2HB      HIS  34 -16.585  -5.046  -2.915
  292    HB3  HIS  34           1HB      HIS  34 -16.661  -4.523  -4.591
  293    HD1  HIS  34           1HD      HIS  34 -18.747  -6.509  -2.103
  294    HD2  HIS  34           2HD      HIS  34 -19.190  -4.169  -5.514
  295    HE1  HIS  34           1HE      HIS  34 -21.223  -6.207  -2.405
  296    HE2  HIS  34           2HE      HIS  34 -21.455  -4.638  -4.363
  297    H    ASN  35           H        ASN  35 -15.268  -6.499  -6.583
  298    HA   ASN  35           HA       ASN  35 -17.419  -7.978  -7.933
  299    HB2  ASN  35           2HB      ASN  35 -16.565  -6.759 -10.028
  300    HB3  ASN  35           1HB      ASN  35 -17.514  -5.825  -8.882
  301   HD21  ASN  35          1HD2      ASN  35 -14.086  -6.694  -8.551
  302   HD22  ASN  35          2HD2      ASN  35 -13.513  -5.064  -8.572
  303    H    PHE  36           H        PHE  36 -16.817  -9.588  -9.362
  304    HA   PHE  36           HA       PHE  36 -14.028 -10.438  -9.049
  305    HB2  PHE  36           2HB      PHE  36 -16.536 -12.010  -9.541
  306    HB3  PHE  36           1HB      PHE  36 -14.928 -12.717  -9.705
  307    HD1  PHE  36           1HD      PHE  36 -13.381 -12.618  -7.718
  308    HD2  PHE  36           2HD      PHE  36 -17.551 -11.819  -7.447
  309    HE1  PHE  36           1HE      PHE  36 -13.284 -12.977  -5.291
  310    HE2  PHE  36           2HE      PHE  36 -17.464 -12.180  -5.012
  311    HZ   PHE  36           HZ       PHE  36 -15.323 -12.749  -3.941
  312    HA   PRO  37           HA       PRO  37 -14.561 -10.402 -13.703
  313    HB2  PRO  37           2HB      PRO  37 -16.921 -10.550 -14.927
  314    HB3  PRO  37           1HB      PRO  37 -16.195 -11.964 -14.166
  315    HG2  PRO  37           2HG      PRO  37 -18.475 -10.318 -13.269
  316    HG3  PRO  37           1HG      PRO  37 -18.127 -12.027 -12.963
  317    HD2  PRO  37           2HD      PRO  37 -17.600  -9.793 -11.261
  318    HD3  PRO  37           1HD      PRO  37 -17.212 -11.493 -10.972
  319    HA   PRO  38           HA       PRO  38 -15.759  -5.965 -13.464
  320    HB2  PRO  38           2HB      PRO  38 -13.050  -5.162 -13.736
  321    HB3  PRO  38           1HB      PRO  38 -14.021  -5.151 -12.264
  322    HG2  PRO  38           2HG      PRO  38 -11.823  -6.785 -12.726
  323    HG3  PRO  38           1HG      PRO  38 -13.065  -7.059 -11.494
  324    HD2  PRO  38           2HD      PRO  38 -12.792  -8.276 -14.196
  325    HD3  PRO  38           1HD      PRO  38 -13.317  -9.008 -12.666
  326    H    ASP  39           H        ASP  39 -16.198  -7.325 -15.748
  327    HA   ASP  39           HA       ASP  39 -14.528  -6.229 -17.857
  328    HB2  ASP  39           2HB      ASP  39 -15.033  -8.577 -17.970
  329    HB3  ASP  39           1HB      ASP  39 -16.752  -8.254 -17.785
  Start of MODEL    4
    1    H2   PRO   1           1HT      PRO   1  -5.625  17.013  -5.392
    2    H3   PRO   1           2HT      PRO   1  -6.791  18.077  -5.820
    3    HA   PRO   1           HA       PRO   1  -8.051  17.614  -4.175
    4    HB2  PRO   1           2HB      PRO   1  -7.893  14.879  -3.588
    5    HB3  PRO   1           1HB      PRO   1  -9.169  15.691  -4.509
    6    HG2  PRO   1           2HG      PRO   1  -6.740  14.264  -5.484
    7    HG3  PRO   1           1HG      PRO   1  -8.364  14.332  -6.195
    8    HD2  PRO   1           2HD      PRO   1  -6.377  15.746  -7.256
    9    HD3  PRO   1           1HD      PRO   1  -7.996  16.455  -7.119
   10    HA   PRO   2           HA       PRO   2  -3.948  17.185  -1.922
   11    HB2  PRO   2           2HB      PRO   2  -4.461  19.943  -1.066
   12    HB3  PRO   2           1HB      PRO   2  -3.030  19.263  -1.842
   13    HG2  PRO   2           2HG      PRO   2  -4.704  20.945  -3.125
   14    HG3  PRO   2           1HG      PRO   2  -3.838  19.644  -3.965
   15    HD2  PRO   2           2HD      PRO   2  -6.689  19.749  -3.055
   16    HD3  PRO   2           1HD      PRO   2  -6.011  19.093  -4.561
   17    H    SER   3           H        SER   3  -6.354  19.456  -0.606
   18    HA   SER   3           HA       SER   3  -6.190  18.156   1.971
   19    HB2  SER   3           2HB      SER   3  -7.918  20.056   2.481
   20    HB3  SER   3           1HB      SER   3  -6.231  20.477   2.188
   21    HG   SER   3           HG       SER   3  -8.460  20.735   0.462
   22    H    VAL   4           H        VAL   4  -7.539  16.966  -0.480
   23    HA   VAL   4           HA       VAL   4 -10.195  16.517   0.680
   24    HB   VAL   4           HB       VAL   4  -9.146  15.801  -2.066
   25   HG11  VAL   4          1HG1      VAL   4 -11.452  15.197  -2.599
   26   HG12  VAL   4          2HG1      VAL   4 -11.933  15.536  -0.938
   27   HG13  VAL   4          3HG1      VAL   4 -10.831  14.203  -1.282
   28   HG21  VAL   4          3HG2      VAL   4 -11.083  17.934  -1.178
   29   HG22  VAL   4          1HG2      VAL   4 -10.704  17.531  -2.853
   30   HG23  VAL   4          2HG2      VAL   4  -9.452  18.189  -1.799
   31    H    SER   5           H        SER   5  -7.503  14.720  -0.820
   32    HA   SER   5           HA       SER   5  -8.546  12.254   0.293
   33    HB2  SER   5           2HB      SER   5  -6.647  11.211  -0.932
   34    HB3  SER   5           1HB      SER   5  -7.725  12.154  -1.967
   35    HG   SER   5           HG       SER   5  -5.602  12.684  -2.469
   36    H    GLU   6           H        GLU   6  -6.373  14.660   1.342
   37    HA   GLU   6           HA       GLU   6  -4.348  13.133   2.507
   38    HB2  GLU   6           2HB      GLU   6  -3.935  15.076   3.960
   39    HB3  GLU   6           1HB      GLU   6  -4.135  15.530   2.275
   40    HG2  GLU   6           2HG      GLU   6  -6.344  16.343   2.688
   41    HG3  GLU   6           1HG      GLU   6  -6.307  15.726   4.343
   42    H    ILE   7           H        ILE   7  -7.620  13.517   3.434
   43    HA   ILE   7           HA       ILE   7  -7.167  12.841   6.207
   44    HB   ILE   7           HB       ILE   7  -9.767  13.164   4.709
   45   HG12  ILE   7          2HG1      ILE   7  -8.505  15.234   4.672
   46   HG13  ILE   7          1HG1      ILE   7  -9.838  15.388   5.811
   47   HG21  ILE   7          1HG2      ILE   7  -9.209  13.077   7.671
   48   HG22  ILE   7          2HG2      ILE   7 -10.043  11.842   6.730
   49   HG23  ILE   7          3HG2      ILE   7 -10.769  13.436   6.932
   50   HD11  ILE   7          3HD1      ILE   7  -7.804  16.388   6.677
   51   HD12  ILE   7          1HD1      ILE   7  -6.970  14.841   6.527
   52   HD13  ILE   7          2HD1      ILE   7  -8.307  15.017   7.666
   53    H    GLN   8           H        GLN   8  -8.300  11.207   3.278
   54    HA   GLN   8           HA       GLN   8  -9.029   8.876   4.897
   55    HB2  GLN   8           2HB      GLN   8  -9.421   9.269   1.926
   56    HB3  GLN   8           1HB      GLN   8 -10.080   7.969   2.908
   57    HG2  GLN   8           2HG      GLN   8 -11.879   9.377   2.650
   58    HG3  GLN   8           1HG      GLN   8 -11.243   9.858   4.222
   59   HE21  GLN   8          1HE2      GLN   8  -9.814  10.644   1.124
   60   HE22  GLN   8          2HE2      GLN   8 -10.085  12.351   1.231
   61    H    LEU   9           H        LEU   9  -6.893   9.852   2.267
   62    HA   LEU   9           HA       LEU   9  -5.730   7.202   2.112
   63    HB2  LEU   9           2HB      LEU   9  -4.759   9.716   0.762
   64    HB3  LEU   9           1HB      LEU   9  -4.402   8.064   0.309
   65    HG   LEU   9           HG       LEU   9  -6.946   9.608  -0.100
   66   HD11  LEU   9          1HD1      LEU   9  -6.638   8.880  -2.416
   67   HD12  LEU   9          2HD1      LEU   9  -5.157   8.043  -1.950
   68   HD13  LEU   9          3HD1      LEU   9  -5.255   9.799  -1.819
   69   HD21  LEU   9          3HD2      LEU   9  -7.779   7.358  -1.069
   70   HD22  LEU   9          1HD2      LEU   9  -7.875   7.635   0.674
   71   HD23  LEU   9          2HD2      LEU   9  -6.580   6.637   0.006
   72    H    MET  10           H        MET  10  -5.153  10.188   3.718
   73    HA   MET  10           HA       MET  10  -3.478  11.040   4.983
   74    HB2  MET  10           2HB      MET  10  -3.467   8.119   5.641
   75    HB3  MET  10           1HB      MET  10  -2.375   9.233   6.452
   76    HG2  MET  10           2HG      MET  10  -4.329  10.543   7.187
   77    HG3  MET  10           1HG      MET  10  -5.381   9.337   6.445
   78    HE1  MET  10           3HE      MET  10  -6.596   9.174   8.852
   79    HE2  MET  10           1HE      MET  10  -5.435  10.303   9.544
   80    HE3  MET  10           2HE      MET  10  -5.743   8.758  10.338
   81    H    HIS  11           H        HIS  11  -2.003  11.853   3.470
   82    HA   HIS  11           HA       HIS  11  -0.130  10.130   2.146
   83    HB2  HIS  11           2HB      HIS  11  -0.255  13.135   2.424
   84    HB3  HIS  11           1HB      HIS  11   0.975  12.299   1.484
   85    HD1  HIS  11           1HD      HIS  11  -2.109  13.959   1.025
   86    HD2  HIS  11           2HD      HIS  11  -0.442  10.470  -0.511
   87    HE1  HIS  11           1HE      HIS  11  -3.408  13.451  -1.074
   88    HE2  HIS  11           2HE      HIS  11  -2.268  11.432  -2.068
   89    H    ASN  12           H        ASN  12  -0.378  10.794   5.244
   90    HA   ASN  12           HA       ASN  12   2.410  11.190   5.858
   91    HB2  ASN  12           2HB      ASN  12   1.677  11.089   8.199
   92    HB3  ASN  12           1HB      ASN  12   0.722  12.230   7.264
   93   HD21  ASN  12          1HD2      ASN  12  -0.943  12.179   8.737
   94   HD22  ASN  12          2HD2      ASN  12  -2.020  10.830   8.866
   95    H    ARG  13           H        ARG  13   0.935   8.635   4.599
   96    HA   ARG  13           HA       ARG  13   1.476   6.424   6.183
   97    HB2  ARG  13           2HB      ARG  13   2.217   6.442   3.259
   98    HB3  ARG  13           1HB      ARG  13   1.662   5.090   4.222
   99    HG2  ARG  13           2HG      ARG  13   0.033   7.389   3.179
  100    HG3  ARG  13           1HG      ARG  13  -0.048   5.702   2.690
  101    HD2  ARG  13           2HD      ARG  13  -0.962   6.944   5.274
  102    HD3  ARG  13           1HD      ARG  13  -1.919   6.113   4.060
  103    HE   ARG  13           HE       ARG  13  -0.160   4.208   4.937
  104   HH11  ARG  13          1HH1      ARG  13  -2.510   6.309   6.440
  105   HH12  ARG  13          2HH1      ARG  13  -2.943   5.176   7.681
  106   HH21  ARG  13          1HH2      ARG  13  -0.701   2.703   6.560
  107   HH22  ARG  13          2HH2      ARG  13  -1.885   3.126   7.772
  108    H    GLY  14           H        GLY  14   3.305   5.333   6.765
  109    HA2  GLY  14           2HA      GLY  14   5.544   6.967   7.200
  110    HA3  GLY  14           1HA      GLY  14   5.465   5.244   7.519
  111    H    LYS  15           H        LYS  15   4.883   4.678   4.647
  112    HA   LYS  15           HA       LYS  15   6.038   4.035   2.800
  113    HB2  LYS  15           2HB      LYS  15   7.603   6.558   3.373
  114    HB3  LYS  15           1HB      LYS  15   7.776   5.601   1.908
  115    HG2  LYS  15           2HG      LYS  15   5.262   6.976   2.827
  116    HG3  LYS  15           1HG      LYS  15   6.346   7.536   1.554
  117    HD2  LYS  15           2HD      LYS  15   5.883   5.498   0.271
  118    HD3  LYS  15           1HD      LYS  15   4.794   4.948   1.546
  119    HE2  LYS  15           2HE      LYS  15   3.548   5.942  -0.298
  120    HE3  LYS  15           1HE      LYS  15   3.374   6.895   1.176
  121    HZ1  LYS  15           3HZ      LYS  15   3.756   8.259  -0.809
  122    HZ2  LYS  15           1HZ      LYS  15   5.268   7.528  -1.022
  123    HZ3  LYS  15           2HZ      LYS  15   4.962   8.474   0.352
  124    H    HIS  16           H        HIS  16   6.915   3.425   5.605
  125    HA   HIS  16           HA       HIS  16   9.766   3.015   5.460
  126    HB2  HIS  16           2HB      HIS  16   8.456   3.615   7.546
  127    HB3  HIS  16           1HB      HIS  16   7.779   1.986   7.503
  128    HD1  HIS  16           1HD      HIS  16  10.770   3.922   8.503
  129    HD2  HIS  16           2HD      HIS  16   9.684  -0.076   8.114
  130    HE1  HIS  16           1HE      HIS  16  12.533   2.616   9.735
  131    HE2  HIS  16           2HE      HIS  16  11.863   0.198   9.489
  132    H    LEU  17           H        LEU  17   7.306   0.728   6.483
  133    HA   LEU  17           HA       LEU  17   8.055  -1.126   4.366
  134    HB2  LEU  17           2HB      LEU  17   9.408  -1.791   6.255
  135    HB3  LEU  17           1HB      LEU  17   8.018  -1.751   7.329
  136    HG   LEU  17           HG       LEU  17   7.063  -3.576   5.795
  137   HD11  LEU  17          1HD1      LEU  17   8.992  -3.069   4.151
  138   HD12  LEU  17          2HD1      LEU  17   8.476  -4.739   4.391
  139   HD13  LEU  17          3HD1      LEU  17   9.931  -4.140   5.191
  140   HD21  LEU  17          3HD2      LEU  17   9.453  -4.144   7.548
  141   HD22  LEU  17          1HD2      LEU  17   8.228  -5.319   7.063
  142   HD23  LEU  17          2HD2      LEU  17   7.786  -3.958   8.095
  143    H    ASN  18           H        ASN  18   5.935   0.174   3.928
  144    HA   ASN  18           HA       ASN  18   3.638  -0.685   5.416
  145    HB2  ASN  18           2HB      ASN  18   3.711   0.836   2.796
  146    HB3  ASN  18           1HB      ASN  18   2.337   0.672   3.874
  147   HD21  ASN  18          1HD2      ASN  18   4.297   0.941   6.187
  148   HD22  ASN  18          2HD2      ASN  18   4.495   2.651   6.310
  149    H    SER  19           H        SER  19   5.314  -2.673   3.978
  150    HA   SER  19           HA       SER  19   3.927  -3.599   1.686
  151    HB2  SER  19           2HB      SER  19   6.337  -4.116   2.326
  152    HB3  SER  19           1HB      SER  19   5.686  -5.241   3.516
  153    HG   SER  19           HG       SER  19   5.193  -6.613   1.984
  154    H    MET  20           H        MET  20   3.030  -3.534   4.877
  155    HA   MET  20           HA       MET  20   1.433  -5.990   4.717
  156    HB2  MET  20           2HB      MET  20   1.165  -5.790   7.083
  157    HB3  MET  20           1HB      MET  20   2.840  -5.377   6.746
  158    HG2  MET  20           2HG      MET  20   2.300  -2.999   6.856
  159    HG3  MET  20           1HG      MET  20   0.626  -3.420   7.224
  160    HE1  MET  20           3HE      MET  20   0.975  -5.138  10.726
  161    HE2  MET  20           1HE      MET  20   0.995  -5.921   9.145
  162    HE3  MET  20           2HE      MET  20  -0.142  -4.613   9.463
  163    H    GLU  21           H        GLU  21   1.419  -2.702   4.403
  164    HA   GLU  21           HA       GLU  21  -1.421  -2.264   4.694
  165    HB2  GLU  21           2HB      GLU  21   0.863  -0.519   3.715
  166    HB3  GLU  21           1HB      GLU  21  -0.818   0.028   3.837
  167    HG2  GLU  21           2HG      GLU  21  -0.807  -0.440   6.204
  168    HG3  GLU  21           1HG      GLU  21   0.873  -1.010   6.096
  169    H    ARG  22           H        ARG  22   0.934  -1.992   2.074
  170    HA   ARG  22           HA       ARG  22  -0.727  -1.419  -0.048
  171    HB2  ARG  22           2HB      ARG  22   1.804  -3.025   0.090
  172    HB3  ARG  22           1HB      ARG  22   0.924  -2.805  -1.401
  173    HG2  ARG  22           2HG      ARG  22   2.403  -1.080  -1.594
  174    HG3  ARG  22           1HG      ARG  22   1.119  -0.252  -0.708
  175    HD2  ARG  22           2HD      ARG  22   2.273  -0.776   1.400
  176    HD3  ARG  22           1HD      ARG  22   3.575  -1.524   0.481
  177    HE   ARG  22           HE       ARG  22   3.029   1.317   0.778
  178   HH11  ARG  22          1HH1      ARG  22   4.898  -1.216  -0.766
  179   HH12  ARG  22          2HH1      ARG  22   6.142  -0.129  -1.318
  180   HH21  ARG  22          1HH2      ARG  22   4.632   2.736   0.039
  181   HH22  ARG  22          2HH2      ARG  22   5.977   2.126  -0.878
  182    H    VAL  23           H        VAL  23   0.375  -4.695   0.855
  183    HA   VAL  23           HA       VAL  23  -0.733  -5.920  -1.395
  184    HB   VAL  23           HB       VAL  23  -0.304  -7.997  -0.107
  185   HG11  VAL  23          1HG1      VAL  23   1.930  -5.992   0.119
  186   HG12  VAL  23          2HG1      VAL  23   1.509  -6.843  -1.369
  187   HG13  VAL  23          3HG1      VAL  23   2.096  -7.746   0.027
  188   HG21  VAL  23          3HG2      VAL  23  -0.436  -7.884   2.088
  189   HG22  VAL  23          1HG2      VAL  23  -0.639  -6.138   1.908
  190   HG23  VAL  23          2HG2      VAL  23   0.986  -6.824   2.108
  191    H    GLU  24           H        GLU  24  -2.319  -4.734   1.347
  192    HA   GLU  24           HA       GLU  24  -4.528  -6.634   1.125
  193    HB2  GLU  24           2HB      GLU  24  -4.551  -4.160   2.842
  194    HB3  GLU  24           1HB      GLU  24  -5.381  -5.689   3.104
  195    HG2  GLU  24           2HG      GLU  24  -2.411  -5.380   3.222
  196    HG3  GLU  24           1HG      GLU  24  -3.454  -5.204   4.632
  197    H    TRP  25           H        TRP  25  -3.774  -3.183   0.617
  198    HA   TRP  25           HA       TRP  25  -6.405  -2.802  -0.436
  199    HB2  TRP  25           2HB      TRP  25  -5.592  -0.580  -1.191
  200    HB3  TRP  25           1HB      TRP  25  -5.724  -0.869   0.524
  201    HD1  TRP  25           HD       TRP  25  -3.550  -0.570   1.926
  202    HE1  TRP  25           1HE      TRP  25  -1.274   0.513   1.416
  203    HE3  TRP  25           3HE      TRP  25  -3.775  -0.608  -3.139
  204    HZ2  TRP  25           2HZ      TRP  25   0.223   1.243  -0.855
  205    HZ3  TRP  25           3HZ      TRP  25  -1.897   0.308  -4.431
  206    HH2  TRP  25           HH       TRP  25   0.076   1.200  -3.303
  207    H    LEU  26           H        LEU  26  -3.431  -3.811  -1.763
  208    HA   LEU  26           HA       LEU  26  -3.581  -3.027  -4.323
  209    HB2  LEU  26           2HB      LEU  26  -3.046  -5.868  -3.512
  210    HB3  LEU  26           1HB      LEU  26  -2.515  -5.102  -4.986
  211    HG   LEU  26           HG       LEU  26  -1.470  -4.781  -2.211
  212   HD11  LEU  26          1HD1      LEU  26   0.674  -5.051  -3.325
  213   HD12  LEU  26          2HD1      LEU  26  -0.127  -5.090  -4.896
  214   HD13  LEU  26          3HD1      LEU  26  -0.407  -6.383  -3.729
  215   HD21  LEU  26          3HD2      LEU  26  -0.283  -2.774  -2.914
  216   HD22  LEU  26          1HD2      LEU  26  -2.045  -2.591  -2.900
  217   HD23  LEU  26          2HD2      LEU  26  -1.182  -2.787  -4.437
  218    H    ARG  27           H        ARG  27  -5.764  -5.124  -2.703
  219    HA   ARG  27           HA       ARG  27  -6.774  -6.131  -5.251
  220    HB2  ARG  27           2HB      ARG  27  -7.438  -7.093  -2.479
  221    HB3  ARG  27           1HB      ARG  27  -7.788  -7.908  -3.999
  222    HG2  ARG  27           2HG      ARG  27  -5.937  -9.059  -3.356
  223    HG3  ARG  27           1HG      ARG  27  -5.185  -7.762  -4.293
  224    HD2  ARG  27           2HD      ARG  27  -4.162  -8.312  -2.000
  225    HD3  ARG  27           1HD      ARG  27  -4.487  -6.603  -2.321
  226    HE   ARG  27           HE       ARG  27  -6.368  -6.760  -0.887
  227   HH11  ARG  27          1HH1      ARG  27  -4.381  -9.638  -0.927
  228   HH12  ARG  27          2HH1      ARG  27  -4.952 -10.218   0.604
  229   HH21  ARG  27          1HH2      ARG  27  -7.157  -7.543   1.131
  230   HH22  ARG  27          2HH2      ARG  27  -6.565  -9.059   1.747
  231    H    LYS  28           H        LYS  28  -7.766  -4.430  -2.341
  232    HA   LYS  28           HA       LYS  28 -10.475  -4.183  -3.265
  233    HB2  LYS  28           2HB      LYS  28 -10.871  -2.948  -1.234
  234    HB3  LYS  28           1HB      LYS  28  -9.969  -4.418  -0.879
  235    HG2  LYS  28           2HG      LYS  28  -7.925  -3.174  -0.737
  236    HG3  LYS  28           1HG      LYS  28  -8.766  -1.710  -1.228
  237    HD2  LYS  28           2HD      LYS  28 -10.201  -1.961   0.809
  238    HD3  LYS  28           1HD      LYS  28  -9.112  -3.259   1.315
  239    HE2  LYS  28           2HE      LYS  28  -7.230  -1.708   1.244
  240    HE3  LYS  28           1HE      LYS  28  -8.311  -0.416   0.726
  241    HZ1  LYS  28           3HZ      LYS  28  -9.498  -0.586   2.810
  242    HZ2  LYS  28           1HZ      LYS  28  -7.856  -0.320   3.117
  243    HZ3  LYS  28           2HZ      LYS  28  -8.507  -1.872   3.313
  244    H    LYS  29           H        LYS  29  -7.724  -2.698  -4.259
  245    HA   LYS  29           HA       LYS  29  -9.265  -0.284  -4.920
  246    HB2  LYS  29           2HB      LYS  29  -6.282  -0.354  -4.366
  247    HB3  LYS  29           1HB      LYS  29  -7.197   1.060  -4.845
  248    HG2  LYS  29           2HG      LYS  29  -7.278  -0.398  -2.203
  249    HG3  LYS  29           1HG      LYS  29  -6.767   1.255  -2.537
  250    HD2  LYS  29           2HD      LYS  29  -9.577   0.190  -2.764
  251    HD3  LYS  29           1HD      LYS  29  -8.958   1.242  -1.494
  252    HE2  LYS  29           2HE      LYS  29  -9.166   1.939  -4.422
  253    HE3  LYS  29           1HE      LYS  29 -10.260   2.487  -3.155
  254    HZ1  LYS  29           3HZ      LYS  29  -7.444   3.245  -3.626
