*HEADER    ANTIBIOTIC                              06-MAR-06   2G9L              
*TITLE     THE HIGH-RESOLUTION SOLUTION CONFORMATION OF AN                       
*TITLE    2 ANTIMICROBIAL PEPTIDE GAEGURIN 4 AND ITS MODE OF MEMBRANE            
*TITLE    3 INTERACTION                                                          
*COMPND    MOL_ID: 1;                                                            
*COMPND   2 MOLECULE: GAEGURIN-4;                                                
*COMPND   3 CHAIN: A;                                                            
*COMPND   4 SYNONYM: GGN4;                                                       
*COMPND   5 ENGINEERED: YES                                                      
*SOURCE    MOL_ID: 1;                                                            
*SOURCE   2 SYNTHETIC: YES;                                                      
*SOURCE   3 OTHER_DETAILS: THE PEPTIDE WAS CHEMICALLY SYNTHESIZED. THE           
*SOURCE   4 SEQUENCE OCCURS NATURALLY FOUND IN KOREAN FROG, RANA                 
*SOURCE   5 RUGOSA.                                                              
*KEYWDS    AMPHIPATHIC HELIX                                                     
*EXPDTA    NMR, 15 STRUCTURES                                                    
*AUTHOR    S.-W.CHI, K.-H.HAN                                                    
*REVDAT   1   16-JAN-07 2G9L    0                                                

!BIOSYM restraint 1
!With S-S bond, no S-S constraints
!
#chiral
!
1:ILE_2:CA            S
1:ILE_2:CB            S
1:LEU_3:CA            S
1:ASP_4:CA            S
1:THR_5:CA            S
1:THR_5:CB            R
1:LEU_6:CA            S
1:LYS_7:CA            S
1:GLN_8:CA            S
1:PHE_9:CA            S
1:ALA_10:CA           S
1:LYS_11:CA           S
1:VAL_13:CA           S
1:LYS_15:CA           S
1:ASP_16:CA           S
1:LEU_17:CA           S
1:VAL_18:CA           S
1:LYS_19:CA           S
1:ALA_21:CA           S
1:ALA_22:CA           S
1:GLN_23:CA           S
1:VAL_25:CA           S
1:LEU_26:CA           S
1:SER_27:CA           S
1:THR_28:CA           S
1:THR_28:CB           R
1:VAL_29:CA           S
1:SER_30:CA           S
1:CYS_31:CA           R
1:LYS_32:CA           S
1:LEU_33:CA           S
1:ALA_34:CA           S
1:LYS_35:CA           S
1:THR_36:CA           S
1:THR_36:CB           R
1:CYS_37:CA           R
!
#distance
!
!S-S bonds bound range;( SG - SG;1.5 - 2.5 , CB - SG;2.5 - 3.5 )
!1:CYS_31:SG      1:CYS_37:SG         1.500    2.500   300.000   300.000   500.000
!1:CYS_31:CB      1:CYS_37:SG         2.500    3.500   100.000   100.000   500.000
!1:CYS_37:CB      1:CYS_31:SG         2.500    3.500   100.000   100.000   500.000
!
1:LEU_6:HN       1:LEU_6:HA          -1.000   3.000   30.000  30.000  1000.000
1:GLN_8:HN       1:GLN_8:HA          -1.000   3.000   30.000  30.000  1000.000
1:CYS_31:HN      1:CYS_31:HA         -1.000   3.000   30.000  30.000  1000.000
!
#NOE_distance
!
!ggn4 80% MeOH (20% add)
1:ILE_2:HA       1:ILE_2:HB          -1.000   2.598   2.098  1.000   1.000  1000.000  0.000
1:ILE_2:HA       1:THR_5:HG2*        -1.000   6.154   5.154  1.000   1.000  1000.000  0.000
1:ILE_2:HA       1:ILE_2:HG2*        -1.000   4.271   3.271  1.000   1.000  1000.000  0.000
1:ILE_2:HB       1:ILE_2:HG12        -1.000   4.544   4.044  1.000   1.000  1000.000  0.000
1:ILE_2:HB       1:ILE_2:HG2*        -1.000   3.788   2.788  1.000   1.000  1000.000  0.000
1:ILE_2:HG12     1:ILE_2:HG2*        -1.000   4.238   3.238  1.000   1.000  1000.000  0.000
1:ILE_2:HN       1:ILE_2:HA          -1.000   3.313   2.813 30.000  30.000  1000.000  0.000
1:ILE_2:HN       1:GLYN_1:HA1        -1.000   3.672   3.172 30.000  30.000  1000.000  0.000
1:ILE_2:HN       1:GLYN_1:HA2        -1.000   3.736   3.236 30.000  30.000  1000.000  0.000
1:ILE_2:HN       1:ILE_2:HB          -1.000   3.105   2.605  1.000   1.000  1000.000  0.000
1:ILE_2:HN       1:ILE_2:HG12        -1.000   3.778   3.278  1.000   1.000  1000.000  0.000
1:ILE_2:HN       1:ILE_2:HG2*        -1.000   4.794   3.794  1.000   1.000  1000.000  0.000
1:ILE_2:HN       1:LEU_3:HN          -1.000   3.483   2.983 30.000  30.000  1000.000  0.000
1:LEU_3:HA       1:LEU_3:HD1*        -1.000   4.496   3.496  1.000   1.000  1000.000  0.000
1:LEU_3:HB1      1:LEU_3:HD1*        -1.000   4.631   3.631  1.000   1.000  1000.000  0.000
1:LEU_3:HG       1:LEU_3:HD1*        -1.000   4.222   3.222  1.000   1.000  1000.000  0.000
1:LEU_3:HG       1:LEU_3:HD2*        -1.000   4.083   3.083  1.000   1.000  1000.000  0.000
1:LEU_3:HN       1:LEU_3:HA          -1.000   3.259   2.759 30.000  30.000  1000.000  0.000
1:LEU_3:HN       1:ILE_2:HA          -1.000   4.197   3.697 30.000  30.000  1000.000  0.000
1:LEU_3:HN       1:ILE_2:HB          -1.000   4.128   3.628  1.000   1.000  1000.000  0.000
1:LEU_3:HN       1:LEU_3:HB1         -1.000   3.136   2.636  1.000   1.000  1000.000  0.000
1:LEU_3:HN       1:LEU_3:HG          -1.000   3.544   3.044  1.000   1.000  1000.000  0.000
1:LEU_3:HN       1:LEU_3:HB2         -1.000   3.600   3.100  1.000   1.000  1000.000  0.000
1:LEU_3:HN       1:LEU_3:HD1*        -1.000   4.554   3.554  1.000   1.000  1000.000  0.000
1:LEU_3:HN       1:ASP_4:HN          -1.000   3.205   2.705 30.000  30.000  1000.000  0.000
1:ASP_4:HA       1:ASP_4:HB1         -1.000   3.424   2.924  1.000   1.000  1000.000  0.000
1:ASP_4:HA       1:ASP_4:HB2         -1.000   3.102   2.602  1.000   1.000  1000.000  0.000
1:ASP_4:HA       1:LYS_7:HB1         -1.000   3.578   3.078  1.000   1.000  1000.000  0.000
1:ASP_4:HA       1:LYS_7:HB2         -1.000   3.834   3.334  1.000   1.000  1000.000  0.000
1:ASP_4:HA       1:LYS_7:HD*         -1.000   4.728   3.728  1.000   1.000  1000.000  0.000
1:ASP_4:HB1      1:ASP_4:HB2         -1.000   2.467   1.967  1.000   1.000  1000.000  0.000
1:ASP_4:HN       1:ASP_4:HA          -1.000   3.350   2.850 30.000  30.000  1000.000  0.000
1:ASP_4:HN       1:THR_5:HB          -1.000   4.294   3.794  1.000   1.000  1000.000  0.000
1:ASP_4:HN       1:LEU_3:HA          -1.000   3.541   3.041 30.000  30.000  1000.000  0.000
1:ASP_4:HN       1:ILE_2:HA          -1.000   5.203   4.703 30.000  30.000  1000.000  0.000
1:ASP_4:HN       1:THR_5:HA          -1.000   4.477   3.977 30.000  30.000  1000.000  0.000
1:ASP_4:HN       1:ASP_4:HB1         -1.000   3.375   2.875  1.000   1.000  1000.000  0.000
1:ASP_4:HN       1:ASP_4:HB2         -1.000   3.105   2.605  1.000   1.000  1000.000  0.000
1:ASP_4:HN       1:LEU_3:HB1         -1.000   3.643   3.143  1.000   1.000  1000.000  0.000
1:ASP_4:HN       1:LEU_3:HB2         -1.000   3.918   3.418  1.000   1.000  1000.000  0.000
1:THR_5:HA       1:GLN_8:HG*         -1.000   4.910   3.910  1.000   1.000  1000.000  0.000
1:THR_5:HA       1:GLN_8:HB1         -1.000   3.418   2.918  1.000   1.000  1000.000  0.000
1:THR_5:HA       1:GLN_8:HB2         -1.000   3.424   2.924  1.000   1.000  1000.000  0.000
1:THR_5:HA       1:THR_5:HG2*        -1.000   3.959   2.959  1.000   1.000  1000.000  0.000
1:THR_5:HB       1:ILE_2:HA          -1.000   3.213   2.713  1.000   1.000  1000.000  0.000
1:THR_5:HB       1:THR_5:HA          -1.000   3.332   2.832  1.000   1.000  1000.000  0.000
1:THR_5:HB       1:THR_5:HG2*        -1.000   3.675   2.675  1.000   1.000  1000.000  0.000
1:THR_5:HN       1:ASP_4:HA          -1.000   3.735   3.235 30.000  30.000  1000.000  0.000
1:THR_5:HN       1:THR_5:HB          -1.000   3.355   2.855  1.000   1.000  1000.000  0.000
1:THR_5:HN       1:LEU_3:HA          -1.000   3.970   3.470 30.000  30.000  1000.000  0.000
1:THR_5:HN       1:ILE_2:HA          -1.000   3.772   3.272 30.000  30.000  1000.000  0.000
1:THR_5:HN       1:THR_5:HA          -1.000   3.225   2.725 30.000  30.000  1000.000  0.000
1:THR_5:HN       1:ASP_4:HB1         -1.000   3.894   3.394  1.000   1.000  1000.000  0.000
1:THR_5:HN       1:ASP_4:HB2         -1.000   3.672   3.172  1.000   1.000  1000.000  0.000
1:THR_5:HN       1:THR_5:HG2*        -1.000   4.823   3.823  1.000   1.000  1000.000  0.000
1:THR_5:HN       1:LEU_3:HN          -1.000   4.410   3.910 30.000  30.000  1000.000  0.000
1:LEU_6:HA       1:PHE_9:HB*         -1.000   4.096   3.096  1.000   1.000  1000.000  0.000
1:LEU_6:HA       1:LEU_6:HB2         -1.000   2.962   2.462  1.000   1.000  1000.000  0.000
1:LEU_6:HB2      1:LEU_6:HD*         -1.000   4.697   3.697  1.000   1.000  1000.000  0.000
