*HEADER    UNKNOWN FUNCTION                        13-DEC-13   2MIG              
*TITLE     SOLUTION STRUCTURE OF THE CLAVATA-LIKE ENCODED PEPTIDE OF MELOIDOGYNE 
*TITLE    2 HAPLA - MHCLE5                                                       
*COMPND    MOL_ID: 1;                                                            
*COMPND   2 MOLECULE: CLAVATA-LIKE ENCODED PEPTIDE OF MELOIDOGYNE HAPLA - MHCLE5;
*COMPND   3 CHAIN: A;                                                            
*COMPND   4 ENGINEERED: YES                                                      
*SOURCE    MOL_ID: 1;                                                            
*SOURCE   2 SYNTHETIC: YES;                                                      
*SOURCE   3 ORGANISM_SCIENTIFIC: MELOIDOGYNE HAPLA;                              
*SOURCE   4 ORGANISM_TAXID: 6305                                                 
*KEYWDS    CLE, CLAVATA, UNKNOWN FUNCTION                                        
*EXPDTA    SOLUTION NMR                                                          
*NUMMDL    10                                                                    
*AUTHOR    B.G.BOBAY, P.M.DIGENNARO, D.M.BIRD                                    
*REVDAT   1   24-DEC-14 2MIG    0                                                


assign (segid "    " and resid    2 and name   HN) (segid "    " and resid    2 and name  HB2) 2.905 1.055 1.055 weight 1.000 ! spec=noesy_300ms, no=1, id=1, vol=5.268616e+02
    or (segid "    " and resid    2 and name   HN) (segid "    " and resid    2 and name  HB1)
assign (segid "    " and resid    3 and name   HN) (segid "    " and resid    3 and name   HB) 2.577 0.830 0.830 weight 1.000 ! spec=noesy_300ms, no=7, id=7, vol=1.079440e+03
    or (segid "    " and resid   10 and name   HN) (segid "    " and resid   10 and name  HB1)
assign (segid "    " and resid    3 and name   HN) (segid "    " and resid    2 and name   HA) 2.049 0.525 0.525 weight 1.000 ! spec=noesy_300ms, no=10, id=10, vol=4.274981e+03
    or (segid "    " and resid    3 and name   HN) (segid "    " and resid    3 and name   HA)
assign (segid "    " and resid    5 and name   HN) (segid "    " and resid    5 and name   HA) 2.382 0.709 0.709 weight 1.000 ! spec=noesy_300ms, no=12, id=12, vol=1.733059e+03
    or (segid "    " and resid   11 and name   HN) (segid "    " and resid   10 and name   HA)
assign (segid "    " and resid    5 and name   HN) (segid "    " and resid    5 and name   HA) 2.928 1.072 1.072 weight 1.000 ! spec=noesy_300ms, no=43, id=42, vol=5.018792e+02
    or (segid "    " and resid   11 and name   HA) (segid "    " and resid   11 and name   HN)
assign (segid "    " and resid    4 and name  HB2) (segid "    " and resid    4 and name  HG1) 2.545 0.810 0.810 weight 1.000 ! spec=noesy_300ms, no=65, id=58, vol=1.163507e+03
    or (segid "    " and resid    9 and name  HB2) (segid "    " and resid    4 and name  HG1)
assign (segid "    " and resid    3 and name   HB) (segid "    " and resid    3 and name HG22) 2.742 0.940 0.940 weight 1.000 ! spec=noesy_300ms, no=69, id=62, vol=7.448622e+02
    or (segid "    " and resid    3 and name   HB) (segid "    " and resid    3 and name HG21)
    or (segid "    " and resid    3 and name   HB) (segid "    " and resid    3 and name HG23)
    or (segid "    " and resid    3 and name   HB) (segid "    " and resid    3 and name HG12)
    or (segid "    " and resid    3 and name   HB) (segid "    " and resid    3 and name HG11)
    or (segid "    " and resid    3 and name   HB) (segid "    " and resid    3 and name HG13)
assign (segid "    " and resid    2 and name  HG2) (segid "    " and resid    2 and name  HE2) 2.300 0.661 0.661 weight 1.000 ! spec=noesy_300ms, no=72, id=65, vol=2.138221e+03
    or (segid "    " and resid   11 and name  HG2) (segid "    " and resid   11 and name  HE2)
assign (segid "    " and resid    2 and name   HA) (segid "    " and resid    2 and name  HB2) 3.151 1.241 1.241 weight 1.000 ! spec=noesy_50ms, no=16, id=81, vol=1.057477e+02
    or (segid "    " and resid    2 and name   HA) (segid "    " and resid    2 and name  HB1)
assign (segid "    " and resid    2 and name  HG2) (segid "    " and resid    2 and name  HD2) 1.967 0.484 0.484 weight 1.000 ! spec=noesy_50ms, no=20, id=85, vol=1.785417e+03
    or (segid "    " and resid    2 and name  HG1) (segid "    " and resid    2 and name  HD2)
assign (segid "    " and resid    2 and name   HN) (segid "    " and resid    1 and name   HA) 2.627 0.862 0.862 weight 1.000 ! spec=noesy_300ms, no=0, id=0, vol=9.630873e+02
assign (segid "    " and resid    8 and name   HN) (segid "    " and resid    8 and name   HA) 3.351 1.403 1.403 weight 1.000 ! spec=noesy_300ms, no=2, id=2, vol=2.235477e+02
assign (segid "    " and resid    8 and name   HN) (segid "    " and resid    7 and name   HA) 2.467 0.761 0.761 weight 1.000 ! spec=noesy_300ms, no=3, id=3, vol=1.403257e+03
assign (segid "    " and resid    8 and name   HN) (segid "    " and resid    7 and name  HB2) 3.502 1.533 1.533 weight 1.000 ! spec=noesy_300ms, no=4, id=4, vol=1.714077e+02
assign (segid "    " and resid    8 and name   HN) (segid "    " and resid    8 and name  HB1) 2.961 1.096 1.096 weight 1.000 ! spec=noesy_300ms, no=5, id=5, vol=4.694418e+02
assign (segid "    " and resid    8 and name   HN) (segid "    " and resid    8 and name  HB2) 3.293 1.356 1.356 weight 1.000 ! spec=noesy_300ms, no=6, id=6, vol=2.480451e+02
assign (segid "    " and resid    6 and name   HN) (segid "    " and resid    6 and name  HA2) 2.490 0.775 0.775 weight 1.000 ! spec=noesy_300ms, no=8, id=8, vol=1.326635e+03
assign (segid "    " and resid    6 and name   HN) (segid "    " and resid    5 and name   HA) 2.367 0.700 0.700 weight 1.000 ! spec=noesy_300ms, no=9, id=9, vol=1.799524e+03
assign (segid "    " and resid   11 and name   HN) (segid "    " and resid    9 and name   HA) 2.253 0.635 0.635 weight 1.000 ! spec=noesy_300ms, no=11, id=11, vol=2.417738e+03
assign (segid "    " and resid   10 and name   HN) (segid "    " and resid   10 and name  HB2) 2.701 0.912 0.912 weight 1.000 ! spec=noesy_300ms, no=13, id=13, vol=8.144418e+02
assign (segid "    " and resid    3 and name   HN) (segid "    " and resid    3 and name HG22) 2.576 0.829 0.829 weight 1.000 ! spec=noesy_300ms, no=14, id=14, vol=1.083588e+03
    or (segid "    " and resid    3 and name   HN) (segid "    " and resid    3 and name HG21)
    or (segid "    " and resid    3 and name   HN) (segid "    " and resid    3 and name HG23)
assign (segid "    " and resid    5 and name   HN) (segid "    " and resid    4 and name  HG1) 3.335 1.390 1.390 weight 1.000 ! spec=noesy_300ms, no=15, id=15, vol=2.300684e+02
assign (segid "    " and resid   11 and name   HN) (segid "    " and resid   11 and name  HB1) 2.992 1.119 1.119 weight 1.000 ! spec=noesy_300ms, no=16, id=16, vol=4.407490e+02
assign (segid "    " and resid    5 and name   HN) (segid "    " and resid    5 and name HG21) 2.779 0.966 0.966 weight 1.000 ! spec=noesy_300ms, no=17, id=17, vol=6.864697e+02
    or (segid "    " and resid    5 and name   HN) (segid "    " and resid    5 and name HG22)
    or (segid "    " and resid    5 and name   HN) (segid "    " and resid    5 and name HG23)
assign (segid "    " and resid    7 and name   HN) (segid "    " and resid    6 and name  HA2) 2.496 0.779 0.779 weight 1.000 ! spec=noesy_300ms, no=18, id=18, vol=1.308937e+03
assign (segid "    " and resid    7 and name   HN) (segid "    " and resid    7 and name  HB2) 3.174 1.260 1.260 weight 1.000 ! spec=noesy_300ms, no=19, id=19, vol=3.091847e+02
assign (segid "    " and resid   12 and name   HN) (segid "    " and resid   11 and name   HA) 3.532 1.560 1.560 weight 1.000 ! spec=noesy_300ms, no=22, id=21, vol=1.628866e+02
assign (segid "    " and resid    1 and name  HT3) (segid "    " and resid    1 and name  HG2) 3.189 1.271 1.271 weight 1.000 ! spec=noesy_300ms, no=23, id=22, vol=3.009493e+02
    or (segid "    " and resid    1 and name  HT2) (segid "    " and resid    1 and name  HG2)
    or (segid "    " and resid    1 and name  HT1) (segid "    " and resid    1 and name  HG2)
assign (segid "    " and resid    1 and name  HT3) (segid "    " and resid    1 and name  HB2) 3.375 1.424 1.424 weight 1.000 ! spec=noesy_300ms, no=24, id=23, vol=2.140153e+02
    or (segid "    " and resid    1 and name  HT2) (segid "    " and resid    1 and name  HB2)
    or (segid "    " and resid    1 and name  HT1) (segid "    " and resid    1 and name  HB2)
assign (segid "    " and resid    1 and name  HT3) (segid "    " and resid    1 and name  HD2) 2.794 0.976 0.976 weight 1.000 ! spec=noesy_300ms, no=25, id=24, vol=6.650720e+02
    or (segid "    " and resid    1 and name  HT2) (segid "    " and resid    1 and name  HD2)
    or (segid "    " and resid    1 and name  HT1) (segid "    " and resid    1 and name  HD2)
assign (segid "    " and resid   10 and name HE21) (segid "    " and resid   11 and name  HD2) 3.255 1.324 1.324 weight 1.000 ! spec=noesy_300ms, no=26, id=25, vol=2.662141e+02
assign (segid "    " and resid   10 and name HE21) (segid "    " and resid   10 and name  HG2) 3.098 1.199 1.199 weight 1.000 ! spec=noesy_300ms, no=27, id=26, vol=3.581355e+02
assign (segid "    " and resid   10 and name HE21) (segid "    " and resid   12 and name  HB2) 3.111 1.210 1.210 weight 1.000 ! spec=noesy_300ms, no=28, id=27, vol=3.491468e+02
assign (segid "    " and resid   10 and name HE21) (segid "    " and resid   12 and name  HB1) 3.050 1.163 1.163 weight 1.000 ! spec=noesy_300ms, no=29, id=28, vol=3.928550e+02
assign (segid "    " and resid   10 and name HE21) (segid "    " and resid   11 and name  HE2) 2.632 0.866 0.866 weight 1.000 ! spec=noesy_300ms, no=30, id=29, vol=9.522990e+02
assign (segid "    " and resid   10 and name HE22) (segid "    " and resid   10 and name  HG2) 3.466 1.502 1.502 weight 1.000 ! spec=noesy_300ms, no=31, id=30, vol=1.824860e+02
assign (segid "    " and resid   10 and name HE22) (segid "    " and resid   12 and name  HB2) 3.711 1.721 1.721 weight 1.000 ! spec=noesy_300ms, no=32, id=31, vol=1.211368e+02
assign (segid "    " and resid   10 and name HE22) (segid "    " and resid   12 and name  HB1) 3.485 1.518 1.518 weight 1.000 ! spec=noesy_300ms, no=33, id=32, vol=1.765943e+02
assign (segid "    " and resid    8 and name   HA) (segid "    " and resid    8 and name  HB2) 3.728 1.737 1.737 weight 1.000 ! spec=noesy_300ms, no=34, id=33, vol=1.178428e+02
assign (segid "    " and resid   10 and name   HA) (segid "    " and resid   10 and name   HN) 3.753 1.760 1.760 weight 1.000 ! spec=noesy_300ms, no=44, id=43, vol=1.132862e+02
assign (segid "    " and resid    5 and name   HB) (segid "    " and resid    6 and name   HN) 4.614 2.661 2.661 weight 1.000 ! spec=noesy_300ms, no=45, id=44, vol=3.278019e+01