  255    HZ2  LYS  29           1HZ      LYS  29  -8.156   3.452  -2.094
  256    HZ3  LYS  29           2HZ      LYS  29  -8.803   4.245  -3.447
  257    H    LEU  30           H        LEU  30  -7.136  -2.796  -6.154
  258    HA   LEU  30           HA       LEU  30  -6.132  -1.449  -8.376
  259    HB2  LEU  30           2HB      LEU  30  -5.281  -3.451  -9.098
  260    HB3  LEU  30           1HB      LEU  30  -5.542  -3.805  -7.405
  261    HG   LEU  30           HG       LEU  30  -7.919  -4.593  -8.631
  262   HD11  LEU  30          1HD1      LEU  30  -6.811  -4.346 -10.814
  263   HD12  LEU  30          2HD1      LEU  30  -7.241  -6.019 -10.465
  264   HD13  LEU  30          3HD1      LEU  30  -5.569  -5.487 -10.298
  265   HD21  LEU  30          3HD2      LEU  30  -7.044  -6.900  -8.210
  266   HD22  LEU  30          1HD2      LEU  30  -6.922  -5.822  -6.818
  267   HD23  LEU  30          2HD2      LEU  30  -5.493  -6.178  -7.790
  268    H    GLN  31           H        GLN  31  -9.032  -3.233  -7.860
  269    HA   GLN  31           HA       GLN  31 -10.494  -1.527  -9.618
  270    HB2  GLN  31           2HB      GLN  31 -11.603  -3.598 -10.732
  271    HB3  GLN  31           1HB      GLN  31 -10.080  -3.010 -11.376
  272    HG2  GLN  31           2HG      GLN  31 -10.038  -5.402 -11.304
  273    HG3  GLN  31           1HG      GLN  31  -8.899  -4.769 -10.118
  274   HE21  GLN  31          1HE2      GLN  31  -9.250  -5.177  -7.950
  275   HE22  GLN  31          2HE2      GLN  31 -10.516  -6.175  -7.376
  276    H    ASP  32           H        ASP  32  -9.998  -2.748  -6.872
  277    HA   ASP  32           HA       ASP  32 -10.908  -3.823  -5.150
  278    HB2  ASP  32           2HB      ASP  32 -12.127  -2.163  -4.400
  279    HB3  ASP  32           1HB      ASP  32 -12.773  -1.786  -5.977
  280    H    VAL  33           H        VAL  33 -11.407  -5.720  -4.741
  281    HA   VAL  33           HA       VAL  33 -11.976  -7.433  -6.932
  282    HB   VAL  33           HB       VAL  33 -10.307  -8.109  -5.413
  283   HG11  VAL  33          1HG1      VAL  33 -10.938  -6.858  -3.496
  284   HG12  VAL  33          2HG1      VAL  33 -10.755  -8.554  -3.028
  285   HG13  VAL  33          3HG1      VAL  33 -12.367  -7.866  -3.240
  286   HG21  VAL  33          3HG2      VAL  33 -12.707  -9.872  -4.940
  287   HG22  VAL  33          1HG2      VAL  33 -11.026 -10.318  -4.632
  288   HG23  VAL  33          2HG2      VAL  33 -11.563  -9.990  -6.279
  289    H    HIS  34           H        HIS  34 -14.079  -5.847  -4.898
  290    HA   HIS  34           HA       HIS  34 -16.071  -7.778  -4.436
  291    HB2  HIS  34           2HB      HIS  34 -16.202  -5.725  -3.229
  292    HB3  HIS  34           1HB      HIS  34 -16.213  -4.778  -4.712
  293    HD1  HIS  34           1HD      HIS  34 -18.434  -3.982  -5.412
  294    HD2  HIS  34           2HD      HIS  34 -18.699  -7.391  -3.047
  295    HE1  HIS  34           1HE      HIS  34 -20.892  -4.403  -5.094
  296    HE2  HIS  34           2HE      HIS  34 -21.015  -6.609  -3.885
  297    H    ASN  35           H        ASN  35 -15.239  -6.007  -7.276
  298    HA   ASN  35           HA       ASN  35 -17.685  -6.901  -8.637
  299    HB2  ASN  35           2HB      ASN  35 -16.581  -5.470 -10.551
  300    HB3  ASN  35           1HB      ASN  35 -17.412  -4.677  -9.214
  301   HD21  ASN  35          1HD2      ASN  35 -14.214  -5.747 -10.306
  302   HD22  ASN  35          2HD2      ASN  35 -13.315  -4.548  -9.414
  303    H    PHE  36           H        PHE  36 -14.340  -7.544  -8.382
  304    HA   PHE  36           HA       PHE  36 -12.877  -8.921  -9.408
  305    HB2  PHE  36           2HB      PHE  36 -15.397 -10.017 -10.649
  306    HB3  PHE  36           1HB      PHE  36 -13.802 -10.638 -11.068
  307    HD1  PHE  36           1HD      PHE  36 -12.360 -11.591  -9.246
  308    HD2  PHE  36           2HD      PHE  36 -16.479 -10.669  -8.693
  309    HE1  PHE  36           1HE      PHE  36 -12.430 -13.081  -7.289
  310    HE2  PHE  36           2HE      PHE  36 -16.553 -12.147  -6.732
  311    HZ   PHE  36           HZ       PHE  36 -14.450 -13.270  -5.974
  312    HA   PRO  37           HA       PRO  37 -11.345  -6.961 -13.065
  313    HB2  PRO  37           2HB      PRO  37 -11.462  -9.606 -14.455
  314    HB3  PRO  37           1HB      PRO  37 -10.158  -8.413 -14.412
  315    HG2  PRO  37           2HG      PRO  37 -10.038 -10.588 -12.889
  316    HG3  PRO  37           1HG      PRO  37  -9.494  -9.018 -12.271
  317    HD2  PRO  37           2HD      PRO  37 -11.964 -10.551 -11.639
  318    HD3  PRO  37           1HD      PRO  37 -11.024  -9.453 -10.612
  319    HA   PRO  38           HA       PRO  38 -15.022  -8.137 -16.250
  320    HB2  PRO  38           2HB      PRO  38 -16.670  -9.345 -14.076
  321    HB3  PRO  38           1HB      PRO  38 -16.702  -9.669 -15.820
  322    HG2  PRO  38           2HG      PRO  38 -15.497 -11.371 -14.211
  323    HG3  PRO  38           1HG      PRO  38 -14.723 -10.915 -15.740
  324    HD2  PRO  38           2HD      PRO  38 -14.105 -10.014 -12.979
  325    HD3  PRO  38           1HD      PRO  38 -13.010 -10.377 -14.321
  326    H    ASP  39           H        ASP  39 -15.004  -5.819 -15.976
  327    HA   ASP  39           HA       ASP  39 -16.567  -4.674 -13.835
  328    HB2  ASP  39           2HB      ASP  39 -14.583  -3.511 -14.425
  329    HB3  ASP  39           1HB      ASP  39 -14.982  -3.578 -16.138
  Start of MODEL    5
    1    H2   PRO   1           1HT      PRO   1  17.716   5.286 -12.110
    2    H3   PRO   1           2HT      PRO   1  18.887   5.084 -10.984
    3    HA   PRO   1           HA       PRO   1  17.449   4.621  -9.538
    4    HB2  PRO   1           2HB      PRO   1  15.743   6.997  -9.705
    5    HB3  PRO   1           1HB      PRO   1  16.727   6.405  -8.357
    6    HG2  PRO   1           2HG      PRO   1  17.429   8.574  -9.787
    7    HG3  PRO   1           1HG      PRO   1  18.628   7.461  -9.102
    8    HD2  PRO   1           2HD      PRO   1  17.595   7.634 -11.921
    9    HD3  PRO   1           1HD      PRO   1  19.263   7.434 -11.350
   10    HA   PRO   2           HA       PRO   2  14.414   3.407 -12.779
   11    HB2  PRO   2           2HB      PRO   2  14.824   0.705 -11.749
   12    HB3  PRO   2           1HB      PRO   2  15.090   1.336 -13.376
   13    HG2  PRO   2           2HG      PRO   2  17.134   0.620 -11.761
   14    HG3  PRO   2           1HG      PRO   2  17.268   1.945 -12.934
   15    HD2  PRO   2           2HD      PRO   2  16.773   2.077  -9.974
   16    HD3  PRO   2           1HD      PRO   2  17.857   3.065 -10.981
   17    H    SER   3           H        SER   3  14.389   1.257  -9.914
   18    HA   SER   3           HA       SER   3  11.621   2.127  -9.425
   19    HB2  SER   3           2HB      SER   3  11.232  -0.390  -8.885
   20    HB3  SER   3           1HB      SER   3  11.252   0.136 -10.570
   21    HG   SER   3           HG       SER   3  13.061  -0.908 -10.903
   22    H    VAL   4           H        VAL   4  14.662   1.145  -8.122
   23    HA   VAL   4           HA       VAL   4  13.877   0.429  -5.525
   24    HB   VAL   4           HB       VAL   4  16.133   0.023  -6.460
   25   HG11  VAL   4          1HG1      VAL   4  16.541   2.973  -6.018
   26   HG12  VAL   4          2HG1      VAL   4  16.506   2.140  -7.574
   27   HG13  VAL   4          3HG1      VAL   4  17.806   1.813  -6.427
   28   HG21  VAL   4          3HG2      VAL   4  17.390   0.471  -4.413
   29   HG22  VAL   4          1HG2      VAL   4  15.775  -0.144  -4.062
   30   HG23  VAL   4          2HG2      VAL   4  16.123   1.575  -3.878
   31    H    SER   5           H        SER   5  13.976   3.491  -7.068
   32    HA   SER   5           HA       SER   5  14.037   4.969  -4.555
   33    HB2  SER   5           2HB      SER   5  13.890   5.988  -7.395
   34    HB3  SER   5           1HB      SER   5  14.161   6.955  -5.940
   35    HG   SER   5           HG       SER   5  15.959   5.079  -5.842
   36    H    GLU   6           H        GLU   6  11.655   3.396  -6.203
   37    HA   GLU   6           HA       GLU   6   9.594   5.328  -6.039
   38    HB2  GLU   6           2HB      GLU   6   9.419   2.320  -6.038
   39    HB3  GLU   6           1HB      GLU   6   8.051   3.410  -6.227
   40    HG2  GLU   6           2HG      GLU   6   9.105   4.312  -8.265
   41    HG3  GLU   6           1HG      GLU   6  10.395   3.119  -8.079
   42    H    ILE   7           H        ILE   7  11.278   4.870  -3.586
   43    HA   ILE   7           HA       ILE   7   9.031   4.566  -1.723
   44    HB   ILE   7           HB       ILE   7  11.956   4.200  -1.075
   45   HG12  ILE   7          2HG1      ILE   7  11.362   2.379  -2.513
   46   HG13  ILE   7          1HG1      ILE   7  11.383   1.769  -0.864
   47   HG21  ILE   7          1HG2      ILE   7  10.635   4.898   0.821
   48   HG22  ILE   7          2HG2      ILE   7  11.100   3.208   1.013
   49   HG23  ILE   7          3HG2      ILE   7   9.460   3.619   0.514
   50   HD11  ILE   7          3HD1      ILE   7   9.501   0.871  -2.065
   51   HD12  ILE   7          1HD1      ILE   7   8.951   2.502  -2.461
   52   HD13  ILE   7          2HD1      ILE   7   8.939   1.949  -0.784
   53    H    GLN   8           H        GLN   8  12.229   6.081  -2.001
   54    HA   GLN   8           HA       GLN   8  11.430   8.210  -0.229
   55    HB2  GLN   8           2HB      GLN   8  13.749   8.998  -0.450
   56    HB3  GLN   8           1HB      GLN   8  13.667   7.309   0.013
   57    HG2  GLN   8           2HG      GLN   8  14.012   8.058  -2.859
   58    HG3  GLN   8           1HG      GLN   8  15.386   8.109  -1.762
   59   HE21  GLN   8          1HE2      GLN   8  16.490   6.477  -2.782
   60   HE22  GLN   8          2HE2      GLN   8  15.981   4.823  -2.737
   61    H    LEU   9           H        LEU   9  11.783   7.703  -3.661
   62    HA   LEU   9           HA       LEU   9  11.407  10.548  -4.155
   63    HB2  LEU   9           2HB      LEU   9  11.926   8.187  -5.901
   64    HB3  LEU   9           1HB      LEU   9  11.200   9.616  -6.604
   65    HG   LEU   9           HG       LEU   9  13.557   9.690  -6.998
   66   HD11  LEU   9          1HD1      LEU   9  12.796  11.603  -4.801
   67   HD12  LEU   9          2HD1      LEU   9  12.519  11.817  -6.529
   68   HD13  LEU   9          3HD1      LEU   9  14.164  11.794  -5.898
   69   HD21  LEU   9          3HD2      LEU   9  14.355   8.200  -5.288
   70   HD22  LEU   9          1HD2      LEU   9  13.885   9.335  -4.023
   71   HD23  LEU   9          2HD2      LEU   9  15.185   9.747  -5.141
   72    H    MET  10           H        MET  10   9.595   7.503  -4.730
   73    HA   MET  10           HA       MET  10   7.306   9.011  -5.611
   74    HB2  MET  10           2HB      MET  10   7.995   6.108  -5.371
   75    HB3  MET  10           1HB      MET  10   6.336   6.610  -5.654
   76    HG2  MET  10           2HG      MET  10   7.431   6.030  -7.715
   77    HG3  MET  10           1HG      MET  10   7.018   7.742  -7.691
   78    HE1  MET  10           3HE      MET  10  10.304   7.641  -9.819
   79    HE2  MET  10           1HE      MET  10   8.620   8.161  -9.768
   80    HE3  MET  10           2HE      MET  10   9.011   6.441  -9.803
   81    H    HIS  11           H        HIS  11   6.249  10.043  -4.001
   82    HA   HIS  11           HA       HIS  11   5.750   8.649  -1.480
   83    HB2  HIS  11           2HB      HIS  11   5.049  11.456  -2.379
   84    HB3  HIS  11           1HB      HIS  11   4.783  10.809  -0.767
   85    HD1  HIS  11           1HD      HIS  11   7.442  12.099  -3.023
   86    HD2  HIS  11           2HD      HIS  11   7.094  10.536   0.810
   87    HE1  HIS  11           1HE      HIS  11   9.645  12.572  -1.899
   88    HE2  HIS  11           2HE      HIS  11   9.474  11.443   0.354
   89    H    ASN  12           H        ASN  12   4.465   8.804  -4.478
   90    HA   ASN  12           HA       ASN  12   1.660   8.790  -3.845
   91    HB2  ASN  12           2HB      ASN  12   1.385   8.184  -6.224
   92    HB3  ASN  12           1HB      ASN  12   2.452   9.570  -6.029
   93   HD21  ASN  12          1HD2      ASN  12   2.263   7.671  -8.260
   94   HD22  ASN  12          2HD2      ASN  12   3.863   7.013  -8.425
   95    H    ARG  13           H        ARG  13   3.899   6.697  -2.976
   96    HA   ARG  13           HA       ARG  13   2.678   4.244  -3.840
   97    HB2  ARG  13           2HB      ARG  13   4.718   4.492  -1.651
   98    HB3  ARG  13           1HB      ARG  13   4.403   3.115  -2.690
   99    HG2  ARG  13           2HG      ARG  13   5.774   5.685  -3.405
  100    HG3  ARG  13           1HG      ARG  13   6.471   4.070  -3.335
  101    HD2  ARG  13           2HD      ARG  13   4.599   5.229  -5.370
  102    HD3  ARG  13           1HD      ARG  13   6.191   4.531  -5.609
  103    HE   ARG  13           HE       ARG  13   5.118   2.350  -4.973
  104   HH11  ARG  13          1HH1      ARG  13   3.277   4.950  -6.433
  105   HH12  ARG  13          2HH1      ARG  13   2.116   3.884  -7.167
  106   HH21  ARG  13          1HH2      ARG  13   3.582   0.949  -5.958
  107   HH22  ARG  13          2HH2      ARG  13   2.300   1.636  -6.910
  108    H    GLY  14           H        GLY  14   2.901   6.182  -0.906
  109    HA2  GLY  14           2HA      GLY  14   0.509   5.595   0.238
  110    HA3  GLY  14           1HA      GLY  14   1.530   4.245   0.714
  111    H    LYS  15           H        LYS  15   2.154   4.516   2.740
  112    HA   LYS  15           HA       LYS  15   3.295   7.111   3.508
  113    HB2  LYS  15           2HB      LYS  15   1.211   5.536   5.017
  114    HB3  LYS  15           1HB      LYS  15   2.202   6.775   5.776
  115    HG2  LYS  15           2HG      LYS  15   0.528   7.354   3.353
  116    HG3  LYS  15           1HG      LYS  15  -0.129   7.434   4.989
  117    HD2  LYS  15           2HD      LYS  15   2.270   8.978   4.002
  118    HD3  LYS  15           1HD      LYS  15   0.638   9.632   4.159
  119    HE2  LYS  15           2HE      LYS  15   2.362   8.554   6.390
  120    HE3  LYS  15           1HE      LYS  15   1.987  10.249   6.082
  121    HZ1  LYS  15           3HZ      LYS  15   0.027   8.137   6.827
  122    HZ2  LYS  15           1HZ      LYS  15  -0.357   9.754   6.493
  123    HZ3  LYS  15           2HZ      LYS  15   0.598   9.372   7.840
  124    H    HIS  16           H        HIS  16   5.264   6.865   4.332
  125    HA   HIS  16           HA       HIS  16   7.000   6.109   5.596
  126    HB2  HIS  16           2HB      HIS  16   5.253   5.684   7.320
  127    HB3  HIS  16           1HB      HIS  16   5.053   4.048   6.681
  128    HD1  HIS  16           1HD      HIS  16   5.776   3.115   9.025
  129    HD2  HIS  16           2HD      HIS  16   8.689   5.356   7.076
  130    HE1  HIS  16           1HE      HIS  16   7.927   2.652  10.249
  131    HE2  HIS  16           2HE      HIS  16   9.623   4.191   9.186
  132    H    LEU  17           H        LEU  17   5.239   3.110   4.993
  133    HA   LEU  17           HA       LEU  17   7.108   2.140   3.056
  134    HB2  LEU  17           2HB      LEU  17   8.583   1.459   4.656
  135    HB3  LEU  17           1HB      LEU  17   7.365   1.362   5.916
  136    HG   LEU  17           HG       LEU  17   6.576  -0.758   4.635
  137   HD11  LEU  17          1HD1      LEU  17   8.125  -0.124   2.716
  138   HD12  LEU  17          2HD1      LEU  17   8.089  -1.812   3.217
  139   HD13  LEU  17          3HD1      LEU  17   9.424  -0.769   3.715
  140   HD21  LEU  17          3HD2      LEU  17   8.159  -2.139   5.867
  141   HD22  LEU  17          1HD2      LEU  17   7.610  -0.784   6.853
  142   HD23  LEU  17          2HD2      LEU  17   9.209  -0.742   6.108
  143    H    ASN  18           H        ASN  18   4.730   1.319   5.513
  144    HA   ASN  18           HA       ASN  18   2.831   0.135   5.506
  145    HB2  ASN  18           2HB      ASN  18   3.009   0.548   2.523
  146    HB3  ASN  18           1HB      ASN  18   1.614  -0.154   3.333
  147   HD21  ASN  18          1HD2      ASN  18   2.171   1.667   5.638
  148   HD22  ASN  18          2HD2      ASN  18   1.496   3.188   5.140
  149    H    SER  19           H        SER  19   3.850  -1.164   2.409
  150    HA   SER  19           HA       SER  19   4.180  -3.268   1.674
  151    HB2  SER  19           2HB      SER  19   6.235  -2.997   3.051
  152    HB3  SER  19           1HB      SER  19   5.385  -3.741   4.407
  153    HG   SER  19           HG       SER  19   5.699  -5.642   3.554
  154    H    MET  20           H        MET  20   3.055  -3.429   5.045
  155    HA   MET  20           HA       MET  20   1.673  -5.915   4.589
  156    HB2  MET  20           2HB      MET  20   1.114  -5.766   6.908
  157    HB3  MET  20           1HB      MET  20   2.749  -5.141   6.754
  158    HG2  MET  20           2HG      MET  20   1.809  -2.822   6.723
  159    HG3  MET  20           1HG      MET  20   0.235  -3.547   7.070
  160    HE1  MET  20           3HE      MET  20   3.709  -4.778   8.435
  161    HE2  MET  20           1HE      MET  20   3.838  -3.868   9.941
  162    HE3  MET  20           2HE      MET  20   3.905  -3.026   8.393
  163    H    GLU  21           H        GLU  21   1.158  -2.580   4.559
  164    HA   GLU  21           HA       GLU  21  -1.700  -2.665   4.561
  165    HB2  GLU  21           2HB      GLU  21   0.268  -0.444   3.983
  166    HB3  GLU  21           1HB      GLU  21  -1.483  -0.232   4.143
  167    HG2  GLU  21           2HG      GLU  21  -1.419  -1.049   6.392
  168    HG3  GLU  21           1HG      GLU  21   0.318  -1.396   6.256
  169    H    ARG  22           H        ARG  22   0.827  -2.086   2.133
  170    HA   ARG  22           HA       ARG  22  -0.696  -1.468  -0.084
  171    HB2  ARG  22           2HB      ARG  22   1.836  -3.049   0.187
  172    HB3  ARG  22           1HB      ARG  22   0.999  -2.947  -1.348
  173    HG2  ARG  22           2HG      ARG  22   2.321  -1.180  -1.673
  174    HG3  ARG  22           1HG      ARG  22   1.117  -0.343  -0.689
  175    HD2  ARG  22           2HD      ARG  22   2.404  -0.707   1.283
  176    HD3  ARG  22           1HD      ARG  22   3.571  -1.688   0.399
  177    HE   ARG  22           HE       ARG  22   3.557   1.136   0.617
  178   HH11  ARG  22          1HH1      ARG  22   4.210  -1.419  -1.697
  179   HH12  ARG  22          2HH1      ARG  22   5.423  -0.520  -2.550
  180   HH21  ARG  22          1HH2      ARG  22   5.182   2.314  -0.506
  181   HH22  ARG  22          2HH2      ARG  22   5.967   1.601  -1.885
  182    H    VAL  23           H        VAL  23   0.372  -4.739   0.837
  183    HA   VAL  23           HA       VAL  23  -0.871  -5.991  -1.336
  184    HB   VAL  23           HB       VAL  23  -0.357  -8.056  -0.036
  185   HG11  VAL  23          1HG1      VAL  23   1.916  -6.085  -0.026
  186   HG12  VAL  23          2HG1      VAL  23   1.348  -6.906  -1.481
  187   HG13  VAL  23          3HG1      VAL  23   2.035  -7.840  -0.150
  188   HG21  VAL  23          3HG2      VAL  23  -0.400  -7.826   2.158
  189   HG22  VAL  23          1HG2      VAL  23  -0.376  -6.076   1.946
  190   HG23  VAL  23          2HG2      VAL  23   1.149  -6.972   2.028
  191    H    GLU  24           H        GLU  24  -2.384  -4.617   1.283
  192    HA   GLU  24           HA       GLU  24  -4.622  -6.498   1.128
  193    HB2  GLU  24           2HB      GLU  24  -4.667  -3.954   2.727
  194    HB3  GLU  24           1HB      GLU  24  -5.536  -5.454   3.019
  195    HG2  GLU  24           2HG      GLU  24  -3.447  -6.528   3.675
  196    HG3  GLU  24           1HG      GLU  24  -2.594  -5.008   3.381
  197    H    TRP  25           H        TRP  25  -3.791  -3.071   0.574
  198    HA   TRP  25           HA       TRP  25  -6.351  -2.639  -0.584
  199    HB2  TRP  25           2HB      TRP  25  -5.443  -0.462  -1.359
  200    HB3  TRP  25           1HB      TRP  25  -5.626  -0.705   0.359
  201    HD1  TRP  25           HD       TRP  25  -3.463  -0.446   1.809
  202    HE1  TRP  25           1HE      TRP  25  -1.167   0.591   1.323
  203    HE3  TRP  25           3HE      TRP  25  -3.597  -0.577  -3.259
  204    HZ2  TRP  25           2HZ      TRP  25   0.391   1.256  -0.934
  205    HZ3  TRP  25           3HZ      TRP  25  -1.673   0.278  -4.531
  206    HH2  TRP  25           HH       TRP  25   0.291   1.163  -3.386
  207    H    LEU  26           H        LEU  26  -3.327  -3.716  -1.816
  208    HA   LEU  26           HA       LEU  26  -3.472  -3.037  -4.407
  209    HB2  LEU  26           2HB      LEU  26  -2.912  -5.854  -3.522
  210    HB3  LEU  26           1HB      LEU  26  -2.362  -5.102  -4.996
  211    HG   LEU  26           HG       LEU  26  -1.360  -4.742  -2.207
  212   HD11  LEU  26          1HD1      LEU  26  -0.281  -6.378  -3.663
  213   HD12  LEU  26          2HD1      LEU  26   0.798  -5.035  -3.287
  214   HD13  LEU  26          3HD1      LEU  26   0.016  -5.122  -4.865
  215   HD21  LEU  26          3HD2      LEU  26  -0.136  -2.761  -2.959
  216   HD22  LEU  26          1HD2      LEU  26  -1.892  -2.557  -2.926
  217   HD23  LEU  26          2HD2      LEU  26  -1.053  -2.788  -4.471
  218    H    ARG  27           H        ARG  27  -5.627  -5.027  -2.698