1:LEU_6:HN       1:THR_5:HB          -1.000   3.859   3.359  1.000   1.000  1000.000  0.000
!1:LEU_6:HN       1:THR_5:HA          -1.000   3.544   3.044 30.000  30.000  1000.000  0.000
1:LEU_6:HN       1:THR_5:HA          -1.000   3.760   3.260 30.000  30.000  1000.000  0.000
1:LEU_6:HN       1:LEU_6:HB1         -1.000   3.073   2.573  1.000   1.000  1000.000  0.000
1:LEU_6:HN       1:LEU_6:HG          -1.000   3.098   2.598  1.000   1.000  1000.000  0.000
1:LEU_6:HN       1:LEU_6:HB2         -1.000   3.486   2.986  1.000   1.000  1000.000  0.000
1:LEU_6:HN       1:THR_5:HG2*        -1.000   6.082   5.082  1.000   1.000  1000.000  0.000
1:LEU_6:HN       1:LEU_6:HD*         -1.000   6.060   5.060  1.000   1.000  1000.000  0.000
1:LEU_6:HN       1:ILE_2:HD1*        -1.000   5.045   4.045  1.000   1.000  1000.000  0.000
!1:LEU_6:HN       1:LYS_7:HN          -1.000   3.049   2.549 30.000  30.000  1000.000  0.000
1:LEU_6:HN       1:THR_5:HN          -1.000   3.188   2.688 30.000  30.000  1000.000  0.000
1:LYS_7:HA       1:LYS_7:HB1         -1.000   2.944   2.444  1.000   1.000  1000.000  0.000
1:LYS_7:HA       1:LYS_7:HD*         -1.000   3.905   2.905  1.000   1.000  1000.000  0.000
1:LYS_7:HA       1:ALA_10:HB*        -1.000   3.692   2.692  1.000   1.000  1000.000  0.000
1:LYS_7:HA       1:LYS_7:HG*         -1.000   3.827   2.827  1.000   1.000  1000.000  0.000
1:LYS_7:HB1      1:LYS_7:HD*         -1.000   9.400   8.400  1.000   1.000  1000.000  0.000
1:LYS_7:HN       1:ASP_4:HA          -1.000   4.258   3.758 30.000  30.000  1000.000  0.000
1:LYS_7:HN       1:LYS_7:HA          -1.000   3.049   2.549 30.000  30.000  1000.000  0.000
1:LYS_7:HN       1:LYS_7:HB1         -1.000   2.940   2.440  1.000   1.000  1000.000  0.000
1:LYS_7:HN       1:LYS_7:HD*         -1.000   4.056   3.056  1.000   1.000  1000.000  0.000
1:LYS_7:HN       1:LEU_6:HB2         -1.000   3.780   3.280  1.000   1.000  1000.000  0.000
1:LYS_7:HN       1:LYS_7:HG*         -1.000   4.031   3.031  1.000   1.000  1000.000  0.000
1:GLN_8:HA       1:GLN_8:HG*         -1.000   3.959   2.959  1.000   1.000  1000.000  0.000
1:GLN_8:HE21     1:GLN_8:HG*         -1.000   4.737   3.737  1.000   1.000  1000.000  0.000
1:GLN_8:HE22     1:GLN_8:HG*         -1.000   5.234   4.234  1.000   1.000  1000.000  0.000
1:GLN_8:HG*      1:GLN_8:HB1         -1.000   3.460   2.460  1.000   1.000  1000.000  0.000
1:GLN_8:HG*      1:GLN_8:HB2         -1.000   3.404   2.404  1.000   1.000  1000.000  0.000
1:GLN_8:HN       1:THR_5:HA          -1.000   3.680   3.180 30.000  30.000  1000.000  0.000
1:GLN_8:HN       1:GLN_8:HG*         -1.000   4.053   3.053  1.000   1.000  1000.000  0.000
1:GLN_8:HN       1:GLN_8:HB1         -1.000   3.312   2.812  1.000   1.000  1000.000  0.000
1:GLN_8:HN       1:GLN_8:HB2         -1.000   3.256   2.756  1.000   1.000  1000.000  0.000
1:PHE_9:HA       1:PHE_9:HB*         -1.000   3.516   2.516  1.000   1.000  1000.000  0.000
1:PHE_9:HN       1:PHE_9:HD*         -1.000   6.356   4.356  1.000   1.000  1000.000  0.000
1:PHE_9:HN       1:PHE_9:HA          -1.000   3.115   2.615 30.000  30.000  1000.000  0.000
!1:PHE_9:HN       1:GLN_8:HA          -1.000   3.451   2.951 30.000  30.000  1000.000  0.000
1:PHE_9:HN       1:GLN_8:HA          -1.000   4.030   3.530 30.000  30.000  1000.000  0.000
1:PHE_9:HN       1:GLN_8:HG*         -1.000   5.506   4.506  1.000   1.000  1000.000  0.000
1:PHE_9:HN       1:GLN_8:HB1         -1.000   3.576   3.076  1.000   1.000  1000.000  0.000
1:PHE_9:HN       1:GLN_8:HB2         -1.000   3.482   2.982  1.000   1.000  1000.000  0.000
!1:PHE_9:HN       1:GLN_8:HN          -1.000   2.983   2.483 30.000  30.000  1000.000  0.000
1:PHE_9:HN       1:GLN_8:HN          -1.000   3.380   2.880 30.000  30.000  1000.000  0.000
1:ALA_10:HA      1:VAL_13:HB         -1.000   3.243   2.743  1.000   1.000  1000.000  0.000
1:ALA_10:HA      1:ALA_10:HB*        -1.000   3.629   2.629  1.000   1.000  1000.000  0.000
1:ALA_10:HA      1:VAL_13:HG1*       -1.000   6.455   5.455  1.000   1.000  1000.000  0.000
1:ALA_10:HA      1:VAL_13:HG2*       -1.000   4.566   3.566  1.000   1.000  1000.000  0.000
1:ALA_10:HN      1:ALA_10:HA         -1.000   3.026   2.526 30.000  30.000  1000.000  0.000
1:ALA_10:HN      1:ALA_10:HB*        -1.000   3.683   2.683  1.000   1.000  1000.000  0.000
!1:ALA_10:HN      1:LYS_11:HN         -1.000   3.105   2.605 30.000  30.000  1000.000  0.000
1:ALA_10:HN      1:LYS_11:HN         -1.000   4.160   3.660 30.000  30.000  1000.000  0.000
1:LYS_11:HN      1:PHE_9:HA          -1.000   4.470   3.970 30.000  30.000  1000.000  0.000
!1:LYS_11:HN      1:LYS_11:HA         -1.000   2.702   2.202 30.000  30.000  1000.000  0.000
1:LYS_11:HN      1:LYS_11:HA         -1.000   3.28    2.78  30.000  30.000  1000.000  0.000
1:LYS_11:HN      1:LYS_11:HD*        -1.000   4.526   3.526  1.000   1.000  1000.000  0.000
1:LYS_11:HN      1:ALA_10:HB*        -1.000   4.193   3.193  1.000   1.000  1000.000  0.000
1:LYS_11:HN      1:LYS_11:HG*        -1.000   5.421   4.421  1.000   1.000  1000.000  0.000
1:GLY_12:HN      1:PHE_9:HA          -1.000   4.318   3.818 30.000  30.000  1000.000  0.000
1:GLY_12:HN      1:GLY_12:HA1        -1.000   2.910   2.410 30.000  30.000  1000.000  0.000
1:GLY_12:HN      1:GLY_12:HA2        -1.000   2.978   2.478 30.000  30.000  1000.000  0.000
1:VAL_13:HA      1:ASP_16:HB1        -1.000   3.220   2.720  1.000   1.000  1000.000  0.000
1:VAL_13:HA      1:ASP_16:HB2        -1.000   3.489   2.989  1.000   1.000  1000.000  0.000
1:VAL_13:HA      1:VAL_13:HB         -1.000   3.086   2.586  1.000   1.000  1000.000  0.000
1:VAL_13:HA      1:VAL_13:HG1*       -1.000   4.652   3.652  1.000   1.000  1000.000  0.000
1:VAL_13:HA      1:VAL_13:HG2*       -1.000   3.741   2.741  1.000   1.000  1000.000  0.000
1:VAL_13:HB      1:VAL_13:HG1*       -1.000   3.532   2.532  1.000   1.000  1000.000  0.000
1:VAL_13:HB      1:VAL_13:HG2*       -1.000   3.798   2.798  1.000   1.000  1000.000  0.000
1:VAL_13:HN      1:ALA_10:HA         -1.000   3.357   2.857 30.000  30.000  1000.000  0.000
1:VAL_13:HN      1:VAL_13:HA         -1.000   3.126   2.626 30.000  30.000  1000.000  0.000
1:VAL_13:HN      1:VAL_13:HB         -1.000   2.924   2.424  1.000   1.000  1000.000  0.000
1:VAL_13:HN      1:VAL_13:HG1*       -1.000   4.854   3.854  1.000   1.000  1000.000  0.000
1:VAL_13:HN      1:VAL_13:HG2*       -1.000   3.885   2.885  1.000   1.000  1000.000  0.000
1:GLY_14:HA1     1:LEU_17:HB1        -1.000   3.753   3.253  1.000   1.000  1000.000  0.000
1:GLY_14:HN      1:GLY_12:HA1        -1.000   2.968   2.468 30.000  30.000  1000.000  0.000
1:GLY_14:HN      1:GLY_14:HA1        -1.000   3.046   2.546 30.000  30.000  1000.000  0.000
1:GLY_14:HN      1:GLY_14:HA2        -1.000   3.218   2.718 30.000  30.000  1000.000  0.000
!1:GLY_14:HN      1:VAL_13:HA         -1.000   3.252   2.752 30.000  30.000  1000.000  0.000
1:GLY_14:HN      1:VAL_13:HA         -1.000   3.98    3.48  30.000  30.000  1000.000  0.000
1:GLY_14:HN      1:VAL_13:HB         -1.000   3.510   3.010  1.000   1.000  1000.000  0.000
1:GLY_14:HN      1:LYS_15:HB*        -1.000   4.737   3.737  1.000   1.000  1000.000  0.000
1:GLY_14:HN      1:VAL_13:HG1*       -1.000   5.752   4.752  1.000   1.000  1000.000  0.000
1:GLY_14:HN      1:VAL_13:HG2*       -1.000   5.448   4.448  1.000   1.000  1000.000  0.000
1:GLY_14:HN      1:ASP_16:HN         -1.000   3.498   2.998 30.000  30.000  1000.000  0.000
!1:GLY_14:HN      1:VAL_13:HN         -1.000   3.270   2.770 30.000  30.000  1000.000  0.000
1:GLY_14:HN      1:VAL_13:HN         -1.000   3.390   2.890 30.000  30.000  1000.000  0.000
1:GLY_14:HN      1:LYS_15:HN         -1.000   3.316   2.816 30.000  30.000  1000.000  0.000
1:GLY_14:HN      1:VAL_18:HN         -1.000   4.806   4.306 30.000  30.000  1000.000  0.000
1:LYS_15:HA      1:VAL_18:HB         -1.000   3.082   2.582  1.000   1.000  1000.000  0.000
1:LYS_15:HA      1:VAL_18:HG1*       -1.000   4.604   3.604  1.000   1.000  1000.000  0.000
1:LYS_15:HA      1:VAL_18:HG2*       -1.000   5.448   4.448  1.000   1.000  1000.000  0.000
1:LYS_15:HE*     1:LYS_15:HD2        -1.000   5.722   4.722  1.000   1.000  1000.000  0.000
1:LYS_15:HN      1:LYS_11:HA         -1.000   4.104   3.604  1.000   1.000  1000.000  0.000
1:LYS_15:HN      1:LYS_15:HA         -1.000   3.136   2.636 30.000  30.000  1000.000  0.000