assign (segid "    " and resid    5 and name   HB) (segid "    " and resid    5 and name HG21) 3.099 1.201 1.201 weight 1.000 ! spec=noesy_300ms, no=46, id=45, vol=3.571170e+02
    or (segid "    " and resid    5 and name   HB) (segid "    " and resid    5 and name HG22)
    or (segid "    " and resid    5 and name   HB) (segid "    " and resid    5 and name HG23)
assign (segid "    " and resid    2 and name   HA) (segid "    " and resid    2 and name  HB2) 4.211 2.216 2.216 weight 1.000 ! spec=noesy_300ms, no=49, id=47, vol=5.676728e+01
assign (segid "    " and resid   10 and name   HA) (segid "    " and resid    9 and name  HD2) 3.756 1.764 1.764 weight 1.000 ! spec=noesy_300ms, no=51, id=48, vol=1.126520e+02
assign (segid "    " and resid    9 and name  HD2) (segid "    " and resid    3 and name   HA) 2.347 0.689 0.689 weight 1.000 ! spec=noesy_300ms, no=58, id=52, vol=1.891107e+03
assign (segid "    " and resid    2 and name  HE2) (segid "    " and resid    2 and name  HD2) 1.841 0.424 0.424 weight 1.000 ! spec=noesy_300ms, no=59, id=53, vol=8.128912e+03
assign (segid "    " and resid   12 and name  HB1) (segid "    " and resid   12 and name   HA) 2.941 1.081 1.081 weight 1.000 ! spec=noesy_300ms, no=60, id=54, vol=4.890270e+02
assign (segid "    " and resid   12 and name   HA) (segid "    " and resid   12 and name  HB2) 2.721 0.925 0.925 weight 1.000 ! spec=noesy_300ms, no=61, id=55, vol=7.797399e+02
assign (segid "    " and resid   10 and name  HG2) (segid "    " and resid   10 and name  HB1) 2.471 0.763 0.763 weight 1.000 ! spec=noesy_300ms, no=63, id=56, vol=1.389108e+03
assign (segid "    " and resid    9 and name  HB2) (segid "    " and resid    4 and name  HG1) 2.372 0.703 0.703 weight 1.000 ! spec=noesy_300ms, no=64, id=57, vol=1.775905e+03
assign (segid "    " and resid    9 and name  HB2) (segid "    " and resid    9 and name   HA) 3.146 1.237 1.237 weight 1.000 ! spec=noesy_300ms, no=66, id=59, vol=3.264396e+02
assign (segid "    " and resid    4 and name  HB2) (segid "    " and resid    4 and name  HG1) 2.155 0.580 0.580 weight 1.000 ! spec=noesy_300ms, no=70, id=63, vol=3.162056e+03
assign (segid "    " and resid   12 and name   HA) (segid "    " and resid   12 and name   HN) 4.090 2.091 2.091 weight 1.000 ! spec=noesy_50ms, no=10, id=75, vol=2.209776e+01
assign (segid "    " and resid    9 and name   HA) (segid "    " and resid    4 and name  HG1) 4.230 2.237 2.237 weight 1.000 ! spec=noesy_50ms, no=12, id=77, vol=1.805499e+01
assign (segid "    " and resid    7 and name   HN) (segid "    " and resid    7 and name   HA) 3.146 1.237 1.237 weight 1.000 ! spec=noesy_50ms, no=13, id=78, vol=1.065979e+02
assign (segid "    " and resid   11 and name   HA) (segid "    " and resid   11 and name  HB1) 3.311 1.370 1.370 weight 1.000 ! spec=noesy_50ms, no=17, id=82, vol=7.851718e+01
assign (segid "    " and resid    1 and name  HB2) (segid "    " and resid    1 and name  HG2) 1.979 0.489 0.489 weight 1.000 ! spec=noesy_50ms, no=19, id=84, vol=1.723372e+03
assign (segid "    " and resid    2 and name  HG1) (segid "    " and resid    2 and name  HD2) 2.058 0.529 0.529 weight 1.000 ! spec=noesy_50ms, no=21, id=86, vol=1.360710e+03

  Entry H atom name         Submitted Coord H atom name
  Start of MODEL    1
    1    H1   ARG   1           HT1      ARG   1   5.845   9.618   1.340
    2    H2   ARG   1           HT2      ARG   1   4.987   8.874   2.592
    3    H3   ARG   1           HT3      ARG   1   4.295  10.160   1.741
    4    HA   ARG   1           HA       ARG   1   3.363   8.046   1.068
    5    HB2  ARG   1           HB2      ARG   1   3.425   9.851  -0.560
    6    HB3  ARG   1           HB1      ARG   1   5.076   9.444  -0.995
    7    HG2  ARG   1           HG2      ARG   1   3.461   8.682  -2.667
    8    HG3  ARG   1           HG1      ARG   1   4.349   7.342  -1.946
    9    HD2  ARG   1           HD2      ARG   1   1.966   6.832  -2.207
   10    HD3  ARG   1           HD1      ARG   1   2.461   6.828  -0.515
   11    HE   ARG   1           HE       ARG   1   1.543   9.326  -0.809
   12   HH11  ARG   1          HH11      ARG   1   0.170   6.263  -1.803
   13   HH12  ARG   1          HH12      ARG   1  -1.467   6.771  -1.550
   14   HH21  ARG   1          HH21      ARG   1  -0.612  10.001  -0.482
   15   HH22  ARG   1          HH22      ARG   1  -1.911   8.896  -0.804
   16    H    LYS   2           HN       LYS   2   3.695   5.940   0.992
   17    HA   LYS   2           HA       LYS   2   6.183   4.870  -0.083
   18    HB2  LYS   2           HB2      LYS   2   6.713   5.072   2.268
   19    HB3  LYS   2           HB1      LYS   2   5.187   4.328   2.722
   20    HG2  LYS   2           HG2      LYS   2   5.939   2.224   1.672
   21    HG3  LYS   2           HG1      LYS   2   7.493   2.984   1.328
   22    HD2  LYS   2           HD2      LYS   2   6.321   2.704   4.093
   23    HD3  LYS   2           HD1      LYS   2   7.475   1.574   3.390
   24    HE2  LYS   2           HE2      LYS   2   7.993   4.521   3.713
   25    HE3  LYS   2           HE1      LYS   2   8.449   3.309   4.905
   26    HZ1  LYS   2           HZ1      LYS   2   9.848   2.248   3.276
   27    HZ2  LYS   2           HZ2      LYS   2  10.278   3.879   3.402
   28    HZ3  LYS   2           HZ3      LYS   2   9.370   3.344   2.082
   29    H    VAL   3           HN       VAL   3   5.652   3.263  -1.434
   30    HA   VAL   3           HA       VAL   3   3.042   1.969  -1.112
   31    HB   VAL   3           HB       VAL   3   3.524   1.037  -3.424
   32   HG11  VAL   3          HG11      VAL   3   3.366   4.032  -3.094
   33   HG12  VAL   3          HG12      VAL   3   2.010   2.906  -3.047
   34   HG13  VAL   3          HG13      VAL   3   2.917   3.131  -4.542
   35   HG21  VAL   3          HG21      VAL   3   5.187   2.192  -4.781
   36   HG22  VAL   3          HG22      VAL   3   5.957   1.377  -3.420
   37   HG23  VAL   3          HG23      VAL   3   5.707   3.123  -3.380
   38    HA   PRO   4           HA       PRO   4   5.662  -1.306   0.652
   39    HB2  PRO   4           HB2      PRO   4   3.146  -2.303   1.755
   40    HB3  PRO   4           HB1      PRO   4   4.581  -1.721   2.601
   41    HG2  PRO   4           HG2      PRO   4   2.267  -0.337   2.593
   42    HG3  PRO   4           HG1      PRO   4   3.850   0.464   2.619
   43    HD2  PRO   4           HD2      PRO   4   2.009  -0.016   0.297
   44    HD3  PRO   4           HD1      PRO   4   2.897   1.459   0.744
   45    H    THR   5           HN       THR   5   4.343  -3.822   1.104
   46    HA   THR   5           HA       THR   5   4.776  -4.967  -1.413
   47    HB   THR   5           HB       THR   5   5.123  -6.208   0.689
   48    HG1  THR   5           HG1      THR   5   3.435  -8.008  -0.283
   49   HG21  THR   5          HG21      THR   5   2.107  -6.358   0.789
   50   HG22  THR   5          HG22      THR   5   3.126  -5.437   1.895
   51   HG23  THR   5          HG23      THR   5   3.225  -7.197   1.864
   52    H    GLY   6           HN       GLY   6   1.987  -3.666  -0.009
   53    HA2  GLY   6           HA2      GLY   6   0.100  -5.008  -1.733
   54    HA3  GLY   6           HA1      GLY   6  -0.248  -3.665  -0.652
   55    H    SER   7           HN       SER   7   2.407  -2.927  -2.487
   56    HA   SER   7           HA       SER   7   2.853  -1.368  -4.041
   57    HB2  SER   7           HB2      SER   7   1.569  -1.589  -6.221
   58    HB3  SER   7           HB1      SER   7   2.387  -3.036  -5.645
   59    HG   SER   7           HG       SER   7  -0.179  -2.836  -4.722
   60    H    ASN   8           HN       ASN   8   0.613  -0.847  -2.031
   61    HA   ASN   8           HA       ASN   8   0.227   1.856  -2.559
   62    HB2  ASN   8           HB2      ASN   8  -1.278   0.938  -4.371
   63    HB3  ASN   8           HB1      ASN   8  -2.271   0.233  -3.103
   64   HD21  ASN   8          HD21      ASN   8  -2.988   2.183  -5.101
   65   HD22  ASN   8          HD22      ASN   8  -3.540   3.581  -4.247
   66    HA   PRO   9           HA       PRO   9  -0.734   0.988   1.755
   67    HB2  PRO   9           HB2      PRO   9  -0.376   3.489   2.655
   68    HB3  PRO   9           HB1      PRO   9   0.994   2.471   2.186
   69    HG2  PRO   9           HG2      PRO   9  -0.418   4.581   0.574
   70    HG3  PRO   9           HG1      PRO   9   1.325   4.378   0.852
   71    HD2  PRO   9           HD2      PRO   9   0.162   3.470  -1.390
   72    HD3  PRO   9           HD1      PRO   9   1.478   2.596  -0.608
   73    H    GLN  10           HN       GLN  10  -3.028   0.978   0.222
   74    HA   GLN  10           HA       GLN  10  -4.757   3.060   1.205
   75    HB2  GLN  10           HB2      GLN  10  -6.587   1.890   0.207
   76    HB3  GLN  10           HB1      GLN  10  -5.239   1.777  -0.911
   77    HG2  GLN  10           HG2      GLN  10  -5.827  -0.415   1.034
   78    HG3  GLN  10           HG1      GLN  10  -6.678  -0.300  -0.501
   79   HE21  GLN  10          HE21      GLN  10  -4.799  -2.324   0.544
   80   HE22  GLN  10          HE22      GLN  10  -3.543  -2.430  -0.641
   81    H    LYS  11           HN       LYS  11  -3.515   0.085   2.293
   82    HA   LYS  11           HA       LYS  11  -4.248   0.469   4.958
   83    HB2  LYS  11           HB2      LYS  11  -5.850  -1.322   5.344
   84    HB3  LYS  11           HB1      LYS  11  -6.515  -0.170   4.200
   85    HG2  LYS  11           HG2      LYS  11  -5.912  -1.703   2.358
   86    HG3  LYS  11           HG1      LYS  11  -5.347  -2.869   3.554
   87    HD2  LYS  11           HD2      LYS  11  -7.609  -2.889   4.547
   88    HD3  LYS  11           HD1      LYS  11  -8.153  -1.800   3.270
   89    HE2  LYS  11           HE2      LYS  11  -8.760  -4.069   2.713
   90    HE3  LYS  11           HE1      LYS  11  -7.521  -3.496   1.597
   91    HZ1  LYS  11           HZ1      LYS  11  -5.866  -4.715   2.827
   92    HZ2  LYS  11           HZ2      LYS  11  -7.110  -5.764   2.374
   93    HZ3  LYS  11           HZ3      LYS  11  -7.010  -5.210   3.969
   94    H    ASN  12           HN       ASN  12  -1.977  -0.086   3.462
   95    HA   ASN  12           HA       ASN  12  -1.113  -2.632   4.577
   96    HB2  ASN  12           HB2      ASN  12  -1.885  -3.157   2.281
   97    HB3  ASN  12           HB1      ASN  12  -0.785  -1.940   1.644
   98   HD21  ASN  12          HD21      ASN  12  -1.027  -5.044   3.207
   99   HD22  ASN  12          HD22      ASN  12   0.570  -5.582   2.821
  Start of MODEL    2
    1    H1   ARG   1           HT1      ARG   1   8.698   3.965  -4.573
    2    H2   ARG   1           HT2      ARG   1   9.369   5.386  -3.949
    3    H3   ARG   1           HT3      ARG   1   8.718   5.375  -5.508
    4    HA   ARG   1           HA       ARG   1   7.234   6.462  -3.958