  219    HA   ARG  27           HA       ARG  27  -6.720  -6.120  -5.175
  220    HB2  ARG  27           2HB      ARG  27  -7.266  -7.017  -2.356
  221    HB3  ARG  27           1HB      ARG  27  -7.656  -7.872  -3.843
  222    HG2  ARG  27           2HG      ARG  27  -5.777  -8.994  -3.254
  223    HG3  ARG  27           1HG      ARG  27  -5.047  -7.697  -4.207
  224    HD2  ARG  27           2HD      ARG  27  -3.973  -8.224  -1.947
  225    HD3  ARG  27           1HD      ARG  27  -4.344  -6.517  -2.235
  226    HE   ARG  27           HE       ARG  27  -6.135  -6.704  -0.743
  227   HH11  ARG  27          1HH1      ARG  27  -4.270  -9.649  -0.986
  228   HH12  ARG  27          2HH1      ARG  27  -4.870 -10.329   0.495
  229   HH21  ARG  27          1HH2      ARG  27  -6.959  -7.591   1.228
  230   HH22  ARG  27          2HH2      ARG  27  -6.410  -9.158   1.753
  231    H    LYS  28           H        LYS  28  -7.647  -4.450  -2.190
  232    HA   LYS  28           HA       LYS  28 -10.402  -4.314  -2.951
  233    HB2  LYS  28           2HB      LYS  28 -10.716  -3.031  -0.927
  234    HB3  LYS  28           1HB      LYS  28  -9.715  -4.443  -0.599
  235    HG2  LYS  28           2HG      LYS  28  -7.734  -3.117  -0.630
  236    HG3  LYS  28           1HG      LYS  28  -8.658  -1.707  -1.137
  237    HD2  LYS  28           2HD      LYS  28  -9.948  -1.907   1.010
  238    HD3  LYS  28           1HD      LYS  28  -8.776  -3.141   1.495
  239    HE2  LYS  28           2HE      LYS  28  -6.969  -1.546   1.212
  240    HE3  LYS  28           1HE      LYS  28  -8.117  -0.312   0.707
  241    HZ1  LYS  28           3HZ      LYS  28  -9.078  -0.276   2.858
  242    HZ2  LYS  28           1HZ      LYS  28  -7.401  -0.163   3.066
  243    HZ3  LYS  28           2HZ      LYS  28  -8.196  -1.631   3.368
  244    H    LYS  29           H        LYS  29  -7.717  -2.620  -3.967
  245    HA   LYS  29           HA       LYS  29  -9.396  -0.298  -4.612
  246    HB2  LYS  29           2HB      LYS  29  -6.375  -0.422  -4.458
  247    HB3  LYS  29           1HB      LYS  29  -7.312   0.999  -4.893
  248    HG2  LYS  29           2HG      LYS  29  -7.194  -0.376  -2.209
  249    HG3  LYS  29           1HG      LYS  29  -6.606   1.233  -2.635
  250    HD2  LYS  29           2HD      LYS  29  -9.497   0.372  -2.662
  251    HD3  LYS  29           1HD      LYS  29  -8.726   1.354  -1.416
  252    HE2  LYS  29           2HE      LYS  29  -8.875   2.136  -4.324
  253    HE3  LYS  29           1HE      LYS  29 -10.054   2.636  -3.115
  254    HZ1  LYS  29           3HZ      LYS  29  -8.257   4.276  -3.594
  255    HZ2  LYS  29           1HZ      LYS  29  -7.150   3.205  -2.882
  256    HZ3  LYS  29           2HZ      LYS  29  -8.413   3.855  -1.958
  257    H    LEU  30           H        LEU  30  -7.206  -2.719  -5.974
  258    HA   LEU  30           HA       LEU  30  -6.746  -1.543  -8.425
  259    HB2  LEU  30           2HB      LEU  30  -5.641  -3.420  -8.936
  260    HB3  LEU  30           1HB      LEU  30  -5.914  -3.800  -7.250
  261    HG   LEU  30           HG       LEU  30  -8.171  -4.806  -8.480
  262   HD11  LEU  30          1HD1      LEU  30  -7.198  -4.419 -10.677
  263   HD12  LEU  30          2HD1      LEU  30  -7.347  -6.146 -10.347
  264   HD13  LEU  30          3HD1      LEU  30  -5.775  -5.357 -10.223
  265   HD21  LEU  30          3HD2      LEU  30  -7.194  -6.987  -8.020
  266   HD22  LEU  30          1HD2      LEU  30  -6.870  -5.874  -6.688
  267   HD23  LEU  30          2HD2      LEU  30  -5.599  -6.258  -7.855
  268    H    GLN  31           H        GLN  31  -9.398  -3.565  -7.381
  269    HA   GLN  31           HA       GLN  31 -11.143  -2.359  -9.309
  270    HB2  GLN  31           2HB      GLN  31 -11.916  -4.653 -10.155
  271    HB3  GLN  31           1HB      GLN  31 -10.416  -4.017 -10.810
  272    HG2  GLN  31           2HG      GLN  31  -9.749  -6.139 -10.393
  273    HG3  GLN  31           1HG      GLN  31  -9.370  -5.416  -8.832
  274   HE21  GLN  31          1HE2      GLN  31 -10.458  -6.114  -7.006
  275   HE22  GLN  31          2HE2      GLN  31 -11.604  -7.405  -7.058
  276    H    ASP  32           H        ASP  32 -10.759  -2.586  -6.481
  277    HA   ASP  32           HA       ASP  32 -11.425  -3.495  -4.527
  278    HB2  ASP  32           2HB      ASP  32 -13.784  -3.029  -3.996
  279    HB3  ASP  32           1HB      ASP  32 -12.940  -1.678  -4.735
  280    H    VAL  33           H        VAL  33 -11.065  -5.370  -4.082
  281    HA   VAL  33           HA       VAL  33 -11.690  -7.614  -5.568
  282    HB   VAL  33           HB       VAL  33  -9.804  -7.660  -4.187
  283   HG11  VAL  33          1HG1      VAL  33 -10.490  -6.035  -2.579
  284   HG12  VAL  33          2HG1      VAL  33  -9.891  -7.476  -1.747
  285   HG13  VAL  33          3HG1      VAL  33 -11.629  -7.172  -1.847
  286   HG21  VAL  33          3HG2      VAL  33 -10.093  -9.682  -2.823
  287   HG22  VAL  33          1HG2      VAL  33 -10.886  -9.839  -4.390
  288   HG23  VAL  33          2HG2      VAL  33 -11.844  -9.512  -2.946
  289    H    HIS  34           H        HIS  34 -13.105  -9.177  -5.482
  290    HA   HIS  34           HA       HIS  34 -15.025 -10.319  -5.077
  291    HB2  HIS  34           2HB      HIS  34 -14.747  -9.999  -2.644
  292    HB3  HIS  34           1HB      HIS  34 -15.533  -8.428  -2.772
  293    HD1  HIS  34           1HD      HIS  34 -16.351 -12.079  -3.493
  294    HD2  HIS  34           2HD      HIS  34 -18.216  -8.530  -2.378
  295    HE1  HIS  34           1HE      HIS  34 -18.751 -12.685  -3.035
  296    HE2  HIS  34           2HE      HIS  34 -19.831 -10.546  -2.256
  297    H    ASN  35           H        ASN  35 -14.715  -7.047  -5.618
  298    HA   ASN  35           HA       ASN  35 -15.805  -5.542  -6.885
  299    HB2  ASN  35           2HB      ASN  35 -17.157  -7.986  -8.036
  300    HB3  ASN  35           1HB      ASN  35 -17.199  -6.374  -8.744
  301   HD21  ASN  35          1HD2      ASN  35 -14.389  -5.887  -7.873
  302   HD22  ASN  35          2HD2      ASN  35 -13.405  -6.783  -8.996
  303    H    PHE  36           H        PHE  36 -16.867  -4.312  -5.579
  304    HA   PHE  36           HA       PHE  36 -19.283  -5.235  -4.307
  305    HB2  PHE  36           2HB      PHE  36 -17.755  -2.648  -4.142
  306    HB3  PHE  36           1HB      PHE  36 -19.186  -3.017  -3.162
  307    HD1  PHE  36           2HD      PHE  36 -19.059  -5.322  -1.898
  308    HD2  PHE  36           1HD      PHE  36 -15.696  -3.127  -3.298
  309    HE1  PHE  36           2HE      PHE  36 -17.638  -6.444  -0.233
  310    HE2  PHE  36           1HE      PHE  36 -14.271  -4.239  -1.636
  311    HZ   PHE  36           HZ       PHE  36 -15.231  -6.089  -0.263
  312    HA   PRO  37           HA       PRO  37 -21.236  -1.698  -7.050
  313    HB2  PRO  37           2HB      PRO  37 -19.093  -1.200  -9.029
  314    HB3  PRO  37           1HB      PRO  37 -20.173  -0.061  -8.216
  315    HG2  PRO  37           2HG      PRO  37 -17.598  -0.239  -7.538
  316    HG3  PRO  37           1HG      PRO  37 -18.856   0.038  -6.319
  317    HD2  PRO  37           2HD      PRO  37 -17.408  -2.497  -7.006
  318    HD3  PRO  37           1HD      PRO  37 -17.845  -1.849  -5.411
  319    HA   PRO  38           HA       PRO  38 -20.720  -4.047 -11.203
  320    HB2  PRO  38           2HB      PRO  38 -18.547  -5.977 -10.920
  321    HB3  PRO  38           1HB      PRO  38 -18.806  -4.757 -12.170
  322    HG2  PRO  38           2HG      PRO  38 -16.840  -4.521 -10.350
  323    HG3  PRO  38           1HG      PRO  38 -17.711  -3.110 -10.976
  324    HD2  PRO  38           2HD      PRO  38 -18.123  -4.577  -8.411
  325    HD3  PRO  38           1HD      PRO  38 -18.022  -2.831  -8.706
  326    H    ASP  39           H        ASP  39 -22.638  -4.918 -10.287
  327    HA   ASP  39           HA       ASP  39 -22.811  -7.404  -9.012
  328    HB2  ASP  39           2HB      ASP  39 -24.583  -5.610  -9.332
  329    HB3  ASP  39           1HB      ASP  39 -24.810  -6.257 -10.951
  Start of MODEL    6
    1    H2   PRO   1           1HT      PRO   1  24.980  -0.091  -4.063
    2    H3   PRO   1           2HT      PRO   1  26.296   0.826  -4.390
    3    HA   PRO   1           HA       PRO   1  25.280   2.710  -4.138
    4    HB2  PRO   1           2HB      PRO   1  22.525   2.226  -4.684
    5    HB3  PRO   1           1HB      PRO   1  23.667   3.205  -5.614
    6    HG2  PRO   1           2HG      PRO   1  22.840   0.392  -6.007
    7    HG3  PRO   1           1HG      PRO   1  23.417   1.574  -7.196
    8    HD2  PRO   1           2HD      PRO   1  24.974  -0.448  -6.425
    9    HD3  PRO   1           1HD      PRO   1  25.658   1.163  -6.700
   10    HA   PRO   2           HA       PRO   2  24.021   0.207  -0.358
   11    HB2  PRO   2           2HB      PRO   2  25.808   2.212   0.901
   12    HB3  PRO   2           1HB      PRO   2  25.722   0.461   1.133
   13    HG2  PRO   2           2HG      PRO   2  27.718   1.538  -0.261
   14    HG3  PRO   2           1HG      PRO   2  26.969   0.013  -0.774
   15    HD2  PRO   2           2HD      PRO   2  26.569   2.779  -1.860
   16    HD3  PRO   2           1HD      PRO   2  26.717   1.236  -2.730
   17    H    SER   3           H        SER   3  22.024   0.785  -0.019
   18    HA   SER   3           HA       SER   3  20.156   1.909   0.571
   19    HB2  SER   3           2HB      SER   3  22.073   3.580   2.212
   20    HB3  SER   3           1HB      SER   3  20.324   3.502   2.430
   21    HG   SER   3           HG       SER   3  20.940   1.041   2.522
   22    H    VAL   4           H        VAL   4  22.218   3.116  -1.524
   23    HA   VAL   4           HA       VAL   4  21.278   5.836  -1.722
   24    HB   VAL   4           HB       VAL   4  22.891   4.201  -3.690
   25   HG11  VAL   4          1HG1      VAL   4  22.393   7.177  -3.582
   26   HG12  VAL   4          2HG1      VAL   4  21.713   6.058  -4.765
   27   HG13  VAL   4          3HG1      VAL   4  23.454   6.344  -4.720
   28   HG21  VAL   4          3HG2      VAL   4  24.808   5.476  -2.849
   29   HG22  VAL   4          1HG2      VAL   4  24.059   4.511  -1.577
   30   HG23  VAL   4          2HG2      VAL   4  23.764   6.249  -1.655
   31    H    SER   5           H        SER   5  20.819   2.793  -3.495
   32    HA   SER   5           HA       SER   5  18.323   3.980  -4.514
   33    HB2  SER   5           2HB      SER   5  18.507   2.366  -6.392
   34    HB3  SER   5           1HB      SER   5  19.796   3.574  -6.365
   35    HG   SER   5           HG       SER   5  20.207   1.096  -6.591
   36    H    GLU   6           H        GLU   6  19.775   1.349  -2.839
   37    HA   GLU   6           HA       GLU   6  18.021  -0.735  -3.328
   38    HB2  GLU   6           2HB      GLU   6  19.443  -0.201  -0.724
   39    HB3  GLU   6           1HB      GLU   6  18.932  -1.762  -1.353
   40    HG2  GLU   6           2HG      GLU   6  20.546  -1.663  -3.106
   41    HG3  GLU   6           1HG      GLU   6  20.954   0.006  -2.704
   42    H    ILE   7           H        ILE   7  17.497   2.086  -1.433
   43    HA   ILE   7           HA       ILE   7  15.160   0.843  -0.165
   44    HB   ILE   7           HB       ILE   7  16.549   3.367   0.724
   45   HG12  ILE   7          2HG1      ILE   7  18.148   1.552   0.905
   46   HG13  ILE   7          1HG1      ILE   7  17.576   1.989   2.511
   47   HG21  ILE   7          1HG2      ILE   7  14.613   1.541   2.135
   48   HG22  ILE   7          2HG2      ILE   7  14.249   3.137   1.483
   49   HG23  ILE   7          3HG2      ILE   7  15.371   2.972   2.833
   50   HD11  ILE   7          3HD1      ILE   7  17.741  -0.412   2.288
   51   HD12  ILE   7          1HD1      ILE   7  16.680  -0.374   0.880
   52   HD13  ILE   7          2HD1      ILE   7  16.054   0.065   2.470
   53    H    GLN   8           H        GLN   8  16.095   3.168  -2.530
   54    HA   GLN   8           HA       GLN   8  13.601   4.688  -2.076
   55    HB2  GLN   8           2HB      GLN   8  16.178   5.525  -3.393
   56    HB3  GLN   8           1HB      GLN   8  14.695   6.458  -3.520
   57    HG2  GLN   8           2HG      GLN   8  15.899   7.463  -1.805
   58    HG3  GLN   8           1HG      GLN   8  14.679   6.494  -0.984
   59   HE21  GLN   8          1HE2      GLN   8  17.583   5.269  -2.495
   60   HE22  GLN   8          2HE2      GLN   8  18.353   4.751  -1.038
   61    H    LEU   9           H        LEU   9  15.335   2.760  -4.356
   62    HA   LEU   9           HA       LEU   9  13.545   3.523  -6.509
   63    HB2  LEU   9           2HB      LEU   9  15.988   1.796  -6.340
   64    HB3  LEU   9           1HB      LEU   9  14.920   1.692  -7.729
   65    HG   LEU   9           HG       LEU   9  15.259   4.124  -8.128
   66   HD11  LEU   9          1HD1      LEU   9  15.935   4.609  -5.705
   67   HD12  LEU   9          2HD1      LEU   9  16.861   5.399  -6.986
   68   HD13  LEU   9          3HD1      LEU   9  17.526   3.988  -6.165
   69   HD21  LEU   9          3HD2      LEU   9  16.557   2.461  -9.332
   70   HD22  LEU   9          1HD2      LEU   9  17.765   2.456  -8.046
   71   HD23  LEU   9          2HD2      LEU   9  17.518   3.906  -9.019
   72    H    MET  10           H        MET  10  13.844   1.117  -4.080
   73    HA   MET  10           HA       MET  10  11.893  -0.670  -5.084
   74    HB2  MET  10           2HB      MET  10  12.965   0.037  -2.383
   75    HB3  MET  10           1HB      MET  10  11.480  -0.899  -2.486
   76    HG2  MET  10           2HG      MET  10  13.464  -2.294  -2.230
   77    HG3  MET  10           1HG      MET  10  12.587  -2.615  -3.724
   78    HE1  MET  10           3HE      MET  10  15.528  -3.613  -3.083
   79    HE2  MET  10           1HE      MET  10  16.390  -3.278  -4.586
   80    HE3  MET  10           2HE      MET  10  14.766  -3.965  -4.633
   81    H    HIS  11           H        HIS  11   9.764  -0.274  -5.419
   82    HA   HIS  11           HA       HIS  11   8.737   2.339  -4.746
   83    HB2  HIS  11           2HB      HIS  11   7.434   0.014  -6.179
   84    HB3  HIS  11           1HB      HIS  11   6.718   1.612  -5.999
   85    HD1  HIS  11           1HD      HIS  11   7.582   0.137  -8.734
   86    HD2  HIS  11           2HD      HIS  11   9.590   3.227  -6.802
   87    HE1  HIS  11           1HE      HIS  11   8.966   1.258 -10.503
   88    HE2  HIS  11           2HE      HIS  11  10.329   2.981  -9.271
   89    H    ASN  12           H        ASN  12   9.344   1.018  -2.488
   90    HA   ASN  12           HA       ASN  12   6.762   0.228  -1.308
   91    HB2  ASN  12           2HB      ASN  12   9.555  -0.408  -0.310
   92    HB3  ASN  12           1HB      ASN  12   8.047  -1.018   0.357
   93   HD21  ASN  12          1HD2      ASN  12  10.401  -2.383  -0.752
   94   HD22  ASN  12          2HD2      ASN  12   9.802  -3.409  -2.011
   95    H    ARG  13           H        ARG  13   8.235   2.856  -1.805
   96    HA   ARG  13           HA       ARG  13   9.158   3.955   0.587
   97    HB2  ARG  13           2HB      ARG  13   7.838   5.369  -1.734
   98    HB3  ARG  13           1HB      ARG  13   8.822   6.131  -0.493
   99    HG2  ARG  13           2HG      ARG  13   9.766   4.104  -2.512
  100    HG3  ARG  13           1HG      ARG  13  10.082   5.839  -2.548
  101    HD2  ARG  13           2HD      ARG  13  11.026   3.872  -0.464
  102    HD3  ARG  13           1HD      ARG  13  12.014   4.667  -1.688
  103    HE   ARG  13           HE       ARG  13  11.100   6.793  -0.437
  104   HH11  ARG  13          1HH1      ARG  13  12.330   3.794   0.889
  105   HH12  ARG  13          2HH1      ARG  13  12.813   4.512   2.399
  106   HH21  ARG  13          1HH2      ARG  13  11.722   7.736   1.543
  107   HH22  ARG  13          2HH2      ARG  13  12.437   6.744   2.778
  108    H    GLY  14           H        GLY  14   8.161   5.409   2.066
  109    HA2  GLY  14           2HA      GLY  14   5.637   6.354   2.180
  110    HA3  GLY  14           1HA      GLY  14   5.428   4.672   2.643
  111    H    LYS  15           H        LYS  15   5.157   4.568   4.741
  112    HA   LYS  15           HA       LYS  15   6.421   6.529   6.495
  113    HB2  LYS  15           2HB      LYS  15   4.328   4.419   7.040
  114    HB3  LYS  15           1HB      LYS  15   4.883   5.626   8.193
  115    HG2  LYS  15           2HG      LYS  15   4.004   7.403   6.842
  116    HG3  LYS  15           1HG      LYS  15   3.570   6.265   5.565
  117    HD2  LYS  15           2HD      LYS  15   1.650   6.955   6.973
  118    HD3  LYS  15           1HD      LYS  15   1.943   5.215   6.990
  119    HE2  LYS  15           2HE      LYS  15   2.961   5.322   9.131
  120    HE3  LYS  15           1HE      LYS  15   3.014   7.084   9.086
  121    HZ1  LYS  15           3HZ      LYS  15   1.208   6.120  10.486
  122    HZ2  LYS  15           1HZ      LYS  15   0.496   5.504   9.076
  123    HZ3  LYS  15           2HZ      LYS  15   0.655   7.181   9.284
  124    H    HIS  16           H        HIS  16   5.808   3.041   6.661
  125    HA   HIS  16           HA       HIS  16   8.358   2.697   8.102
  126    HB2  HIS  16           2HB      HIS  16   6.317   2.036   9.340
  127    HB3  HIS  16           1HB      HIS  16   5.880   0.935   8.039
  128    HD1  HIS  16           1HD      HIS  16   7.792   1.151  11.154
  129    HD2  HIS  16           2HD      HIS  16   7.690  -1.341   7.824
  130    HE1  HIS  16           1HE      HIS  16   8.949  -0.976  11.854
  131    HE2  HIS  16           2HE      HIS  16   8.724  -2.524   9.873
  132    H    LEU  17           H        LEU  17   6.193   1.120   5.857
  133    HA   LEU  17           HA       LEU  17   7.944   0.484   3.814
  134    HB2  LEU  17           2HB      LEU  17   9.177  -1.112   4.904
  135    HB3  LEU  17           1HB      LEU  17   7.914  -1.466   6.070
  136    HG   LEU  17           HG       LEU  17   6.747  -2.640   4.065
  137   HD11  LEU  17          1HD1      LEU  17   8.460  -1.606   2.504
  138   HD12  LEU  17          2HD1      LEU  17   8.063  -3.307   2.266
  139   HD13  LEU  17          3HD1      LEU  17   9.565  -2.851   3.077
  140   HD21  LEU  17          3HD2      LEU  17   7.645  -3.814   6.006
  141   HD22  LEU  17          1HD2      LEU  17   9.260  -3.779   5.291
  142   HD23  LEU  17          2HD2      LEU  17   7.972  -4.708   4.520
  143    H    ASN  18           H        ASN  18   5.464  -0.925   5.851
  144    HA   ASN  18           HA       ASN  18   3.267  -1.283   5.597
  145    HB2  ASN  18           2HB      ASN  18   3.425   0.878   3.500
  146    HB3  ASN  18           1HB      ASN  18   2.012   0.412   4.434
  147   HD21  ASN  18          1HD2      ASN  18   2.365   0.498   6.817
  148   HD22  ASN  18          2HD2      ASN  18   3.164   1.911   7.433
  149    H    SER  19           H        SER  19   5.046  -2.868   4.020
  150    HA   SER  19           HA       SER  19   4.033  -3.334   1.451
  151    HB2  SER  19           2HB      SER  19   6.198  -4.222   2.276
  152    HB3  SER  19           1HB      SER  19   5.324  -5.299   3.368
  153    HG   SER  19           HG       SER  19   5.003  -6.625   1.778
  154    H    MET  20           H        MET  20   3.016  -4.310   4.634
  155    HA   MET  20           HA       MET  20   1.047  -6.194   3.720
  156    HB2  MET  20           2HB      MET  20   0.388  -6.366   6.020
  157    HB3  MET  20           1HB      MET  20   2.139  -6.273   5.970
  158    HG2  MET  20           2HG      MET  20   2.045  -3.915   6.578
  159    HG3  MET  20           1HG      MET  20   0.287  -4.023   6.635
  160    HE1  MET  20           3HE      MET  20  -1.080  -5.306   8.435
  161    HE2  MET  20           1HE      MET  20  -0.370  -6.329   9.685
  162    HE3  MET  20           2HE      MET  20  -0.277  -6.815   7.991
  163    H    GLU  21           H        GLU  21   0.950  -2.870   4.994
  164    HA   GLU  21           HA       GLU  21  -1.722  -2.275   4.742
  165    HB2  GLU  21           2HB      GLU  21   0.746  -0.654   4.216
  166    HB3  GLU  21           1HB      GLU  21  -0.833   0.032   3.861
  167    HG2  GLU  21           2HG      GLU  21  -0.082   0.726   6.028
  168    HG3  GLU  21           1HG      GLU  21  -1.495  -0.312   6.186
  169    H    ARG  22           H        ARG  22   0.721  -1.829   2.258
  170    HA   ARG  22           HA       ARG  22  -0.846  -1.237   0.041
  171    HB2  ARG  22           2HB      ARG  22   1.829  -2.454   0.519
  172    HB3  ARG  22           1HB      ARG  22   1.120  -2.633  -1.069
  173    HG2  ARG  22           2HG      ARG  22   2.652  -0.711  -0.906
  174    HG3  ARG  22           1HG      ARG  22   1.013  -0.246  -1.351
  175    HD2  ARG  22           2HD      ARG  22   1.148   1.261   0.283
  176    HD3  ARG  22           1HD      ARG  22   0.982  -0.096   1.398
  177    HE   ARG  22           HE       ARG  22   3.392  -0.128   1.590
  178   HH11  ARG  22          1HH1      ARG  22   1.951   2.708   0.177
  179   HH12  ARG  22          2HH1      ARG  22   3.340   3.719   0.430
  180   HH21  ARG  22          1HH2      ARG  22   5.257   1.170   1.922
  181   HH22  ARG  22          2HH2      ARG  22   5.238   2.829   1.393