1:LYS_15:HN      1:GLY_12:HA1        -1.000   3.909   3.409 30.000  30.000  1000.000  0.000
1:LYS_15:HN      1:GLY_14:HA1        -1.000   3.550   3.050 30.000  30.000  1000.000  0.000
1:LYS_15:HN      1:GLY_14:HA2        -1.000   3.912   3.412 30.000  30.000  1000.000  0.000
1:LYS_15:HN      1:VAL_13:HA         -1.000   3.880   3.380 30.000  30.000  1000.000  0.000
1:LYS_15:HN      1:LYS_15:HD1        -1.000   4.998   4.498  1.000   1.000  1000.000  0.000
1:LYS_15:HN      1:LYS_15:HD2        -1.000   3.762   3.262  1.000   1.000  1000.000  0.000
1:LYS_15:HN      1:LYS_15:HG*        -1.000   5.332   4.332  1.000   1.000  1000.000  0.000
1:ASP_16:HA      1:ASP_16:HB1        -1.000   3.272   2.772  1.000   1.000  1000.000  0.000
1:ASP_16:HA      1:ASP_16:HB2        -1.000   3.092   2.592  1.000   1.000  1000.000  0.000
1:ASP_16:HA      1:LYS_19:HB*        -1.000   3.921   2.921  1.000   1.000  1000.000  0.000
!1:ASP_16:HB1     1:ASP_16:HB2        -1.000   2.619   2.119 30.000  30.000  1000.000  0.000
1:ASP_16:HN      1:ASP_16:HA         -1.000   3.433   2.933 30.000  30.000  1000.000  0.000
1:ASP_16:HN      1:VAL_13:HA         -1.000   3.739   3.239 30.000  30.000  1000.000  0.000
1:ASP_16:HN      1:ASP_16:HB1        -1.000   3.440   2.940  1.000   1.000  1000.000  0.000
1:ASP_16:HN      1:ASP_16:HB2        -1.000   3.595   3.095  1.000   1.000  1000.000  0.000
1:ASP_16:HN      1:LYS_15:HN         -1.000   3.102   2.602 30.000  30.000  1000.000  0.000
1:ASP_16:HN      1:VAL_18:HN         -1.000   4.082   3.582 30.000  30.000  1000.000  0.000
!1:LEU_17:HB1     1:LEU_17:HB2        -1.000   2.492   1.992 30.000  30.000  1000.000  0.000
1:LEU_17:HN      1:ASP_16:HA         -1.000   4.344   3.844 30.000  30.000  1000.000  0.000
1:LEU_17:HN      1:GLY_14:HA2        -1.000   4.329   3.829 30.000  30.000  1000.000  0.000
1:LEU_17:HN      1:VAL_13:HA         -1.000   4.764   4.264 30.000  30.000  1000.000  0.000
1:LEU_17:HN      1:LEU_17:HB1        -1.000   3.364   2.864  1.000   1.000  1000.000  0.000
1:LEU_17:HN      1:LEU_17:HG         -1.000   3.159   2.659  1.000   1.000  1000.000  0.000
1:LEU_17:HN      1:LEU_17:HB2        -1.000   2.738   2.238  1.000   1.000  1000.000  0.000
1:LEU_17:HN      1:VAL_18:HG1*       -1.000   5.884   4.884  1.000   1.000  1000.000  0.000
1:LEU_17:HN      1:LEU_17:HD*        -1.000   5.463   4.463  1.000   1.000  1000.000  0.000
1:LEU_17:HN      1:LYS_19:HN         -1.000   3.115   2.615 30.000  30.000  1000.000  0.000
!1:LEU_17:HN      1:ASP_16:HN         -1.000   3.126   2.626 30.000  30.000  1000.000  0.000
1:LEU_17:HN      1:ASP_16:HN         -1.000   3.330   2.830 30.000  30.000  1000.000  0.000
1:LEU_17:HN      1:VAL_18:HN         -1.000   3.364   2.864 30.000  30.000  1000.000  0.000
1:VAL_18:HA      1:VAL_18:HB         -1.000   3.188   2.688  1.000   1.000  1000.000  0.000
1:VAL_18:HA      1:LEU_17:HB1        -1.000   3.738   3.238  1.000   1.000  1000.000  0.000
1:VAL_18:HA      1:ALA_21:HB*        -1.000   3.984   2.984  1.000   1.000  1000.000  0.000
1:VAL_18:HA      1:VAL_18:HG1*       -1.000   3.576   2.576  1.000   1.000  1000.000  0.000
1:VAL_18:HA      1:VAL_18:HG2*       -1.000   3.968   2.968  1.000   1.000  1000.000  0.000
1:VAL_18:HB      1:VAL_18:HG1*       -1.000   3.352   2.352  1.000   1.000  1000.000  0.000
1:VAL_18:HB      1:VAL_18:HG2*       -1.000   3.386   2.386  1.000   1.000  1000.000  0.000
1:VAL_18:HN      1:LYS_15:HA         -1.000   3.570   3.070 30.000  30.000  1000.000  0.000
1:VAL_18:HN      1:VAL_18:HA         -1.000   3.144   2.644 30.000  30.000  1000.000  0.000
1:VAL_18:HN      1:VAL_18:HB         -1.000   3.112   2.612  1.000   1.000  1000.000  0.000
1:VAL_18:HN      1:LEU_17:HB1        -1.000   3.753   3.253  1.000   1.000  1000.000  0.000
1:VAL_18:HN      1:LYS_15:HB*        -1.000   4.526   3.526  1.000   1.000  1000.000  0.000
1:VAL_18:HN      1:LEU_17:HB2        -1.000   4.060   3.560  1.000   1.000  1000.000  0.000
1:VAL_18:HN      1:VAL_18:HG1*       -1.000   3.984   2.984  1.000   1.000  1000.000  0.000
1:VAL_18:HN      1:VAL_18:HG2*       -1.000   4.881   3.881  1.000   1.000  1000.000  0.000
1:LYS_19:HA      1:LYS_19:HD*        -1.000   3.878   2.878  1.000   1.000  1000.000  0.000
1:LYS_19:HA      1:LYS_19:HG*        -1.000   3.419   2.419  1.000   1.000  1000.000  0.000
1:LYS_19:HN      1:ASP_16:HA         -1.000   5.704   5.204 30.000  30.000  1000.000  0.000
!1:LYS_19:HN      1:VAL_18:HA         -1.000   3.238   2.738 30.000  30.000  1000.000  0.000
1:LYS_19:HN      1:VAL_18:HA         -1.000   3.61    3.11  30.000  30.000  1000.000  0.000
1:LYS_19:HN      1:VAL_18:HB         -1.000   3.148   2.648  1.000   1.000  1000.000  0.000
1:LYS_19:HN      1:LYS_19:HB*        -1.000   3.683   2.683  1.000   1.000  1000.000  0.000
1:LYS_19:HN      1:VAL_18:HG2*       -1.000   4.958   3.958  1.000   1.000  1000.000  0.000
1:LYS_19:HN      1:VAL_18:HN         -1.000   3.310   2.810 30.000  30.000  1000.000  0.000
1:GLY_20:HA*     1:GLN_23:HB1        -1.000   4.641   3.641  1.000   1.000  1000.000  0.000
1:GLY_20:HA*     1:GLN_23:HB2        -1.000   4.509   3.509  1.000   1.000  1000.000  0.000
1:GLY_20:HA*     1:LYS_19:HB*        -1.000   4.902   3.402  1.000   1.000  1000.000  0.000
1:GLY_20:HA*     1:ALA_21:HB*        -1.000   5.844   4.344  1.000   1.000  1000.000  0.000
1:GLY_20:HN      1:LEU_17:HA         -1.000   3.572   3.072 30.000  30.000  1000.000  0.000
1:GLY_20:HN      1:GLY_20:HA*        -1.000   3.656   2.656 30.000  30.000  1000.000  0.000
1:GLY_20:HN      1:LYS_19:HB*        -1.000   3.968   2.968  1.000   1.000  1000.000  0.000
1:GLY_20:HN      1:ALA_22:HN         -1.000   3.548   3.048 30.000  30.000  1000.000  0.000
!1:GLY_20:HN      1:ALA_21:HN         -1.000   2.931   2.431 30.000  30.000  1000.000  0.000
1:GLY_20:HN      1:ALA_21:HN         2.500   3.500   2.431 30.000  30.000  1000.000  0.000
!1:ALA_21:HA      1:ALA_22:HA         -1.000   3.552   3.052 30.000  30.000  1000.000  0.000
1:ALA_21:HA      1:ALA_21:HB*        -1.000   3.148   2.148  1.000   1.000  1000.000  0.000
1:ALA_21:HN      1:ALA_21:HA         -1.000   3.021   2.521 30.000  30.000  1000.000  0.000
1:ALA_21:HN      1:GLY_20:HA*        -1.000   3.741   2.741 50.000  50.000  1000.000  0.000
1:ALA_21:HN      1:ALA_21:HB*        -1.000   3.372   2.372  1.000   1.000  1000.000  0.000
1:ALA_22:HA      1:VAL_25:HG1*       -1.000   4.140   3.140  1.000   1.000  1000.000  0.000
1:ALA_22:HN      1:ALA_21:HA         -1.000   3.525   3.025 30.000  30.000  1000.000  0.000
!1:ALA_22:HN      1:ALA_22:HA         -1.000   2.852   2.352 30.000  30.000  1000.000  0.000
1:ALA_22:HN      1:ALA_22:HA         -1.000   2.92    2.42  30.000  30.000  1000.000  0.000
1:ALA_22:HN      1:ALA_22:HB*        -1.000   3.436   2.436  1.000   1.000  1000.000  0.000
!1:ALA_22:HN      1:ALA_21:HN         -1.000   2.781   2.281 30.000  30.000  1000.000  0.000
1:ALA_22:HN      1:ALA_21:HN         2.500   3.500   2.281 30.000  30.000  1000.000  0.000
1:GLN_23:HA      1:GLN_23:HG2        -1.000   3.572   3.072  1.000   1.000  1000.000  0.000
1:GLN_23:HE21    1:GLN_23:HG1        -1.000   4.945   4.445  1.000   1.000  1000.000  0.000
1:GLN_23:HE21    1:GLN_23:HG2        -1.000   6.010   5.510  1.000   1.000  1000.000  0.000
1:GLN_23:HE22    1:GLN_23:HG1        -1.000   5.547   5.047  1.000   1.000  1000.000  0.000
1:GLN_23:HG2     1:GLN_23:HB1        -1.000   3.069   2.569  1.000   1.000  1000.000  0.000
1:GLN_23:HG2     1:GLN_23:HB2        -1.000   2.967   2.467  1.000   1.000  1000.000  0.000
1:GLN_23:HN      1:ALA_21:HA         -1.000   4.101   3.601 30.000  30.000  1000.000  0.000
!1:GLN_23:HN      1:ALA_22:HA         -1.000   3.156   2.656 30.000  30.000  1000.000  0.000
1:GLN_23:HN      1:ALA_22:HA         -1.000   3.62    3.12  30.000  30.000  1000.000  0.000
!1:GLN_23:HN      1:GLN_23:HA         -1.000   2.968   2.468 30.000  30.000  1000.000  0.000
1:GLN_23:HN      1:GLN_23:HA         -1.000   3.2     2.7   30.000  30.000  1000.000  0.000
1:GLN_23:HN      1:GLN_23:HG1        -1.000   4.201   3.701  1.000   1.000  1000.000  0.000
1:GLN_23:HN      1:GLN_23:HG2        -1.000   4.323   3.823  1.000   1.000  1000.000  0.000
1:GLN_23:HN      1:GLN_23:HB1        -1.000   3.126   2.626  1.000   1.000  1000.000  0.000
1:GLN_23:HN      1:GLN_23:HB2        -1.000   3.200   2.700  1.000   1.000  1000.000  0.000