    5    HB2  ARG   1           HB2      ARG   1   6.253   3.776  -4.944
    6    HB3  ARG   1           HB1      ARG   1   5.213   5.083  -4.401
    7    HG2  ARG   1           HG2      ARG   1   6.027   6.495  -6.216
    8    HG3  ARG   1           HG1      ARG   1   7.086   5.189  -6.756
    9    HD2  ARG   1           HD2      ARG   1   5.170   3.782  -7.204
   10    HD3  ARG   1           HD1      ARG   1   4.084   5.018  -6.575
   11    HE   ARG   1           HE       ARG   1   5.664   6.046  -8.698
   12   HH11  ARG   1          HH11      ARG   1   2.922   3.970  -8.050
   13   HH12  ARG   1          HH12      ARG   1   2.163   4.279  -9.578
   14   HH21  ARG   1          HH21      ARG   1   4.671   6.456 -10.711
   15   HH22  ARG   1          HH22      ARG   1   3.163   5.691 -11.099
   16    H    LYS   2           HN       LYS   2   5.921   6.348  -2.090
   17    HA   LYS   2           HA       LYS   2   7.144   4.791   0.003
   18    HB2  LYS   2           HB2      LYS   2   4.860   6.767   0.091
   19    HB3  LYS   2           HB1      LYS   2   5.630   6.053   1.499
   20    HG2  LYS   2           HG2      LYS   2   7.783   7.073   0.736
   21    HG3  LYS   2           HG1      LYS   2   6.863   7.921  -0.506
   22    HD2  LYS   2           HD2      LYS   2   6.975   9.494   1.194
   23    HD3  LYS   2           HD1      LYS   2   5.409   8.740   1.477
   24    HE2  LYS   2           HE2      LYS   2   7.949   7.928   2.878
   25    HE3  LYS   2           HE1      LYS   2   6.817   9.115   3.513
   26    HZ1  LYS   2           HZ1      LYS   2   6.354   7.021   4.509
   27    HZ2  LYS   2           HZ2      LYS   2   6.304   6.236   3.016
   28    HZ3  LYS   2           HZ3      LYS   2   5.096   7.345   3.425
   29    H    VAL   3           HN       VAL   3   6.446   2.766  -1.055
   30    HA   VAL   3           HA       VAL   3   3.812   1.966  -0.029
   31    HB   VAL   3           HB       VAL   3   3.585   0.406  -1.967
   32   HG11  VAL   3          HG11      VAL   3   2.431   2.574  -1.927
   33   HG12  VAL   3          HG12      VAL   3   2.853   2.079  -3.565
   34   HG13  VAL   3          HG13      VAL   3   3.809   3.312  -2.741
   35   HG21  VAL   3          HG21      VAL   3   5.908   1.967  -3.097
   36   HG22  VAL   3          HG22      VAL   3   4.924   0.803  -3.981
   37   HG23  VAL   3          HG23      VAL   3   5.928   0.266  -2.635
   38    HA   PRO   4           HA       PRO   4   6.475  -0.941   2.074
   39    HB2  PRO   4           HB2      PRO   4   4.468  -2.246   3.385
   40    HB3  PRO   4           HB1      PRO   4   5.139  -0.704   3.917
   41    HG2  PRO   4           HG2      PRO   4   2.630  -1.260   2.401
   42    HG3  PRO   4           HG1      PRO   4   2.920  -0.087   3.698
   43    HD2  PRO   4           HD2      PRO   4   2.823   0.605   1.077
   44    HD3  PRO   4           HD1      PRO   4   3.827   1.463   2.262
   45    H    THR   5           HN       THR   5   3.406  -2.046   0.661
   46    HA   THR   5           HA       THR   5   4.616  -3.938  -1.045
   47    HB   THR   5           HB       THR   5   4.951  -5.164   1.085
   48    HG1  THR   5           HG1      THR   5   3.449  -7.035   0.317
   49   HG21  THR   5          HG21      THR   5   3.039  -4.297   2.333
   50   HG22  THR   5          HG22      THR   5   3.013  -6.061   2.293
   51   HG23  THR   5          HG23      THR   5   1.935  -5.140   1.244
   52    H    GLY   6           HN       GLY   6   3.005  -5.084  -2.323
   53    HA2  GLY   6           HA2      GLY   6   0.930  -5.361  -3.297
   54    HA3  GLY   6           HA1      GLY   6   0.215  -4.534  -1.921
   55    H    SER   7           HN       SER   7  -1.043  -3.788  -3.948
   56    HA   SER   7           HA       SER   7   0.199  -1.676  -5.459
   57    HB2  SER   7           HB2      SER   7  -2.737  -2.392  -5.274
   58    HB3  SER   7           HB1      SER   7  -1.950  -1.459  -6.547
   59    HG   SER   7           HG       SER   7  -0.965  -3.276  -7.288
   60    H    ASN   8           HN       ASN   8   0.868  -0.530  -3.483
   61    HA   ASN   8           HA       ASN   8   0.773   1.327  -2.179
   62    HB2  ASN   8           HB2      ASN   8  -1.992   1.697  -3.356
   63    HB3  ASN   8           HB1      ASN   8  -1.201   2.854  -2.292
   64   HD21  ASN   8          HD21      ASN   8  -1.363   1.525  -5.461
   65   HD22  ASN   8          HD22      ASN   8  -0.291   2.651  -6.217
   66    HA   PRO   9           HA       PRO   9  -1.579  -0.095   1.359
   67    HB2  PRO   9           HB2      PRO   9  -0.499   1.472   3.208
   68    HB3  PRO   9           HB1      PRO   9   0.525   0.326   2.334
   69    HG2  PRO   9           HG2      PRO   9   0.316   3.275   2.043
   70    HG3  PRO   9           HG1      PRO   9   1.708   2.215   1.774
   71    HD2  PRO   9           HD2      PRO   9  -0.124   3.235  -0.176
   72    HD3  PRO   9           HD1      PRO   9   1.226   2.130  -0.437
   73    H    GLN  10           HN       GLN  10  -2.907   1.689  -0.408
   74    HA   GLN  10           HA       GLN  10  -3.950   3.860   1.150
   75    HB2  GLN  10           HB2      GLN  10  -3.617   4.131  -1.254
   76    HB3  GLN  10           HB1      GLN  10  -4.710   2.798  -1.579
   77    HG2  GLN  10           HG2      GLN  10  -5.763   4.945  -1.999
   78    HG3  GLN  10           HG1      GLN  10  -6.570   4.072  -0.698
   79   HE21  GLN  10          HE21      GLN  10  -6.382   4.805   1.408
   80   HE22  GLN  10          HE22      GLN  10  -5.871   6.421   1.764
   81    H    LYS  11           HN       LYS  11  -4.523   0.580   0.858
   82    HA   LYS  11           HA       LYS  11  -6.177  -0.863   1.432
   83    HB2  LYS  11           HB2      LYS  11  -7.044   1.495   3.101
   84    HB3  LYS  11           HB1      LYS  11  -7.875  -0.050   3.144
   85    HG2  LYS  11           HG2      LYS  11  -6.440  -0.119   4.970
   86    HG3  LYS  11           HG1      LYS  11  -5.604  -1.057   3.734
   87    HD2  LYS  11           HD2      LYS  11  -3.990   0.352   4.768
   88    HD3  LYS  11           HD1      LYS  11  -4.317   1.018   3.166
   89    HE2  LYS  11           HE2      LYS  11  -5.776   2.692   4.124
   90    HE3  LYS  11           HE1      LYS  11  -5.566   1.995   5.730
   91    HZ1  LYS  11           HZ1      LYS  11  -3.274   2.605   5.712
   92    HZ2  LYS  11           HZ2      LYS  11  -4.176   3.975   5.303
   93    HZ3  LYS  11           HZ3      LYS  11  -3.355   3.115   4.100
   94    H    ASN  12           HN       ASN  12  -6.538   1.081  -0.849
   95    HA   ASN  12           HA       ASN  12  -9.324   0.488  -1.379
   96    HB2  ASN  12           HB2      ASN  12  -9.356   2.680  -0.181
   97    HB3  ASN  12           HB1      ASN  12  -8.320   3.348  -1.436
   98   HD21  ASN  12          HD21      ASN  12 -11.501   2.199  -0.654
   99   HD22  ASN  12          HD22      ASN  12 -12.292   2.836  -2.055
  Start of MODEL    3
    1    H1   ARG   1           HT1      ARG   1   9.540   4.017   4.726
    2    H2   ARG   1           HT2      ARG   1   7.976   4.528   5.103
    3    H3   ARG   1           HT3      ARG   1   8.848   5.312   3.886
    4    HA   ARG   1           HA       ARG   1   8.831   3.323   2.542
    5    HB2  ARG   1           HB2      ARG   1   7.065   2.226   4.741
    6    HB3  ARG   1           HB1      ARG   1   7.410   1.431   3.212
    7    HG2  ARG   1           HG2      ARG   1   9.752   1.235   3.821
    8    HG3  ARG   1           HG1      ARG   1   9.442   2.084   5.336
    9    HD2  ARG   1           HD2      ARG   1   7.901   0.301   6.009
   10    HD3  ARG   1           HD1      ARG   1   8.231  -0.548   4.500
   11    HE   ARG   1           HE       ARG   1  10.654  -0.067   5.840
   12   HH11  ARG   1          HH11      ARG   1   7.758  -2.004   6.138
   13   HH12  ARG   1          HH12      ARG   1   8.548  -3.281   7.004
   14   HH21  ARG   1          HH21      ARG   1  11.696  -1.749   6.985
   15   HH22  ARG   1          HH22      ARG   1  10.789  -3.140   7.476
   16    H    LYS   2           HN       LYS   2   7.767   4.508   1.042
   17    HA   LYS   2           HA       LYS   2   5.109   5.514   1.617
   18    HB2  LYS   2           HB2      LYS   2   5.271   6.588  -0.603
   19    HB3  LYS   2           HB1      LYS   2   6.612   6.999   0.454
   20    HG2  LYS   2           HG2      LYS   2   8.021   5.370  -0.713
   21    HG3  LYS   2           HG1      LYS   2   6.673   4.987  -1.784
   22    HD2  LYS   2           HD2      LYS   2   8.147   6.536  -2.895
   23    HD3  LYS   2           HD1      LYS   2   6.638   7.355  -2.514
   24    HE2  LYS   2           HE2      LYS   2   8.468   8.808  -2.030
   25    HE3  LYS   2           HE1      LYS   2   7.701   8.330  -0.523
   26    HZ1  LYS   2           HZ1      LYS   2  10.108   8.261  -0.357
   27    HZ2  LYS   2           HZ2      LYS   2  10.190   7.159  -1.637
   28    HZ3  LYS   2           HZ3      LYS   2   9.456   6.712  -0.182
   29    H    VAL   3           HN       VAL   3   6.541   2.830   0.078
   30    HA   VAL   3           HA       VAL   3   3.873   1.886  -0.664
   31    HB   VAL   3           HB       VAL   3   4.949   0.675  -2.633
   32   HG11  VAL   3          HG11      VAL   3   3.441   2.554  -2.933
   33   HG12  VAL   3          HG12      VAL   3   4.750   2.624  -4.111
   34   HG13  VAL   3          HG13      VAL   3   4.774   3.682  -2.703
   35   HG21  VAL   3          HG21      VAL   3   7.289   1.016  -2.002
   36   HG22  VAL   3          HG22      VAL   3   7.092   2.757  -2.201
   37   HG23  VAL   3          HG23      VAL   3   6.952   1.689  -3.597
   38    HA   PRO   4           HA       PRO   4   6.302  -1.097   2.145
   39    HB2  PRO   4           HB2      PRO   4   3.952  -1.687   3.535
   40    HB3  PRO   4           HB1      PRO   4   5.224  -0.592   4.078
   41    HG2  PRO   4           HG2      PRO   4   2.639   0.024   2.721
   42    HG3  PRO   4           HG1      PRO   4   3.470   0.912   4.011
   43    HD2  PRO   4           HD2      PRO   4   3.529   1.785   1.490
   44    HD3  PRO   4           HD1      PRO   4   4.962   1.910   2.529
   45    H    THR   5           HN       THR   5   2.844  -1.587   1.380
   46    HA   THR   5           HA       THR   5   3.367  -4.313   0.583
   47    HB   THR   5           HB       THR   5   0.795  -4.095   0.014
   48    HG1  THR   5           HG1      THR   5  -0.156  -2.480   1.394
   49   HG21  THR   5          HG21      THR   5   0.273  -4.633   2.346
   50   HG22  THR   5          HG22      THR   5   1.862  -4.048   2.838
   51   HG23  THR   5          HG23      THR   5   1.727  -5.472   1.807
   52    H    GLY   6           HN       GLY   6   1.690  -4.805  -1.512
   53    HA2  GLY   6           HA2      GLY   6   3.165  -3.583  -3.684