  182    H    VAL  23           H        VAL  23   0.524  -4.435   0.811
  183    HA   VAL  23           HA       VAL  23  -0.612  -5.787  -1.327
  184    HB   VAL  23           HB       VAL  23   1.258  -6.597   0.103
  185   HG11  VAL  23          1HG1      VAL  23  -0.504  -6.049   2.016
  186   HG12  VAL  23          2HG1      VAL  23   0.956  -7.025   2.265
  187   HG13  VAL  23          3HG1      VAL  23  -0.607  -7.814   1.987
  188   HG21  VAL  23          3HG2      VAL  23  -0.147  -8.097  -1.426
  189   HG22  VAL  23          1HG2      VAL  23  -0.924  -8.630   0.059
  190   HG23  VAL  23          2HG2      VAL  23   0.803  -8.890  -0.165
  191    H    GLU  24           H        GLU  24  -2.135  -4.848   1.690
  192    HA   GLU  24           HA       GLU  24  -4.420  -6.544   1.303
  193    HB2  GLU  24           2HB      GLU  24  -4.336  -3.884   2.747
  194    HB3  GLU  24           1HB      GLU  24  -5.557  -5.142   2.914
  195    HG2  GLU  24           2HG      GLU  24  -2.685  -5.402   3.648
  196    HG3  GLU  24           1HG      GLU  24  -3.990  -5.068   4.787
  197    H    TRP  25           H        TRP  25  -3.846  -3.065   0.816
  198    HA   TRP  25           HA       TRP  25  -6.344  -2.804  -0.457
  199    HB2  TRP  25           2HB      TRP  25  -5.661  -0.603  -1.205
  200    HB3  TRP  25           1HB      TRP  25  -5.671  -0.867   0.519
  201    HD1  TRP  25           HD       TRP  25  -3.558  -0.215   1.754
  202    HE1  TRP  25           1HE      TRP  25  -1.351   0.942   1.100
  203    HE3  TRP  25           3HE      TRP  25  -3.854  -0.844  -3.229
  204    HZ2  TRP  25           2HZ      TRP  25   0.069   1.488  -1.291
  205    HZ3  TRP  25           3HZ      TRP  25  -2.059   0.015  -4.675
  206    HH2  TRP  25           HH       TRP  25  -0.123   1.151  -3.719
  207    H    LEU  26           H        LEU  26  -3.318  -3.778  -1.734
  208    HA   LEU  26           HA       LEU  26  -3.637  -3.189  -4.353
  209    HB2  LEU  26           2HB      LEU  26  -3.095  -6.007  -3.430
  210    HB3  LEU  26           1HB      LEU  26  -2.581  -5.270  -4.925
  211    HG   LEU  26           HG       LEU  26  -1.461  -4.922  -2.177
  212   HD11  LEU  26          1HD1      LEU  26  -0.231  -5.441  -4.886
  213   HD12  LEU  26          2HD1      LEU  26  -0.483  -6.630  -3.605
  214   HD13  LEU  26          3HD1      LEU  26   0.653  -5.300  -3.366
  215   HD21  LEU  26          3HD2      LEU  26  -0.199  -3.002  -2.987
  216   HD22  LEU  26          1HD2      LEU  26  -1.946  -2.731  -2.951
  217   HD23  LEU  26          2HD2      LEU  26  -1.124  -3.036  -4.494
  218    H    ARG  27           H        ARG  27  -5.410  -5.411  -2.374
  219    HA   ARG  27           HA       ARG  27  -6.890  -6.305  -4.720
  220    HB2  ARG  27           2HB      ARG  27  -6.672  -7.503  -1.959
  221    HB3  ARG  27           1HB      ARG  27  -7.538  -8.213  -3.323
  222    HG2  ARG  27           2HG      ARG  27  -5.595  -9.297  -3.666
  223    HG3  ARG  27           1HG      ARG  27  -5.142  -7.777  -4.461
  224    HD2  ARG  27           2HD      ARG  27  -4.037  -6.990  -2.403
  225    HD3  ARG  27           1HD      ARG  27  -4.538  -8.492  -1.580
  226    HE   ARG  27           HE       ARG  27  -2.748  -8.483  -3.936
  227   HH11  ARG  27          1HH1      ARG  27  -3.511  -9.591  -0.690
  228   HH12  ARG  27          2HH1      ARG  27  -2.236 -10.770  -0.663
  229   HH21  ARG  27          1HH2      ARG  27  -1.106 -10.021  -3.906
  230   HH22  ARG  27          2HH2      ARG  27  -0.873 -11.035  -2.512
  231    H    LYS  28           H        LYS  28  -7.264  -3.772  -2.882
  232    HA   LYS  28           HA       LYS  28 -10.134  -4.048  -3.392
  233    HB2  LYS  28           2HB      LYS  28 -10.672  -2.659  -1.575
  234    HB3  LYS  28           1HB      LYS  28  -9.527  -3.850  -0.959
  235    HG2  LYS  28           2HG      LYS  28  -7.723  -2.208  -1.312
  236    HG3  LYS  28           1HG      LYS  28  -8.958  -1.035  -1.754
  237    HD2  LYS  28           2HD      LYS  28 -10.012  -1.448   0.479
  238    HD3  LYS  28           1HD      LYS  28  -8.573  -2.406   0.873
  239    HE2  LYS  28           2HE      LYS  28  -7.164  -0.483   0.436
  240    HE3  LYS  28           1HE      LYS  28  -8.584   0.482   0.034
  241    HZ1  LYS  28           3HZ      LYS  28  -9.388   0.197   2.299
  242    HZ2  LYS  28           1HZ      LYS  28  -7.855   0.918   2.290
  243    HZ3  LYS  28           2HZ      LYS  28  -8.014  -0.718   2.696
  244    H    LYS  29           H        LYS  29  -7.198  -2.263  -3.975
  245    HA   LYS  29           HA       LYS  29  -8.558  -0.587  -5.855
  246    HB2  LYS  29           2HB      LYS  29  -8.094   1.560  -4.816
  247    HB3  LYS  29           1HB      LYS  29  -9.168   0.576  -3.840
  248    HG2  LYS  29           2HG      LYS  29  -7.718   1.543  -2.304
  249    HG3  LYS  29           1HG      LYS  29  -7.068  -0.086  -2.525
  250    HD2  LYS  29           2HD      LYS  29  -5.164   1.222  -2.680
  251    HD3  LYS  29           1HD      LYS  29  -5.650   0.998  -4.371
  252    HE2  LYS  29           2HE      LYS  29  -6.432   3.412  -2.739
  253    HE3  LYS  29           1HE      LYS  29  -4.962   3.350  -3.707
  254    HZ1  LYS  29           3HZ      LYS  29  -7.754   3.100  -4.710
  255    HZ2  LYS  29           1HZ      LYS  29  -6.365   2.920  -5.667
  256    HZ3  LYS  29           2HZ      LYS  29  -6.709   4.412  -4.946
  257    H    LEU  30           H        LEU  30  -5.986  -2.359  -5.654
  258    HA   LEU  30           HA       LEU  30  -3.825  -0.628  -6.077
  259    HB2  LEU  30           2HB      LEU  30  -2.636  -2.506  -6.245
  260    HB3  LEU  30           1HB      LEU  30  -4.145  -3.307  -5.861
  261    HG   LEU  30           HG       LEU  30  -3.806  -2.833  -8.723
  262   HD11  LEU  30          1HD1      LEU  30  -1.456  -3.192  -8.080
  263   HD12  LEU  30          2HD1      LEU  30  -2.094  -4.508  -9.067
  264   HD13  LEU  30          3HD1      LEU  30  -1.911  -4.720  -7.325
  265   HD21  LEU  30          3HD2      LEU  30  -5.551  -4.249  -8.121
  266   HD22  LEU  30          1HD2      LEU  30  -4.588  -5.098  -6.903
  267   HD23  LEU  30          2HD2      LEU  30  -4.283  -5.364  -8.627
  268    H    GLN  31           H        GLN  31  -6.014  -2.233  -8.205
  269    HA   GLN  31           HA       GLN  31  -6.321   0.019  -9.867
  270    HB2  GLN  31           2HB      GLN  31  -5.858  -1.480 -11.997
  271    HB3  GLN  31           1HB      GLN  31  -4.556  -0.567 -11.258
  272    HG2  GLN  31           2HG      GLN  31  -3.437  -2.489 -11.354
  273    HG3  GLN  31           1HG      GLN  31  -4.364  -2.921  -9.925
  274   HE21  GLN  31          1HE2      GLN  31  -5.979  -4.428 -10.074
  275   HE22  GLN  31          2HE2      GLN  31  -6.192  -5.425 -11.467
  276    H    ASP  32           H        ASP  32  -8.470  -0.012  -9.679
  277    HA   ASP  32           HA       ASP  32  -9.696  -2.363  -8.777
  278    HB2  ASP  32           2HB      ASP  32 -11.865  -1.068  -9.105
  279    HB3  ASP  32           1HB      ASP  32 -10.684  -0.397  -7.991
  280    H    VAL  33           H        VAL  33  -9.810  -3.994  -9.922
  281    HA   VAL  33           HA       VAL  33 -11.113  -3.964 -12.541
  282    HB   VAL  33           HB       VAL  33  -8.537  -5.381 -11.839
  283   HG11  VAL  33          1HG1      VAL  33  -8.569  -6.272 -14.125
  284   HG12  VAL  33          2HG1      VAL  33 -10.153  -5.545 -14.390
  285   HG13  VAL  33          3HG1      VAL  33  -9.962  -6.836 -13.204
  286   HG21  VAL  33          3HG2      VAL  33  -7.576  -4.057 -13.653
  287   HG22  VAL  33          1HG2      VAL  33  -8.253  -3.035 -12.382
  288   HG23  VAL  33          2HG2      VAL  33  -9.135  -3.262 -13.898
  289    H    HIS  34           H        HIS  34  -9.564  -6.413 -10.424
  290    HA   HIS  34           HA       HIS  34 -12.083  -7.924 -10.509
  291    HB2  HIS  34           2HB      HIS  34  -9.887  -9.033 -11.149
  292    HB3  HIS  34           1HB      HIS  34  -9.415  -8.882  -9.460
  293    HD1  HIS  34           1HD      HIS  34  -9.954 -10.846  -8.052
  294    HD2  HIS  34           2HD      HIS  34 -12.421 -10.589 -11.394
  295    HE1  HIS  34           1HE      HIS  34 -11.400 -12.905  -7.997
  296    HE2  HIS  34           2HE      HIS  34 -13.011 -12.626  -9.915
  297    H    ASN  35           H        ASN  35 -10.253  -5.898  -8.615
  298    HA   ASN  35           HA       ASN  35 -11.450  -6.779  -6.106
  299    HB2  ASN  35           2HB      ASN  35  -9.978  -4.750  -5.292
  300    HB3  ASN  35           1HB      ASN  35  -9.236  -6.306  -5.649
  301   HD21  ASN  35          1HD2      ASN  35  -9.876  -3.113  -6.921
  302   HD22  ASN  35          2HD2      ASN  35  -8.530  -3.072  -8.010
  303    H    PHE  36           H        PHE  36 -13.481  -6.156  -7.277
  304    HA   PHE  36           HA       PHE  36 -13.953  -3.278  -7.353
  305    HB2  PHE  36           2HB      PHE  36 -14.502  -5.230  -9.194
  306    HB3  PHE  36           1HB      PHE  36 -16.065  -4.995  -8.416
  307    HD1  PHE  36           1HD      PHE  36 -13.258  -2.813  -9.575
  308    HD2  PHE  36           2HD      PHE  36 -17.447  -3.544  -9.486
  309    HE1  PHE  36           1HE      PHE  36 -13.633  -0.801 -10.936
  310    HE2  PHE  36           2HE      PHE  36 -17.831  -1.535 -10.850
  311    HZ   PHE  36           HZ       PHE  36 -15.890  -0.131 -11.541
  312    HA   PRO  37           HA       PRO  37 -17.513  -5.563  -4.451
  313    HB2  PRO  37           2HB      PRO  37 -15.141  -6.176  -2.721
  314    HB3  PRO  37           1HB      PRO  37 -16.747  -6.915  -2.719
  315    HG2  PRO  37           2HG      PRO  37 -14.707  -8.095  -3.957
  316    HG3  PRO  37           1HG      PRO  37 -16.338  -8.126  -4.651
  317    HD2  PRO  37           2HD      PRO  37 -13.945  -6.649  -5.544
  318    HD3  PRO  37           1HD      PRO  37 -15.384  -7.129  -6.462
  319    HA   PRO  38           HA       PRO  38 -15.730  -2.163  -1.393
  320    HB2  PRO  38           2HB      PRO  38 -13.497  -1.126  -3.044
  321    HB3  PRO  38           1HB      PRO  38 -13.604  -1.323  -1.290
  322    HG2  PRO  38           2HG      PRO  38 -12.137  -3.001  -2.724
  323    HG3  PRO  38           1HG      PRO  38 -13.142  -3.606  -1.395
  324    HD2  PRO  38           2HD      PRO  38 -13.689  -3.656  -4.326
  325    HD3  PRO  38           1HD      PRO  38 -13.897  -4.938  -3.119
  326    H    ASP  39           H        ASP  39 -17.773  -1.609  -2.453
  327    HA   ASP  39           HA       ASP  39 -18.048   0.051  -4.658
  328    HB2  ASP  39           2HB      ASP  39 -19.816  -1.192  -3.393
  329    HB3  ASP  39           1HB      ASP  39 -19.729   0.051  -2.153
  Start of MODEL    7
    1    H2   PRO   1           1HT      PRO   1  17.479  10.843 -14.359
    2    H3   PRO   1           2HT      PRO   1  18.859  10.316 -15.064
    3    HA   PRO   1           HA       PRO   1  18.785   8.361 -14.190
    4    HB2  PRO   1           2HB      PRO   1  17.377   8.589 -11.726
    5    HB3  PRO   1           1HB      PRO   1  19.100   8.258 -11.967
    6    HG2  PRO   1           2HG      PRO   1  17.725  10.831 -11.435
    7    HG3  PRO   1           1HG      PRO   1  19.368  10.322 -11.004
    8    HD2  PRO   1           2HD      PRO   1  18.967  12.082 -12.963
    9    HD3  PRO   1           1HD      PRO   1  20.209  10.827 -13.126
   10    HA   PRO   2           HA       PRO   2  14.419   8.571 -15.614
   11    HB2  PRO   2           2HB      PRO   2  15.213   6.559 -17.557
   12    HB3  PRO   2           1HB      PRO   2  14.590   8.185 -17.836
   13    HG2  PRO   2           2HG      PRO   2  17.158   7.452 -18.373
   14    HG3  PRO   2           1HG      PRO   2  16.681   9.106 -17.951
   15    HD2  PRO   2           2HD      PRO   2  17.946   7.001 -16.244
   16    HD3  PRO   2           1HD      PRO   2  18.247   8.751 -16.285
   17    H    SER   3           H        SER   3  15.334   5.399 -16.673
   18    HA   SER   3           HA       SER   3  13.440   4.260 -14.837
   19    HB2  SER   3           2HB      SER   3  15.189   2.999 -16.957
   20    HB3  SER   3           1HB      SER   3  13.973   2.128 -16.015
   21    HG   SER   3           HG       SER   3  12.548   3.983 -16.817
   22    H    VAL   4           H        VAL   4  16.531   5.178 -14.493
   23    HA   VAL   4           HA       VAL   4  17.680   3.132 -12.951
   24    HB   VAL   4           HB       VAL   4  18.023   6.127 -12.671
   25   HG11  VAL   4          1HG1      VAL   4  20.177   5.579 -11.622
   26   HG12  VAL   4          2HG1      VAL   4  19.771   3.865 -11.702
   27   HG13  VAL   4          3HG1      VAL   4  18.816   4.951 -10.692
   28   HG21  VAL   4          3HG2      VAL   4  19.983   5.853 -14.086
   29   HG22  VAL   4          1HG2      VAL   4  18.534   5.298 -14.923
   30   HG23  VAL   4          2HG2      VAL   4  19.656   4.128 -14.230
   31    H    SER   5           H        SER   5  15.772   6.004 -11.955
   32    HA   SER   5           HA       SER   5  14.970   4.517  -9.559
   33    HB2  SER   5           2HB      SER   5  16.051   7.336  -9.448
   34    HB3  SER   5           1HB      SER   5  15.516   6.345  -8.090
   35    HG   SER   5           HG       SER   5  17.779   6.303  -8.288
   36    H    GLU   6           H        GLU   6  13.645   5.673 -12.104
   37    HA   GLU   6           HA       GLU   6  12.102   7.871 -11.604
   38    HB2  GLU   6           2HB      GLU   6  10.357   6.789 -13.104
   39    HB3  GLU   6           1HB      GLU   6  11.973   6.982 -13.766
   40    HG2  GLU   6           2HG      GLU   6  12.449   4.649 -13.405
   41    HG3  GLU   6           1HG      GLU   6  10.909   4.422 -12.582
   42    H    ILE   7           H        ILE   7  10.778   4.581 -11.154
   43    HA   ILE   7           HA       ILE   7   8.997   5.717  -9.112
   44    HB   ILE   7           HB       ILE   7   8.553   3.196 -10.715
   45   HG12  ILE   7          2HG1      ILE   7   8.620   5.059 -12.263
   46   HG13  ILE   7          1HG1      ILE   7   6.954   4.544 -12.045
   47   HG21  ILE   7          1HG2      ILE   7   6.685   4.879  -9.047
   48   HG22  ILE   7          2HG2      ILE   7   7.293   3.271  -8.642
   49   HG23  ILE   7          3HG2      ILE   7   6.207   3.487 -10.016
   50   HD11  ILE   7          3HD1      ILE   7   7.100   6.954 -12.103
   51   HD12  ILE   7          1HD1      ILE   7   8.255   6.931 -10.769
   52   HD13  ILE   7          2HD1      ILE   7   6.589   6.411 -10.502
   53    H    GLN   8           H        GLN   8  11.797   4.043  -9.289
   54    HA   GLN   8           HA       GLN   8  11.007   1.840  -7.544
   55    HB2  GLN   8           2HB      GLN   8  13.643   2.392  -8.914
   56    HB3  GLN   8           1HB      GLN   8  13.311   0.989  -7.905
   57    HG2  GLN   8           2HG      GLN   8  12.954   0.104  -9.969
   58    HG3  GLN   8           1HG      GLN   8  11.324   0.651  -9.580
   59   HE21  GLN   8          1HE2      GLN   8  14.020   2.696 -10.509
   60   HE22  GLN   8          2HE2      GLN   8  13.356   3.198 -12.022
   61    H    LEU   9           H        LEU   9  13.527   4.375  -7.583
   62    HA   LEU   9           HA       LEU   9  14.019   3.860  -4.765
   63    HB2  LEU   9           2HB      LEU   9  15.444   5.530  -6.820
   64    HB3  LEU   9           1HB      LEU   9  15.816   5.657  -5.112
   65    HG   LEU   9           HG       LEU   9  17.435   4.217  -6.071
   66   HD11  LEU   9          1HD1      LEU   9  15.364   2.558  -4.645
   67   HD12  LEU   9          2HD1      LEU   9  16.653   3.507  -3.902
   68   HD13  LEU   9          3HD1      LEU   9  17.050   2.102  -4.892
   69   HD21  LEU   9          3HD2      LEU   9  16.305   3.641  -8.136
   70   HD22  LEU   9          1HD2      LEU   9  15.159   2.628  -7.255
   71   HD23  LEU   9          2HD2      LEU   9  16.866   2.184  -7.316
   72    H    MET  10           H        MET  10  11.610   5.296  -5.994
   73    HA   MET  10           HA       MET  10  11.556   7.917  -4.996
   74    HB2  MET  10           2HB      MET  10   9.542   5.893  -5.781
   75    HB3  MET  10           1HB      MET  10   8.985   7.157  -4.697
   76    HG2  MET  10           2HG      MET  10   9.773   8.834  -6.302
   77    HG3  MET  10           1HG      MET  10  10.221   7.536  -7.410
   78    HE1  MET  10           3HE      MET  10   8.681   8.740  -9.290
   79    HE2  MET  10           1HE      MET  10   8.293   9.986  -8.109
   80    HE3  MET  10           2HE      MET  10   6.998   9.184  -8.999
   81    H    HIS  11           H        HIS  11  12.034   8.426  -2.929
   82    HA   HIS  11           HA       HIS  11  11.376   6.799  -0.682
   83    HB2  HIS  11           2HB      HIS  11  11.972   9.762  -0.885
   84    HB3  HIS  11           1HB      HIS  11  11.804   8.891   0.635
   85    HD1  HIS  11           1HD      HIS  11  14.350  10.139  -1.420
   86    HD2  HIS  11           2HD      HIS  11  13.746   6.497   0.491
   87    HE1  HIS  11           1HE      HIS  11  16.620   9.068  -1.272
   88    HE2  HIS  11           2HE      HIS  11  16.183   6.759  -0.337
   89    H    ASN  12           H        ASN  12   9.633   8.707  -2.772
   90    HA   ASN  12           HA       ASN  12   7.379   9.476  -1.282
   91    HB2  ASN  12           2HB      ASN  12   7.757  10.413  -3.443
   92    HB3  ASN  12           1HB      ASN  12   7.881   8.832  -4.190
   93   HD21  ASN  12          1HD2      ASN  12   6.480   8.920  -5.643
   94   HD22  ASN  12          2HD2      ASN  12   4.791   9.116  -5.381
   95    H    ARG  13           H        ARG  13   8.421   6.402  -2.560
   96    HA   ARG  13           HA       ARG  13   5.938   5.218  -3.055
   97    HB2  ARG  13           2HB      ARG  13   8.586   3.952  -2.379
   98    HB3  ARG  13           1HB      ARG  13   7.170   3.037  -2.868
   99    HG2  ARG  13           2HG      ARG  13   8.683   5.058  -4.496
  100    HG3  ARG  13           1HG      ARG  13   8.596   3.317  -4.757
  101    HD2  ARG  13           2HD      ARG  13   6.378   5.330  -5.058
  102    HD3  ARG  13           1HD      ARG  13   7.148   4.391  -6.335
  103    HE   ARG  13           HE       ARG  13   5.141   3.477  -4.440
  104   HH11  ARG  13          1HH1      ARG  13   7.463   2.625  -6.920
  105   HH12  ARG  13          2HH1      ARG  13   6.681   1.121  -7.306
  106   HH21  ARG  13          1HH2      ARG  13   4.127   1.506  -4.922
  107   HH22  ARG  13          2HH2      ARG  13   4.805   0.468  -6.144
  108    H    GLY  14           H        GLY  14   7.880   5.224  -0.070
  109    HA2  GLY  14           2HA      GLY  14   5.525   4.254   1.361
  110    HA3  GLY  14           1HA      GLY  14   6.960   3.243   1.424
  111    H    LYS  15           H        LYS  15   5.609   4.519   3.623
  112    HA   LYS  15           HA       LYS  15   7.590   6.543   4.414
  113    HB2  LYS  15           2HB      LYS  15   4.850   5.985   5.561
  114    HB3  LYS  15           1HB      LYS  15   5.964   7.208   6.158
  115    HG2  LYS  15           2HG      LYS  15   5.894   8.252   3.883
  116    HG3  LYS  15           1HG      LYS  15   4.597   7.126   3.482
  117    HD2  LYS  15           2HD      LYS  15   3.696   9.284   4.179
  118    HD3  LYS  15           1HD      LYS  15   3.258   8.016   5.328
  119    HE2  LYS  15           2HE      LYS  15   4.966   8.727   6.851
  120    HE3  LYS  15           1HE      LYS  15   5.598   9.880   5.679
  121    HZ1  LYS  15           3HZ      LYS  15   4.247  10.967   7.359
  122    HZ2  LYS  15           1HZ      LYS  15   2.914  10.001   6.953
  123    HZ3  LYS  15           2HZ      LYS  15   3.529  11.119   5.835
  124    H    HIS  16           H        HIS  16   5.690   3.938   5.947
  125    HA   HIS  16           HA       HIS  16   8.095   3.285   7.519
  126    HB2  HIS  16           2HB      HIS  16   6.178   4.389   8.824
  127    HB3  HIS  16           1HB      HIS  16   5.269   2.909   8.531
  128    HD1  HIS  16           1HD      HIS  16   6.850   4.330  11.213
  129    HD2  HIS  16           2HD      HIS  16   7.359   0.632   9.371
  130    HE1  HIS  16           1HE      HIS  16   7.898   2.846  12.948
  131    HE2  HIS  16           2HE      HIS  16   8.058   0.576  11.864
  132    H    LEU  17           H        LEU  17   7.813   2.156   5.167
  133    HA   LEU  17           HA       LEU  17   7.457   0.307   3.934
  134    HB2  LEU  17           2HB      LEU  17   8.681  -0.443   6.440
  135    HB3  LEU  17           1HB      LEU  17   7.887  -1.782   5.619
  136    HG   LEU  17           HG       LEU  17  10.235  -1.533   4.993
  137   HD11  LEU  17          1HD1      LEU  17   8.534  -2.511   3.468
  138   HD12  LEU  17          2HD1      LEU  17   9.942  -1.836   2.652
  139   HD13  LEU  17          3HD1      LEU  17   8.428  -0.934   2.683
  140   HD21  LEU  17          3HD2      LEU  17  10.966   0.311   3.595
  141   HD22  LEU  17          1HD2      LEU  17  10.437   0.882   5.176
  142   HD23  LEU  17          2HD2      LEU  17   9.380   1.068   3.773
  143    H    ASN  18           H        ASN  18   5.324   0.598   3.546
  144    HA   ASN  18           HA       ASN  18   3.394  -0.484   5.430
  145    HB2  ASN  18           2HB      ASN  18   2.831   1.158   2.955