1:GLY_24:HN      1:GLY_24:HA*        -1.000   3.898   2.898 30.000  30.000  1000.000  0.000
1:GLY_24:HN      1:VAL_25:HA         -1.000   3.877   3.377 30.000  30.000  1000.000  0.000
1:GLY_24:HN      1:GLN_23:HB1        -1.000   3.417   2.917  1.000   1.000  1000.000  0.000
1:VAL_25:HA      1:VAL_25:HB         -1.000   3.252   2.752  1.000   1.000  1000.000  0.000
1:VAL_25:HA      1:THR_28:HG2*       -1.000   5.344   4.344  1.000   1.000  1000.000  0.000
1:VAL_25:HA      1:VAL_25:HG1*       -1.000   3.633   2.633  1.000   1.000  1000.000  0.000
1:VAL_25:HA      1:VAL_25:HG2*       -1.000   4.061   3.061  1.000   1.000  1000.000  0.000
1:VAL_25:HB      1:VAL_25:HG1*       -1.000   3.692   2.692  1.000   1.000  1000.000  0.000
1:VAL_25:HB      1:VAL_25:HG2*       -1.000   3.723   2.723  1.000   1.000  1000.000  0.000
1:VAL_25:HN      1:GLY_24:HA*        -1.000   4.078   3.078 30.000  30.000  1000.000  0.000
!1:VAL_25:HN      1:VAL_25:HA         -1.000   3.024   2.524 30.000  30.000  1000.000  0.000
1:VAL_25:HN      1:VAL_25:HA         -1.000   3.260   2.760 30.000  30.000  1000.000  0.000
1:VAL_25:HN      1:VAL_25:HB         -1.000   3.040   2.540  1.000   1.000  1000.000  0.000
1:VAL_25:HN      1:VAL_25:HG1*       -1.000   3.827   2.827  1.000   1.000  1000.000  0.000
1:VAL_25:HN      1:VAL_25:HG2*       -1.000   4.473   3.473  1.000   1.000  1000.000  0.000
1:LEU_26:HA      1:LEU_26:HB1        -1.000   2.852   2.352  1.000   1.000  1000.000  0.000
1:LEU_26:HA      1:LEU_26:HG         -1.000   3.321   2.821  1.000   1.000  1000.000  0.000
1:LEU_26:HA      1:LEU_26:HB2        -1.000   2.976   2.476  1.000   1.000  1000.000  0.000
1:LEU_26:HA      1:LEU_26:HD*        -1.000   3.959   2.959  1.000   1.000  1000.000  0.000
1:LEU_26:HB2     1:LEU_26:HD*        -1.000   4.193   3.193  1.000   1.000  1000.000  0.000
1:LEU_26:HG      1:LEU_26:HD*        -1.000   4.180   3.180  1.000   1.000  1000.000  0.000
!1:LEU_26:HN      1:VAL_25:HA         -1.000   3.651   3.151 30.000  30.000  1000.000  0.000
1:LEU_26:HN      1:VAL_25:HA         -1.000   3.99    3.49  30.000  30.000  1000.000  0.000
1:LEU_26:HN      1:VAL_25:HB         -1.000   3.205   2.705  1.000   1.000  1000.000  0.000
1:LEU_26:HN      1:LEU_26:HB1        -1.000   3.183   2.683  1.000   1.000  1000.000  0.000
1:LEU_26:HN      1:LEU_26:HG         -1.000   3.291   2.791  1.000   1.000  1000.000  0.000
1:LEU_26:HN      1:LEU_26:HB2        -1.000   3.360   2.860  1.000   1.000  1000.000  0.000
1:LEU_26:HN      1:VAL_25:HG1*       -1.000   4.061   3.061  1.000   1.000  1000.000  0.000
1:LEU_26:HN      1:LEU_26:HD*        -1.000   5.592   4.592  1.000   1.000  1000.000  0.000
!1:LEU_26:HN      1:VAL_25:HN         -1.000   3.076   2.576 30.000  30.000  1000.000  0.000
1:LEU_26:HN      1:VAL_25:HN         -1.000   4.110   3.610 30.000  30.000  1000.000  0.000
1:SER_27:HA      1:SER_27:HB1        -1.000   3.057   2.557  1.000   1.000  1000.000  0.000
1:SER_27:HA      1:SER_27:HB2        -1.000   3.277   2.777  1.000   1.000  1000.000  0.000
1:SER_27:HA      1:SER_30:HB2        -1.000   3.298   2.798  1.000   1.000  1000.000  0.000
1:SER_27:HN      1:SER_27:HA         -1.000   3.285   2.785 30.000  30.000  1000.000  0.000
1:SER_27:HN      1:LEU_26:HA         -1.000   3.682   3.182 30.000  30.000  1000.000  0.000
1:SER_27:HN      1:SER_27:HB1        -1.000   3.440   2.940  1.000   1.000  1000.000  0.000
1:SER_27:HN      1:SER_27:HB2        -1.000   3.514   3.014  1.000   1.000  1000.000  0.000
1:SER_27:HN      1:LEU_26:HB1        -1.000   3.940   3.440  1.000   1.000  1000.000  0.000
1:SER_27:HN      1:LEU_26:HG         -1.000   4.490   3.990  1.000   1.000  1000.000  0.000
1:SER_27:HN      1:LEU_26:HB2        -1.000   4.148   3.648  1.000   1.000  1000.000  0.000
1:SER_27:HN      1:VAL_29:HN         -1.000   4.233   3.733 30.000  30.000  1000.000  0.000
1:SER_27:HN      1:LEU_26:HN         -1.000   3.363   2.863 30.000  30.000  1000.000  0.000
1:SER_27:HN      1:VAL_25:HN         -1.000   4.995   4.495 30.000  30.000  1000.000  0.000
1:SER_27:HN      1:THR_28:HN         -1.000   3.498   2.998 30.000  30.000  1000.000  0.000
1:THR_28:HA      1:THR_28:HB         -1.000   3.523   3.023  1.000   1.000  1000.000  0.000
1:THR_28:HA      1:THR_28:HG2*       -1.000   3.912   2.912  1.000   1.000  1000.000  0.000
!1:THR_28:HB      1:SER_30:HA         -1.000   4.675   4.175  1.000   1.000  1000.000  0.000
1:THR_28:HB      1:VAL_25:HA         -1.000   3.392   2.892  1.000   1.000  1000.000  0.000
1:THR_28:HB      1:THR_28:HG2*       -1.000   3.692   2.692  1.000   1.000  1000.000  0.000
1:THR_28:HN      1:THR_28:HA         -1.000   3.528   3.028 30.000  30.000  1000.000  0.000
1:THR_28:HN      1:THR_28:HB         -1.000   3.445   2.945  1.000   1.000  1000.000  0.000
1:THR_28:HN      1:SER_27:HA         -1.000   3.736   3.236 30.000  30.000  1000.000  0.000
1:THR_28:HN      1:SER_27:HB1        -1.000   4.458   3.958  1.000   1.000  1000.000  0.000
1:THR_28:HN      1:SER_27:HB2        -1.000   4.426   3.926  1.000   1.000  1000.000  0.000
1:THR_28:HN      1:VAL_25:HA         -1.000   4.120   3.620 30.000  30.000  1000.000  0.000
1:THR_28:HN      1:THR_28:HG2*       -1.000   4.850   3.850  1.000   1.000  1000.000  0.000
1:THR_28:HN      1:VAL_29:HG1*       -1.000   6.948   5.948  1.000   1.000  1000.000  0.000
1:THR_28:HN      1:LEU_26:HN         -1.000   4.657   4.157 30.000  30.000  1000.000  0.000
1:VAL_29:HA      1:VAL_29:HB         -1.000   2.985   2.485  1.000   1.000  1000.000  0.000
1:VAL_29:HA      1:VAL_29:HG1*       -1.000   3.771   2.771  1.000   1.000  1000.000  0.000
1:VAL_29:HA      1:VAL_29:HG2*       -1.000   4.208   3.208  1.000   1.000  1000.000  0.000
1:VAL_29:HN      1:THR_28:HB         -1.000   4.381   3.881  1.000   1.000  1000.000  0.000
!1:VAL_29:HN      1:SER_30:HA         -1.000   3.661   3.161 30.000  30.000  1000.000  0.000
1:VAL_29:HN      1:THR_28:HA         -1.000   3.661   3.161 30.000  30.000  1000.000  0.000
1:VAL_29:HN      1:VAL_29:HA         -1.000   3.332   2.832 30.000  30.000  1000.000  0.000
1:VAL_29:HN      1:VAL_29:HB         -1.000   2.871   2.371  1.000   1.000  1000.000  0.000
1:VAL_29:HN      1:THR_28:HG2*       -1.000   6.657   5.657  1.000   1.000  1000.000  0.000
1:VAL_29:HN      1:VAL_29:HG1*       -1.000   3.864   2.864  1.000   1.000  1000.000  0.000
1:VAL_29:HN      1:VAL_29:HG2*       -1.000   4.781   3.781  1.000   1.000  1000.000  0.000
!1:VAL_29:HN      1:SER_30:HN         -1.000   2.802   2.302 30.000  30.000  1000.000  0.000
1:VAL_29:HN      1:SER_30:HN         -1.000   4.02    3.52  30.000  30.000  1000.000  0.000
1:VAL_29:HN      1:THR_28:HN         -1.000   3.788   3.288 30.000  30.000  1000.000  0.000
1:SER_30:HA      1:SER_30:HB1        -1.000   3.112   2.612  1.000   1.000  1000.000  0.000
1:SER_30:HA      1:SER_30:HB2        -1.000   3.122   2.622  1.000   1.000  1000.000  0.000
1:SER_30:HN      1:SER_27:HA         -1.000   4.225   3.725 30.000  30.000  1000.000  0.000
!1:SER_30:HN      1:SER_30:HA         -1.000   3.092   2.592 30.000  30.000  1000.000  0.000
1:SER_30:HN      1:SER_30:HA         -1.000   3.36    2.86  30.000  30.000  1000.000  0.000
1:SER_30:HN      1:SER_30:HB1        -1.000   3.235   2.735  1.000   1.000  1000.000  0.000
1:SER_30:HN      1:SER_30:HB2        -1.000   2.992   2.492  1.000   1.000  1000.000  0.000
1:SER_30:HN      1:VAL_29:HA         -1.000   4.034   3.534 30.000  30.000  1000.000  0.000
1:SER_30:HN      1:VAL_29:HB         -1.000   3.052   2.552  1.000   1.000  1000.000  0.000
1:SER_30:HN      1:THR_28:HN         -1.000   4.984   4.484 30.000  30.000  1000.000  0.000
1:CYS_31:HA      1:CYS_31:HB1        -1.000   3.397   2.897  1.000   1.000  1000.000  0.000
1:CYS_31:HA      1:CYS_31:HB2        -1.000   3.417   2.917  1.000   1.000  1000.000  0.000
1:CYS_31:HB1     1:CYS_31:HB2        -1.000   2.875   2.375  1.000   1.000  1000.000  0.000
1:CYS_31:HB1     1:CYS_37:HB2        -1.000   4.272   3.772  1.000   1.000  1000.000  0.000
!1:CYS_31:HN      1:CYS_31:HA         -1.000   4.540   4.040 30.000  30.000  1000.000  0.000
1:CYS_31:HN      1:SER_30:HB1        -1.000   3.598   3.098  1.000   1.000  1000.000  0.000
1:CYS_31:HN      1:SER_30:HB2        -1.000   3.102   2.602  1.000   1.000  1000.000  0.000
1:CYS_31:HN      1:CYS_31:HB1        -1.000   4.152   3.652  1.000   1.000  1000.000  0.000