   54    HA3  GLY   6           HA1      GLY   6   2.021  -4.910  -3.813
   55    H    SER   7           HN       SER   7  -0.301  -4.303  -3.487
   56    HA   SER   7           HA       SER   7  -0.838  -2.119  -5.300
   57    HB2  SER   7           HB2      SER   7  -2.745  -4.079  -4.002
   58    HB3  SER   7           HB1      SER   7  -3.097  -3.033  -5.377
   59    HG   SER   7           HG       SER   7  -1.516  -4.165  -6.561
   60    H    ASN   8           HN       ASN   8  -1.155  -0.128  -4.605
   61    HA   ASN   8           HA       ASN   8  -1.712   1.672  -3.325
   62    HB2  ASN   8           HB2      ASN   8  -4.024  -0.167  -2.685
   63    HB3  ASN   8           HB1      ASN   8  -3.975   1.536  -2.242
   64   HD21  ASN   8          HD21      ASN   8  -5.760   0.015  -4.039
   65   HD22  ASN   8          HD22      ASN   8  -5.691   0.838  -5.557
   66    HA   PRO   9           HA       PRO   9  -0.141  -0.279   0.572
   67    HB2  PRO   9           HB2      PRO   9   2.348   1.138   0.189
   68    HB3  PRO   9           HB1      PRO   9   2.067  -0.602   0.193
   69    HG2  PRO   9           HG2      PRO   9   2.803   0.746  -2.040
   70    HG3  PRO   9           HG1      PRO   9   1.764  -0.693  -2.089
   71    HD2  PRO   9           HD2      PRO   9   0.982   2.204  -2.124
   72    HD3  PRO   9           HD1      PRO   9   0.441   0.892  -3.211
   73    H    GLN  10           HN       GLN  10  -1.872   1.472   1.010
   74    HA   GLN  10           HA       GLN  10  -1.016   3.989   1.963
   75    HB2  GLN  10           HB2      GLN  10  -3.220   3.857   3.287
   76    HB3  GLN  10           HB1      GLN  10  -3.306   3.848   1.535
   77    HG2  GLN  10           HG2      GLN  10  -4.827   2.221   2.152
   78    HG3  GLN  10           HG1      GLN  10  -3.387   1.290   1.755
   79   HE21  GLN  10          HE21      GLN  10  -3.976  -0.454   3.014
   80   HE22  GLN  10          HE22      GLN  10  -3.982  -0.398   4.745
   81    H    LYS  11           HN       LYS  11  -0.870   0.826   3.210
   82    HA   LYS  11           HA       LYS  11   1.152   1.301   4.990
   83    HB2  LYS  11           HB2      LYS  11   0.225   1.215   7.194
   84    HB3  LYS  11           HB1      LYS  11  -0.572   2.531   6.352
   85    HG2  LYS  11           HG2      LYS  11  -2.526   1.087   5.982
   86    HG3  LYS  11           HG1      LYS  11  -1.718  -0.207   6.871
   87    HD2  LYS  11           HD2      LYS  11  -1.606   1.259   8.850
   88    HD3  LYS  11           HD1      LYS  11  -2.468   2.509   7.954
   89    HE2  LYS  11           HE2      LYS  11  -4.003   1.313   9.393
   90    HE3  LYS  11           HE1      LYS  11  -4.381   0.982   7.702
   91    HZ1  LYS  11           HZ1      LYS  11  -3.317  -1.137   7.870
   92    HZ2  LYS  11           HZ2      LYS  11  -4.427  -1.006   9.138
   93    HZ3  LYS  11           HZ3      LYS  11  -2.776  -0.813   9.438
   94    H    ASN  12           HN       ASN  12  -1.711  -0.511   4.224
   95    HA   ASN  12           HA       ASN  12  -0.143  -2.917   3.959
   96    HB2  ASN  12           HB2      ASN  12  -0.877  -2.995   6.333
   97    HB3  ASN  12           HB1      ASN  12  -2.547  -2.863   5.804
   98   HD21  ASN  12          HD21      ASN  12  -0.076  -4.755   4.180
   99   HD22  ASN  12          HD22      ASN  12  -0.778  -6.295   4.518
  Start of MODEL    4
    1    H1   ARG   1           HT1      ARG   1   5.475   8.637  -2.298
    2    H2   ARG   1           HT2      ARG   1   5.987   9.358  -0.863
    3    H3   ARG   1           HT3      ARG   1   4.616   9.944  -1.656
    4    HA   ARG   1           HA       ARG   1   3.999   8.650   0.265
    5    HB2  ARG   1           HB2      ARG   1   2.266   7.507  -0.757
    6    HB3  ARG   1           HB1      ARG   1   2.751   8.590  -2.048
    7    HG2  ARG   1           HG2      ARG   1   3.583   5.705  -1.801
    8    HG3  ARG   1           HG1      ARG   1   2.283   6.307  -2.825
    9    HD2  ARG   1           HD2      ARG   1   5.195   7.055  -3.050
   10    HD3  ARG   1           HD1      ARG   1   4.346   5.916  -4.086
   11    HE   ARG   1           HE       ARG   1   3.212   8.581  -3.994
   12   HH11  ARG   1          HH11      ARG   1   5.365   6.366  -5.637
   13   HH12  ARG   1          HH12      ARG   1   5.380   7.272  -7.114
   14   HH21  ARG   1          HH21      ARG   1   3.211   9.767  -5.937
   15   HH22  ARG   1          HH22      ARG   1   4.148   9.215  -7.289
   16    H    LYS   2           HN       LYS   2   3.855   6.477   1.214
   17    HA   LYS   2           HA       LYS   2   6.369   5.026   0.797
   18    HB2  LYS   2           HB2      LYS   2   5.925   5.854   3.075
   19    HB3  LYS   2           HB1      LYS   2   4.429   4.932   3.118
   20    HG2  LYS   2           HG2      LYS   2   5.700   2.858   2.936
   21    HG3  LYS   2           HG1      LYS   2   7.198   3.777   2.879
   22    HD2  LYS   2           HD2      LYS   2   6.808   4.619   5.109
   23    HD3  LYS   2           HD1      LYS   2   5.241   3.817   5.171
   24    HE2  LYS   2           HE2      LYS   2   6.847   2.531   6.396
   25    HE3  LYS   2           HE1      LYS   2   6.367   1.645   4.953
   26    HZ1  LYS   2           HZ1      LYS   2   8.405   2.367   3.874
   27    HZ2  LYS   2           HZ2      LYS   2   8.753   1.540   5.305
   28    HZ3  LYS   2           HZ3      LYS   2   8.864   3.221   5.259
   29    H    VAL   3           HN       VAL   3   6.365   3.055  -0.085
   30    HA   VAL   3           HA       VAL   3   3.791   1.659  -0.312
   31    HB   VAL   3           HB       VAL   3   4.187   2.668  -2.443
   32   HG11  VAL   3          HG11      VAL   3   6.560   3.099  -2.291
   33   HG12  VAL   3          HG12      VAL   3   6.197   2.230  -3.780
   34   HG13  VAL   3          HG13      VAL   3   6.908   1.376  -2.412
   35   HG21  VAL   3          HG21      VAL   3   4.284   0.706  -3.908
   36   HG22  VAL   3          HG22      VAL   3   3.254   0.431  -2.504
   37   HG23  VAL   3          HG23      VAL   3   4.874  -0.264  -2.559
   38    HA   PRO   4           HA       PRO   4   6.776  -1.406   1.426
   39    HB2  PRO   4           HB2      PRO   4   5.037  -2.412   3.258
   40    HB3  PRO   4           HB1      PRO   4   6.090  -1.032   3.586
   41    HG2  PRO   4           HG2      PRO   4   3.187  -1.076   2.879
   42    HG3  PRO   4           HG1      PRO   4   4.047  -0.041   4.031
   43    HD2  PRO   4           HD2      PRO   4   3.308   0.762   1.532
   44    HD3  PRO   4           HD1      PRO   4   4.693   1.430   2.404
   45    H    THR   5           HN       THR   5   3.267  -1.821   1.025
   46    HA   THR   5           HA       THR   5   3.713  -4.474  -0.127
   47    HB   THR   5           HB       THR   5   1.020  -3.292   0.504
   48    HG1  THR   5           HG1      THR   5   2.965  -4.311   2.301
   49   HG21  THR   5          HG21      THR   5   0.439  -5.638   0.900
   50   HG22  THR   5          HG22      THR   5   2.105  -6.108   0.566
   51   HG23  THR   5          HG23      THR   5   1.112  -5.414  -0.716
   52    H    GLY   6           HN       GLY   6   3.273  -4.888  -2.248
   53    HA2  GLY   6           HA2      GLY   6   2.703  -2.686  -4.014
   54    HA3  GLY   6           HA1      GLY   6   2.939  -4.367  -4.478
   55    H    SER   7           HN       SER   7   0.590  -2.464  -2.598
   56    HA   SER   7           HA       SER   7  -1.568  -3.436  -4.291
   57    HB2  SER   7           HB2      SER   7  -1.600  -3.860  -1.289
   58    HB3  SER   7           HB1      SER   7  -2.898  -4.264  -2.411
   59    HG   SER   7           HG       SER   7  -0.591  -5.382  -3.223
   60    H    ASN   8           HN       ASN   8  -0.321  -0.901  -3.880
   61    HA   ASN   8           HA       ASN   8  -0.692   1.287  -3.402
   62    HB2  ASN   8           HB2      ASN   8  -2.628   0.803  -4.922
   63    HB3  ASN   8           HB1      ASN   8  -3.618   0.522  -3.494
   64   HD21  ASN   8          HD21      ASN   8  -3.934   2.507  -5.589
   65   HD22  ASN   8          HD22      ASN   8  -3.890   4.052  -4.810
   66    HA   PRO   9           HA       PRO   9  -1.625   0.669   1.047
   67    HB2  PRO   9           HB2      PRO   9   0.822   0.798   2.060
   68    HB3  PRO   9           HB1      PRO   9   0.304  -0.652   1.188
   69    HG2  PRO   9           HG2      PRO   9   2.038   1.593   0.269
   70    HG3  PRO   9           HG1      PRO   9   2.198  -0.145  -0.046
   71    HD2  PRO   9           HD2      PRO   9   1.049   1.755  -1.758
   72    HD3  PRO   9           HD1      PRO   9   0.885  -0.007  -1.895
   73    H    GLN  10           HN       GLN  10  -1.751   3.075  -0.620
   74    HA   GLN  10           HA       GLN  10  -0.514   5.139   1.024
   75    HB2  GLN  10           HB2      GLN  10  -0.535   5.258  -1.489
   76    HB3  GLN  10           HB1      GLN  10  -2.280   5.450  -1.414
   77    HG2  GLN  10           HG2      GLN  10  -1.346   7.402   0.294
   78    HG3  GLN  10           HG1      GLN  10  -0.172   7.401  -1.022
   79   HE21  GLN  10          HE21      GLN  10  -3.497   7.886  -0.142
   80   HE22  GLN  10          HE22      GLN  10  -3.977   8.685  -1.605
   81    H    LYS  11           HN       LYS  11  -2.834   3.281   1.747
   82    HA   LYS  11           HA       LYS  11  -4.587   3.384   3.178
   83    HB2  LYS  11           HB2      LYS  11  -3.504   5.194   4.353
   84    HB3  LYS  11           HB1      LYS  11  -4.036   6.356   3.153
   85    HG2  LYS  11           HG2      LYS  11  -6.082   4.807   4.663
   86    HG3  LYS  11           HG1      LYS  11  -5.248   6.138   5.462
   87    HD2  LYS  11           HD2      LYS  11  -6.707   6.367   2.831
   88    HD3  LYS  11           HD1      LYS  11  -7.401   6.794   4.395
   89    HE2  LYS  11           HE2      LYS  11  -5.519   8.415   4.691
   90    HE3  LYS  11           HE1      LYS  11  -5.024   8.061   3.037
   91    HZ1  LYS  11           HZ1      LYS  11  -7.177   8.850   2.267
   92    HZ2  LYS  11           HZ2      LYS  11  -6.380  10.052   3.145
   93    HZ3  LYS  11           HZ3      LYS  11  -7.648   9.189   3.853
   94    H    ASN  12           HN       ASN  12  -4.779   6.024   0.794
   95    HA   ASN  12           HA       ASN  12  -7.609   5.380   0.377
   96    HB2  ASN  12           HB2      ASN  12  -6.972   7.755   0.758
   97    HB3  ASN  12           HB1      ASN  12  -5.983   7.699  -0.696
   98   HD21  ASN  12          HD21      ASN  12  -7.110   9.260  -1.763
   99   HD22  ASN  12          HD22      ASN  12  -8.726   9.043  -2.339
  Start of MODEL    5
    1    H1   ARG   1           HT1      ARG   1   8.390   5.810   3.668
    2    H2   ARG   1           HT2      ARG   1   7.838   4.954   5.018
    3    H3   ARG   1           HT3      ARG   1   6.734   5.577   3.902