  146    HB3  ASN  18           1HB      ASN  18   1.782   0.902   4.345
  147   HD21  ASN  18          1HD2      ASN  18   2.554   1.650   6.379
  148   HD22  ASN  18          2HD2      ASN  18   3.484   3.108   6.446
  149    H    SER  19           H        SER  19   5.052  -2.150   3.818
  150    HA   SER  19           HA       SER  19   3.636  -3.173   1.586
  151    HB2  SER  19           2HB      SER  19   5.768  -4.511   3.272
  152    HB3  SER  19           1HB      SER  19   5.312  -4.937   1.618
  153    HG   SER  19           HG       SER  19   6.662  -3.469   0.975
  154    H    MET  20           H        MET  20   2.934  -3.297   4.807
  155    HA   MET  20           HA       MET  20   1.607  -5.901   4.698
  156    HB2  MET  20           2HB      MET  20   1.343  -5.689   7.049
  157    HB3  MET  20           1HB      MET  20   2.925  -5.006   6.713
  158    HG2  MET  20           2HG      MET  20   1.930  -2.747   6.735
  159    HG3  MET  20           1HG      MET  20   0.394  -3.481   7.198
  160    HE1  MET  20           3HE      MET  20   1.503  -1.719  10.503
  161    HE2  MET  20           1HE      MET  20   0.214  -1.920   9.316
  162    HE3  MET  20           2HE      MET  20   1.725  -1.142   8.852
  163    H    GLU  21           H        GLU  21   1.177  -2.588   4.434
  164    HA   GLU  21           HA       GLU  21  -1.708  -2.573   4.602
  165    HB2  GLU  21           2HB      GLU  21   0.301  -0.464   3.758
  166    HB3  GLU  21           1HB      GLU  21  -1.429  -0.186   3.990
  167    HG2  GLU  21           2HG      GLU  21  -1.228  -0.770   6.323
  168    HG3  GLU  21           1HG      GLU  21   0.502  -1.109   6.104
  169    H    ARG  22           H        ARG  22   0.772  -1.977   2.158
  170    HA   ARG  22           HA       ARG  22  -0.687  -1.462  -0.093
  171    HB2  ARG  22           2HB      ARG  22   1.889  -2.884   0.365
  172    HB3  ARG  22           1HB      ARG  22   1.135  -2.998  -1.209
  173    HG2  ARG  22           2HG      ARG  22   2.494  -1.192  -1.531
  174    HG3  ARG  22           1HG      ARG  22   1.022  -0.386  -1.002
  175    HD2  ARG  22           2HD      ARG  22   2.483  -1.076   1.299
  176    HD3  ARG  22           1HD      ARG  22   3.622  -0.346   0.166
  177    HE   ARG  22           HE       ARG  22   1.325   0.932   1.426
  178   HH11  ARG  22          1HH1      ARG  22   3.975   1.160  -0.842
  179   HH12  ARG  22          2HH1      ARG  22   3.977   2.898  -0.861
  180   HH21  ARG  22          1HH2      ARG  22   1.298   3.206   1.382
  181   HH22  ARG  22          2HH2      ARG  22   2.430   4.068   0.382
  182    H    VAL  23           H        VAL  23   0.397  -4.734   0.849
  183    HA   VAL  23           HA       VAL  23  -0.734  -5.979  -1.384
  184    HB   VAL  23           HB       VAL  23  -0.294  -8.049  -0.094
  185   HG11  VAL  23          1HG1      VAL  23   1.947  -6.047   0.097
  186   HG12  VAL  23          2HG1      VAL  23   1.505  -6.904  -1.379
  187   HG13  VAL  23          3HG1      VAL  23   2.107  -7.801   0.017
  188   HG21  VAL  23          3HG2      VAL  23  -0.340  -7.960   2.107
  189   HG22  VAL  23          1HG2      VAL  23  -0.632  -6.226   1.936
  190   HG23  VAL  23          2HG2      VAL  23   1.025  -6.829   2.099
  191    H    GLU  24           H        GLU  24  -2.321  -4.710   1.292
  192    HA   GLU  24           HA       GLU  24  -4.572  -6.568   1.083
  193    HB2  GLU  24           2HB      GLU  24  -4.443  -4.051   2.749
  194    HB3  GLU  24           1HB      GLU  24  -5.497  -5.445   2.966
  195    HG2  GLU  24           2HG      GLU  24  -2.529  -5.517   3.254
  196    HG3  GLU  24           1HG      GLU  24  -3.636  -5.263   4.605
  197    H    TRP  25           H        TRP  25  -3.750  -3.144   0.599
  198    HA   TRP  25           HA       TRP  25  -6.330  -2.696  -0.517
  199    HB2  TRP  25           2HB      TRP  25  -5.475  -0.514  -1.264
  200    HB3  TRP  25           1HB      TRP  25  -5.572  -0.797   0.453
  201    HD1  TRP  25           HD       TRP  25  -3.370  -0.490   1.807
  202    HE1  TRP  25           1HE      TRP  25  -1.095   0.566   1.230
  203    HE3  TRP  25           3HE      TRP  25  -3.703  -0.651  -3.235
  204    HZ2  TRP  25           2HZ      TRP  25   0.371   1.217  -1.109
  205    HZ3  TRP  25           3HZ      TRP  25  -1.849   0.199  -4.605
  206    HH2  TRP  25           HH       TRP  25   0.163   1.106  -3.554
  207    H    LEU  26           H        LEU  26  -3.351  -3.767  -1.820
  208    HA   LEU  26           HA       LEU  26  -3.510  -3.063  -4.398
  209    HB2  LEU  26           2HB      LEU  26  -3.046  -5.900  -3.518
  210    HB3  LEU  26           1HB      LEU  26  -2.506  -5.183  -5.014
  211    HG   LEU  26           HG       LEU  26  -1.419  -4.842  -2.257
  212   HD11  LEU  26          1HD1      LEU  26  -0.396  -6.509  -3.701
  213   HD12  LEU  26          2HD1      LEU  26   0.715  -5.161  -3.448
  214   HD13  LEU  26          3HD1      LEU  26  -0.166  -5.305  -4.971
  215   HD21  LEU  26          3HD2      LEU  26  -0.172  -2.889  -3.024
  216   HD22  LEU  26          1HD2      LEU  26  -1.924  -2.642  -2.987
  217   HD23  LEU  26          2HD2      LEU  26  -1.094  -2.903  -4.533
  218    H    ARG  27           H        ARG  27  -5.657  -5.112  -2.692
  219    HA   ARG  27           HA       ARG  27  -6.823  -6.156  -5.168
  220    HB2  ARG  27           2HB      ARG  27  -7.333  -7.050  -2.348
  221    HB3  ARG  27           1HB      ARG  27  -7.767  -7.889  -3.834
  222    HG2  ARG  27           2HG      ARG  27  -5.898  -9.053  -3.290
  223    HG3  ARG  27           1HG      ARG  27  -5.156  -7.756  -4.237
  224    HD2  ARG  27           2HD      ARG  27  -4.118  -8.343  -1.947
  225    HD3  ARG  27           1HD      ARG  27  -4.384  -6.627  -2.303
  226    HE   ARG  27           HE       ARG  27  -6.305  -6.706  -0.892
  227   HH11  ARG  27          1HH1      ARG  27  -4.303  -9.567  -0.765
  228   HH12  ARG  27          2HH1      ARG  27  -4.872 -10.053   0.800
  229   HH21  ARG  27          1HH2      ARG  27  -7.106  -7.381   1.161
  230   HH22  ARG  27          2HH2      ARG  27  -6.467  -8.831   1.885
  231    H    LYS  28           H        LYS  28  -7.615  -4.304  -2.280
  232    HA   LYS  28           HA       LYS  28 -10.397  -4.206  -3.029
  233    HB2  LYS  28           2HB      LYS  28 -10.744  -2.958  -1.015
  234    HB3  LYS  28           1HB      LYS  28  -9.735  -4.359  -0.673
  235    HG2  LYS  28           2HG      LYS  28  -7.765  -2.977  -0.691
  236    HG3  LYS  28           1HG      LYS  28  -8.746  -1.582  -1.123
  237    HD2  LYS  28           2HD      LYS  28 -10.021  -1.933   1.000
  238    HD3  LYS  28           1HD      LYS  28  -8.815  -3.151   1.429
  239    HE2  LYS  28           2HE      LYS  28  -7.057  -1.478   1.228
  240    HE3  LYS  28           1HE      LYS  28  -8.258  -0.259   0.816
  241    HZ1  LYS  28           3HZ      LYS  28  -8.078  -1.741   3.392
  242    HZ2  LYS  28           1HZ      LYS  28  -9.276  -0.604   3.007
  243    HZ3  LYS  28           2HZ      LYS  28  -7.661  -0.117   3.142
  244    H    LYS  29           H        LYS  29  -7.683  -2.525  -3.988
  245    HA   LYS  29           HA       LYS  29  -9.374  -0.221  -4.625
  246    HB2  LYS  29           2HB      LYS  29  -6.362  -0.170  -4.358
  247    HB3  LYS  29           1HB      LYS  29  -7.417   1.209  -4.603
  248    HG2  LYS  29           2HG      LYS  29  -7.170  -0.487  -2.116
  249    HG3  LYS  29           1HG      LYS  29  -6.691   1.196  -2.334
  250    HD2  LYS  29           2HD      LYS  29  -9.525   0.178  -2.496
  251    HD3  LYS  29           1HD      LYS  29  -8.804   0.945  -1.080
  252    HE2  LYS  29           2HE      LYS  29  -8.385   2.968  -2.453
  253    HE3  LYS  29           1HE      LYS  29  -9.224   2.193  -3.795
  254    HZ1  LYS  29           3HZ      LYS  29 -10.388   2.910  -1.158
  255    HZ2  LYS  29           1HZ      LYS  29 -11.203   2.034  -2.361
  256    HZ3  LYS  29           2HZ      LYS  29 -10.731   3.635  -2.651
  257    H    LEU  30           H        LEU  30  -7.742  -2.837  -6.047
  258    HA   LEU  30           HA       LEU  30  -7.102  -1.381  -8.429
  259    HB2  LEU  30           2HB      LEU  30  -5.705  -3.038  -8.949
  260    HB3  LEU  30           1HB      LEU  30  -5.949  -3.540  -7.294
  261    HG   LEU  30           HG       LEU  30  -7.993  -4.829  -8.618
  262   HD11  LEU  30          1HD1      LEU  30  -7.083  -4.160 -10.779
  263   HD12  LEU  30          2HD1      LEU  30  -6.950  -5.904 -10.548
  264   HD13  LEU  30          3HD1      LEU  30  -5.529  -4.877 -10.352
  265   HD21  LEU  30          3HD2      LEU  30  -6.689  -6.843  -8.256
  266   HD22  LEU  30          1HD2      LEU  30  -6.511  -5.754  -6.872
  267   HD23  LEU  30          2HD2      LEU  30  -5.221  -5.885  -8.072
  268    H    GLN  31           H        GLN  31  -9.472  -3.660  -7.285
  269    HA   GLN  31           HA       GLN  31 -11.527  -2.713  -8.906
  270    HB2  GLN  31           2HB      GLN  31 -11.896  -4.862 -10.259
  271    HB3  GLN  31           1HB      GLN  31 -10.679  -3.744 -10.843
  272    HG2  GLN  31           2HG      GLN  31  -9.914  -6.024 -11.055
  273    HG3  GLN  31           1HG      GLN  31  -8.922  -5.153  -9.891
  274   HE21  GLN  31          1HE2      GLN  31  -8.993  -5.735  -7.737
  275   HE22  GLN  31          2HE2      GLN  31  -9.726  -7.191  -7.181
  276    H    ASP  32           H        ASP  32 -11.346  -3.049  -6.333
  277    HA   ASP  32           HA       ASP  32 -11.255  -5.140  -4.849
  278    HB2  ASP  32           2HB      ASP  32 -12.950  -4.275  -3.308
  279    HB3  ASP  32           1HB      ASP  32 -11.891  -3.016  -3.938
  280    H    VAL  33           H        VAL  33 -11.705  -7.106  -5.048
  281    HA   VAL  33           HA       VAL  33 -14.398  -7.926  -5.873
  282    HB   VAL  33           HB       VAL  33 -12.774  -8.138  -7.734
  283   HG11  VAL  33          1HG1      VAL  33 -10.760  -8.653  -6.506
  284   HG12  VAL  33          2HG1      VAL  33 -11.099  -9.929  -7.674
  285   HG13  VAL  33          3HG1      VAL  33 -11.449 -10.183  -5.964
  286   HG21  VAL  33          3HG2      VAL  33 -14.757  -9.551  -7.651
  287   HG22  VAL  33          1HG2      VAL  33 -13.884 -10.746  -6.694
  288   HG23  VAL  33          2HG2      VAL  33 -13.399 -10.426  -8.360
  289    H    HIS  34           H        HIS  34 -11.414  -8.865  -4.137
  290    HA   HIS  34           HA       HIS  34 -13.100 -10.762  -2.601
  291    HB2  HIS  34           2HB      HIS  34 -10.108 -10.749  -3.046
  292    HB3  HIS  34           1HB      HIS  34 -10.925 -11.816  -1.914
  293    HD1  HIS  34           1HD      HIS  34  -9.342 -12.323  -4.826
  294    HD2  HIS  34           2HD      HIS  34 -13.327 -12.899  -3.793
  295    HE1  HIS  34           1HE      HIS  34 -10.237 -13.999  -6.467
  296    HE2  HIS  34           2HE      HIS  34 -12.553 -14.532  -5.637
  297    H    ASN  35           H        ASN  35 -13.320  -8.109  -2.046
  298    HA   ASN  35           HA       ASN  35 -12.096  -7.897   0.602
  299    HB2  ASN  35           2HB      ASN  35 -12.129  -5.372  -0.940
  300    HB3  ASN  35           1HB      ASN  35 -10.960  -5.952   0.242
  301   HD21  ASN  35          1HD2      ASN  35 -11.993  -6.095  -3.074
  302   HD22  ASN  35          2HD2      ASN  35 -10.477  -6.655  -3.728
  303    H    PHE  36           H        PHE  36 -14.740  -8.379  -0.621
  304    HA   PHE  36           HA       PHE  36 -16.314  -6.050  -0.140
  305    HB2  PHE  36           2HB      PHE  36 -16.849  -8.897  -0.806
  306    HB3  PHE  36           1HB      PHE  36 -18.183  -7.917  -0.194
  307    HD1  PHE  36           2HD      PHE  36 -18.977  -5.993  -1.487
  308    HD2  PHE  36           1HD      PHE  36 -15.918  -8.555  -2.958
  309    HE1  PHE  36           2HE      PHE  36 -19.319  -5.092  -3.749
  310    HE2  PHE  36           1HE      PHE  36 -16.253  -7.660  -5.223
  311    HZ   PHE  36           HZ       PHE  36 -17.922  -5.853  -5.593
  312    HA   PRO  37           HA       PRO  37 -17.212  -8.404   4.096
  313    HB2  PRO  37           2HB      PRO  37 -14.654  -9.914   4.225
  314    HB3  PRO  37           1HB      PRO  37 -16.257 -10.357   4.820
  315    HG2  PRO  37           2HG      PRO  37 -15.267 -11.471   2.609
  316    HG3  PRO  37           1HG      PRO  37 -16.986 -11.054   2.733
  317    HD2  PRO  37           2HD      PRO  37 -14.791  -9.648   1.276
  318    HD3  PRO  37           1HD      PRO  37 -16.486  -9.883   0.807
  319    HA   PRO  38           HA       PRO  38 -12.851  -6.329   5.486
  320    HB2  PRO  38           2HB      PRO  38 -12.261  -5.605   2.635
  321    HB3  PRO  38           1HB      PRO  38 -11.145  -5.773   4.003
  322    HG2  PRO  38           2HG      PRO  38 -11.362  -7.736   2.258
  323    HG3  PRO  38           1HG      PRO  38 -11.292  -8.105   3.991
  324    HD2  PRO  38           2HD      PRO  38 -13.615  -8.145   2.155
  325    HD3  PRO  38           1HD      PRO  38 -13.249  -9.185   3.538
  326    H    ASP  39           H        ASP  39 -13.567  -4.496   6.352
  327    HA   ASP  39           HA       ASP  39 -15.564  -2.936   4.948
  328    HB2  ASP  39           2HB      ASP  39 -16.081  -3.630   7.185
  329    HB3  ASP  39           1HB      ASP  39 -14.549  -2.999   7.780
  Start of MODEL    8
    1    H2   PRO   1           1HT      PRO   1  18.773  -5.423  -3.168
    2    H3   PRO   1           2HT      PRO   1  19.969  -4.425  -3.672
    3    HA   PRO   1           HA       PRO   1  19.190  -2.694  -2.708
    4    HB2  PRO   1           2HB      PRO   1  16.367  -2.985  -2.547
    5    HB3  PRO   1           1HB      PRO   1  17.284  -1.860  -3.557
    6    HG2  PRO   1           2HG      PRO   1  16.163  -4.519  -4.231
    7    HG3  PRO   1           1HG      PRO   1  16.450  -3.117  -5.276
    8    HD2  PRO   1           2HD      PRO   1  18.019  -5.270  -5.428
    9    HD3  PRO   1           1HD      PRO   1  18.703  -3.640  -5.571
   10    HA   PRO   2           HA       PRO   2  18.463  -5.165   1.036
   11    HB2  PRO   2           2HB      PRO   2  20.848  -4.732   2.197
   12    HB3  PRO   2           1HB      PRO   2  20.633  -5.949   0.936
   13    HG2  PRO   2           2HG      PRO   2  22.000  -3.346   0.810
   14    HG3  PRO   2           1HG      PRO   2  22.203  -4.771  -0.218
   15    HD2  PRO   2           2HD      PRO   2  20.664  -2.393  -0.744
   16    HD3  PRO   2           1HD      PRO   2  20.915  -3.799  -1.797
   17    H    SER   3           H        SER   3  19.591  -4.164   3.422
   18    HA   SER   3           HA       SER   3  17.924  -1.906   3.906
   19    HB2  SER   3           2HB      SER   3  20.039  -3.233   5.611
   20    HB3  SER   3           1HB      SER   3  19.011  -1.916   6.174
   21    HG   SER   3           HG       SER   3  17.217  -3.342   5.428
   22    H    VAL   4           H        VAL   4  21.027  -2.197   2.632
   23    HA   VAL   4           HA       VAL   4  22.352   0.078   3.527
   24    HB   VAL   4           HB       VAL   4  22.429  -1.163   0.773
   25   HG11  VAL   4          1HG1      VAL   4  23.383   1.070   0.740
   26   HG12  VAL   4          2HG1      VAL   4  24.658  -0.140   0.587
   27   HG13  VAL   4          3HG1      VAL   4  24.397   0.677   2.129
   28   HG21  VAL   4          3HG2      VAL   4  24.158  -1.661   3.190
   29   HG22  VAL   4          1HG2      VAL   4  24.403  -2.356   1.588
   30   HG23  VAL   4          2HG2      VAL   4  22.959  -2.767   2.517
   31    H    SER   5           H        SER   5  20.006  -0.293   0.875
   32    HA   SER   5           HA       SER   5  20.294   2.522   0.240
   33    HB2  SER   5           2HB      SER   5  18.609   1.910  -1.584
   34    HB3  SER   5           1HB      SER   5  20.243   1.257  -1.705
   35    HG   SER   5           HG       SER   5  19.203  -0.565  -1.900
   36    H    GLU   6           H        GLU   6  18.293   0.679   2.264
   37    HA   GLU   6           HA       GLU   6  15.868   2.032   2.052
   38    HB2  GLU   6           2HB      GLU   6  17.215   0.948   4.527
   39    HB3  GLU   6           1HB      GLU   6  15.532   1.449   4.444
   40    HG2  GLU   6           2HG      GLU   6  15.203  -0.270   2.660
   41    HG3  GLU   6           1HG      GLU   6  16.840  -0.837   3.002
   42    H    ILE   7           H        ILE   7  18.917   3.138   3.094
   43    HA   ILE   7           HA       ILE   7  18.051   5.293   4.734
   44    HB   ILE   7           HB       ILE   7  20.673   4.982   3.260
   45   HG12  ILE   7          2HG1      ILE   7  20.232   3.084   4.761
   46   HG13  ILE   7          1HG1      ILE   7  21.547   4.086   5.367
   47   HG21  ILE   7          1HG2      ILE   7  20.211   7.274   4.005
   48   HG22  ILE   7          2HG2      ILE   7  21.556   6.556   4.891
   49   HG23  ILE   7          3HG2      ILE   7  19.969   6.683   5.649
   50   HD11  ILE   7          3HD1      ILE   7  20.086   3.368   7.162
   51   HD12  ILE   7          1HD1      ILE   7  18.707   4.115   6.359
   52   HD13  ILE   7          2HD1      ILE   7  20.027   5.119   6.965
   53    H    GLN   8           H        GLN   8  19.426   5.270   1.406
   54    HA   GLN   8           HA       GLN   8  18.408   8.010   1.181
   55    HB2  GLN   8           2HB      GLN   8  20.022   8.321  -0.664
   56    HB3  GLN   8           1HB      GLN   8  20.768   7.962   0.880
   57    HG2  GLN   8           2HG      GLN   8  20.315   5.855  -1.205
   58    HG3  GLN   8           1HG      GLN   8  21.750   6.873  -1.185
   59   HE21  GLN   8          1HE2      GLN   8  20.158   4.180   0.193
   60   HE22  GLN   8          2HE2      GLN   8  21.402   3.730   1.313
   61    H    LEU   9           H        LEU   9  17.628   4.929   0.131
   62    HA   LEU   9           HA       LEU   9  16.075   6.084  -2.081
   63    HB2  LEU   9           2HB      LEU   9  16.721   3.256  -1.313
   64    HB3  LEU   9           1HB      LEU   9  15.333   3.598  -2.322
   65    HG   LEU   9           HG       LEU   9  17.181   2.964  -3.720
   66   HD11  LEU   9          1HD1      LEU   9  16.729   5.936  -3.895
   67   HD12  LEU   9          2HD1      LEU   9  15.685   4.687  -4.580
   68   HD13  LEU   9          3HD1      LEU   9  17.329   4.899  -5.189
   69   HD21  LEU   9          3HD2      LEU   9  19.023   3.503  -2.224
   70   HD22  LEU   9          1HD2      LEU   9  18.714   5.223  -2.444
   71   HD23  LEU   9          2HD2      LEU   9  19.263   4.247  -3.804
   72    H    MET  10           H        MET  10  15.922   5.309   1.155
   73    HA   MET  10           HA       MET  10  14.383   5.634   2.746
   74    HB2  MET  10           2HB      MET  10  12.839   6.631   0.394
   75    HB3  MET  10           1HB      MET  10  12.140   6.602   2.005
   76    HG2  MET  10           2HG      MET  10  13.981   8.025   2.787
   77    HG3  MET  10           1HG      MET  10  14.607   8.092   1.140
   78    HE1  MET  10           3HE      MET  10  14.572  10.719   1.042
   79    HE2  MET  10           1HE      MET  10  14.085  10.707   2.733
   80    HE3  MET  10           2HE      MET  10  13.201  11.697   1.570
   81    H    HIS  11           H        HIS  11  13.294   4.134   3.857
   82    HA   HIS  11           HA       HIS  11  11.608   2.273   2.326
   83    HB2  HIS  11           2HB      HIS  11  11.454   0.916   4.390
   84    HB3  HIS  11           1HB      HIS  11  13.100   1.100   3.817
   85    HD1  HIS  11           1HD      HIS  11  14.274   0.722   5.974
   86    HD2  HIS  11           2HD      HIS  11  11.362   3.680   6.271
   87    HE1  HIS  11           1HE      HIS  11  14.592   1.763   8.243
   88    HE2  HIS  11           2HE      HIS  11  12.759   3.480   8.445
   89    H    ASN  12           H        ASN  12  11.469   5.101   4.027
   90    HA   ASN  12           HA       ASN  12   8.740   4.868   4.907
   91    HB2  ASN  12           2HB      ASN  12   8.942   7.290   5.365
   92    HB3  ASN  12           1HB      ASN  12  10.268   6.373   6.066
   93   HD21  ASN  12          1HD2      ASN  12   9.359   8.741   3.709
   94   HD22  ASN  12          2HD2      ASN  12  10.966   9.201   3.254
   95    H    ARG  13           H        ARG  13   8.957   4.038   2.304
   96    HA   ARG  13           HA       ARG  13   8.616   5.936   0.289
   97    HB2  ARG  13           2HB      ARG  13   7.510   3.131   0.473
   98    HB3  ARG  13           1HB      ARG  13   7.597   4.081  -1.001
   99    HG2  ARG  13           2HG      ARG  13   9.976   3.213   0.629
  100    HG3  ARG  13           1HG      ARG  13   9.367   2.372  -0.794
  101    HD2  ARG  13           2HD      ARG  13   9.654   4.724  -1.921
  102    HD3  ARG  13           1HD      ARG  13  10.782   4.991  -0.587
  103    HE   ARG  13           HE       ARG  13  11.763   2.744  -1.434
  104   HH11  ARG  13          1HH1      ARG  13  10.439   5.299  -3.423
  105   HH12  ARG  13          2HH1      ARG  13  11.465   4.961  -4.777
  106   HH21  ARG  13          1HH2      ARG  13  13.099   2.260  -3.222
  107   HH22  ARG  13          2HH2      ARG  13  12.989   3.221  -4.667
  108    H    GLY  14           H        GLY  14   6.419   4.723   2.669
  109    HA2  GLY  14           2HA      GLY  14   4.406   6.626   1.654