1:CYS_31:HN      1:CYS_31:HB2        -1.000   3.860   3.360  1.000   1.000  1000.000  0.000
!1:CYS_31:HN      1:SER_30:HN         -1.000   3.225   2.725 30.000  30.000  1000.000  0.000
1:CYS_31:HN      1:SER_30:HN         -1.000   3.36   2.725 30.000  30.000  1000.000  0.000
1:LYS_32:HA      1:LYS_32:HB*        -1.000   3.917   2.917  1.000   1.000  1000.000  0.000
1:LYS_32:HA      1:LYS_32:HD1        -1.000   3.067   2.567  1.000   1.000  1000.000  0.000
1:LYS_32:HA      1:LYS_32:HG1        -1.000   3.405   2.905  1.000   1.000  1000.000  0.000
1:LYS_32:HB*     1:LYS_32:HG1        -1.000   3.741   2.741  1.000   1.000  1000.000  0.000
1:LYS_32:HB*     1:LYS_35:HD2        -1.000   4.054   3.054  1.000   1.000  1000.000  0.000
1:LYS_32:HB*     1:LYS_32:HG2        -1.000   4.022   3.022  1.000   1.000  1000.000  0.000
1:LYS_32:HE1     1:LYS_32:HD1        -1.000   3.964   3.464  1.000   1.000  1000.000  0.000
1:LYS_32:HE1     1:LYS_32:HD2        -1.000   4.309   3.809  1.000   1.000  1000.000  0.000
1:LYS_32:HE1     1:THR_28:HG2*       -1.000   6.096   5.096  1.000   1.000  1000.000  0.000
1:LYS_32:HE2     1:LYS_32:HD1        -1.000   3.824   3.324  1.000   1.000  1000.000  0.000
1:LYS_32:HE2     1:LYS_32:HD2        -1.000   4.813   4.313  1.000   1.000  1000.000  0.000
1:LYS_32:HE2     1:THR_28:HG2*       -1.000   5.628   4.628  1.000   1.000  1000.000  0.000
1:LYS_32:HN      1:LYS_32:HA         -1.000   3.270   2.770 30.000  30.000  1000.000  0.000
1:LYS_32:HN      1:SER_30:HA         -1.000   3.586   3.086 30.000  30.000  1000.000  0.000
1:LYS_32:HN      1:VAL_29:HA         -1.000   4.189   3.689 30.000  30.000  1000.000  0.000
1:LYS_32:HN      1:LYS_32:HB*        -1.000   4.041   3.041  1.000   1.000  1000.000  0.000
1:LYS_32:HN      1:LYS_32:HG1        -1.000   3.765   3.265  1.000   1.000  1000.000  0.000
1:LYS_32:HN      1:LYS_32:HG2        -1.000   3.930   3.430  1.000   1.000  1000.000  0.000
!1:LYS_32:HN      1:CYS_31:HN         -1.000   2.890   2.390 30.000  30.000  1000.000  0.000
1:LYS_32:HN      1:CYS_31:HN         -1.000   3.390   2.890 30.000  30.000  1000.000  0.000
!1:LYS_32:HN      1:LEU_33:HN         -1.000   3.001   2.501 30.000  30.000  1000.000  0.000
1:LYS_32:HN      1:LEU_33:HN         -1.000   3.49    2.99  30.000  30.000  1000.000  0.000
1:LEU_33:HN      1:LYS_32:HA         -1.000   4.318   3.818 30.000  30.000  1000.000  0.000
!1:LEU_33:HN      1:LEU_33:HA         -1.000   2.850   2.350 30.000  30.000  1000.000  0.000
1:LEU_33:HN      1:LEU_33:HA         -1.000   3.220   2.720 30.000  30.000  1000.000  0.000
1:LEU_33:HN      1:LYS_32:HB*        -1.000   4.455   3.455  1.000   1.000  1000.000  0.000
1:LEU_33:HN      1:LYS_32:HG2        -1.000   3.642   3.142  1.000   1.000  1000.000  0.000
1:LEU_33:HN      1:LEU_33:HD*        -1.000   5.265   4.265  1.000   1.000  1000.000  0.000
1:LEU_33:HN      1:ALA_34:HN         -1.000   3.650   3.150 30.000  30.000  1000.000  0.000
1:ALA_34:HN      1:ALA_34:HA         -1.000   3.086   2.586 30.000  30.000  1000.000  0.000
1:ALA_34:HN      1:LEU_33:HA         -1.000   3.712   3.212 30.000  30.000  1000.000  0.000
1:ALA_34:HN      1:LEU_33:HB1        -1.000   4.432   3.932  1.000   1.000  1000.000  0.000
1:ALA_34:HN      1:ALA_34:HB*        -1.000   3.809   2.809  1.000   1.000  1000.000  0.000
1:LYS_35:HA      1:LYS_35:HB1        -1.000   3.188   2.688  1.000   1.000  1000.000  0.000
1:LYS_35:HA      1:LYS_35:HB2        -1.000   2.962   2.462  1.000   1.000  1000.000  0.000
1:LYS_35:HB1     1:LYS_35:HB2        -1.000   2.470   1.970  1.000   1.000  1000.000  0.000
1:LYS_35:HB1     1:LYS_35:HG*        -1.000   3.792   2.792  1.000   1.000  1000.000  0.000
1:LYS_35:HB2     1:LYS_35:HG*        -1.000   3.598   2.598  1.000   1.000  1000.000  0.000
1:LYS_35:HD2     1:THR_28:HG2*       -1.000   5.132   4.132  1.000   1.000  1000.000  0.000
1:LYS_35:HE*     1:LYS_35:HD1        -1.000   4.804   3.804  1.000   1.000  1000.000  0.000
1:LYS_35:HE*     1:LYS_35:HD2        -1.000   5.687   4.687  1.000   1.000  1000.000  0.000
1:LYS_35:HN      1:ALA_34:HA         -1.000   3.288   2.788 30.000  30.000  1000.000  0.000
1:LYS_35:HN      1:LYS_35:HA         -1.000   2.889   2.389 30.000  30.000  1000.000  0.000
1:LYS_35:HN      1:LYS_35:HB1        -1.000   3.484   2.984  1.000   1.000  1000.000  0.000
1:LYS_35:HN      1:LYS_35:HB2        -1.000   3.435   2.935  1.000   1.000  1000.000  0.000
1:LYS_35:HN      1:ALA_34:HB*        -1.000   4.354   3.354  1.000   1.000  1000.000  0.000
1:LYS_35:HN      1:LYS_35:HG*        -1.000   4.162   3.162  1.000   1.000  1000.000  0.000
1:LYS_35:HN      1:LEU_33:HN         -1.000   4.992   4.492 30.000  30.000  1000.000  0.000
1:THR_36:HA      1:THR_36:HG2*       -1.000   3.788   2.788  1.000   1.000  1000.000  0.000
1:THR_36:HB      1:THR_36:HG2*       -1.000   3.756   2.756  1.000   1.000  1000.000  0.000
1:THR_36:HN      1:CYS_31:HA         -1.000   5.730   5.230 30.000  30.000  1000.000  0.000
1:THR_36:HN      1:THR_36:HA         -1.000   3.685   3.185 30.000  30.000  1000.000  0.000
1:THR_36:HN      1:LYS_35:HA         -1.000   3.957   3.457 30.000  30.000  1000.000  0.000
1:THR_36:HN      1:LYS_35:HB1        -1.000   4.584   4.084  1.000   1.000  1000.000  0.000
1:THR_36:HN      1:THR_36:HG2*       -1.000   4.383   3.383  1.000   1.000  1000.000  0.000
1:THR_36:HN      1:LYS_35:HN         -1.000   3.115   2.615 30.000  30.000  1000.000  0.000
1:THR_36:HN      1:CYS_37:HN         -1.000   2.775   2.275 30.000  30.000  1000.000  0.000
1:CYS_37:HA      1:CYS_37:HB1        -1.000   2.928   2.428  1.000   1.000  1000.000  0.000
1:CYS_37:HA      1:CYS_37:HB2        -1.000   2.876   2.376  1.000   1.000  1000.000  0.000
1:CYS_37:HB1     1:CYS_37:HB2        -1.000   2.737   2.237  1.000   1.000  1000.000  0.000
1:CYS_37:HN      1:CYS_37:HA         -1.000   3.220   2.720 30.000  30.000  1000.000  0.000
1:CYS_37:HN      1:LYS_32:HA         -1.000   3.830   3.330 30.000  30.000  1000.000  0.000
1:CYS_37:HN      1:LYS_35:HA         -1.000   3.410   2.910 30.000  30.000  1000.000  0.000
1:CYS_37:HN      1:CYS_37:HB1        -1.000   4.376   3.876  1.000   1.000  1000.000  0.000
1:CYS_37:HN      1:CYS_31:HB1        -1.000   4.674   4.174  1.000   1.000  1000.000  0.000
1:CYS_37:HN      1:CYS_37:HB2        -1.000   3.756   3.256  1.000   1.000  1000.000  0.000
1:CYS_37:HN      1:LYS_35:HB2        -1.000   4.537   4.037  1.000   1.000  1000.000  0.000
1:CYS_37:HN      1:THR_36:HG2*       -1.000   5.381   4.381  1.000   1.000  1000.000  0.000
!
1:ASP_4:HN       1:THR_5:HN          -1.000   3.36   2.86  30.000  30.000  1000.000  0.000
1:LYS_7:HN       1:LEU_6:HN          -1.000   3.990  3.490 30.000  30.000  1000.000  0.000
1:LYS_7:HN       1:LEU_6:HA           2.5     4.1    3.650 30.000  30.000  1000.000  0.000
1:GLN_8:HN       1:LYS_7:HA           2.5     4.1    3.650 30.000  30.000  1000.000  0.000
1:ALA_10:HN      1:PHE_9:HA           2.5     4.1    3.650 30.000  30.000  1000.000  0.000
1:LYS_11:HN      1:ALA_10:HA         -1.000   3.63   3.13  30.000  30.000  1000.000  0.000
1:GLY_12:HN      1:LYS_11:HA         -1.000   3.68   3.18  30.000  30.000  1000.000  0.000
1:VAL_13:HN      1:GLY_12:HA1         2.5     4.1    3.65  30.000  30.000  1000.000  0.000
1:VAL_13:HN      1:GLY_12:HA2         2.5     4.1    3.65  30.000  30.000  1000.000  0.000
1:LEU_17:HN      1:LEU_17:HA         -1.000   3.4    2.9   30.000  30.000  1000.000  0.000
1:VAL_18:HN      1:LEU_17:HA         -1.000   3.92   3.42  30.000  30.000  1000.000  0.000
1:LYS_19:HN      1:LYS_19:HA         -1.000   3.3    2.800 30.000  30.000  1000.000  0.000
1:GLY_20:HN      1:LYS_19:HA         -1.000   3.61   3.11  30.000  30.000  1000.000  0.000
1:GLY_20:HN      1:LYS_19:HN         -1.000   4.380  3.880 30.000  30.000  1000.000  0.000
1:GLN_23:HN      1:ALA_22:HN          2.500   3.500  2.656 30.000  30.000  1000.000  0.000
1:GLY_24:HN      1:GLN_23:HN          2.500   3.50   2.917 30.000  30.000  1000.000  0.000
1:GLY_24:HN      1:GLN_23:HA          3.000   4.1    3.65  30.000  30.000  1000.000  0.000
1:VAL_25:HN      1:GLY_24:HN         -1.000   4.160  3.760 30.000  30.000  1000.000  0.000
1:LEU_26:HN      1:LEU_26:HA         -1.000   3.3    2.80  30.000  30.000  1000.000  0.000
1:LYS_32:HN      1:CYS_31:HA          3.000   4.10   3.65  30.000  30.000  1000.000  0.000
1:CYS_37:HN      1:THR_36:HA         -1.000   5.23   4.730 30.000  30.000  1000.000  0.000
!