    4    HA   ARG   1           HA       ARG   1   8.746   3.505   3.314
    5    HB2  ARG   1           HB2      ARG   1   7.086   2.565   4.791
    6    HB3  ARG   1           HB1      ARG   1   5.783   3.270   3.843
    7    HG2  ARG   1           HG2      ARG   1   6.001   0.886   3.403
    8    HG3  ARG   1           HG1      ARG   1   6.354   1.833   1.957
    9    HD2  ARG   1           HD2      ARG   1   8.801   1.646   2.631
   10    HD3  ARG   1           HD1      ARG   1   8.281   0.416   3.779
   11    HE   ARG   1           HE       ARG   1   7.294  -0.197   1.205
   12   HH11  ARG   1          HH11      ARG   1  10.264  -0.146   3.050
   13   HH12  ARG   1          HH12      ARG   1  11.033  -1.380   2.102
   14   HH21  ARG   1          HH21      ARG   1   8.307  -1.816  -0.063
   15   HH22  ARG   1          HH22      ARG   1   9.924  -2.316   0.326
   16    H    LYS   2           HN       LYS   2   5.601   4.760   2.224
   17    HA   LYS   2           HA       LYS   2   4.692   5.033   0.177
   18    HB2  LYS   2           HB2      LYS   2   6.587   6.524  -0.291
   19    HB3  LYS   2           HB1      LYS   2   7.559   5.148  -0.787
   20    HG2  LYS   2           HG2      LYS   2   6.717   6.371  -2.710
   21    HG3  LYS   2           HG1      LYS   2   6.048   4.740  -2.657
   22    HD2  LYS   2           HD2      LYS   2   4.002   5.658  -1.624
   23    HD3  LYS   2           HD1      LYS   2   4.666   7.283  -1.801
   24    HE2  LYS   2           HE2      LYS   2   4.773   6.918  -4.239
   25    HE3  LYS   2           HE1      LYS   2   4.043   5.332  -3.998
   26    HZ1  LYS   2           HZ1      LYS   2   2.771   7.914  -3.279
   27    HZ2  LYS   2           HZ2      LYS   2   2.074   6.381  -3.118
   28    HZ3  LYS   2           HZ3      LYS   2   2.408   6.999  -4.654
   29    H    VAL   3           HN       VAL   3   3.687   3.114   0.083
   30    HA   VAL   3           HA       VAL   3   3.063   1.119  -0.793
   31    HB   VAL   3           HB       VAL   3   5.564   1.286  -2.485
   32   HG11  VAL   3          HG11      VAL   3   4.728  -0.993  -2.308
   33   HG12  VAL   3          HG12      VAL   3   4.438  -0.350  -3.925
   34   HG13  VAL   3          HG13      VAL   3   3.113  -0.452  -2.768
   35   HG21  VAL   3          HG21      VAL   3   2.718   2.056  -3.133
   36   HG22  VAL   3          HG22      VAL   3   4.071   2.069  -4.263
   37   HG23  VAL   3          HG23      VAL   3   4.063   3.169  -2.886
   38    HA   PRO   4           HA       PRO   4   5.533  -1.130   2.297
   39    HB2  PRO   4           HB2      PRO   4   3.072  -2.766   2.325
   40    HB3  PRO   4           HB1      PRO   4   3.910  -1.975   3.664
   41    HG2  PRO   4           HG2      PRO   4   1.574  -1.042   2.741
   42    HG3  PRO   4           HG1      PRO   4   2.854   0.049   3.305
   43    HD2  PRO   4           HD2      PRO   4   2.075  -0.669   0.504
   44    HD3  PRO   4           HD1      PRO   4   2.530   0.908   1.180
   45    H    THR   5           HN       THR   5   3.285  -2.828   0.101
   46    HA   THR   5           HA       THR   5   5.353  -4.084  -1.340
   47    HB   THR   5           HB       THR   5   5.705  -5.461   0.588
   48    HG1  THR   5           HG1      THR   5   5.797  -6.598  -1.357
   49   HG21  THR   5          HG21      THR   5   2.754  -6.101   0.509
   50   HG22  THR   5          HG22      THR   5   3.579  -5.145   1.739
   51   HG23  THR   5          HG23      THR   5   3.940  -6.862   1.568
   52    H    GLY   6           HN       GLY   6   4.397  -3.790  -3.235
   53    HA2  GLY   6           HA2      GLY   6   3.066  -4.392  -5.016
   54    HA3  GLY   6           HA1      GLY   6   2.196  -5.482  -3.951
   55    H    SER   7           HN       SER   7   0.988  -4.000  -2.151
   56    HA   SER   7           HA       SER   7  -0.938  -2.528  -3.761
   57    HB2  SER   7           HB2      SER   7  -1.684  -4.314  -2.191
   58    HB3  SER   7           HB1      SER   7  -1.075  -3.349  -0.847
   59    HG   SER   7           HG       SER   7  -2.719  -2.007  -1.039
   60    H    ASN   8           HN       ASN   8  -1.541  -0.417  -3.384
   61    HA   ASN   8           HA       ASN   8   0.396   1.199  -1.918
   62    HB2  ASN   8           HB2      ASN   8  -1.765   1.936  -3.895
   63    HB3  ASN   8           HB1      ASN   8  -0.806   3.126  -3.027
   64   HD21  ASN   8          HD21      ASN   8   0.098   3.964  -4.874
   65   HD22  ASN   8          HD22      ASN   8   1.260   3.107  -5.824
   66    HA   PRO   9           HA       PRO   9  -2.602   1.547   1.346
   67    HB2  PRO   9           HB2      PRO   9  -1.042   2.749   3.126
   68    HB3  PRO   9           HB1      PRO   9  -0.671   1.103   2.590
   69    HG2  PRO   9           HG2      PRO   9   0.560   3.697   1.741
   70    HG3  PRO   9           HG1      PRO   9   1.346   2.152   2.107
   71    HD2  PRO   9           HD2      PRO   9   0.727   3.046  -0.442
   72    HD3  PRO   9           HD1      PRO   9   0.999   1.351  -0.001
   73    H    GLN  10           HN       GLN  10  -3.502   3.154  -0.426
   74    HA   GLN  10           HA       GLN  10  -3.390   5.910   0.019
   75    HB2  GLN  10           HB2      GLN  10  -4.460   4.940  -1.938
   76    HB3  GLN  10           HB1      GLN  10  -5.656   4.147  -0.932
   77    HG2  GLN  10           HG2      GLN  10  -5.496   7.082  -0.712
   78    HG3  GLN  10           HG1      GLN  10  -6.091   6.437  -2.238
   79   HE21  GLN  10          HE21      GLN  10  -7.277   4.081  -0.996
   80   HE22  GLN  10          HE22      GLN  10  -8.696   4.631  -0.177
   81    H    LYS  11           HN       LYS  11  -5.129   3.317   1.578
   82    HA   LYS  11           HA       LYS  11  -5.196   4.018   4.116
   83    HB2  LYS  11           HB2      LYS  11  -7.085   5.346   4.720
   84    HB3  LYS  11           HB1      LYS  11  -6.196   6.246   3.505
   85    HG2  LYS  11           HG2      LYS  11  -7.831   5.485   1.809
   86    HG3  LYS  11           HG1      LYS  11  -8.749   4.702   3.100
   87    HD2  LYS  11           HD2      LYS  11  -8.970   6.886   4.225
   88    HD3  LYS  11           HD1      LYS  11  -8.123   7.648   2.879
   89    HE2  LYS  11           HE2      LYS  11 -10.476   7.967   2.575
   90    HE3  LYS  11           HE1      LYS  11  -9.911   6.818   1.365
   91    HZ1  LYS  11           HZ1      LYS  11 -11.288   6.112   3.901
   92    HZ2  LYS  11           HZ2      LYS  11 -10.771   5.015   2.723
   93    HZ3  LYS  11           HZ3      LYS  11 -12.000   6.122   2.367
   94    H    ASN  12           HN       ASN  12  -7.121   2.968   1.454
   95    HA   ASN  12           HA       ASN  12  -8.188   0.780   3.094
   96    HB2  ASN  12           HB2      ASN  12  -9.690   2.581   1.206
   97    HB3  ASN  12           HB1      ASN  12 -10.255   0.949   1.531
   98   HD21  ASN  12          HD21      ASN  12  -9.494   0.842   4.258
   99   HD22  ASN  12          HD22      ASN  12 -10.529   1.913   5.134
  Start of MODEL    6
    1    H1   ARG   1           HT1      ARG   1   5.987   8.893  -0.542
    2    H2   ARG   1           HT2      ARG   1   4.836   8.246   0.511
    3    H3   ARG   1           HT3      ARG   1   5.442   7.306  -0.758
    4    HA   ARG   1           HA       ARG   1   7.631   7.326   0.213
    5    HB2  ARG   1           HB2      ARG   1   6.242   8.942   2.347
    6    HB3  ARG   1           HB1      ARG   1   7.774   8.127   2.617
    7    HG2  ARG   1           HG2      ARG   1   8.804   9.445   0.853
    8    HG3  ARG   1           HG1      ARG   1   7.265  10.251   0.545
    9    HD2  ARG   1           HD2      ARG   1   7.272  11.190   2.770
   10    HD3  ARG   1           HD1      ARG   1   8.742  10.306   3.171
   11    HE   ARG   1           HE       ARG   1   9.401  11.807   0.979
   12   HH11  ARG   1          HH11      ARG   1   8.134  12.492   4.167
   13   HH12  ARG   1          HH12      ARG   1   8.877  14.055   4.270
   14   HH21  ARG   1          HH21      ARG   1  10.407  13.859   1.115
   15   HH22  ARG   1          HH22      ARG   1  10.184  14.830   2.535
   16    H    LYS   2           HN       LYS   2   4.413   6.642   1.256
   17    HA   LYS   2           HA       LYS   2   5.403   4.280   2.705
   18    HB2  LYS   2           HB2      LYS   2   2.717   5.650   2.920
   19    HB3  LYS   2           HB1      LYS   2   3.188   4.200   3.790
   20    HG2  LYS   2           HG2      LYS   2   5.000   5.500   4.871
   21    HG3  LYS   2           HG1      LYS   2   4.376   6.947   4.081
   22    HD2  LYS   2           HD2      LYS   2   3.363   7.068   6.156
   23    HD3  LYS   2           HD1      LYS   2   2.126   6.256   5.202
   24    HE2  LYS   2           HE2      LYS   2   4.152   4.830   6.913
   25    HE3  LYS   2           HE1      LYS   2   2.545   5.284   7.462
   26    HZ1  LYS   2           HZ1      LYS   2   1.650   3.915   5.611
   27    HZ2  LYS   2           HZ2      LYS   2   2.490   3.029   6.772
   28    HZ3  LYS   2           HZ3      LYS   2   3.221   3.376   5.293
   29    H    VAL   3           HN       VAL   3   5.675   3.613   0.310
   30    HA   VAL   3           HA       VAL   3   3.214   2.173  -0.429
   31    HB   VAL   3           HB       VAL   3   5.284   3.202  -2.384
   32   HG11  VAL   3          HG11      VAL   3   4.206   1.146  -3.125
   33   HG12  VAL   3          HG12      VAL   3   3.672   2.515  -4.100
   34   HG13  VAL   3          HG13      VAL   3   2.622   1.862  -2.846
   35   HG21  VAL   3          HG21      VAL   3   3.582   4.782  -3.120
   36   HG22  VAL   3          HG22      VAL   3   3.974   5.032  -1.420
   37   HG23  VAL   3          HG23      VAL   3   2.484   4.203  -1.868
   38    HA   PRO   4           HA       PRO   4   6.563  -0.925   0.154
   39    HB2  PRO   4           HB2      PRO   4   5.532  -2.288   2.199
   40    HB3  PRO   4           HB1      PRO   4   6.344  -0.743   2.460
   41    HG2  PRO   4           HG2      PRO   4   3.427  -1.365   2.398
   42    HG3  PRO   4           HG1      PRO   4   4.314  -0.242   3.444
   43    HD2  PRO   4           HD2      PRO   4   2.892   0.449   1.142
   44    HD3  PRO   4           HD1      PRO   4   4.103   1.457   1.953
   45    H    THR   5           HN       THR   5   5.501  -3.479   1.032
   46    HA   THR   5           HA       THR   5   4.697  -4.573  -1.417
   47    HB   THR   5           HB       THR   5   4.262  -5.790   1.314
   48    HG1  THR   5           HG1      THR   5   6.370  -5.710   1.456
   49   HG21  THR   5          HG21      THR   5   3.218  -6.998  -0.554
   50   HG22  THR   5          HG22      THR   5   4.560  -7.912   0.139
   51   HG23  THR   5          HG23      THR   5   4.773  -7.049  -1.385