  110    HA3  GLY  14           1HA      GLY  14   3.940   5.069   2.334
  111    H    LYS  15           H        LYS  15   4.000   4.754   4.534
  112    HA   LYS  15           HA       LYS  15   5.218   6.782   6.244
  113    HB2  LYS  15           2HB      LYS  15   2.337   5.886   6.474
  114    HB3  LYS  15           1HB      LYS  15   3.209   6.701   7.762
  115    HG2  LYS  15           2HG      LYS  15   3.559   8.619   6.235
  116    HG3  LYS  15           1HG      LYS  15   2.532   7.806   5.053
  117    HD2  LYS  15           2HD      LYS  15   1.242   9.434   6.310
  118    HD3  LYS  15           1HD      LYS  15   0.691   7.797   6.679
  119    HE2  LYS  15           2HE      LYS  15   1.901   7.808   8.761
  120    HE3  LYS  15           1HE      LYS  15   2.635   9.362   8.371
  121    HZ1  LYS  15           3HZ      LYS  15  -0.277   8.903   8.771
  122    HZ2  LYS  15           1HZ      LYS  15   0.474  10.396   8.476
  123    HZ3  LYS  15           2HZ      LYS  15   0.770   9.567   9.926
  124    H    HIS  16           H        HIS  16   6.531   5.692   7.568
  125    HA   HIS  16           HA       HIS  16   7.368   4.111   8.981
  126    HB2  HIS  16           2HB      HIS  16   5.115   4.166  10.028
  127    HB3  HIS  16           1HB      HIS  16   4.576   2.915   8.910
  128    HD1  HIS  16           1HD      HIS  16   5.964   3.386  12.205
  129    HD2  HIS  16           2HD      HIS  16   6.094   0.389   9.325
  130    HE1  HIS  16           1HE      HIS  16   6.596   1.283  13.438
  131    HE2  HIS  16           2HE      HIS  16   6.821  -0.482  11.649
  132    H    LEU  17           H        LEU  17   5.037   2.356   6.976
  133    HA   LEU  17           HA       LEU  17   6.984   0.979   5.428
  134    HB2  LEU  17           2HB      LEU  17   7.390  -0.367   7.312
  135    HB3  LEU  17           1HB      LEU  17   5.702  -0.379   7.797
  136    HG   LEU  17           HG       LEU  17   5.411  -1.710   5.554
  137   HD11  LEU  17          1HD1      LEU  17   7.818  -1.267   4.989
  138   HD12  LEU  17          2HD1      LEU  17   7.292  -2.943   4.853
  139   HD13  LEU  17          3HD1      LEU  17   8.244  -2.424   6.246
  140   HD21  LEU  17          3HD2      LEU  17   6.648  -2.929   8.024
  141   HD22  LEU  17          1HD2      LEU  17   5.736  -3.797   6.789
  142   HD23  LEU  17          2HD2      LEU  17   4.935  -2.585   7.787
  143    H    ASN  18           H        ASN  18   3.868   0.019   6.818
  144    HA   ASN  18           HA       ASN  18   1.852  -0.451   5.937
  145    HB2  ASN  18           2HB      ASN  18   2.505   1.566   3.795
  146    HB3  ASN  18           1HB      ASN  18   0.915   1.010   4.268
  147   HD21  ASN  18          1HD2      ASN  18   1.819   1.086   7.139
  148   HD22  ASN  18          2HD2      ASN  18   1.724   2.765   7.563
  149    H    SER  19           H        SER  19   4.449  -1.679   4.679
  150    HA   SER  19           HA       SER  19   3.573  -2.413   2.070
  151    HB2  SER  19           2HB      SER  19   5.654  -3.726   3.805
  152    HB3  SER  19           1HB      SER  19   5.468  -3.934   2.069
  153    HG   SER  19           HG       SER  19   6.663  -2.232   1.856
  154    H    MET  20           H        MET  20   2.552  -3.284   5.112
  155    HA   MET  20           HA       MET  20   1.523  -5.859   4.221
  156    HB2  MET  20           2HB      MET  20   0.418  -5.558   6.630
  157    HB3  MET  20           1HB      MET  20   2.037  -6.195   6.426
  158    HG2  MET  20           2HG      MET  20   2.949  -3.970   6.879
  159    HG3  MET  20           1HG      MET  20   1.313  -3.345   7.095
  160    HE1  MET  20           3HE      MET  20   3.774  -3.157   9.253
  161    HE2  MET  20           1HE      MET  20   2.869  -3.434  10.744
  162    HE3  MET  20           2HE      MET  20   2.196  -2.402   9.483
  163    H    GLU  21           H        GLU  21   0.719  -2.564   4.779
  164    HA   GLU  21           HA       GLU  21  -2.089  -2.700   4.455
  165    HB2  GLU  21           2HB      GLU  21  -0.150  -0.467   3.766
  166    HB3  GLU  21           1HB      GLU  21  -1.899  -0.299   3.925
  167    HG2  GLU  21           2HG      GLU  21  -0.007  -1.102   6.118
  168    HG3  GLU  21           1HG      GLU  21  -0.661   0.521   5.855
  169    H    ARG  22           H        ARG  22   0.614  -2.085   2.277
  170    HA   ARG  22           HA       ARG  22  -0.496  -1.534  -0.145
  171    HB2  ARG  22           2HB      ARG  22   1.622  -3.669   0.170
  172    HB3  ARG  22           1HB      ARG  22   1.367  -2.597  -1.185
  173    HG2  ARG  22           2HG      ARG  22   2.424  -1.906   1.529
  174    HG3  ARG  22           1HG      ARG  22   3.338  -1.983   0.026
  175    HD2  ARG  22           2HD      ARG  22   2.159  -0.081  -0.838
  176    HD3  ARG  22           1HD      ARG  22   1.092  -0.072   0.568
  177    HE   ARG  22           HE       ARG  22   2.776   0.880   1.833
  178   HH11  ARG  22          1HH1      ARG  22   3.953   0.068  -1.362
  179   HH12  ARG  22          2HH1      ARG  22   5.540   0.727  -1.087
  180   HH21  ARG  22          1HH2      ARG  22   4.879   1.710   2.213
  181   HH22  ARG  22          2HH2      ARG  22   6.074   1.624   0.953
  182    H    VAL  23           H        VAL  23   0.352  -4.856   0.726
  183    HA   VAL  23           HA       VAL  23  -0.991  -6.019  -1.423
  184    HB   VAL  23           HB       VAL  23  -0.616  -8.121  -0.045
  185   HG11  VAL  23          1HG1      VAL  23   1.806  -6.365  -0.378
  186   HG12  VAL  23          2HG1      VAL  23   1.021  -7.202  -1.718
  187   HG13  VAL  23          3HG1      VAL  23   1.759  -8.127  -0.412
  188   HG21  VAL  23          3HG2      VAL  23  -0.423  -7.758   2.124
  189   HG22  VAL  23          1HG2      VAL  23  -0.225  -6.034   1.798
  190   HG23  VAL  23          2HG2      VAL  23   1.189  -7.100   1.783
  191    H    GLU  24           H        GLU  24  -2.424  -4.646   1.287
  192    HA   GLU  24           HA       GLU  24  -4.775  -6.347   0.966
  193    HB2  GLU  24           2HB      GLU  24  -4.707  -3.742   2.463
  194    HB3  GLU  24           1HB      GLU  24  -5.792  -5.109   2.687
  195    HG2  GLU  24           2HG      GLU  24  -3.813  -6.416   3.478
  196    HG3  GLU  24           1HG      GLU  24  -2.914  -4.891   3.446
  197    H    TRP  25           H        TRP  25  -3.746  -2.948   0.496
  198    HA   TRP  25           HA       TRP  25  -6.200  -2.380  -0.769
  199    HB2  TRP  25           2HB      TRP  25  -5.204  -0.242  -1.472
  200    HB3  TRP  25           1HB      TRP  25  -5.384  -0.527   0.241
  201    HD1  TRP  25           HD       TRP  25  -3.249  -0.319   1.684
  202    HE1  TRP  25           1HE      TRP  25  -0.882   0.593   1.195
  203    HE3  TRP  25           3HE      TRP  25  -3.396  -0.451  -3.375
  204    HZ2  TRP  25           2HZ      TRP  25   0.688   1.177  -1.082
  205    HZ3  TRP  25           3HZ      TRP  25  -1.448   0.315  -4.669
  206    HH2  TRP  25           HH       TRP  25   0.566   1.102  -3.533
  207    H    LEU  26           H        LEU  26  -3.156  -3.496  -2.021
  208    HA   LEU  26           HA       LEU  26  -3.554  -2.866  -4.662
  209    HB2  LEU  26           2HB      LEU  26  -2.815  -5.691  -3.987
  210    HB3  LEU  26           1HB      LEU  26  -2.205  -4.684  -5.267
  211    HG   LEU  26           HG       LEU  26  -1.397  -4.680  -2.366
  212   HD11  LEU  26          1HD1      LEU  26  -0.302  -6.320  -3.775
  213   HD12  LEU  26          2HD1      LEU  26   0.830  -5.047  -3.320
  214   HD13  LEU  26          3HD1      LEU  26   0.133  -5.070  -4.941
  215   HD21  LEU  26          3HD2      LEU  26   0.091  -2.787  -3.007
  216   HD22  LEU  26          1HD2      LEU  26  -1.636  -2.421  -2.929
  217   HD23  LEU  26          2HD2      LEU  26  -0.846  -2.631  -4.499
  218    H    ARG  27           H        ARG  27  -5.238  -5.021  -2.575
  219    HA   ARG  27           HA       ARG  27  -6.713  -6.208  -4.803
  220    HB2  ARG  27           2HB      ARG  27  -6.203  -7.271  -2.033
  221    HB3  ARG  27           1HB      ARG  27  -7.091  -8.101  -3.311
  222    HG2  ARG  27           2HG      ARG  27  -5.083  -9.027  -3.729
  223    HG3  ARG  27           1HG      ARG  27  -4.848  -7.524  -4.630
  224    HD2  ARG  27           2HD      ARG  27  -3.781  -6.535  -2.579
  225    HD3  ARG  27           1HD      ARG  27  -3.885  -8.145  -1.841
  226    HE   ARG  27           HE       ARG  27  -2.384  -7.633  -4.343
  227   HH11  ARG  27          1HH1      ARG  27  -2.654  -9.114  -1.176
  228   HH12  ARG  27          2HH1      ARG  27  -1.125  -9.926  -1.291
  229   HH21  ARG  27          1HH2      ARG  27  -0.348  -8.657  -4.465
  230   HH22  ARG  27          2HH2      ARG  27   0.196  -9.655  -3.146
  231    H    LYS  28           H        LYS  28  -7.197  -3.994  -2.240
  232    HA   LYS  28           HA       LYS  28 -10.072  -4.523  -2.488
  233    HB2  LYS  28           2HB      LYS  28 -10.396  -3.311  -0.425
  234    HB3  LYS  28           1HB      LYS  28  -9.195  -4.581  -0.187
  235    HG2  LYS  28           2HG      LYS  28  -7.482  -2.816  -0.715
  236    HG3  LYS  28           1HG      LYS  28  -8.769  -1.642  -0.485
  237    HD2  LYS  28           2HD      LYS  28  -9.057  -2.287   1.785
  238    HD3  LYS  28           1HD      LYS  28  -7.996  -3.689   1.582
  239    HE2  LYS  28           2HE      LYS  28  -6.137  -2.190   1.080
  240    HE3  LYS  28           1HE      LYS  28  -7.182  -0.812   1.305
  241    HZ1  LYS  28           3HZ      LYS  28  -5.800  -1.318   3.279
  242    HZ2  LYS  28           1HZ      LYS  28  -6.604  -2.804   3.430
  243    HZ3  LYS  28           2HZ      LYS  28  -7.464  -1.358   3.611
  244    H    LYS  29           H        LYS  29  -7.753  -2.637  -3.822
  245    HA   LYS  29           HA       LYS  29  -9.568  -0.340  -4.022
  246    HB2  LYS  29           2HB      LYS  29  -6.552  -0.182  -4.017
  247    HB3  LYS  29           1HB      LYS  29  -7.671   1.171  -4.060
  248    HG2  LYS  29           2HG      LYS  29  -7.217  -0.740  -1.750
  249    HG3  LYS  29           1HG      LYS  29  -6.743   0.962  -1.859
  250    HD2  LYS  29           2HD      LYS  29  -9.596  -0.018  -1.922
  251    HD3  LYS  29           1HD      LYS  29  -8.779   0.624  -0.496
  252    HE2  LYS  29           2HE      LYS  29  -9.187   2.135  -3.073
  253    HE3  LYS  29           1HE      LYS  29 -10.213   2.287  -1.649
  254    HZ1  LYS  29           3HZ      LYS  29  -8.600   4.056  -1.710
  255    HZ2  LYS  29           1HZ      LYS  29  -7.315   2.949  -1.802
  256    HZ3  LYS  29           2HZ      LYS  29  -8.261   3.038  -0.399
  257    H    LEU  30           H        LEU  30  -7.465  -2.507  -5.797
  258    HA   LEU  30           HA       LEU  30  -7.091  -0.884  -8.057
  259    HB2  LEU  30           2HB      LEU  30  -5.886  -2.566  -8.921
  260    HB3  LEU  30           1HB      LEU  30  -5.912  -3.102  -7.255
  261    HG   LEU  30           HG       LEU  30  -7.946  -4.099  -9.226
  262   HD11  LEU  30          1HD1      LEU  30  -5.556  -4.304 -10.006
  263   HD12  LEU  30          2HD1      LEU  30  -6.508  -5.790  -9.936
  264   HD13  LEU  30          3HD1      LEU  30  -5.323  -5.439  -8.672
  265   HD21  LEU  30          3HD2      LEU  30  -8.231  -4.524  -6.767
  266   HD22  LEU  30          1HD2      LEU  30  -6.722  -5.438  -6.806
  267   HD23  LEU  30          2HD2      LEU  30  -8.108  -5.978  -7.754
  268    H    GLN  31           H        GLN  31  -9.336  -3.370  -7.256
  269    HA   GLN  31           HA       GLN  31 -11.571  -2.253  -8.519
  270    HB2  GLN  31           2HB      GLN  31 -11.971  -4.171 -10.128
  271    HB3  GLN  31           1HB      GLN  31 -10.746  -3.018 -10.633
  272    HG2  GLN  31           2HG      GLN  31  -9.635  -4.922 -11.112
  273    HG3  GLN  31           1HG      GLN  31  -9.161  -4.776  -9.422
  274   HE21  GLN  31          1HE2      GLN  31 -10.093  -6.144  -7.885
  275   HE22  GLN  31          2HE2      GLN  31 -10.857  -7.617  -8.365
  276    H    ASP  32           H        ASP  32 -10.396  -3.208  -6.161
  277    HA   ASP  32           HA       ASP  32 -10.148  -4.993  -4.734
  278    HB2  ASP  32           2HB      ASP  32 -12.148  -5.096  -3.305
  279    HB3  ASP  32           1HB      ASP  32 -11.606  -3.466  -3.674
  280    H    VAL  33           H        VAL  33  -9.680  -6.893  -5.208
  281    HA   VAL  33           HA       VAL  33 -11.069  -8.479  -7.108
  282    HB   VAL  33           HB       VAL  33  -8.654  -8.592  -6.791
  283   HG11  VAL  33          1HG1      VAL  33  -8.520  -8.258  -4.442
  284   HG12  VAL  33          2HG1      VAL  33  -7.707  -9.772  -4.853
  285   HG13  VAL  33          3HG1      VAL  33  -9.316  -9.799  -4.125
  286   HG21  VAL  33          3HG2      VAL  33  -8.370 -11.042  -6.812
  287   HG22  VAL  33          1HG2      VAL  33  -9.713 -10.510  -7.824
  288   HG23  VAL  33          2HG2      VAL  33 -10.028 -11.220  -6.241
  289    H    HIS  34           H        HIS  34 -11.693  -7.866  -3.904
  290    HA   HIS  34           HA       HIS  34 -12.959 -10.151  -2.982
  291    HB2  HIS  34           2HB      HIS  34 -12.782  -8.138  -1.621
  292    HB3  HIS  34           1HB      HIS  34 -13.839  -7.273  -2.728
  293    HD1  HIS  34           1HD      HIS  34 -16.323  -7.454  -2.352
  294    HD2  HIS  34           2HD      HIS  34 -14.126 -10.123  -0.025
  295    HE1  HIS  34           1HE      HIS  34 -17.965  -8.450  -0.717
  296    HE2  HIS  34           2HE      HIS  34 -16.577  -9.920   0.792
  297    H    ASN  35           H        ASN  35 -13.917  -7.927  -5.482
  298    HA   ASN  35           HA       ASN  35 -16.334  -9.526  -5.921
  299    HB2  ASN  35           2HB      ASN  35 -17.039  -7.728  -7.528
  300    HB3  ASN  35           1HB      ASN  35 -16.958  -7.246  -5.846
  301   HD21  ASN  35          1HD2      ASN  35 -14.190  -7.474  -8.099
  302   HD22  ASN  35          2HD2      ASN  35 -13.800  -5.796  -8.010
  303    H    PHE  36           H        PHE  36 -16.715 -10.637  -7.724
  304    HA   PHE  36           HA       PHE  36 -14.413 -10.970  -9.494
  305    HB2  PHE  36           2HB      PHE  36 -16.491 -12.856  -8.501
  306    HB3  PHE  36           1HB      PHE  36 -15.668 -13.192 -10.022
  307    HD1  PHE  36           1HD      PHE  36 -15.175 -12.676  -6.405
  308    HD2  PHE  36           2HD      PHE  36 -13.437 -13.934 -10.076
  309    HE1  PHE  36           1HE      PHE  36 -13.240 -13.567  -5.177
  310    HE2  PHE  36           2HE      PHE  36 -11.503 -14.834  -8.857
  311    HZ   PHE  36           HZ       PHE  36 -11.401 -14.646  -6.407
  312    HA   PRO  37           HA       PRO  37 -17.661 -10.096 -12.654
  313    HB2  PRO  37           2HB      PRO  37 -19.924  -8.847 -12.088
  314    HB3  PRO  37           1HB      PRO  37 -19.709 -10.547 -11.667
  315    HG2  PRO  37           2HG      PRO  37 -19.696  -8.162  -9.917
  316    HG3  PRO  37           1HG      PRO  37 -20.169  -9.830  -9.548
  317    HD2  PRO  37           2HD      PRO  37 -17.647  -8.558  -9.058
  318    HD3  PRO  37           1HD      PRO  37 -18.114 -10.224  -8.699
  319    HA   PRO  38           HA       PRO  38 -16.385  -5.635 -12.554
  320    HB2  PRO  38           2HB      PRO  38 -13.789  -6.051 -13.570
  321    HB3  PRO  38           1HB      PRO  38 -14.205  -5.594 -11.918
  322    HG2  PRO  38           2HG      PRO  38 -13.064  -8.022 -12.718
  323    HG3  PRO  38           1HG      PRO  38 -13.812  -7.688 -11.151
  324    HD2  PRO  38           2HD      PRO  38 -14.961  -9.047 -13.532
  325    HD3  PRO  38           1HD      PRO  38 -15.207  -9.372 -11.805
  326    H    ASP  39           H        ASP  39 -18.020  -6.077 -14.214
  327    HA   ASP  39           HA       ASP  39 -17.931  -7.315 -16.554
  328    HB2  ASP  39           2HB      ASP  39 -19.780  -5.942 -15.551
  329    HB3  ASP  39           1HB      ASP  39 -19.039  -4.529 -16.292
  Start of MODEL    9
    1    H2   PRO   1           1HT      PRO   1  -2.095  18.670 -10.594
    2    H3   PRO   1           2HT      PRO   1  -2.906  18.947 -11.994
    3    HA   PRO   1           HA       PRO   1  -3.622  16.982 -11.879
    4    HB2  PRO   1           2HB      PRO   1  -1.180  15.466 -12.167
    5    HB3  PRO   1           1HB      PRO   1  -2.455  15.755 -13.358
    6    HG2  PRO   1           2HG      PRO   1   0.028  16.860 -13.544
    7    HG3  PRO   1           1HG      PRO   1  -1.434  17.619 -14.201
    8    HD2  PRO   1           2HD      PRO   1  -0.003  18.189 -11.620
    9    HD3  PRO   1           1HD      PRO   1  -0.656  19.327 -12.812
   10    HA   PRO   2           HA       PRO   2  -2.334  16.747  -7.409
   11    HB2  PRO   2           2HB      PRO   2  -5.225  16.073  -7.212
   12    HB3  PRO   2           1HB      PRO   2  -4.256  17.190  -6.243
   13    HG2  PRO   2           2HG      PRO   2  -5.952  18.115  -8.067
   14    HG3  PRO   2           1HG      PRO   2  -4.364  18.874  -7.839
   15    HD2  PRO   2           2HD      PRO   2  -5.280  17.002  -9.987
   16    HD3  PRO   2           1HD      PRO   2  -4.231  18.431 -10.107
   17    H    SER   3           H        SER   3  -4.897  14.549  -8.620
   18    HA   SER   3           HA       SER   3  -3.567  12.383  -7.184
   19    HB2  SER   3           2HB      SER   3  -6.312  12.553  -8.438
   20    HB3  SER   3           1HB      SER   3  -5.676  11.123  -7.612
   21    HG   SER   3           HG       SER   3  -5.249  12.725  -5.832
   22    H    VAL   4           H        VAL   4  -3.031  13.640 -10.005
   23    HA   VAL   4           HA       VAL   4  -2.850  11.092 -11.446
   24    HB   VAL   4           HB       VAL   4  -2.383  13.908 -12.452
   25   HG11  VAL   4          1HG1      VAL   4  -1.032  12.322 -13.686
   26   HG12  VAL   4          2HG1      VAL   4  -2.378  12.856 -14.691
   27   HG13  VAL   4          3HG1      VAL   4  -2.427  11.272 -13.920
   28   HG21  VAL   4          3HG2      VAL   4  -4.479  13.556 -13.708
   29   HG22  VAL   4          1HG2      VAL   4  -4.725  13.526 -11.962
   30   HG23  VAL   4          2HG2      VAL   4  -4.697  12.018 -12.874
   31    H    SER   5           H        SER   5  -0.937  13.836 -10.299
   32    HA   SER   5           HA       SER   5   1.511  12.420 -11.044
   33    HB2  SER   5           2HB      SER   5   1.139  15.261 -10.087
   34    HB3  SER   5           1HB      SER   5   2.640  14.546 -10.681
   35    HG   SER   5           HG       SER   5   1.328  14.080 -12.653
   36    H    GLU   6           H        GLU   6  -0.429  12.488  -8.388
   37    HA   GLU   6           HA       GLU   6   1.463  12.854  -6.323
   38    HB2  GLU   6           2HB      GLU   6  -0.174  11.782  -4.842
   39    HB3  GLU   6           1HB      GLU   6  -0.917  13.014  -5.850
   40    HG2  GLU   6           2HG      GLU   6  -1.902  11.373  -7.263
   41    HG3  GLU   6           1HG      GLU   6  -1.005  10.076  -6.472
   42    H    ILE   7           H        ILE   7   1.273  10.501  -8.620
   43    HA   ILE   7           HA       ILE   7   2.259   8.376  -6.898
   44    HB   ILE   7           HB       ILE   7   1.705   8.281  -9.867
   45   HG12  ILE   7          2HG1      ILE   7  -0.364   8.774  -8.706
   46   HG13  ILE   7          1HG1      ILE   7  -0.386   7.097  -9.238
   47   HG21  ILE   7          1HG2      ILE   7   2.084   6.058  -7.868
   48   HG22  ILE   7          2HG2      ILE   7   3.244   6.553  -9.101
   49   HG23  ILE   7          3HG2      ILE   7   1.693   5.859  -9.576
   50   HD11  ILE   7          3HD1      ILE   7  -1.304   7.322  -7.008
   51   HD12  ILE   7          1HD1      ILE   7   0.198   8.058  -6.448
   52   HD13  ILE   7          2HD1      ILE   7   0.182   6.375  -6.977
   53    H    GLN   8           H        GLN   8   3.299  10.240  -9.745
   54    HA   GLN   8           HA       GLN   8   5.878   8.885  -9.680
   55    HB2  GLN   8           2HB      GLN   8   5.267  11.162 -11.533
   56    HB3  GLN   8           1HB      GLN   8   6.319   9.779 -11.784
   57    HG2  GLN   8           2HG      GLN   8   4.543   9.375 -13.203
   58    HG3  GLN   8           1HG      GLN   8   4.154   8.395 -11.788
   59   HE21  GLN   8          1HE2      GLN   8   1.939   8.420 -12.311
   60   HE22  GLN   8          2HE2      GLN   8   0.972   9.841 -12.044
   61    H    LEU   9           H        LEU   9   4.503  12.106  -9.207
   62    HA   LEU   9           HA       LEU   9   7.151  13.207  -8.727
   63    HB2  LEU   9           2HB      LEU   9   4.429  14.474  -8.922
   64    HB3  LEU   9           1HB      LEU   9   5.865  15.374  -8.476
   65    HG   LEU   9           HG       LEU   9   5.556  15.806 -10.756
   66   HD11  LEU   9          1HD1      LEU   9   7.849  15.321 -10.240
   67   HD12  LEU   9          2HD1      LEU   9   7.470  14.745 -11.864
   68   HD13  LEU   9          3HD1      LEU   9   7.586  13.602 -10.526
   69   HD21  LEU   9          3HD2      LEU   9   3.926  14.167 -11.344
   70   HD22  LEU   9          1HD2      LEU   9   5.086  12.854 -11.135
   71   HD23  LEU   9          2HD2      LEU   9   5.286  14.008 -12.453
   72    H    MET  10           H        MET  10   4.485  12.016  -6.884