#mixing_times
3.000000E+02
!
#NMR_dihedral
!
!{backbone phi angle(C-N-CA-C) - from 3JHNa(HA-CA-N-HN)}
!(If 3JHNa < 6.0 Hz, -60 +-30; if 3JHNa > 8.0 Hz, -120 +-30 degree)
! < 6.0Hz
1:GLYN_1:C   1:ILE_2:N     1:ILE_2:CA     1:ILE_2:C     -90.0    -30.000    200.00  200.00  200.00
1:ILE_2:C    1:LEU_3:N     1:LEU_3:CA     1:LEU_3:C     -90.0    -30.000    200.00  200.00  200.00
1:LEU_3:C    1:ASP_4:N     1:ASP_4:CA     1:ASP_4:C     -90.0    -30.000    200.00  200.00  200.00
1:ASP_4:C    1:THR_5:N     1:THR_5:CA     1:THR_5:C     -90.0    -30.000    200.00  200.00  200.00
1:THR_5:C    1:LEU_6:N     1:LEU_6:CA     1:LEU_6:C     -90.0    -30.000    200.00  200.00  200.00
1:LEU_6:C    1:LYS_7:N     1:LYS_7:CA     1:LYS_7:C     -90.0    -30.000    200.00  200.00  200.00
1:LYS_7:C    1:GLN_8:N     1:GLN_8:CA     1:GLN_8:C     -90.0    -30.000    200.00  200.00  200.00
1:GLN_8:C    1:PHE_9:N     1:PHE_9:CA     1:PHE_9:C     -90.0    -30.000    200.00  200.00  200.00
1:PHE_9:C    1:ALA_10:N    1:ALA_10:CA    1:ALA_10:C    -90.0    -30.000    200.00  200.00  200.00
1:ALA_10:C   1:LYS_11:N    1:LYS_11:CA    1:LYS_11:C    -90.0    -30.000    200.00  200.00  200.00
1:GLY_12:C   1:VAL_13:N    1:VAL_13:CA    1:VAL_13:C    -90.0    -30.000    200.00  200.00  200.00
1:GLY_14:C   1:LYS_15:N    1:LYS_15:CA    1:LYS_15:C    -90.0    -30.000    200.00  200.00  200.00
1:LYS_15:C   1:ASP_16:N    1:ASP_16:CA    1:ASP_16:C    -90.0    -30.000    200.00  200.00  200.00
1:ASP_16:C   1:LEU_17:N    1:LEU_17:CA    1:LEU_17:C    -90.0    -30.000    200.00  200.00  200.00
1:LEU_17:C   1:VAL_18:N    1:VAL_18:CA    1:VAL_18:C    -90.0    -30.000    200.00  200.00  200.00
1:VAL_18:C   1:LYS_19:N    1:LYS_19:CA    1:LYS_19:C    -90.0    -30.000    200.00  200.00  200.00
1:GLY_20:C   1:ALA_21:N    1:ALA_21:CA    1:ALA_21:C    -90.0    -30.000    200.00  200.00  200.00
1:ALA_21:C   1:ALA_22:N    1:ALA_22:CA    1:ALA_22:C    -90.0    -30.000    200.00  200.00  200.00
1:ALA_22:C   1:GLN_23:N    1:GLN_23:CA    1:GLN_23:C    -90.0    -30.000    200.00  200.00  200.00
1:GLY_24:C   1:VAL_25:N    1:VAL_25:CA    1:VAL_25:C    -90.0    -30.000    200.00  200.00  200.00
1:VAL_25:C   1:LEU_26:N    1:LEU_26:CA    1:LEU_26:C    -90.0    -30.000    200.00  200.00  200.00
1:LEU_26:C   1:SER_27:N    1:SER_27:CA    1:SER_27:C    -90.0    -30.000    200.00  200.00  200.00
1:THR_28:C   1:VAL_29:N    1:VAL_29:CA    1:VAL_29:C    -90.0    -30.000    200.00  200.00  200.00
1:VAL_29:C   1:SER_30:N    1:SER_30:CA    1:SER_30:C    -90.0    -30.000    200.00  200.00  200.00
1:SER_30:C   1:CYS_31:N    1:CYS_31:CA    1:CYS_31:C    -90.0    -30.000    200.00  200.00  200.00
1:CYS_31:C   1:LYS_32:N    1:LYS_32:CA    1:LYS_32:C    -90.0    -30.000    200.00  200.00  200.00
1:LYS_32:C   1:LEU_33:N    1:LEU_33:CA    1:LEU_33:C    -90.0    -30.000    200.00  200.00  200.00
!
!{backbone omega angle(CA-C-N-CA), default range 170 ~ -170 degree}
!1:GLYN_1:CA    1:GLYN_1:C    1:ILE_2:N     1:ILE_2:CA      170.000  -170.0     100.00  100.00  100.00
!1:ILE_2:CA     1:ILE_2:C     1:LEU_3:N     1:LEU_3:CA      170.0    -170.0     100.00  100.00  100.00
!1:LEU_3:CA     1:LEU_3:C     1:ASP_4:N     1:ASP_4:CA      170.0    -170.0     100.00  100.00  100.00
!1:ASP_4:CA     1:ASP_4:C     1:THR_5:N     1:THR_5:CA      170.0    -170.0     100.00  100.00  100.00
!1:THR_5:CA     1:THR_5:C     1:LEU_6:N     1:LEU_6:CA      170.0    -170.0     100.00  100.00  100.00
!1:LEU_6:CA     1:LEU_6:C     1:LYS_7:N     1:LYS_7:CA      170.0    -170.0     100.00  100.00  100.00
!1:LYS_7:CA     1:LYS_7:C     1:GLN_8:N     1:GLN_8:CA      170.0    -170.0     100.00  100.00  100.00
!1:GLN_8:CA     1:GLN_8:C     1:PHE_9:N     1:PHE_9:CA      170.0    -170.0     100.00  100.00  100.00
!1:PHE_9:CA     1:PHE_9:C     1:ALA_10:N    1:ALA_10:CA     170.0    -170.0     100.00  100.00  100.00
!1:ALA_10:CA    1:ALA_10:C    1:LYS_11:N    1:LYS_11:CA     170.0    -170.0     100.00  100.00  100.00
!1:LYS_11:CA    1:LYS_11:C    1:GLY_12:N    1:GLY_12:CA     170.0    -170.0     100.00  100.00  100.00
!1:GLY_12:CA    1:GLY_12:C    1:VAL_13:N    1:VAL_13:CA     170.0    -170.0     100.00  100.00  100.00
!1:VAL_13:CA    1:VAL_13:C    1:GLY_14:N    1:GLY_14:CA     170.0    -170.0     100.00  100.00  100.00
!1:GLY_14:CA    1:GLY_14:C    1:LYS_15:N    1:LYS_15:CA     170.0    -170.0     100.00  100.00  100.00
!1:LYS_15:CA    1:LYS_15:C    1:ASP_16:N    1:ASP_16:CA     170.0    -170.0     100.00  100.00  100.00
!1:ASP_16:CA    1:ASP_16:C    1:LEU_17:N    1:LEU_17:CA     170.0    -170.0     100.00  100.00  100.00
!1:LEU_17:CA    1:LEU_17:C    1:VAL_18:N    1:VAL_18:CA     170.0    -170.0     100.00  100.00  100.00
!1:VAL_18:CA    1:VAL_18:C    1:LYS_19:N    1:LYS_19:CA     170.0    -170.0     100.00  100.00  100.00
!1:LYS_19:CA    1:LYS_19:C    1:GLY_20:N    1:GLY_20:CA     170.0    -170.0     100.00  100.00  300.00
1:GLY_20:CA    1:GLY_20:C    1:ALA_21:N    1:ALA_21:CA     170.0    -170.0     200.00  200.00  200.00
!1:ALA_21:CA    1:ALA_21:C    1:ALA_22:N    1:ALA_22:CA     170.0    -170.0     100.00  100.00  300.00
!1:ALA_22:CA    1:ALA_22:C    1:GLN_23:N    1:GLN_23:CA     170.0    -170.0     100.00  100.00  300.00
!1:GLN_23:CA    1:GLN_23:C    1:GLY_24:N    1:GLY_24:CA     170.0    -170.0     100.00  100.00  300.00
!1:GLY_24:CA    1:GLY_24:C    1:VAL_25:N    1:VAL_25:CA     170.0    -170.0     100.00  100.00  300.00
!1:VAL_25:CA    1:VAL_25:C    1:LEU_26:N    1:LEU_26:CA     170.0    -170.0     100.00  100.00  300.00
!1:LEU_26:CA    1:LEU_26:C    1:SER_27:N    1:SER_27:CA     170.0    -170.0     100.00  100.00  300.00
!1:SER_27:CA    1:SER_27:C    1:THR_28:N    1:THR_28:CA     170.0    -170.0     100.00  100.00  300.00
!1:THR_28:CA    1:THR_28:C    1:VAL_29:N    1:VAL_29:CA     170.0    -170.0     100.00  100.00  300.00
!1:VAL_29:CA    1:VAL_29:C    1:SER_30:N    1:SER_30:CA     170.0    -170.0     100.00  100.00  300.00
!1:SER_30:CA    1:SER_30:C    1:CYS_31:N    1:CYS_31:CA     170.0    -170.0     100.00  100.00  300.00
!1:CYS_31:CA    1:CYS_31:C    1:LYS_32:N    1:LYS_32:CA     170.0    -170.0     100.00  100.00  300.00
!1:LYS_32:CA    1:LYS_32:C    1:LEU_33:N    1:LEU_33:CA     170.0    -170.0     100.00  100.00  300.00
!1:LEU_33:CA    1:LEU_33:C    1:ALA_34:N    1:ALA_34:CA     170.0    -170.0     100.00  100.00  300.00
!1:ALA_34:CA    1:ALA_34:C    1:LYS_35:N    1:LYS_35:CA     170.0    -170.0     100.00  100.00  300.00
!1:LYS_35:CA    1:LYS_35:C    1:THR_36:N    1:THR_36:CA     170.0    -170.0     100.00  100.00  300.00
!1:THR_36:CA    1:THR_36:C    1:CYS_37:N    1:CYS_37:CA     170.0    -170.0     100.00  100.00  300.00

  Entry H atom name         Submitted Coord H atom name
  Start of MODEL    1
    1   1H    GLY   1          1H        GLY   1  65.064  53.832  14.587
    2   2H    GLY   1          2H        GLY   1  63.756  54.688  15.112
    3   3H    GLY   1          3H        GLY   1  65.200  54.822  15.900
    4   1HA   GLY   1          2HA       GLY   1  64.817  56.754  14.575
    5   2HA   GLY   1          1HA       GLY   1  66.222  55.829  14.009
    6    H    ILE   2           H        ILE   2  65.542  57.330  12.092
    7    HA   ILE   2           HA       ILE   2  63.331  56.781  10.482
    8    HB   ILE   2           HB       ILE   2  64.834  58.708  10.407
    9   1HG1  ILE   2          1HG1      ILE   2  63.304  57.967   8.478
   10   2HG1  ILE   2          2HG1      ILE   2  64.501  59.247   8.255
   11   1HG2  ILE   2          1HG2      ILE   2  66.949  58.655   9.179
   12   2HG2  ILE   2          2HG2      ILE   2  67.011  57.604  10.604
   13   3HG2  ILE   2          3HG2      ILE   2  66.825  56.895   8.988
   14   1HD1  ILE   2          1HD1      ILE   2  64.925  56.372   7.338
   15   2HD1  ILE   2          2HD1      ILE   2  64.396  57.720   6.319
   16   3HD1  ILE   2          3HD1      ILE   2  66.003  57.757   7.057
   17    H    LEU   3           H        LEU   3  66.463  55.114  10.751
   18    HA   LEU   3           HA       LEU   3  66.099  53.492   8.402
   19   1HB   LEU   3          1HB       LEU   3  67.867  53.082  10.847
   20   2HB   LEU   3          2HB       LEU   3  68.029  52.243   9.298
   21    HG   LEU   3           HG       LEU   3  68.394  55.241   9.761
   22   1HD1  LEU   3          1HD2      LEU   3  70.761  54.763   9.296
   23   2HD1  LEU   3          2HD2      LEU   3  70.392  53.031   9.137
   24   3HD1  LEU   3          3HD2      LEU   3  70.193  53.844  10.706
   25   1HD2  LEU   3          1HD1      LEU   3  67.551  54.844   7.485
   26   2HD2  LEU   3          2HD1      LEU   3  69.277  55.228   7.424
   27   3HD2  LEU   3          3HD1      LEU   3  68.742  53.543   7.248
   28    H    ASP   4           H        ASP   4  64.682  53.335  11.540
   29    HA   ASP   4           HA       ASP   4  64.127  50.434  11.343
   30   1HB   ASP   4          2HB       ASP   4  64.822  51.451  13.519
   31   2HB   ASP   4          1HB       ASP   4  63.383  52.479  13.474