   52    H    GLY   6           HN       GLY   6   2.778  -4.560  -2.408
   53    HA2  GLY   6           HA2      GLY   6   0.392  -5.359  -1.885
   54    HA3  GLY   6           HA1      GLY   6   0.382  -3.975  -0.803
   55    H    SER   7           HN       SER   7  -1.567  -3.858  -2.504
   56    HA   SER   7           HA       SER   7  -0.841  -2.663  -5.020
   57    HB2  SER   7           HB2      SER   7  -3.361  -2.319  -5.180
   58    HB3  SER   7           HB1      SER   7  -2.819  -3.989  -5.032
   59    HG   SER   7           HG       SER   7  -3.755  -2.348  -2.908
   60    H    ASN   8           HN       ASN   8   0.444  -0.951  -4.096
   61    HA   ASN   8           HA       ASN   8   0.877   1.143  -3.351
   62    HB2  ASN   8           HB2      ASN   8  -1.820   1.552  -4.632
   63    HB3  ASN   8           HB1      ASN   8  -0.890   2.887  -3.957
   64   HD21  ASN   8          HD21      ASN   8   1.017   3.525  -4.961
   65   HD22  ASN   8          HD22      ASN   8   1.420   3.025  -6.568
   66    HA   PRO   9           HA       PRO   9  -1.571   0.616   0.561
   67    HB2  PRO   9           HB2      PRO   9   1.024   0.262   1.833
   68    HB3  PRO   9           HB1      PRO   9  -0.355  -0.837   1.806
   69    HG2  PRO   9           HG2      PRO   9   1.955  -1.372   0.501
   70    HG3  PRO   9           HG1      PRO   9   0.376  -1.920  -0.086
   71    HD2  PRO   9           HD2      PRO   9   2.008   0.436  -0.971
   72    HD3  PRO   9           HD1      PRO   9   1.123  -0.754  -1.954
   73    H    GLN  10           HN       GLN  10  -0.970   2.999  -0.698
   74    HA   GLN  10           HA       GLN  10   0.655   4.685   0.974
   75    HB2  GLN  10           HB2      GLN  10  -0.101   6.481  -0.498
   76    HB3  GLN  10           HB1      GLN  10   0.388   5.087  -1.454
   77    HG2  GLN  10           HG2      GLN  10  -1.602   4.990  -2.416
   78    HG3  GLN  10           HG1      GLN  10  -2.395   4.877  -0.846
   79   HE21  GLN  10          HE21      GLN  10  -3.078   6.802   0.188
   80   HE22  GLN  10          HE22      GLN  10  -3.345   8.249  -0.725
   81    H    LYS  11           HN       LYS  11  -1.825   3.223   1.989
   82    HA   LYS  11           HA       LYS  11  -3.929   5.062   2.305
   83    HB2  LYS  11           HB2      LYS  11  -3.244   2.477   3.674
   84    HB3  LYS  11           HB1      LYS  11  -4.618   3.442   4.193
   85    HG2  LYS  11           HG2      LYS  11  -5.405   1.758   2.694
   86    HG3  LYS  11           HG1      LYS  11  -5.516   3.316   1.878
   87    HD2  LYS  11           HD2      LYS  11  -2.978   2.341   1.245
   88    HD3  LYS  11           HD1      LYS  11  -4.048   0.944   1.129
   89    HE2  LYS  11           HE2      LYS  11  -4.539   3.601  -0.212
   90    HE3  LYS  11           HE1      LYS  11  -3.799   2.207  -0.997
   91    HZ1  LYS  11           HZ1      LYS  11  -5.832   0.953  -0.564
   92    HZ2  LYS  11           HZ2      LYS  11  -6.137   2.321  -1.506
   93    HZ3  LYS  11           HZ3      LYS  11  -6.539   2.318   0.134
   94    H    ASN  12           HN       ASN  12  -3.469   6.938   3.142
   95    HA   ASN  12           HA       ASN  12  -1.928   7.153   5.608
   96    HB2  ASN  12           HB2      ASN  12  -1.415   8.610   3.642
   97    HB3  ASN  12           HB1      ASN  12  -3.016   9.316   3.784
   98   HD21  ASN  12          HD21      ASN  12  -0.396  10.556   3.943
   99   HD22  ASN  12          HD22      ASN  12  -0.326  11.350   5.477
  Start of MODEL    7
    1    H1   ARG   1           HT1      ARG   1  10.709   7.474  -0.040
    2    H2   ARG   1           HT2      ARG   1   9.033   7.505   0.160
    3    H3   ARG   1           HT3      ARG   1   9.804   6.073  -0.307
    4    HA   ARG   1           HA       ARG   1  10.921   5.906   1.784
    5    HB2  ARG   1           HB2      ARG   1  11.121   8.352   2.143
    6    HB3  ARG   1           HB1      ARG   1   9.407   8.427   2.502
    7    HG2  ARG   1           HG2      ARG   1  10.722   8.494   4.534
    8    HG3  ARG   1           HG1      ARG   1   9.747   7.027   4.470
    9    HD2  ARG   1           HD2      ARG   1  12.605   7.058   3.556
   10    HD3  ARG   1           HD1      ARG   1  12.184   6.833   5.252
   11    HE   ARG   1           HE       ARG   1  10.672   4.979   3.944
   12   HH11  ARG   1          HH11      ARG   1  14.086   5.720   4.070
   13   HH12  ARG   1          HH12      ARG   1  14.582   4.083   3.791
   14   HH21  ARG   1          HH21      ARG   1  11.320   2.817   3.572
   15   HH22  ARG   1          HH22      ARG   1  13.012   2.430   3.496
   16    H    LYS   2           HN       LYS   2   7.971   5.888   0.390
   17    HA   LYS   2           HA       LYS   2   6.882   4.218   2.522
   18    HB2  LYS   2           HB2      LYS   2   4.669   5.237   2.319
   19    HB3  LYS   2           HB1      LYS   2   5.856   6.415   2.844
   20    HG2  LYS   2           HG2      LYS   2   5.994   7.208   0.484
   21    HG3  LYS   2           HG1      LYS   2   4.650   6.135   0.109
   22    HD2  LYS   2           HD2      LYS   2   4.558   8.324   2.178
   23    HD3  LYS   2           HD1      LYS   2   3.975   8.494   0.526
   24    HE2  LYS   2           HE2      LYS   2   2.045   8.014   1.696
   25    HE3  LYS   2           HE1      LYS   2   2.514   6.436   1.077
   26    HZ1  LYS   2           HZ1      LYS   2   3.351   5.817   3.193
   27    HZ2  LYS   2           HZ2      LYS   2   1.822   6.479   3.457
   28    HZ3  LYS   2           HZ3      LYS   2   3.205   7.386   3.799
   29    H    VAL   3           HN       VAL   3   4.432   3.653   1.318
   30    HA   VAL   3           HA       VAL   3   3.456   2.281  -0.205
   31    HB   VAL   3           HB       VAL   3   5.650   3.085  -2.128
   32   HG11  VAL   3          HG11      VAL   3   4.470   1.060  -2.798
   33   HG12  VAL   3          HG12      VAL   3   4.065   2.404  -3.866
   34   HG13  VAL   3          HG13      VAL   3   2.923   1.891  -2.625
   35   HG21  VAL   3          HG21      VAL   3   2.938   4.312  -1.640
   36   HG22  VAL   3          HG22      VAL   3   3.956   4.664  -3.036
   37   HG23  VAL   3          HG23      VAL   3   4.512   5.073  -1.417
   38    HA   PRO   4           HA       PRO   4   6.512  -1.013   0.737
   39    HB2  PRO   4           HB2      PRO   4   4.935  -2.472   2.352
   40    HB3  PRO   4           HB1      PRO   4   5.804  -1.050   2.939
   41    HG2  PRO   4           HG2      PRO   4   2.926  -1.338   2.190
   42    HG3  PRO   4           HG1      PRO   4   3.656  -0.425   3.523
   43    HD2  PRO   4           HD2      PRO   4   2.822   0.665   1.125
   44    HD3  PRO   4           HD1      PRO   4   4.008   1.405   2.216
   45    H    THR   5           HN       THR   5   5.630  -3.571   0.928
   46    HA   THR   5           HA       THR   5   4.887  -4.255  -1.693
   47    HB   THR   5           HB       THR   5   6.149  -5.806  -0.326
   48    HG1  THR   5           HG1      THR   5   5.122  -7.604  -1.020
   49   HG21  THR   5          HG21      THR   5   5.106  -7.036   1.534
   50   HG22  THR   5          HG22      THR   5   3.674  -6.017   1.394
   51   HG23  THR   5          HG23      THR   5   5.219  -5.310   1.866
   52    H    GLY   6           HN       GLY   6   2.966  -4.597  -2.651
   53    HA2  GLY   6           HA2      GLY   6   0.600  -5.436  -2.121
   54    HA3  GLY   6           HA1      GLY   6   0.567  -4.057  -1.032
   55    H    SER   7           HN       SER   7  -1.382  -3.933  -2.708
   56    HA   SER   7           HA       SER   7  -0.600  -2.691  -5.215
   57    HB2  SER   7           HB2      SER   7  -3.398  -3.064  -4.134
   58    HB3  SER   7           HB1      SER   7  -2.914  -2.822  -5.813
   59    HG   SER   7           HG       SER   7  -1.589  -4.925  -4.974
   60    H    ASN   8           HN       ASN   8   0.438  -1.059  -3.538
   61    HA   ASN   8           HA       ASN   8   0.566   1.095  -2.830
   62    HB2  ASN   8           HB2      ASN   8  -0.479   1.830  -4.866
   63    HB3  ASN   8           HB1      ASN   8  -2.070   1.346  -4.292
   64   HD21  ASN   8          HD21      ASN   8  -3.220   2.698  -3.014
   65   HD22  ASN   8          HD22      ASN   8  -2.709   4.302  -2.607
   66    HA   PRO   9           HA       PRO   9  -1.577   0.477   0.990
   67    HB2  PRO   9           HB2      PRO   9  -0.184   2.133   2.530
   68    HB3  PRO   9           HB1      PRO   9   0.601   0.725   1.792
   69    HG2  PRO   9           HG2      PRO   9   0.622   3.589   0.889
   70    HG3  PRO   9           HG1      PRO   9   1.979   2.460   1.036
   71    HD2  PRO   9           HD2      PRO   9   0.681   2.976  -1.322
   72    HD3  PRO   9           HD1      PRO   9   1.513   1.449  -0.971
   73    H    GLN  10           HN       GLN  10  -3.341   1.837  -0.501
   74    HA   GLN  10           HA       GLN  10  -3.878   4.391   0.780
   75    HB2  GLN  10           HB2      GLN  10  -5.725   4.648  -0.701
   76    HB3  GLN  10           HB1      GLN  10  -4.397   4.002  -1.647
   77    HG2  GLN  10           HG2      GLN  10  -6.516   2.218  -0.507
   78    HG3  GLN  10           HG1      GLN  10  -6.747   3.067  -2.033
   79   HE21  GLN  10          HE21      GLN  10  -5.096   0.496  -0.405
   80   HE22  GLN  10          HE22      GLN  10  -4.375  -0.202  -1.813
   81    H    LYS  11           HN       LYS  11  -4.422   1.177   1.460
   82    HA   LYS  11           HA       LYS  11  -6.226   1.780   3.620
   83    HB2  LYS  11           HB2      LYS  11  -7.993   0.206   2.911
   84    HB3  LYS  11           HB1      LYS  11  -7.849   1.565   1.806
   85    HG2  LYS  11           HG2      LYS  11  -6.522   0.147   0.290
   86    HG3  LYS  11           HG1      LYS  11  -6.778  -1.213   1.378
   87    HD2  LYS  11           HD2      LYS  11  -9.196  -1.024   1.033
   88    HD3  LYS  11           HD1      LYS  11  -8.928   0.332  -0.064
   89    HE2  LYS  11           HE2      LYS  11  -9.263  -1.715  -1.328
   90    HE3  LYS  11           HE1      LYS  11  -7.613  -1.132  -1.534
   91    HZ1  LYS  11           HZ1      LYS  11  -7.605  -3.494  -1.181
   92    HZ2  LYS  11           HZ2      LYS  11  -8.492  -3.337   0.248
   93    HZ3  LYS  11           HZ3      LYS  11  -6.913  -2.742   0.166
   94    H    ASN  12           HN       ASN  12  -3.602   0.804   3.395
   95    HA   ASN  12           HA       ASN  12  -3.889  -1.985   4.261
   96    HB2  ASN  12           HB2      ASN  12  -3.023  -2.155   2.052
   97    HB3  ASN  12           HB1      ASN  12  -1.886  -0.843   2.316
   98   HD21  ASN  12          HD21      ASN  12  -2.612  -4.181   2.960
   99   HD22  ASN  12          HD22      ASN  12  -1.027  -4.639   3.469
  Start of MODEL    8
    1    H1   ARG   1           HT1      ARG   1   5.606   5.575   5.289