   73    HA   MET  10           HA       MET  10   5.528  13.418  -4.515
   74    HB2  MET  10           2HB      MET  10   2.836  12.147  -4.992
   75    HB3  MET  10           1HB      MET  10   3.371  12.751  -3.429
   76    HG2  MET  10           2HG      MET  10   3.681  14.978  -4.448
   77    HG3  MET  10           1HG      MET  10   2.994  14.350  -5.946
   78    HE1  MET  10           3HE      MET  10   1.822  16.924  -4.586
   79    HE2  MET  10           1HE      MET  10   0.091  16.603  -4.681
   80    HE3  MET  10           2HE      MET  10   1.142  16.188  -6.036
   81    H    HIS  11           H        HIS  11   6.362  12.363  -2.860
   82    HA   HIS  11           HA       HIS  11   6.786   9.476  -3.134
   83    HB2  HIS  11           2HB      HIS  11   8.726  10.980  -2.824
   84    HB3  HIS  11           1HB      HIS  11   8.049  11.541  -1.305
   85    HD1  HIS  11           1HD      HIS  11   8.610  10.236   0.756
   86    HD2  HIS  11           2HD      HIS  11   9.643   8.249  -2.752
   87    HE1  HIS  11           1HE      HIS  11   9.984   8.253   1.473
   88    HE2  HIS  11           2HE      HIS  11  10.775   7.194  -0.678
   89    H    ASN  12           H        ASN  12   4.637  11.492  -1.706
   90    HA   ASN  12           HA       ASN  12   4.490  10.382   0.925
   91    HB2  ASN  12           2HB      ASN  12   2.452  11.814   1.104
   92    HB3  ASN  12           1HB      ASN  12   3.897  12.675   0.594
   93   HD21  ASN  12          1HD2      ASN  12   2.775  14.335  -0.347
   94   HD22  ASN  12          2HD2      ASN  12   1.893  14.149  -1.828
   95    H    ARG  13           H        ARG  13   4.271   8.290  -0.946
   96    HA   ARG  13           HA       ARG  13   1.516   7.553  -1.202
   97    HB2  ARG  13           2HB      ARG  13   4.067   6.044  -1.708
   98    HB3  ARG  13           1HB      ARG  13   2.485   5.286  -1.852
   99    HG2  ARG  13           2HG      ARG  13   3.004   5.890  -4.027
  100    HG3  ARG  13           1HG      ARG  13   1.965   7.209  -3.483
  101    HD2  ARG  13           2HD      ARG  13   3.967   8.001  -4.687
  102    HD3  ARG  13           1HD      ARG  13   3.878   8.582  -3.019
  103    HE   ARG  13           HE       ARG  13   5.464   6.710  -2.486
  104   HH11  ARG  13          1HH1      ARG  13   5.386   8.168  -5.679
  105   HH12  ARG  13          2HH1      ARG  13   7.013   7.688  -6.060
  106   HH21  ARG  13          1HH2      ARG  13   7.586   6.105  -2.995
  107   HH22  ARG  13          2HH2      ARG  13   8.265   6.541  -4.535
  108    H    GLY  14           H        GLY  14   3.911   7.317   1.198
  109    HA2  GLY  14           2HA      GLY  14   2.251   6.324   3.188
  110    HA3  GLY  14           1HA      GLY  14   3.099   4.939   2.509
  111    H    LYS  15           H        LYS  15   3.558   5.415   5.091
  112    HA   LYS  15           HA       LYS  15   6.103   6.891   5.169
  113    HB2  LYS  15           2HB      LYS  15   4.274   6.267   7.501
  114    HB3  LYS  15           1HB      LYS  15   5.729   7.251   7.550
  115    HG2  LYS  15           2HG      LYS  15   4.073   8.845   7.507
  116    HG3  LYS  15           1HG      LYS  15   4.481   8.712   5.796
  117    HD2  LYS  15           2HD      LYS  15   2.602   6.916   5.760
  118    HD3  LYS  15           1HD      LYS  15   2.076   7.694   7.253
  119    HE2  LYS  15           2HE      LYS  15   1.939   9.837   6.087
  120    HE3  LYS  15           1HE      LYS  15   2.482   9.060   4.598
  121    HZ1  LYS  15           3HZ      LYS  15   0.137   9.225   4.484
  122    HZ2  LYS  15           1HZ      LYS  15  -0.069   8.602   6.053
  123    HZ3  LYS  15           2HZ      LYS  15   0.479   7.595   4.805
  124    H    HIS  16           H        HIS  16   7.817   5.967   6.414
  125    HA   HIS  16           HA       HIS  16   9.217   4.298   7.032
  126    HB2  HIS  16           2HB      HIS  16   7.735   3.938   8.900
  127    HB3  HIS  16           1HB      HIS  16   6.616   3.014   7.902
  128    HD1  HIS  16           1HD      HIS  16  10.350   2.663   8.659
  129    HD2  HIS  16           2HD      HIS  16   6.853   0.413   8.530
  130    HE1  HIS  16           1HE      HIS  16  11.027   0.314   9.265
  131    HE2  HIS  16           2HE      HIS  16   8.867  -0.990   9.350
  132    H    LEU  17           H        LEU  17   6.579   2.167   6.183
  133    HA   LEU  17           HA       LEU  17   7.205   1.441   3.612
  134    HB2  LEU  17           2HB      LEU  17   9.322   0.610   4.282
  135    HB3  LEU  17           1HB      LEU  17   8.667  -0.151   5.724
  136    HG   LEU  17           HG       LEU  17   7.384  -1.658   4.129
  137   HD11  LEU  17          1HD1      LEU  17   7.974  -0.015   2.222
  138   HD12  LEU  17          2HD1      LEU  17   7.933  -1.745   1.892
  139   HD13  LEU  17          3HD1      LEU  17   9.479  -0.926   2.132
  140   HD21  LEU  17          3HD2      LEU  17  10.398  -1.793   4.180
  141   HD22  LEU  17          1HD2      LEU  17   9.320  -3.133   3.785
  142   HD23  LEU  17          2HD2      LEU  17   9.305  -2.438   5.405
  143    H    ASN  18           H        ASN  18   4.920   1.543   3.798
  144    HA   ASN  18           HA       ASN  18   3.550  -0.178   5.650
  145    HB2  ASN  18           2HB      ASN  18   2.485   1.558   3.423
  146    HB3  ASN  18           1HB      ASN  18   1.512   0.778   4.657
  147   HD21  ASN  18          1HD2      ASN  18   3.472   1.331   6.746
  148   HD22  ASN  18          2HD2      ASN  18   3.324   3.026   7.095
  149    H    SER  19           H        SER  19   5.139  -1.711   4.106
  150    HA   SER  19           HA       SER  19   4.018  -2.650   1.689
  151    HB2  SER  19           2HB      SER  19   5.591  -4.619   2.163
  152    HB3  SER  19           1HB      SER  19   6.330  -3.016   2.059
  153    HG   SER  19           HG       SER  19   5.855  -4.630   4.327
  154    H    MET  20           H        MET  20   3.085  -3.076   4.898
  155    HA   MET  20           HA       MET  20   1.873  -5.674   4.459
  156    HB2  MET  20           2HB      MET  20   1.086  -5.086   6.910
  157    HB3  MET  20           1HB      MET  20   2.706  -5.687   6.612
  158    HG2  MET  20           2HG      MET  20   3.554  -3.400   6.685
  159    HG3  MET  20           1HG      MET  20   1.921  -2.794   6.956
  160    HE1  MET  20           3HE      MET  20   0.763  -5.013   8.967
  161    HE2  MET  20           1HE      MET  20   0.527  -3.275   9.162
  162    HE3  MET  20           2HE      MET  20   1.124  -4.243  10.510
  163    H    GLU  21           H        GLU  21   1.156  -2.327   4.600
  164    HA   GLU  21           HA       GLU  21  -1.688  -2.507   4.695
  165    HB2  GLU  21           2HB      GLU  21   0.067  -0.358   3.465
  166    HB3  GLU  21           1HB      GLU  21  -1.632  -0.193   3.928
  167    HG2  GLU  21           2HG      GLU  21   0.663  -0.691   5.801
  168    HG3  GLU  21           1HG      GLU  21  -0.125   0.862   5.485
  169    H    ARG  22           H        ARG  22   0.699  -1.981   2.192
  170    HA   ARG  22           HA       ARG  22  -0.761  -1.499  -0.053
  171    HB2  ARG  22           2HB      ARG  22   1.595  -3.395  -0.006
  172    HB3  ARG  22           1HB      ARG  22   1.062  -2.363  -1.309
  173    HG2  ARG  22           2HG      ARG  22   2.259  -1.460   1.299
  174    HG3  ARG  22           1HG      ARG  22   3.061  -1.467  -0.276
  175    HD2  ARG  22           2HD      ARG  22   1.934   0.359  -1.005
  176    HD3  ARG  22           1HD      ARG  22   0.490  -0.040  -0.075
  177    HE   ARG  22           HE       ARG  22   2.199   0.669   1.848
  178   HH11  ARG  22          1HH1      ARG  22   1.558   2.216  -1.225
  179   HH12  ARG  22          2HH1      ARG  22   1.541   3.818  -0.555
  180   HH21  ARG  22          1HH2      ARG  22   2.198   2.811   2.723
  181   HH22  ARG  22          2HH2      ARG  22   1.909   4.156   1.666
  182    H    VAL  23           H        VAL  23   0.424  -4.762   0.717
  183    HA   VAL  23           HA       VAL  23  -0.835  -6.005  -1.400
  184    HB   VAL  23           HB       VAL  23  -0.448  -8.073   0.029
  185   HG11  VAL  23          1HG1      VAL  23   1.936  -6.261  -0.151
  186   HG12  VAL  23          2HG1      VAL  23   1.232  -7.044  -1.569
  187   HG13  VAL  23          3HG1      VAL  23   1.913  -8.022  -0.265
  188   HG21  VAL  23          3HG2      VAL  23  -0.492  -7.582   2.204
  189   HG22  VAL  23          1HG2      VAL  23  -0.060  -5.907   1.861
  190   HG23  VAL  23          2HG2      VAL  23   1.204  -7.140   1.954
  191    H    GLU  24           H        GLU  24  -2.286  -4.880   1.512
  192    HA   GLU  24           HA       GLU  24  -4.540  -6.710   1.300
  193    HB2  GLU  24           2HB      GLU  24  -4.483  -4.221   2.987
  194    HB3  GLU  24           1HB      GLU  24  -5.386  -5.711   3.254
  195    HG2  GLU  24           2HG      GLU  24  -3.215  -6.853   3.651
  196    HG3  GLU  24           1HG      GLU  24  -2.448  -5.263   3.561
  197    H    TRP  25           H        TRP  25  -3.702  -3.353   0.623
  198    HA   TRP  25           HA       TRP  25  -6.341  -3.024  -0.458
  199    HB2  TRP  25           2HB      TRP  25  -5.675  -0.755  -1.067
  200    HB3  TRP  25           1HB      TRP  25  -5.733  -1.097   0.647
  201    HD1  TRP  25           HD       TRP  25  -3.525  -0.671   1.988
  202    HE1  TRP  25           1HE      TRP  25  -1.384   0.628   1.401
  203    HE3  TRP  25           3HE      TRP  25  -3.973  -0.670  -3.057
  204    HZ2  TRP  25           2HZ      TRP  25  -0.070   1.540  -0.949
  205    HZ3  TRP  25           3HZ      TRP  25  -2.267   0.446  -4.431
  206    HH2  TRP  25           HH       TRP  25  -0.334   1.510  -3.391
  207    H    LEU  26           H        LEU  26  -3.403  -4.122  -1.649
  208    HA   LEU  26           HA       LEU  26  -3.599  -3.164  -4.240
  209    HB2  LEU  26           2HB      LEU  26  -2.447  -5.854  -3.442
  210    HB3  LEU  26           1HB      LEU  26  -2.108  -5.004  -4.929
  211    HG   LEU  26           HG       LEU  26  -1.074  -4.523  -2.192
  212   HD11  LEU  26          1HD1      LEU  26   1.019  -4.161  -3.411
  213   HD12  LEU  26          2HD1      LEU  26   0.166  -4.378  -4.940
  214   HD13  LEU  26          3HD1      LEU  26   0.300  -5.722  -3.807
  215   HD21  LEU  26          3HD2      LEU  26  -0.460  -2.251  -2.777
  216   HD22  LEU  26          1HD2      LEU  26  -2.212  -2.526  -2.704
  217   HD23  LEU  26          2HD2      LEU  26  -1.389  -2.395  -4.278
  218    H    ARG  27           H        ARG  27  -5.913  -4.737  -2.902
  219    HA   ARG  27           HA       ARG  27  -6.846  -5.899  -5.430
  220    HB2  ARG  27           2HB      ARG  27  -7.732  -6.732  -2.669
  221    HB3  ARG  27           1HB      ARG  27  -8.011  -7.565  -4.196
  222    HG2  ARG  27           2HG      ARG  27  -6.307  -8.839  -3.358
  223    HG3  ARG  27           1HG      ARG  27  -5.399  -7.625  -4.271
  224    HD2  ARG  27           2HD      ARG  27  -4.478  -8.088  -1.984
  225    HD3  ARG  27           1HD      ARG  27  -4.874  -6.385  -2.275
  226    HE   ARG  27           HE       ARG  27  -6.771  -6.654  -0.882
  227   HH11  ARG  27          1HH1      ARG  27  -4.627  -9.424  -0.916
  228   HH12  ARG  27          2HH1      ARG  27  -5.270 -10.096   0.559
  229   HH21  ARG  27          1HH2      ARG  27  -7.601  -7.529   1.076
  230   HH22  ARG  27          2HH2      ARG  27  -6.942  -9.022   1.682
  231    H    LYS  28           H        LYS  28  -8.033  -4.740  -2.309
  232    HA   LYS  28           HA       LYS  28 -10.519  -3.962  -3.244
  233    HB2  LYS  28           2HB      LYS  28 -10.734  -2.759  -1.106
  234    HB3  LYS  28           1HB      LYS  28 -10.189  -4.424  -0.944
  235    HG2  LYS  28           2HG      LYS  28  -7.894  -3.642  -0.723
  236    HG3  LYS  28           1HG      LYS  28  -8.471  -1.987  -0.871
  237    HD2  LYS  28           2HD      LYS  28  -9.922  -2.447   1.147
  238    HD3  LYS  28           1HD      LYS  28  -9.010  -3.945   1.341
  239    HE2  LYS  28           2HE      LYS  28  -6.923  -2.614   1.449
  240    HE3  LYS  28           1HE      LYS  28  -7.898  -1.149   1.351
  241    HZ1  LYS  28           3HZ      LYS  28  -9.002  -1.800   3.419
  242    HZ2  LYS  28           1HZ      LYS  28  -7.324  -1.640   3.641
  243    HZ3  LYS  28           2HZ      LYS  28  -8.024  -3.182   3.524
  244    H    LYS  29           H        LYS  29  -7.504  -2.196  -3.443
  245    HA   LYS  29           HA       LYS  29  -9.065   0.098  -4.445
  246    HB2  LYS  29           2HB      LYS  29  -6.425   0.701  -3.241
  247    HB3  LYS  29           1HB      LYS  29  -7.899   1.651  -3.251
  248    HG2  LYS  29           2HG      LYS  29  -7.427  -0.768  -1.542
  249    HG3  LYS  29           1HG      LYS  29  -7.181   0.902  -1.015
  250    HD2  LYS  29           2HD      LYS  29  -9.827  -0.096  -2.062
  251    HD3  LYS  29           1HD      LYS  29  -9.394  -0.171  -0.356
  252    HE2  LYS  29           2HE      LYS  29 -10.674   1.794  -0.620
  253    HE3  LYS  29           1HE      LYS  29  -9.002   2.326  -0.477
  254    HZ1  LYS  29           3HZ      LYS  29 -10.357   1.958  -3.094
  255    HZ2  LYS  29           1HZ      LYS  29  -8.896   2.767  -2.780
  256    HZ3  LYS  29           2HZ      LYS  29 -10.365   3.429  -2.251
  257    H    LEU  30           H        LEU  30  -6.479  -2.083  -5.077
  258    HA   LEU  30           HA       LEU  30  -4.592  -0.556  -6.321
  259    HB2  LEU  30           2HB      LEU  30  -3.654  -2.455  -7.055
  260    HB3  LEU  30           1HB      LEU  30  -4.793  -3.150  -5.921
  261    HG   LEU  30           HG       LEU  30  -5.662  -2.845  -8.750
  262   HD11  LEU  30          1HD1      LEU  30  -3.322  -3.702  -8.737
  263   HD12  LEU  30          2HD1      LEU  30  -4.517  -4.786  -9.458
  264   HD13  LEU  30          3HD1      LEU  30  -3.906  -5.100  -7.831
  265   HD21  LEU  30          3HD2      LEU  30  -7.242  -3.715  -7.146
  266   HD22  LEU  30          1HD2      LEU  30  -6.077  -4.929  -6.596
  267   HD23  LEU  30          2HD2      LEU  30  -6.742  -5.010  -8.233
  268    H    GLN  31           H        GLN  31  -7.533  -1.826  -7.725
  269    HA   GLN  31           HA       GLN  31  -7.871   0.441  -9.363
  270    HB2  GLN  31           2HB      GLN  31  -7.954  -0.929 -11.553
  271    HB3  GLN  31           1HB      GLN  31  -6.389  -0.407 -10.951
  272    HG2  GLN  31           2HG      GLN  31  -5.973  -2.578 -11.565
  273    HG3  GLN  31           1HG      GLN  31  -6.303  -2.742  -9.846
  274   HE21  GLN  31          1HE2      GLN  31  -8.136  -3.828  -9.169
  275   HE22  GLN  31          2HE2      GLN  31  -9.126  -4.727 -10.255
  276    H    ASP  32           H        ASP  32  -8.912  -1.995  -7.632
  277    HA   ASP  32           HA       ASP  32 -10.828  -3.044  -7.157
  278    HB2  ASP  32           2HB      ASP  32 -11.572  -0.599  -7.200
  279    HB3  ASP  32           1HB      ASP  32 -12.287  -0.984  -8.769
  280    H    VAL  33           H        VAL  33 -12.173  -4.604  -7.887
  281    HA   VAL  33           HA       VAL  33 -12.696  -5.151 -10.596
  282    HB   VAL  33           HB       VAL  33 -10.277  -5.446 -10.768
  283   HG11  VAL  33          1HG1      VAL  33  -9.723  -6.065  -8.501
  284   HG12  VAL  33          2HG1      VAL  33  -9.143  -7.308  -9.609
  285   HG13  VAL  33          3HG1      VAL  33 -10.607  -7.581  -8.664
  286   HG21  VAL  33          3HG2      VAL  33 -11.754  -8.068 -10.941
  287   HG22  VAL  33          1HG2      VAL  33 -10.250  -7.670 -11.768
  288   HG23  VAL  33          2HG2      VAL  33 -11.735  -6.808 -12.174
  289    H    HIS  34           H        HIS  34 -11.882  -6.715  -7.480
  290    HA   HIS  34           HA       HIS  34 -14.506  -8.066  -7.706
  291    HB2  HIS  34           2HB      HIS  34 -12.545  -9.609  -8.191
  292    HB3  HIS  34           1HB      HIS  34 -12.059  -9.379  -6.516
  293    HD1  HIS  34           1HD      HIS  34 -12.689 -11.356  -5.218
  294    HD2  HIS  34           2HD      HIS  34 -15.575 -10.417  -8.061
  295    HE1  HIS  34           1HE      HIS  34 -14.530 -13.042  -4.903
  296    HE2  HIS  34           2HE      HIS  34 -16.144 -12.594  -6.784
  297    H    ASN  35           H        ASN  35 -13.711  -5.628  -6.429
  298    HA   ASN  35           HA       ASN  35 -14.213  -6.300  -3.612
  299    HB2  ASN  35           2HB      ASN  35 -12.577  -3.943  -3.819
  300    HB3  ASN  35           1HB      ASN  35 -12.264  -5.430  -2.929
  301   HD21  ASN  35          1HD2      ASN  35 -11.878  -3.785  -5.998
  302   HD22  ASN  35          2HD2      ASN  35 -10.507  -4.730  -6.527
  303    H    PHE  36           H        PHE  36 -15.775  -5.282  -5.921
  304    HA   PHE  36           HA       PHE  36 -16.421  -2.575  -5.481
  305    HB2  PHE  36           2HB      PHE  36 -17.669  -4.843  -6.946
  306    HB3  PHE  36           1HB      PHE  36 -18.623  -3.382  -6.684
  307    HD1  PHE  36           2HD      PHE  36 -15.718  -4.840  -8.346
  308    HD2  PHE  36           1HD      PHE  36 -18.021  -1.310  -7.767
  309    HE1  PHE  36           2HE      PHE  36 -14.602  -3.805 -10.275
  310    HE2  PHE  36           1HE      PHE  36 -16.912  -0.269  -9.702
  311    HZ   PHE  36           HZ       PHE  36 -15.183  -1.488 -10.925
  312    HA   PRO  37           HA       PRO  37 -20.114  -4.426  -2.760
  313    HB2  PRO  37           2HB      PRO  37 -18.633  -6.816  -1.776
  314    HB3  PRO  37           1HB      PRO  37 -20.362  -6.604  -2.081
  315    HG2  PRO  37           2HG      PRO  37 -18.863  -7.975  -3.788
  316    HG3  PRO  37           1HG      PRO  37 -20.122  -6.873  -4.376
  317    HD2  PRO  37           2HD      PRO  37 -17.157  -6.486  -4.285
  318    HD3  PRO  37           1HD      PRO  37 -18.319  -6.007  -5.539
  319    HA   PRO  38           HA       PRO  38 -16.680  -4.454   1.019
  320    HB2  PRO  38           2HB      PRO  38 -14.749  -3.438  -1.048
  321    HB3  PRO  38           1HB      PRO  38 -14.409  -4.143   0.542
  322    HG2  PRO  38           2HG      PRO  38 -14.268  -5.647  -1.633
  323    HG3  PRO  38           1HG      PRO  38 -14.987  -6.287  -0.145
  324    HD2  PRO  38           2HD      PRO  38 -16.294  -5.505  -2.662
  325    HD3  PRO  38           1HD      PRO  38 -16.826  -6.642  -1.419
  326    H    ASP  39           H        ASP  39 -17.680  -2.799   1.976
  327    HA   ASP  39           HA       ASP  39 -18.152  -0.296   0.631
  328    HB2  ASP  39           2HB      ASP  39 -19.575  -1.740   2.370
  329    HB3  ASP  39           1HB      ASP  39 -18.746  -0.689   3.514
  Start of MODEL   10
    1    H2   PRO   1           1HT      PRO   1  17.323  16.265   6.872
    2    H3   PRO   1           2HT      PRO   1  18.751  15.584   7.298
    3    HA   PRO   1           HA       PRO   1  19.198  14.885   5.342
    4    HB2  PRO   1           2HB      PRO   1  16.782  14.222   4.036
    5    HB3  PRO   1           1HB      PRO   1  17.972  13.102   4.714
    6    HG2  PRO   1           2HG      PRO   1  15.462  14.149   5.908
    7    HG3  PRO   1           1HG      PRO   1  16.250  12.577   6.141
    8    HD2  PRO   1           2HD      PRO   1  16.347  14.440   8.048
    9    HD3  PRO   1           1HD      PRO   1  17.763  13.428   7.703
   10    HA   PRO   2           HA       PRO   2  17.918  19.077   4.019
   11    HB2  PRO   2           2HB      PRO   2  20.618  19.092   2.856
   12    HB3  PRO   2           1HB      PRO   2  19.884  20.214   4.003
   13    HG2  PRO   2           2HG      PRO   2  21.806  18.491   4.746
   14    HG3  PRO   2           1HG      PRO   2  20.481  18.946   5.835
   15    HD2  PRO   2           2HD      PRO   2  20.821  16.457   4.201
   16    HD3  PRO   2           1HD      PRO   2  20.232  16.639   5.867
   17    H    SER   3           H        SER   3  20.283  17.568   1.801
   18    HA   SER   3           HA       SER   3  18.190  17.437  -0.254
   19    HB2  SER   3           2HB      SER   3  20.867  18.779  -0.679
   20    HB3  SER   3           1HB      SER   3  19.579  18.609  -1.872
   21    HG   SER   3           HG       SER   3  18.277  19.788  -0.192
   22    H    VAL   4           H        VAL   4  21.422  16.496   0.815
   23    HA   VAL   4           HA       VAL   4  22.284  14.927  -1.270
   24    HB   VAL   4           HB       VAL   4  22.649  14.447   1.692
   25   HG11  VAL   4          1HG1      VAL   4  24.150  13.238  -0.634
   26   HG12  VAL   4          2HG1      VAL   4  23.095  12.380   0.488
   27   HG13  VAL   4          3HG1      VAL   4  24.601  13.089   1.065
   28   HG21  VAL   4          3HG2      VAL   4  24.393  15.795  -0.367
   29   HG22  VAL   4          1HG2      VAL   4  24.842  15.493   1.312
   30   HG23  VAL   4          2HG2      VAL   4  23.508  16.585   0.939
   31    H    SER   5           H        SER   5  20.056  13.988   1.336
   32    HA   SER   5           HA       SER   5  19.140  11.852  -0.449
   33    HB2  SER   5           2HB      SER   5  19.574  11.536   2.527
   34    HB3  SER   5           1HB      SER   5  18.865  10.331   1.450
   35    HG   SER   5           HG       SER   5  21.337  11.354   0.710
   36    H    GLU   6           H        GLU   6  17.739  14.043  -0.625