   32    HD2  ASP   4           HD2      ASP   4  61.371  51.488  13.575
   33    H    THR   5           H        THR   5  62.920  53.679  10.799
   34    HA   THR   5           HA       THR   5  60.185  53.089  11.080
   35    HB   THR   5           HB       THR   5  61.503  55.355   9.532
   36    HG1  THR   5           HG1      THR   5  61.144  56.446  11.506
   37   1HG2  THR   5          1HG2      THR   5  59.121  55.120   8.939
   38   2HG2  THR   5          2HG2      THR   5  58.689  55.061  10.665
   39   3HG2  THR   5          3HG2      THR   5  59.372  56.545   9.965
   40    H    LEU   6           H        LEU   6  62.162  53.634   8.103
   41    HA   LEU   6           HA       LEU   6  60.175  52.881   6.229
   42   1HB   LEU   6          2HB       LEU   6  63.207  52.686   6.087
   43   2HB   LEU   6          1HB       LEU   6  62.103  52.627   4.706
   44    HG   LEU   6           HG       LEU   6  62.475  55.010   6.579
   45   1HD1  LEU   6          1HD1      LEU   6  63.551  56.047   4.618
   46   2HD1  LEU   6          2HD1      LEU   6  63.350  54.538   3.701
   47   3HD1  LEU   6          3HD1      LEU   6  64.417  54.581   5.123
   48   1HD2  LEU   6          1HD2      LEU   6  60.189  54.987   5.680
   49   2HD2  LEU   6          2HD2      LEU   6  60.812  54.674   4.042
   50   3HD2  LEU   6          3HD2      LEU   6  61.143  56.224   4.847
   51    H    LYS   7           H        LYS   7  62.547  50.993   8.094
   52    HA   LYS   7           HA       LYS   7  62.253  48.514   6.718
   53   1HB   LYS   7          1HB       LYS   7  63.144  49.306   9.499
   54   2HB   LYS   7          2HB       LYS   7  62.978  47.613   9.025
   55   1HG   LYS   7          2HG       LYS   7  65.252  48.285   8.796
   56   2HG   LYS   7          1HG       LYS   7  64.592  47.885   7.210
   57   1HD   LYS   7          2HD       LYS   7  64.565  50.772   8.106
   58   2HD   LYS   7          1HD       LYS   7  66.119  50.046   7.688
   59   1HE   LYS   7          2HE       LYS   7  63.742  50.047   5.788
   60   2HE   LYS   7          1HE       LYS   7  65.064  51.224   5.777
   61   1HZ   LYS   7          1HZ       LYS   7  65.437  49.486   4.227
   62   2HZ   LYS   7          2HZ       LYS   7  65.356  48.334   5.402
   63   3HZ   LYS   7          3HZ       LYS   7  66.584  49.435   5.410
   64    H    GLN   8           H        GLN   8  60.488  49.970   9.490
   65    HA   GLN   8           HA       GLN   8  58.947  47.762  10.221
   66   1HB   GLN   8          2HB       GLN   8  59.215  49.915  11.434
   67   2HB   GLN   8          1HB       GLN   8  58.141  50.705  10.275
   68   1HG   GLN   8          2HG       GLN   8  57.377  48.306  11.985
   69   2HG   GLN   8          1HG       GLN   8  57.088  49.992  12.445
   70   1HE2  GLN   8          2HE2      GLN   8  55.971  51.342  10.585
   71   2HE2  GLN   8          1HE2      GLN   8  54.567  50.569   9.881
   72    H    PHE   9           H        PHE   9  58.005  50.463   8.026
   73    HA   PHE   9           HA       PHE   9  55.575  49.239   7.166
   74   1HB   PHE   9          2HB       PHE   9  57.301  51.387   5.887
   75   2HB   PHE   9          1HB       PHE   9  55.671  50.954   5.363
   76    HD1  PHE   9           HD1      PHE   9  53.763  51.096   7.113
   77    HD2  PHE   9           HD2      PHE   9  57.569  53.058   7.549
   78    HE1  PHE   9           HE1      PHE   9  52.782  52.629   8.797
   79    HE2  PHE   9           HE2      PHE   9  56.589  54.575   9.249
   80    HZ   PHE   9           HZ       PHE   9  54.198  54.361   9.876
   81    H    ALA  10           H        ALA  10  58.909  49.168   5.841
   82    HA   ALA  10           HA       ALA  10  58.275  47.809   3.424
   83   1HB   ALA  10          1HB       ALA  10  60.801  47.670   5.118
   84   2HB   ALA  10          2HB       ALA  10  60.648  47.171   3.421
   85   3HB   ALA  10          3HB       ALA  10  60.454  48.881   3.862
   86    H    LYS  11           H        LYS  11  59.065  46.632   6.724
   87    HA   LYS  11           HA       LYS  11  58.445  43.846   6.006
   88   1HB   LYS  11          2HB       LYS  11  59.070  45.198   8.661
   89   2HB   LYS  11          1HB       LYS  11  58.808  43.455   8.433
   90   1HG   LYS  11          2HG       LYS  11  60.697  43.353   6.856
   91   2HG   LYS  11          1HG       LYS  11  61.001  45.088   7.083
   92   1HD   LYS  11          1HD       LYS  11  61.352  44.700   9.513
   93   2HD   LYS  11          2HD       LYS  11  61.110  42.958   9.265
   94   1HE   LYS  11          2HE       LYS  11  63.290  44.649   7.962
   95   2HE   LYS  11          1HE       LYS  11  63.513  43.582   9.362
   96   1HZ   LYS  11          1HZ       LYS  11  62.675  42.731   6.684
   97   2HZ   LYS  11          2HZ       LYS  11  64.166  42.516   7.353
   98   3HZ   LYS  11          3HZ       LYS  11  62.856  41.744   7.993
   99    H    GLY  12           H        GLY  12  56.409  45.461   5.233
  100   1HA   GLY  12          1HA       GLY  12  54.184  44.288   6.573
  101   2HA   GLY  12          2HA       GLY  12  54.270  46.046   6.913
  102    H    VAL  13           H        VAL  13  55.464  46.707   4.323
  103    HA   VAL  13           HA       VAL  13  53.450  45.752   2.365
  104    HB   VAL  13           HB       VAL  13  55.777  47.664   1.927
  105   1HG1  VAL  13          1HG1      VAL  13  54.824  46.664  -0.157
  106   2HG1  VAL  13          2HG1      VAL  13  53.202  47.175   0.351
  107   3HG1  VAL  13          3HG1      VAL  13  54.436  48.387  -0.051
  108   1HG2  VAL  13          1HG2      VAL  13  54.096  49.508   2.026
  109   2HG2  VAL  13          2HG2      VAL  13  54.288  48.703   3.589
  110   3HG2  VAL  13          3HG2      VAL  13  52.874  48.338   2.574
  111    H    GLY  14           H        GLY  14  54.777  43.927   3.646
  112   1HA   GLY  14          1HA       GLY  14  56.242  42.501   1.550
  113   2HA   GLY  14          2HA       GLY  14  57.109  42.757   3.084
  114    H    LYS  15           H        LYS  15  54.636  42.819   4.682
  115    HA   LYS  15           HA       LYS  15  54.117  39.993   5.066
  116   1HB   LYS  15          2HB       LYS  15  54.274  41.726   6.872
  117   2HB   LYS  15          1HB       LYS  15  52.766  42.437   6.259
  118   1HG   LYS  15          2HG       LYS  15  52.385  40.918   8.179
  119   2HG   LYS  15          1HG       LYS  15  51.576  40.305   6.721
  120   1HD   LYS  15          1HD       LYS  15  53.320  38.675   6.345
  121   2HD   LYS  15          2HD       LYS  15  54.373  39.450   7.548
  122   1HE   LYS  15          1HE       LYS  15  52.767  38.821   9.338
  123   2HE   LYS  15          2HE       LYS  15  51.702  38.080   8.125
  124   1HZ   LYS  15          1HZ       LYS  15  54.443  37.235   8.744
  125   2HZ   LYS  15          2HZ       LYS  15  53.063  36.467   9.218
  126   3HZ   LYS  15          3HZ       LYS  15  53.455  36.546   7.618
  127    H    ASP  16           H        ASP  16  52.541  42.899   3.742
  128    HA   ASP  16           HA       ASP  16  50.014  41.770   3.064
  129   1HB   ASP  16          1HB       ASP  16  50.556  44.197   3.229
  130   2HB   ASP  16          2HB       ASP  16  51.572  44.057   1.788
  131    HD2  ASP  16           HD2      ASP  16  48.895  44.054  -0.443
  132    H    LEU  17           H        LEU  17  53.224  41.437   1.679
  133    HA   LEU  17           HA       LEU  17  52.274  40.596  -0.981
  134   1HB   LEU  17          1HB       LEU  17  54.967  40.970   0.373
  135   2HB   LEU  17          2HB       LEU  17  54.794  40.287  -1.230
  136    HG   LEU  17           HG       LEU  17  55.405  42.726  -1.121
  137   1HD1  LEU  17          1HD1      LEU  17  54.565  41.625  -3.166
  138   2HD1  LEU  17          2HD1      LEU  17  54.019  43.311  -3.068
  139   3HD1  LEU  17          3HD1      LEU  17  52.893  41.993  -2.685
  140   1HD2  LEU  17          1HD2      LEU  17  52.461  43.194  -0.544
  141   2HD2  LEU  17          2HD2      LEU  17  53.719  44.407  -0.826
  142   3HD2  LEU  17          3HD2      LEU  17  53.772  43.416   0.643
  143    H    VAL  18           H        VAL  18  53.887  39.475   2.025
  144    HA   VAL  18           HA       VAL  18  54.037  36.717   1.236
  145    HB   VAL  18           HB       VAL  18  54.108  38.210   3.869
  146   1HG1  VAL  18          1HG1      VAL  18  53.055  36.090   4.407
  147   2HG1  VAL  18          2HG1      VAL  18  54.272  35.209   3.446
  148   3HG1  VAL  18          3HG1      VAL  18  54.746  36.063   4.936
  149   1HG2  VAL  18          1HG2      VAL  18  56.443  37.443   3.870
  150   2HG2  VAL  18          2HG2      VAL  18  56.161  36.508   2.385
  151   3HG2  VAL  18          3HG2      VAL  18  56.102  38.281   2.342
  152    H    LYS  19           H        LYS  19  51.573  38.890   2.524
  153    HA   LYS  19           HA       LYS  19  49.637  36.833   3.218
  154   1HB   LYS  19          2HB       LYS  19  49.662  39.087   4.210
  155   2HB   LYS  19          1HB       LYS  19  49.246  39.783   2.629