    2    H2   ARG   1           HT2      ARG   1   4.456   4.621   4.495
    3    H3   ARG   1           HT3      ARG   1   4.537   6.277   4.181
    4    HA   ARG   1           HA       ARG   1   6.659   6.068   3.171
    5    HB2  ARG   1           HB2      ARG   1   7.593   3.763   2.809
    6    HB3  ARG   1           HB1      ARG   1   7.643   4.325   4.469
    7    HG2  ARG   1           HG2      ARG   1   5.455   3.027   4.770
    8    HG3  ARG   1           HG1      ARG   1   5.874   2.247   3.243
    9    HD2  ARG   1           HD2      ARG   1   7.591   2.314   5.724
   10    HD3  ARG   1           HD1      ARG   1   6.637   0.939   5.171
   11    HE   ARG   1           HE       ARG   1   8.183   1.360   3.048
   12   HH11  ARG   1          HH11      ARG   1   9.013   1.280   6.456
   13   HH12  ARG   1          HH12      ARG   1  10.612   0.674   6.184
   14   HH21  ARG   1          HH21      ARG   1  10.286   0.544   2.689
   15   HH22  ARG   1          HH22      ARG   1  11.337   0.250   4.038
   16    H    LYS   2           HN       LYS   2   6.996   5.187   0.933
   17    HA   LYS   2           HA       LYS   2   4.713   5.863  -0.499
   18    HB2  LYS   2           HB2      LYS   2   7.378   4.777  -1.245
   19    HB3  LYS   2           HB1      LYS   2   6.113   4.775  -2.465
   20    HG2  LYS   2           HG2      LYS   2   7.493   6.761  -2.649
   21    HG3  LYS   2           HG1      LYS   2   5.844   7.189  -2.198
   22    HD2  LYS   2           HD2      LYS   2   6.559   7.391   0.144
   23    HD3  LYS   2           HD1      LYS   2   8.214   7.012  -0.337
   24    HE2  LYS   2           HE2      LYS   2   6.574   9.378  -1.202
   25    HE3  LYS   2           HE1      LYS   2   7.911   9.404  -0.061
   26    HZ1  LYS   2           HZ1      LYS   2   8.685  10.146  -2.181
   27    HZ2  LYS   2           HZ2      LYS   2   8.065   8.781  -2.959
   28    HZ3  LYS   2           HZ3      LYS   2   9.361   8.625  -1.887
   29    H    VAL   3           HN       VAL   3   6.281   2.684  -0.953
   30    HA   VAL   3           HA       VAL   3   3.638   1.473  -0.948
   31    HB   VAL   3           HB       VAL   3   4.309   0.127  -3.023
   32   HG11  VAL   3          HG11      VAL   3   2.550   1.813  -3.038
   33   HG12  VAL   3          HG12      VAL   3   3.469   1.849  -4.543
   34   HG13  VAL   3          HG13      VAL   3   3.749   3.077  -3.308
   35   HG21  VAL   3          HG21      VAL   3   6.207   2.453  -3.353
   36   HG22  VAL   3          HG22      VAL   3   5.841   1.234  -4.576
   37   HG23  VAL   3          HG23      VAL   3   6.668   0.771  -3.089
   38    HA   PRO   4           HA       PRO   4   6.667  -1.276   1.178
   39    HB2  PRO   4           HB2      PRO   4   5.325  -1.572   3.480
   40    HB3  PRO   4           HB1      PRO   4   6.334  -0.154   3.170
   41    HG2  PRO   4           HG2      PRO   4   3.363  -0.443   2.987
   42    HG3  PRO   4           HG1      PRO   4   4.318   0.896   3.644
   43    HD2  PRO   4           HD2      PRO   4   3.203   0.884   1.131
   44    HD3  PRO   4           HD1      PRO   4   4.624   1.844   1.582
   45    H    THR   5           HN       THR   5   3.196  -1.436   0.708
   46    HA   THR   5           HA       THR   5   3.383  -4.330   0.403
   47    HB   THR   5           HB       THR   5   2.670  -4.036   2.715
   48    HG1  THR   5           HG1      THR   5   1.285  -5.608   2.471
   49   HG21  THR   5          HG21      THR   5   0.360  -2.445   1.596
   50   HG22  THR   5          HG22      THR   5   1.693  -1.802   2.556
   51   HG23  THR   5          HG23      THR   5   0.554  -2.938   3.279
   52    H    GLY   6           HN       GLY   6   2.141  -5.116  -1.205
   53    HA2  GLY   6           HA2      GLY   6   0.757  -5.151  -3.029
   54    HA3  GLY   6           HA1      GLY   6  -0.238  -3.977  -2.183
   55    H    SER   7           HN       SER   7  -0.664  -2.894  -4.149
   56    HA   SER   7           HA       SER   7   1.577  -1.575  -5.447
   57    HB2  SER   7           HB2      SER   7  -0.326  -2.554  -6.770
   58    HB3  SER   7           HB1      SER   7  -1.377  -1.328  -6.065
   59    HG   SER   7           HG       SER   7  -0.225  -0.987  -8.236
   60    H    ASN   8           HN       ASN   8  -0.492  -1.098  -2.910
   61    HA   ASN   8           HA       ASN   8   0.445   1.524  -2.339
   62    HB2  ASN   8           HB2      ASN   8  -1.292   2.142  -3.979
   63    HB3  ASN   8           HB1      ASN   8  -2.487   1.232  -3.061
   64   HD21  ASN   8          HD21      ASN   8  -0.591   4.121  -3.220
   65   HD22  ASN   8          HD22      ASN   8  -1.386   4.963  -1.937
   66    HA   PRO   9           HA       PRO   9  -0.574  -0.343   1.621
   67    HB2  PRO   9           HB2      PRO   9   0.214   1.741   3.165
   68    HB3  PRO   9           HB1      PRO   9   1.359   0.621   2.419
   69    HG2  PRO   9           HG2      PRO   9   0.492   3.335   1.487
   70    HG3  PRO   9           HG1      PRO   9   2.128   2.656   1.570
   71    HD2  PRO   9           HD2      PRO   9   0.758   2.735  -0.740
   72    HD3  PRO   9           HD1      PRO   9   1.836   1.387  -0.343
   73    H    GLN  10           HN       GLN  10  -2.803   0.294   0.411
   74    HA   GLN  10           HA       GLN  10  -4.187   2.441   1.755
   75    HB2  GLN  10           HB2      GLN  10  -6.156   1.577   0.411
   76    HB3  GLN  10           HB1      GLN  10  -4.789   2.171  -0.513
   77    HG2  GLN  10           HG2      GLN  10  -5.511   0.224  -1.603
   78    HG3  GLN  10           HG1      GLN  10  -4.044  -0.224  -0.743
   79   HE21  GLN  10          HE21      GLN  10  -7.193   0.184   0.749
   80   HE22  GLN  10          HE22      GLN  10  -7.403  -1.475   1.188
   81    H    LYS  11           HN       LYS  11  -3.246  -0.432   2.773
   82    HA   LYS  11           HA       LYS  11  -5.316  -1.994   3.587
   83    HB2  LYS  11           HB2      LYS  11  -2.755  -1.336   5.036
   84    HB3  LYS  11           HB1      LYS  11  -3.857  -2.601   5.563
   85    HG2  LYS  11           HG2      LYS  11  -2.562  -2.506   2.845
   86    HG3  LYS  11           HG1      LYS  11  -1.936  -3.416   4.223
   87    HD2  LYS  11           HD2      LYS  11  -3.310  -5.102   3.764
   88    HD3  LYS  11           HD1      LYS  11  -4.703  -4.027   3.899
   89    HE2  LYS  11           HE2      LYS  11  -4.481  -3.399   1.571
   90    HE3  LYS  11           HE1      LYS  11  -3.027  -4.387   1.421
   91    HZ1  LYS  11           HZ1      LYS  11  -4.330  -6.350   1.840
   92    HZ2  LYS  11           HZ2      LYS  11  -5.015  -5.495   0.553
   93    HZ3  LYS  11           HZ3      LYS  11  -5.727  -5.428   2.085
   94    H    ASN  12           HN       ASN  12  -7.134  -1.393   4.459
   95    HA   ASN  12           HA       ASN  12  -7.197   0.766   6.419
   96    HB2  ASN  12           HB2      ASN  12  -8.721   0.983   4.534
   97    HB3  ASN  12           HB1      ASN  12  -9.407  -0.604   4.869
   98   HD21  ASN  12          HD21      ASN  12  -9.153   2.701   5.961
   99   HD22  ASN  12          HD22      ASN  12 -10.512   2.657   7.032
  Start of MODEL    9
    1    H1   ARG   1           HT1      ARG   1   9.822   7.642   2.021
    2    H2   ARG   1           HT2      ARG   1   9.691   8.303   0.469
    3    H3   ARG   1           HT3      ARG   1  11.150   7.611   0.974
    4    HA   ARG   1           HA       ARG   1   9.915   6.179  -0.545
    5    HB2  ARG   1           HB2      ARG   1  10.062   4.142   0.816
    6    HB3  ARG   1           HB1      ARG   1  11.450   5.186   1.095
    7    HG2  ARG   1           HG2      ARG   1  10.422   5.986   3.163
    8    HG3  ARG   1           HG1      ARG   1   9.042   4.925   2.882
    9    HD2  ARG   1           HD2      ARG   1  10.502   2.979   3.005
   10    HD3  ARG   1           HD1      ARG   1  11.898   4.030   3.248
   11    HE   ARG   1           HE       ARG   1   9.961   4.595   5.204
   12   HH11  ARG   1          HH11      ARG   1  12.213   2.068   4.325
   13   HH12  ARG   1          HH12      ARG   1  12.411   1.509   5.955
   14   HH21  ARG   1          HH21      ARG   1  10.229   3.866   7.345
   15   HH22  ARG   1          HH22      ARG   1  11.284   2.527   7.665
   16    H    LYS   2           HN       LYS   2   8.113   4.677  -0.759
   17    HA   LYS   2           HA       LYS   2   5.866   4.998   1.030
   18    HB2  LYS   2           HB2      LYS   2   4.274   5.687  -0.672
   19    HB3  LYS   2           HB1      LYS   2   5.554   6.882  -0.546
   20    HG2  LYS   2           HG2      LYS   2   5.633   4.732  -2.631
   21    HG3  LYS   2           HG1      LYS   2   4.723   6.222  -2.876
   22    HD2  LYS   2           HD2      LYS   2   6.739   7.537  -2.587
   23    HD3  LYS   2           HD1      LYS   2   7.660   6.081  -2.215
   24    HE2  LYS   2           HE2      LYS   2   8.000   6.855  -4.521
   25    HE3  LYS   2           HE1      LYS   2   7.322   5.234  -4.425
   26    HZ1  LYS   2           HZ1      LYS   2   6.232   6.571  -6.122
   27    HZ2  LYS   2           HZ2      LYS   2   5.779   7.710  -4.960
   28    HZ3  LYS   2           HZ3      LYS   2   5.144   6.146  -4.900
   29    H    VAL   3           HN       VAL   3   4.076   3.525   0.406
   30    HA   VAL   3           HA       VAL   3   3.258   1.489  -0.151
   31    HB   VAL   3           HB       VAL   3   5.209   1.647  -2.458
   32   HG11  VAL   3          HG11      VAL   3   3.717   0.033  -3.558
   33   HG12  VAL   3          HG12      VAL   3   2.782  -0.099  -2.068
   34   HG13  VAL   3          HG13      VAL   3   4.462  -0.633  -2.105
   35   HG21  VAL   3          HG21      VAL   3   3.275   2.430  -3.752
   36   HG22  VAL   3          HG22      VAL   3   3.666   3.529  -2.429
   37   HG23  VAL   3          HG23      VAL   3   2.298   2.428  -2.283
   38    HA   PRO   4           HA       PRO   4   6.671  -0.702   2.133
   39    HB2  PRO   4           HB2      PRO   4   4.717  -2.179   3.480
   40    HB3  PRO   4           HB1      PRO   4   5.548  -0.754   4.111
   41    HG2  PRO   4           HG2      PRO   4   2.862  -0.975   2.832
   42    HG3  PRO   4           HG1      PRO   4   3.387   0.056   4.176
   43    HD2  PRO   4           HD2      PRO   4   3.041   1.056   1.723
   44    HD3  PRO   4           HD1      PRO   4   4.370   1.613   2.758
   45    H    THR   5           HN       THR   5   3.555  -2.102   1.123
   46    HA   THR   5           HA       THR   5   4.717  -3.676  -0.927
   47    HB   THR   5           HB       THR   5   5.498  -5.090   0.884
   48    HG1  THR   5           HG1      THR   5   3.511  -6.791   0.255
   49   HG21  THR   5          HG21      THR   5   2.619  -5.232   1.784
   50   HG22  THR   5          HG22      THR   5   3.932  -4.419   2.633