   37    HA   GLU   6           HA       GLU   6  15.589  14.027   1.251
   38    HB2  GLU   6           2HB      GLU   6  14.501  15.618  -0.363
   39    HB3  GLU   6           1HB      GLU   6  16.058  16.125   0.270
   40    HG2  GLU   6           2HG      GLU   6  17.145  15.519  -1.802
   41    HG3  GLU   6           1HG      GLU   6  15.629  14.889  -2.442
   42    H    ILE   7           H        ILE   7  15.328  13.594  -2.288
   43    HA   ILE   7           HA       ILE   7  13.397  11.439  -1.761
   44    HB   ILE   7           HB       ILE   7  13.583  13.116  -4.262
   45   HG12  ILE   7          2HG1      ILE   7  12.996  14.581  -2.441
   46   HG13  ILE   7          1HG1      ILE   7  11.553  14.262  -3.396
   47   HG21  ILE   7          1HG2      ILE   7  11.340  12.240  -4.714
   48   HG22  ILE   7          2HG2      ILE   7  11.417  11.279  -3.238
   49   HG23  ILE   7          3HG2      ILE   7  12.522  10.939  -4.569
   50   HD11  ILE   7          3HD1      ILE   7  11.045  14.229  -1.030
   51   HD12  ILE   7          1HD1      ILE   7  12.262  12.976  -0.774
   52   HD13  ILE   7          2HD1      ILE   7  10.820  12.625  -1.731
   53    H    GLN   8           H        GLN   8  15.620  10.308  -1.576
   54    HA   GLN   8           HA       GLN   8  16.193   9.047  -4.163
   55    HB2  GLN   8           2HB      GLN   8  18.285  10.121  -2.261
   56    HB3  GLN   8           1HB      GLN   8  18.627   9.081  -3.640
   57    HG2  GLN   8           2HG      GLN   8  18.137  10.745  -5.176
   58    HG3  GLN   8           1HG      GLN   8  17.154  11.638  -4.012
   59   HE21  GLN   8          1HE2      GLN   8  17.972  13.006  -2.690
   60   HE22  GLN   8          2HE2      GLN   8  19.597  13.532  -2.735
   61    H    LEU   9           H        LEU   9  17.419   8.944  -0.842
   62    HA   LEU   9           HA       LEU   9  17.759   6.279  -0.508
   63    HB2  LEU   9           2HB      LEU   9  17.697   6.615   1.836
   64    HB3  LEU   9           1HB      LEU   9  18.373   8.060   1.113
   65    HG   LEU   9           HG       LEU   9  15.544   7.759   2.138
   66   HD11  LEU   9          1HD1      LEU   9  17.304   7.846   3.873
   67   HD12  LEU   9          2HD1      LEU   9  16.215   9.231   3.911
   68   HD13  LEU   9          3HD1      LEU   9  17.829   9.397   3.220
   69   HD21  LEU   9          3HD2      LEU   9  15.108   9.932   1.488
   70   HD22  LEU   9          1HD2      LEU   9  16.056   9.314   0.127
   71   HD23  LEU   9          2HD2      LEU   9  16.818  10.344   1.348
   72    H    MET  10           H        MET  10  14.726   7.982  -0.499
   73    HA   MET  10           HA       MET  10  13.214   5.851   0.668
   74    HB2  MET  10           2HB      MET  10  12.375   8.325  -0.837
   75    HB3  MET  10           1HB      MET  10  11.242   7.177  -0.137
   76    HG2  MET  10           2HG      MET  10  12.238   7.603   2.076
   77    HG3  MET  10           1HG      MET  10  13.269   8.830   1.346
   78    HE1  MET  10           3HE      MET  10  12.431  10.687   3.024
   79    HE2  MET  10           1HE      MET  10  11.436   9.472   3.827
   80    HE3  MET  10           2HE      MET  10  10.729  11.014   3.345
   81    H    HIS  11           H        HIS  11  14.145   4.196  -0.820
   82    HA   HIS  11           HA       HIS  11  13.148   4.117  -3.518
   83    HB2  HIS  11           2HB      HIS  11  15.241   2.944  -2.746
   84    HB3  HIS  11           1HB      HIS  11  14.219   1.815  -1.862
   85    HD1  HIS  11           1HD      HIS  11  13.512  -0.215  -3.116
   86    HD2  HIS  11           2HD      HIS  11  14.677   2.878  -5.646
   87    HE1  HIS  11           1HE      HIS  11  13.466  -1.178  -5.444
   88    HE2  HIS  11           2HE      HIS  11  14.327   0.666  -6.934
   89    H    ASN  12           H        ASN  12  11.888   3.467  -0.453
   90    HA   ASN  12           HA       ASN  12   9.888   1.591  -1.087
   91    HB2  ASN  12           2HB      ASN  12   8.746   2.515   0.955
   92    HB3  ASN  12           1HB      ASN  12  10.410   2.013   1.211
   93   HD21  ASN  12          1HD2      ASN  12  10.717   3.266   2.983
   94   HD22  ASN  12          2HD2      ASN  12  10.828   4.994   2.912
   95    H    ARG  13           H        ARG  13  10.262   4.947  -1.698
   96    HA   ARG  13           HA       ARG  13   9.024   6.504  -2.786
   97    HB2  ARG  13           2HB      ARG  13   8.639   4.003  -4.402
   98    HB3  ARG  13           1HB      ARG  13   8.045   5.568  -4.950
   99    HG2  ARG  13           2HG      ARG  13  10.900   4.791  -4.397
  100    HG3  ARG  13           1HG      ARG  13  10.168   5.135  -5.965
  101    HD2  ARG  13           2HD      ARG  13  10.555   7.096  -3.704
  102    HD3  ARG  13           1HD      ARG  13  11.487   7.028  -5.198
  103    HE   ARG  13           HE       ARG  13   9.199   7.458  -6.285
  104   HH11  ARG  13          1HH1      ARG  13  10.222   8.740  -3.185
  105   HH12  ARG  13          2HH1      ARG  13   9.250  10.179  -3.308
  106   HH21  ARG  13          1HH2      ARG  13   7.912   9.352  -6.446
  107   HH22  ARG  13          2HH2      ARG  13   7.947  10.520  -5.153
  108    H    GLY  14           H        GLY  14   7.601   6.121  -0.661
  109    HA2  GLY  14           2HA      GLY  14   4.995   6.808  -1.438
  110    HA3  GLY  14           1HA      GLY  14   4.998   5.118  -0.956
  111    H    LYS  15           H        LYS  15   4.866   4.633   1.138
  112    HA   LYS  15           HA       LYS  15   5.229   6.797   3.083
  113    HB2  LYS  15           2HB      LYS  15   2.866   4.907   3.001
  114    HB3  LYS  15           1HB      LYS  15   3.169   6.128   4.229
  115    HG2  LYS  15           2HG      LYS  15   2.649   6.677   1.312
  116    HG3  LYS  15           1HG      LYS  15   1.474   6.842   2.619
  117    HD2  LYS  15           2HD      LYS  15   2.769   8.589   3.637
  118    HD3  LYS  15           1HD      LYS  15   4.081   8.348   2.480
  119    HE2  LYS  15           2HE      LYS  15   2.585   9.022   0.660
  120    HE3  LYS  15           1HE      LYS  15   1.288   9.289   1.827
  121    HZ1  LYS  15           3HZ      LYS  15   2.420  11.345   1.220
  122    HZ2  LYS  15           1HZ      LYS  15   3.888  10.724   1.796
  123    HZ3  LYS  15           2HZ      LYS  15   2.603  11.006   2.869
  124    H    HIS  16           H        HIS  16   7.002   6.015   4.046
  125    HA   HIS  16           HA       HIS  16   8.369   4.710   5.310
  126    HB2  HIS  16           2HB      HIS  16   6.374   5.226   6.831
  127    HB3  HIS  16           1HB      HIS  16   5.821   3.588   6.493
  128    HD1  HIS  16           1HD      HIS  16   6.130   3.577   9.237
  129    HD2  HIS  16           2HD      HIS  16   9.572   3.480   6.899
  130    HE1  HIS  16           1HE      HIS  16   7.953   2.712  10.743
  131    HE2  HIS  16           2HE      HIS  16   9.978   2.482   9.254
  132    H    LEU  17           H        LEU  17   6.564   2.080   6.159
  133    HA   LEU  17           HA       LEU  17   7.288   0.494   3.816
  134    HB2  LEU  17           2HB      LEU  17   9.107   0.067   5.238
  135    HB3  LEU  17           1HB      LEU  17   8.101  -0.007   6.673
  136    HG   LEU  17           HG       LEU  17   7.134  -2.142   5.682
  137   HD11  LEU  17          1HD1      LEU  17   8.132  -1.476   3.414
  138   HD12  LEU  17          2HD1      LEU  17   8.149  -3.174   3.885
  139   HD13  LEU  17          3HD1      LEU  17   9.615  -2.200   4.025
  140   HD21  LEU  17          3HD2      LEU  17   9.006  -3.497   6.443
  141   HD22  LEU  17          1HD2      LEU  17   8.756  -2.125   7.521
  142   HD23  LEU  17          2HD2      LEU  17  10.074  -2.099   6.350
  143    H    ASN  18           H        ASN  18   4.939   1.041   3.645
  144    HA   ASN  18           HA       ASN  18   3.158  -0.334   5.450
  145    HB2  ASN  18           2HB      ASN  18   2.694   1.293   2.948
  146    HB3  ASN  18           1HB      ASN  18   1.391   0.530   3.858
  147   HD21  ASN  18          1HD2      ASN  18   3.007   1.080   6.358
  148   HD22  ASN  18          2HD2      ASN  18   2.667   2.736   6.713
  149    H    SER  19           H        SER  19   4.905  -2.119   4.227
  150    HA   SER  19           HA       SER  19   3.707  -3.212   1.869
  151    HB2  SER  19           2HB      SER  19   5.949  -4.149   3.654
  152    HB3  SER  19           1HB      SER  19   5.430  -5.027   2.215
  153    HG   SER  19           HG       SER  19   5.884  -3.120   1.007
  154    H    MET  20           H        MET  20   2.654  -3.291   4.992
  155    HA   MET  20           HA       MET  20   1.412  -5.919   4.575
  156    HB2  MET  20           2HB      MET  20   0.776  -5.925   6.833
  157    HB3  MET  20           1HB      MET  20   2.333  -5.120   6.875
  158    HG2  MET  20           2HG      MET  20   1.306  -2.970   7.098
  159    HG3  MET  20           1HG      MET  20  -0.294  -3.671   6.843
  160    HE1  MET  20           3HE      MET  20  -0.203  -6.321   8.569
  161    HE2  MET  20           1HE      MET  20  -1.546  -5.181   8.554
  162    HE3  MET  20           2HE      MET  20  -0.872  -5.727  10.089
  163    H    GLU  21           H        GLU  21   0.812  -2.510   4.818
  164    HA   GLU  21           HA       GLU  21  -1.989  -2.499   4.469
  165    HB2  GLU  21           2HB      GLU  21   0.048  -0.439   3.574
  166    HB3  GLU  21           1HB      GLU  21  -1.676  -0.164   3.812
  167    HG2  GLU  21           2HG      GLU  21   0.246  -0.968   5.978
  168    HG3  GLU  21           1HG      GLU  21  -0.253   0.689   5.616
  169    H    ARG  22           H        ARG  22   0.642  -1.936   2.207
  170    HA   ARG  22           HA       ARG  22  -0.636  -1.469  -0.158
  171    HB2  ARG  22           2HB      ARG  22   1.912  -2.842   0.585
  172    HB3  ARG  22           1HB      ARG  22   1.351  -2.970  -1.069
  173    HG2  ARG  22           2HG      ARG  22   3.009  -1.145  -0.627
  174    HG3  ARG  22           1HG      ARG  22   1.521  -0.628  -1.407
  175    HD2  ARG  22           2HD      ARG  22   0.747   0.450   0.502
  176    HD3  ARG  22           1HD      ARG  22   1.786  -0.488   1.571
  177    HE   ARG  22           HE       ARG  22   3.605   0.888   0.969
  178   HH11  ARG  22          1HH1      ARG  22   0.535   2.051  -0.229
  179   HH12  ARG  22          2HH1      ARG  22   1.180   3.570  -0.774
  180   HH21  ARG  22          1HH2      ARG  22   4.451   2.899   0.265
  181   HH22  ARG  22          2HH2      ARG  22   3.379   4.040  -0.498
  182    H    VAL  23           H        VAL  23   0.486  -4.729   0.748
  183    HA   VAL  23           HA       VAL  23  -0.677  -5.994  -1.439
  184    HB   VAL  23           HB       VAL  23  -0.242  -8.042  -0.120
  185   HG11  VAL  23          1HG1      VAL  23   2.005  -6.039   0.021
  186   HG12  VAL  23          2HG1      VAL  23   1.561  -6.936  -1.431
  187   HG13  VAL  23          3HG1      VAL  23   2.163  -7.795  -0.013
  188   HG21  VAL  23          3HG2      VAL  23  -0.228  -7.929   2.084
  189   HG22  VAL  23          1HG2      VAL  23  -0.623  -6.218   1.877
  190   HG23  VAL  23          2HG2      VAL  23   1.071  -6.725   2.046
  191    H    GLU  24           H        GLU  24  -2.202  -4.837   1.434
  192    HA   GLU  24           HA       GLU  24  -4.511  -6.564   1.120
  193    HB2  GLU  24           2HB      GLU  24  -4.497  -3.888   2.510
  194    HB3  GLU  24           1HB      GLU  24  -5.591  -5.241   2.768
  195    HG2  GLU  24           2HG      GLU  24  -3.712  -6.523   3.702
  196    HG3  GLU  24           1HG      GLU  24  -2.703  -5.081   3.515
  197    H    TRP  25           H        TRP  25  -3.716  -3.128   0.603
  198    HA   TRP  25           HA       TRP  25  -6.221  -2.689  -0.578
  199    HB2  TRP  25           2HB      TRP  25  -5.385  -0.511  -1.301
  200    HB3  TRP  25           1HB      TRP  25  -5.419  -0.808   0.418
  201    HD1  TRP  25           HD       TRP  25  -3.183  -0.400   1.687
  202    HE1  TRP  25           1HE      TRP  25  -0.922   0.596   0.986
  203    HE3  TRP  25           3HE      TRP  25  -3.697  -0.741  -3.338
  204    HZ2  TRP  25           2HZ      TRP  25   0.459   1.153  -1.428
  205    HZ3  TRP  25           3HZ      TRP  25  -1.890   0.045  -4.805
  206    HH2  TRP  25           HH       TRP  25   0.163   0.965  -3.857
  207    H    LEU  26           H        LEU  26  -3.235  -3.747  -1.971
  208    HA   LEU  26           HA       LEU  26  -3.539  -3.051  -4.565
  209    HB2  LEU  26           2HB      LEU  26  -3.065  -5.926  -3.802
  210    HB3  LEU  26           1HB      LEU  26  -2.476  -5.095  -5.216
  211    HG   LEU  26           HG       LEU  26  -1.481  -4.924  -2.391
  212   HD11  LEU  26          1HD1      LEU  26   0.670  -5.370  -3.476
  213   HD12  LEU  26          2HD1      LEU  26  -0.125  -5.418  -5.050
  214   HD13  LEU  26          3HD1      LEU  26  -0.508  -6.634  -3.830
  215   HD21  LEU  26          3HD2      LEU  26  -0.079  -3.047  -3.097
  216   HD22  LEU  26          1HD2      LEU  26  -1.813  -2.692  -3.114
  217   HD23  LEU  26          2HD2      LEU  26  -0.955  -2.987  -4.635
  218    H    ARG  27           H        ARG  27  -5.499  -5.174  -2.685
  219    HA   ARG  27           HA       ARG  27  -6.905  -6.118  -5.062
  220    HB2  ARG  27           2HB      ARG  27  -6.931  -7.186  -2.248
  221    HB3  ARG  27           1HB      ARG  27  -7.701  -7.931  -3.646
  222    HG2  ARG  27           2HG      ARG  27  -5.787  -9.113  -3.722
  223    HG3  ARG  27           1HG      ARG  27  -5.220  -7.683  -4.592
  224    HD2  ARG  27           2HD      ARG  27  -4.184  -6.785  -2.573
  225    HD3  ARG  27           1HD      ARG  27  -4.913  -8.091  -1.616
  226    HE   ARG  27           HE       ARG  27  -2.688  -8.370  -3.510
  227   HH11  ARG  27          1HH1      ARG  27  -4.729  -9.724  -1.012
  228   HH12  ARG  27          2HH1      ARG  27  -3.719 -11.110  -0.741
  229   HH21  ARG  27          1HH2      ARG  27  -1.315 -10.172  -3.124
  230   HH22  ARG  27          2HH2      ARG  27  -1.787 -11.370  -1.954
  231    H    LYS  28           H        LYS  28  -7.362  -4.207  -2.207
  232    HA   LYS  28           HA       LYS  28 -10.240  -4.132  -2.685
  233    HB2  LYS  28           2HB      LYS  28 -10.416  -3.022  -0.556
  234    HB3  LYS  28           1HB      LYS  28  -9.432  -4.475  -0.385
  235    HG2  LYS  28           2HG      LYS  28  -7.424  -3.160  -0.465
  236    HG3  LYS  28           1HG      LYS  28  -8.373  -1.708  -0.741
  237    HD2  LYS  28           2HD      LYS  28  -9.486  -2.152   1.471
  238    HD3  LYS  28           1HD      LYS  28  -8.266  -3.409   1.721
  239    HE2  LYS  28           2HE      LYS  28  -6.497  -1.767   1.466
  240    HE3  LYS  28           1HE      LYS  28  -7.688  -0.506   1.166
  241    HZ1  LYS  28           3HZ      LYS  28  -7.290  -2.020   3.696
  242    HZ2  LYS  28           1HZ      LYS  28  -8.563  -0.930   3.428
  243    HZ3  LYS  28           2HZ      LYS  28  -6.961  -0.377   3.426
  244    H    LYS  29           H        LYS  29  -7.668  -2.593  -3.941
  245    HA   LYS  29           HA       LYS  29  -9.165  -0.077  -4.206
  246    HB2  LYS  29           2HB      LYS  29  -6.169  -0.434  -4.220
  247    HB3  LYS  29           1HB      LYS  29  -7.001   1.075  -4.550
  248    HG2  LYS  29           2HG      LYS  29  -7.026  -0.443  -1.944
  249    HG3  LYS  29           1HG      LYS  29  -6.153   1.052  -2.294
  250    HD2  LYS  29           2HD      LYS  29  -8.290   2.193  -2.701
  251    HD3  LYS  29           1HD      LYS  29  -9.147   0.706  -2.294
  252    HE2  LYS  29           2HE      LYS  29  -8.127   0.765  -0.049
  253    HE3  LYS  29           1HE      LYS  29  -7.344   2.290  -0.465
  254    HZ1  LYS  29           3HZ      LYS  29 -10.267   1.796  -0.321
  255    HZ2  LYS  29           1HZ      LYS  29  -9.555   3.254  -0.806
  256    HZ3  LYS  29           2HZ      LYS  29  -9.346   2.698   0.778
  257    H    LEU  30           H        LEU  30  -7.323  -2.562  -5.915
  258    HA   LEU  30           HA       LEU  30  -6.966  -1.150  -8.292
  259    HB2  LEU  30           2HB      LEU  30  -5.871  -2.957  -8.971
  260    HB3  LEU  30           1HB      LEU  30  -6.088  -3.496  -7.321
  261    HG   LEU  30           HG       LEU  30  -8.380  -4.392  -8.501
  262   HD11  LEU  30          1HD1      LEU  30  -6.161  -4.421 -10.516
  263   HD12  LEU  30          2HD1      LEU  30  -7.818  -3.850 -10.714
  264   HD13  LEU  30          3HD1      LEU  30  -7.493  -5.577 -10.558
  265   HD21  LEU  30          3HD2      LEU  30  -7.186  -6.599  -8.520
  266   HD22  LEU  30          1HD2      LEU  30  -7.112  -5.705  -6.996
  267   HD23  LEU  30          2HD2      LEU  30  -5.716  -5.724  -8.086
  268    H    GLN  31           H        GLN  31  -9.505  -3.248  -7.166
  269    HA   GLN  31           HA       GLN  31 -11.415  -1.749  -8.602
  270    HB2  GLN  31           2HB      GLN  31 -12.442  -3.793  -9.738
  271    HB3  GLN  31           1HB      GLN  31 -11.024  -3.077 -10.484
  272    HG2  GLN  31           2HG      GLN  31 -10.418  -5.247 -10.607
  273    HG3  GLN  31           1HG      GLN  31  -9.794  -4.889  -8.995
  274   HE21  GLN  31          1HE2      GLN  31 -10.851  -5.673  -7.209
  275   HE22  GLN  31          2HE2      GLN  31 -12.055  -6.914  -7.314
  276    H    ASP  32           H        ASP  32 -10.718  -2.240  -5.996
  277    HA   ASP  32           HA       ASP  32 -11.280  -3.174  -4.002
  278    HB2  ASP  32           2HB      ASP  32 -13.571  -2.496  -3.291
  279    HB3  ASP  32           1HB      ASP  32 -12.640  -1.209  -4.035
  280    H    VAL  33           H        VAL  33 -13.998  -4.193  -3.292
  281    HA   VAL  33           HA       VAL  33 -15.267  -6.099  -3.436
  282    HB   VAL  33           HB       VAL  33 -13.712  -6.563  -5.980
  283   HG11  VAL  33          1HG1      VAL  33 -15.605  -7.974  -6.665
  284   HG12  VAL  33          2HG1      VAL  33 -16.342  -7.744  -5.078
  285   HG13  VAL  33          3HG1      VAL  33 -14.809  -8.605  -5.224
  286   HG21  VAL  33          3HG2      VAL  33 -15.751  -5.648  -7.094
  287   HG22  VAL  33          1HG2      VAL  33 -14.814  -4.480  -6.153
  288   HG23  VAL  33          2HG2      VAL  33 -16.320  -5.143  -5.499
  289    H    HIS  34           H        HIS  34 -11.857  -6.134  -3.359
  290    HA   HIS  34           HA       HIS  34 -10.304  -7.524  -2.473
  291    HB2  HIS  34           2HB      HIS  34 -12.694  -9.180  -1.654
  292    HB3  HIS  34           1HB      HIS  34 -11.036  -9.653  -1.299
  293    HD1  HIS  34           1HD      HIS  34 -13.811  -7.703   0.004
  294    HD2  HIS  34           2HD      HIS  34  -9.664  -7.672   0.397
  295    HE1  HIS  34           1HE      HIS  34 -13.328  -6.363   2.078
  296    HE2  HIS  34           2HE      HIS  34 -10.818  -6.216   2.203
  297    H    ASN  35           H        ASN  35 -11.672  -7.694  -5.138
  298    HA   ASN  35           HA       ASN  35 -11.262  -8.677  -7.127
  299    HB2  ASN  35           2HB      ASN  35  -9.189 -10.260  -5.616
  300    HB3  ASN  35           1HB      ASN  35  -9.367 -10.245  -7.366
  301   HD21  ASN  35          1HD2      ASN  35 -10.089  -7.305  -7.280
  302   HD22  ASN  35          2HD2      ASN  35  -8.559  -6.529  -7.050
  303    H    PHE  36           H        PHE  36 -13.159  -9.573  -7.469
  304    HA   PHE  36           HA       PHE  36 -13.425 -12.414  -6.817
  305    HB2  PHE  36           2HB      PHE  36 -15.406 -10.201  -6.959
  306    HB3  PHE  36           1HB      PHE  36 -15.944 -11.837  -7.364
  307    HD1  PHE  36           1HD      PHE  36 -13.995 -13.203  -5.405
  308    HD2  PHE  36           2HD      PHE  36 -16.748  -9.990  -4.994
  309    HE1  PHE  36           1HE      PHE  36 -14.212 -13.701  -3.006
  310    HE2  PHE  36           2HE      PHE  36 -16.969 -10.478  -2.598
  311    HZ   PHE  36           HZ       PHE  36 -15.697 -12.336  -1.603
  312    HA   PRO  37           HA       PRO  37 -14.644 -11.808 -11.561
  313    HB2  PRO  37           2HB      PRO  37 -13.266  -9.198 -11.944
  314    HB3  PRO  37           1HB      PRO  37 -14.717  -9.833 -12.728
  315    HG2  PRO  37           2HG      PRO  37 -14.913  -7.974 -10.838
  316    HG3  PRO  37           1HG      PRO  37 -16.081  -9.305 -10.926
  317    HD2  PRO  37           2HD      PRO  37 -13.784  -8.918  -9.056
  318    HD3  PRO  37           1HD      PRO  37 -15.399  -9.585  -8.740
  319    HA   PRO  38           HA       PRO  38  -9.911 -11.821 -12.242
  320    HB2  PRO  38           2HB      PRO  38  -8.587 -10.538 -10.008
  321    HB3  PRO  38           1HB      PRO  38  -8.474 -10.152 -11.726
  322    HG2  PRO  38           2HG      PRO  38  -9.673  -8.524  -9.908
  323    HG3  PRO  38           1HG      PRO  38 -10.152  -8.591 -11.613
  324    HD2  PRO  38           2HD      PRO  38 -11.406  -9.914  -9.254
  325    HD3  PRO  38           1HD      PRO  38 -12.170  -9.064 -10.612
  326    H    ASP  39           H        ASP  39  -8.730 -13.598 -11.676
  327    HA   ASP  39           HA       ASP  39  -9.744 -15.148  -9.493
  328    HB2  ASP  39           2HB      ASP  39  -7.881 -15.556 -11.770
  329    HB3  ASP  39           1HB      ASP  39  -7.754 -16.663 -10.405