   51   HG23  THR   5          HG23      THR   5   3.953  -6.173   2.453
   52    H    GLY   6           HN       GLY   6   3.167  -4.091  -2.402
   53    HA2  GLY   6           HA2      GLY   6   0.837  -5.001  -2.661
   54    HA3  GLY   6           HA1      GLY   6   0.367  -3.754  -1.517
   55    H    SER   7           HN       SER   7  -1.074  -3.513  -3.591
   56    HA   SER   7           HA       SER   7   0.162  -2.195  -5.801
   57    HB2  SER   7           HB2      SER   7  -1.841  -3.593  -6.097
   58    HB3  SER   7           HB1      SER   7  -2.765  -2.462  -5.111
   59    HG   SER   7           HG       SER   7  -1.912  -2.263  -7.740
   60    H    ASN   8           HN       ASN   8  -1.683  -1.207  -3.035
   61    HA   ASN   8           HA       ASN   8  -0.677   1.470  -3.187
   62    HB2  ASN   8           HB2      ASN   8  -3.000   2.508  -3.249
   63    HB3  ASN   8           HB1      ASN   8  -2.389   1.867  -4.766
   64   HD21  ASN   8          HD21      ASN   8  -4.387   1.597  -5.660
   65   HD22  ASN   8          HD22      ASN   8  -5.510   0.397  -5.127
   66    HA   PRO   9           HA       PRO   9  -2.052  -0.122   0.980
   67    HB2  PRO   9           HB2      PRO   9   0.332  -0.595   2.103
   68    HB3  PRO   9           HB1      PRO   9  -0.405  -1.762   0.998
   69    HG2  PRO   9           HG2      PRO   9   1.763   0.227   0.489
   70    HG3  PRO   9           HG1      PRO   9   1.624  -1.445  -0.078
   71    HD2  PRO   9           HD2      PRO   9   0.985   0.786  -1.578
   72    HD3  PRO   9           HD1      PRO   9   0.353  -0.846  -1.874
   73    H    GLN  10           HN       GLN  10  -2.062   2.496   0.188
   74    HA   GLN  10           HA       GLN  10  -0.575   4.219   1.844
   75    HB2  GLN  10           HB2      GLN  10  -2.728   5.673   1.572
   76    HB3  GLN  10           HB1      GLN  10  -1.754   5.314   0.152
   77    HG2  GLN  10           HG2      GLN  10  -3.275   3.656  -0.588
   78    HG3  GLN  10           HG1      GLN  10  -4.142   3.673   0.946
   79   HE21  GLN  10          HE21      GLN  10  -5.651   5.224   1.327
   80   HE22  GLN  10          HE22      GLN  10  -6.205   6.335   0.124
   81    H    LYS  11           HN       LYS  11  -3.400   2.271   2.308
   82    HA   LYS  11           HA       LYS  11  -3.409   1.982   5.022
   83    HB2  LYS  11           HB2      LYS  11  -5.143   3.564   5.815
   84    HB3  LYS  11           HB1      LYS  11  -3.683   4.393   5.296
   85    HG2  LYS  11           HG2      LYS  11  -4.758   4.973   3.183
   86    HG3  LYS  11           HG1      LYS  11  -6.222   4.130   3.694
   87    HD2  LYS  11           HD2      LYS  11  -6.423   5.672   5.600
   88    HD3  LYS  11           HD1      LYS  11  -4.982   6.526   5.049
   89    HE2  LYS  11           HE2      LYS  11  -6.140   7.030   2.925
   90    HE3  LYS  11           HE1      LYS  11  -7.589   6.251   3.560
   91    HZ1  LYS  11           HZ1      LYS  11  -7.660   7.895   5.326
   92    HZ2  LYS  11           HZ2      LYS  11  -7.680   8.653   3.814
   93    HZ3  LYS  11           HZ3      LYS  11  -6.261   8.633   4.731
   94    H    ASN  12           HN       ASN  12  -4.055   0.696   2.589
   95    HA   ASN  12           HA       ASN  12  -6.824  -0.084   3.043
   96    HB2  ASN  12           HB2      ASN  12  -7.093   1.558   1.324
   97    HB3  ASN  12           HB1      ASN  12  -5.721   0.935   0.418
   98   HD21  ASN  12          HD21      ASN  12  -9.045   0.391   1.330
   99   HD22  ASN  12          HD22      ASN  12  -9.398  -0.765   0.093
  Start of MODEL   10
    1    H1   ARG   1           HT1      ARG   1   5.268   9.449   3.688
    2    H2   ARG   1           HT2      ARG   1   6.521   8.462   4.243
    3    H3   ARG   1           HT3      ARG   1   4.951   7.847   4.121
    4    HA   ARG   1           HA       ARG   1   4.981   8.025   1.760
    5    HB2  ARG   1           HB2      ARG   1   7.036   8.727   0.586
    6    HB3  ARG   1           HB1      ARG   1   6.352  10.022   1.556
    7    HG2  ARG   1           HG2      ARG   1   8.022   9.608   3.289
    8    HG3  ARG   1           HG1      ARG   1   8.706   8.304   2.319
    9    HD2  ARG   1           HD2      ARG   1   9.118   9.982   0.508
   10    HD3  ARG   1           HD1      ARG   1   8.617  11.239   1.639
   11    HE   ARG   1           HE       ARG   1  10.635   9.659   2.809
   12   HH11  ARG   1          HH11      ARG   1  10.197  12.105   0.343
   13   HH12  ARG   1          HH12      ARG   1  11.831  12.675   0.439
   14   HH21  ARG   1          HH21      ARG   1  12.795  10.403   2.922
   15   HH22  ARG   1          HH22      ARG   1  13.307  11.704   1.895
   16    H    LYS   2           HN       LYS   2   5.097   5.943   3.462
   17    HA   LYS   2           HA       LYS   2   7.460   4.357   3.118
   18    HB2  LYS   2           HB2      LYS   2   4.707   3.760   4.177
   19    HB3  LYS   2           HB1      LYS   2   5.884   2.481   3.933
   20    HG2  LYS   2           HG2      LYS   2   6.099   3.014   6.172
   21    HG3  LYS   2           HG1      LYS   2   7.429   3.890   5.419
   22    HD2  LYS   2           HD2      LYS   2   6.142   5.941   5.481
   23    HD3  LYS   2           HD1      LYS   2   4.753   5.078   6.138
   24    HE2  LYS   2           HE2      LYS   2   7.418   5.514   7.459
   25    HE3  LYS   2           HE1      LYS   2   5.860   6.192   7.925
   26    HZ1  LYS   2           HZ1      LYS   2   6.356   4.384   9.371
   27    HZ2  LYS   2           HZ2      LYS   2   6.677   3.342   8.081
   28    HZ3  LYS   2           HZ3      LYS   2   5.100   3.885   8.355
   29    H    VAL   3           HN       VAL   3   4.135   4.030   1.935
   30    HA   VAL   3           HA       VAL   3   3.229   2.665   0.357
   31    HB   VAL   3           HB       VAL   3   3.907   3.284  -1.957
   32   HG11  VAL   3          HG11      VAL   3   3.451   5.502   0.030
   33   HG12  VAL   3          HG12      VAL   3   2.224   4.552  -0.810
   34   HG13  VAL   3          HG13      VAL   3   3.251   5.663  -1.713
   35   HG21  VAL   3          HG21      VAL   3   5.942   5.036  -0.572
   36   HG22  VAL   3          HG22      VAL   3   5.519   5.102  -2.282
   37   HG23  VAL   3          HG23      VAL   3   6.297   3.665  -1.624
   38    HA   PRO   4           HA       PRO   4   6.373  -0.687   0.179
   39    HB2  PRO   4           HB2      PRO   4   4.983  -2.506   1.592
   40    HB3  PRO   4           HB1      PRO   4   5.970  -1.270   2.378
   41    HG2  PRO   4           HG2      PRO   4   3.013  -1.369   1.985
   42    HG3  PRO   4           HG1      PRO   4   3.940  -0.824   3.393
   43    HD2  PRO   4           HD2      PRO   4   2.834   0.857   1.511
   44    HD3  PRO   4           HD1      PRO   4   4.215   1.275   2.542
   45    H    THR   5           HN       THR   5   5.616  -3.183  -0.267
   46    HA   THR   5           HA       THR   5   4.007  -2.984  -2.681
   47    HB   THR   5           HB       THR   5   5.570  -5.350  -1.632
   48    HG1  THR   5           HG1      THR   5   7.240  -4.609  -2.904
   49   HG21  THR   5          HG21      THR   5   4.502  -4.724  -4.386
   50   HG22  THR   5          HG22      THR   5   3.843  -5.924  -3.277
   51   HG23  THR   5          HG23      THR   5   5.461  -6.136  -3.946
   52    H    GLY   6           HN       GLY   6   1.907  -2.897  -2.001
   53    HA2  GLY   6           HA2      GLY   6   0.743  -5.373  -1.057
   54    HA3  GLY   6           HA1      GLY   6   0.604  -4.031   0.070
   55    H    SER   7           HN       SER   7   0.401  -4.185  -3.455
   56    HA   SER   7           HA       SER   7  -1.179  -3.564  -4.943
   57    HB2  SER   7           HB2      SER   7  -2.521  -5.284  -3.729
   58    HB3  SER   7           HB1      SER   7  -3.155  -4.009  -2.692
   59    HG   SER   7           HG       SER   7  -3.876  -3.000  -4.728
   60    H    ASN   8           HN       ASN   8   0.154  -1.520  -4.021
   61    HA   ASN   8           HA       ASN   8   0.197   0.734  -3.828
   62    HB2  ASN   8           HB2      ASN   8  -2.633   0.415  -4.818
   63    HB3  ASN   8           HB1      ASN   8  -1.902   1.990  -4.536
   64   HD21  ASN   8          HD21      ASN   8  -0.261   2.700  -5.886
   65   HD22  ASN   8          HD22      ASN   8   0.064   1.955  -7.410
   66    HA   PRO   9           HA       PRO   9  -1.847   0.890   0.280
   67    HB2  PRO   9           HB2      PRO   9   0.441   0.308   1.742
   68    HB3  PRO   9           HB1      PRO   9  -0.788  -0.866   1.271
   69    HG2  PRO   9           HG2      PRO   9   1.911  -0.740   0.383
   70    HG3  PRO   9           HG1      PRO   9   0.641  -1.832  -0.188
   71    HD2  PRO   9           HD2      PRO   9   1.628   0.711  -1.372
   72    HD3  PRO   9           HD1      PRO   9   0.940  -0.720  -2.172
   73    H    GLN  10           HN       GLN  10  -1.735   3.149  -0.603
   74    HA   GLN  10           HA       GLN  10   0.432   4.766   0.473
   75    HB2  GLN  10           HB2      GLN  10  -0.577   5.303  -1.734
   76    HB3  GLN  10           HB1      GLN  10  -2.120   5.582  -0.948
   77    HG2  GLN  10           HG2      GLN  10   0.186   7.169   0.017
   78    HG3  GLN  10           HG1      GLN  10  -0.433   7.540  -1.588
   79   HE21  GLN  10          HE21      GLN  10  -1.044   7.641   1.816
   80   HE22  GLN  10          HE22      GLN  10  -2.484   8.600   1.749
   81    H    LYS  11           HN       LYS  11  -2.618   3.570   1.293
   82    HA   LYS  11           HA       LYS  11  -3.723   3.770   3.380
   83    HB2  LYS  11           HB2      LYS  11  -2.520   6.522   3.381
   84    HB3  LYS  11           HB1      LYS  11  -3.951   6.170   4.337
   85    HG2  LYS  11           HG2      LYS  11  -2.769   4.502   5.594
   86    HG3  LYS  11           HG1      LYS  11  -1.350   4.675   4.557
   87    HD2  LYS  11           HD2      LYS  11  -2.499   6.952   6.147
   88    HD3  LYS  11           HD1      LYS  11  -1.257   5.872   6.791
   89    HE2  LYS  11           HE2      LYS  11   0.135   6.471   4.785
   90    HE3  LYS  11           HE1      LYS  11  -1.072   7.697   4.403
   91    HZ1  LYS  11           HZ1      LYS  11  -0.656   8.678   6.601
   92    HZ2  LYS  11           HZ2      LYS  11   0.716   8.685   5.619
   93    HZ3  LYS  11           HZ3      LYS  11   0.578   7.550   6.864
   94    H    ASN  12           HN       ASN  12  -3.695   5.673   0.565
   95    HA   ASN  12           HA       ASN  12  -6.629   5.662   0.581
   96    HB2  ASN  12           HB2      ASN  12  -5.908   7.979   0.860
   97    HB3  ASN  12           HB1      ASN  12  -4.836   7.838  -0.530
   98   HD21  ASN  12          HD21      ASN  12  -5.882   9.566  -1.536
   99   HD22  ASN  12          HD22      ASN  12  -7.436   9.380  -2.272