  156   1HG   LYS  19          2HG       LYS  19  47.131  38.540   2.598
  157   2HG   LYS  19          1HG       LYS  19  47.577  37.690   4.097
  158   1HD   LYS  19          1HD       LYS  19  47.624  39.825   5.315
  159   2HD   LYS  19          2HD       LYS  19  47.215  40.699   3.820
  160   1HE   LYS  19          1HE       LYS  19  45.074  39.454   3.681
  161   2HE   LYS  19          2HE       LYS  19  45.484  38.580   5.172
  162   1HZ   LYS  19          1HZ       LYS  19  45.501  40.671   6.316
  163   2HZ   LYS  19          2HZ       LYS  19  44.041  40.421   5.590
  164   3HZ   LYS  19          3HZ       LYS  19  45.120  41.482   4.932
  165    H    GLY  20           H        GLY  20  50.499  38.778   0.401
  166   1HA   GLY  20          1HA       GLY  20  48.225  38.097  -1.249
  167   2HA   GLY  20          2HA       GLY  20  49.743  38.867  -1.756
  168    H    ALA  21           H        ALA  21  51.612  36.941  -0.863
  169    HA   ALA  21           HA       ALA  21  51.435  34.836  -2.808
  170   1HB   ALA  21          1HB       ALA  21  53.158  35.102  -0.311
  171   2HB   ALA  21          2HB       ALA  21  53.415  33.954  -1.643
  172   3HB   ALA  21          3HB       ALA  21  53.579  35.701  -1.932
  173    H    ALA  22           H        ALA  22  50.582  35.206   0.612
  174    HA   ALA  22           HA       ALA  22  49.874  32.364   0.839
  175   1HB   ALA  22          1HB       ALA  22  49.746  34.579   2.902
  176   2HB   ALA  22          2HB       ALA  22  51.101  33.451   2.664
  177   3HB   ALA  22          3HB       ALA  22  49.524  32.841   3.200
  178    H    GLN  23           H        GLN  23  48.311  33.905  -1.065
  179    HA   GLN  23           HA       GLN  23  45.806  34.608   0.267
  180   1HB   GLN  23          1HB       GLN  23  46.742  36.020  -1.485
  181   2HB   GLN  23          2HB       GLN  23  46.723  34.673  -2.632
  182   1HG   GLN  23          1HG       GLN  23  44.839  36.171  -3.010
  183   2HG   GLN  23          2HG       GLN  23  44.259  34.577  -2.509
  184   1HE2  GLN  23          1HE2      GLN  23  45.189  37.780  -1.110
  185   2HE2  GLN  23          2HE2      GLN  23  43.930  37.806   0.106
  186    H    GLY  24           H        GLY  24  46.833  32.361  -2.358
  187   1HA   GLY  24          2HA       GLY  24  44.181  31.193  -2.528
  188   2HA   GLY  24          1HA       GLY  24  45.606  30.785  -3.495
  189    H    VAL  25           H        VAL  25  46.847  28.373  -1.060
  190    HA   VAL  25           HA       VAL  25  47.863  30.680  -2.508
  191    HB   VAL  25           HB       VAL  25  49.138  28.061  -1.634
  192   1HG1  VAL  25          1HG1      VAL  25  51.234  29.369  -1.848
  193   2HG1  VAL  25          2HG1      VAL  25  50.402  29.197  -3.407
  194   3HG1  VAL  25          3HG1      VAL  25  50.305  30.734  -2.511
  195   1HG2  VAL  25          1HG2      VAL  25  48.945  30.793  -0.316
  196   2HG2  VAL  25          2HG2      VAL  25  48.298  29.265   0.317
  197   3HG2  VAL  25          3HG2      VAL  25  50.051  29.505   0.216
  198    H    LEU  26           H        LEU  26  47.552  27.139  -3.094
  199    HA   LEU  26           HA       LEU  26  48.657  27.091  -5.656
  200   1HB   LEU  26          2HB       LEU  26  46.474  25.332  -4.482
  201   2HB   LEU  26          1HB       LEU  26  47.499  24.928  -5.867
  202    HG   LEU  26           HG       LEU  26  48.475  25.371  -3.007
  203   1HD1  LEU  26          1HD2      LEU  26  47.170  23.300  -3.313
  204   2HD1  LEU  26          2HD2      LEU  26  48.891  22.948  -3.048
  205   3HD1  LEU  26          3HD2      LEU  26  48.206  22.846  -4.686
  206   1HD2  LEU  26          1HD1      LEU  26  50.229  26.008  -4.604
  207   2HD2  LEU  26          2HD1      LEU  26  49.954  24.516  -5.536
  208   3HD2  LEU  26          3HD1      LEU  26  50.618  24.436  -3.889
  209    H    SER  27           H        SER  27  45.341  27.902  -4.656
  210    HA   SER  27           HA       SER  27  44.179  27.757  -7.270
  211   1HB   SER  27          2HB       SER  27  42.350  29.057  -6.229
  212   2HB   SER  27          1HB       SER  27  42.838  27.665  -5.238
  213    HG   SER  27           HG       SER  27  42.608  29.583  -4.013
  214    H    THR  28           H        THR  28  45.763  30.366  -5.403
  215    HA   THR  28           HA       THR  28  45.217  32.400  -7.397
  216    HB   THR  28           HB       THR  28  47.074  32.359  -4.989
  217    HG1  THR  28           HG1      THR  28  45.340  33.546  -4.093
  218   1HG2  THR  28          1HG2      THR  28  46.071  34.663  -6.722
  219   2HG2  THR  28          2HG2      THR  28  47.754  34.099  -6.602
  220   3HG2  THR  28          3HG2      THR  28  46.965  34.836  -5.196
  221    H    VAL  29           H        VAL  29  48.154  30.611  -6.292
  222    HA   VAL  29           HA       VAL  29  49.926  31.754  -8.178
  223    HB   VAL  29           HB       VAL  29  49.986  29.148  -6.613
  224   1HG1  VAL  29          1HG1      VAL  29  51.488  28.945  -8.542
  225   2HG1  VAL  29          2HG1      VAL  29  52.184  30.547  -8.192
  226   3HG1  VAL  29          3HG1      VAL  29  52.432  29.195  -7.061
  227   1HG2  VAL  29          1HG2      VAL  29  51.331  31.859  -6.197
  228   2HG2  VAL  29          2HG2      VAL  29  49.976  31.225  -5.240
  229   3HG2  VAL  29          3HG2      VAL  29  51.557  30.423  -5.178
  230    H    SER  30           H        SER  30  48.106  28.641  -8.223
  231    HA   SER  30           HA       SER  30  48.978  27.909 -10.856
  232   1HB   SER  30          1HB       SER  30  48.073  26.299  -9.189
  233   2HB   SER  30          2HB       SER  30  46.483  27.085  -9.300
  234    HG   SER  30           HG       SER  30  46.666  25.256 -10.669
  235    H    CYS  31           H        CYS  31  46.063  29.510  -9.568
  236    HA   CYS  31           HA       CYS  31  44.737  30.000 -12.033
  237   1HB   CYS  31          2HB       CYS  31  43.693  30.186  -9.821
  238   2HB   CYS  31          1HB       CYS  31  44.768  31.529  -9.414
  239    H    LYS  32           H        LYS  32  47.730  31.291 -10.825
  240    HA   LYS  32           HA       LYS  32  47.372  33.963 -11.840
  241   1HB   LYS  32          2HB       LYS  32  48.733  33.176  -9.803
  242   2HB   LYS  32          1HB       LYS  32  49.997  32.781 -10.996
  243   1HG   LYS  32          2HG       LYS  32  49.377  35.162 -11.956
  244   2HG   LYS  32          1HG       LYS  32  48.669  35.427 -10.352
  245   1HD   LYS  32          1HD       LYS  32  51.513  34.625 -11.012
  246   2HD   LYS  32          2HD       LYS  32  51.018  36.246 -10.476
  247   1HE   LYS  32          1HE       LYS  32  50.904  33.673  -8.837
  248   2HE   LYS  32          2HE       LYS  32  52.017  35.029  -8.603
  249   1HZ   LYS  32          1HZ       LYS  32  49.102  35.145  -8.302
  250   2HZ   LYS  32          2HZ       LYS  32  50.141  36.410  -8.098
  251   3HZ   LYS  32          3HZ       LYS  32  50.206  35.115  -7.078
  252    H    LEU  33           H        LEU  33  46.762  32.592 -13.944
  253    HA   LEU  33           HA       LEU  33  48.937  32.067 -15.804
  254   1HB   LEU  33          2HB       LEU  33  45.962  32.629 -16.120
  255   2HB   LEU  33          1HB       LEU  33  47.059  32.499 -17.502
  256    HG   LEU  33           HG       LEU  33  47.725  30.223 -16.799
  257   1HD1  LEU  33          1HD2      LEU  33  47.250  30.257 -14.400
  258   2HD1  LEU  33          2HD2      LEU  33  45.525  30.579 -14.714
  259   3HD1  LEU  33          3HD2      LEU  33  46.248  29.022 -15.171
  260   1HD2  LEU  33          1HD1      LEU  33  45.613  29.155 -17.494
  261   2HD2  LEU  33          2HD1      LEU  33  45.940  30.610 -18.459
  262   3HD2  LEU  33          3HD1      LEU  33  44.731  30.662 -17.155
  263    H    ALA  34           H        ALA  34  46.588  34.752 -15.425
  264    HA   ALA  34           HA       ALA  34  48.756  36.705 -15.921
  265   1HB   ALA  34          1HB       ALA  34  47.272  38.039 -17.368
  266   2HB   ALA  34          2HB       ALA  34  47.573  36.440 -18.080
  267   3HB   ALA  34          3HB       ALA  34  46.024  36.773 -17.273
  268    H    LYS  35           H        LYS  35  47.844  35.793 -13.488
  269    HA   LYS  35           HA       LYS  35  46.800  36.237 -11.572
  270   1HB   LYS  35          2HB       LYS  35  48.469  38.091 -11.844
  271   2HB   LYS  35          1HB       LYS  35  47.152  39.133 -12.409
  272   1HG   LYS  35          2HG       LYS  35  47.517  39.534 -10.063
  273   2HG   LYS  35          1HG       LYS  35  45.975  38.665 -10.206
  274   1HD   LYS  35          2HD       LYS  35  47.181  36.528  -9.677
  275   2HD   LYS  35          1HD       LYS  35  48.677  37.459  -9.461
  276   1HE   LYS  35          1HE       LYS  35  46.105  37.845  -7.864
  277   2HE   LYS  35          2HE       LYS  35  47.526  36.939  -7.313
  278   1HZ   LYS  35          1HZ       LYS  35  47.475  39.796  -7.970
  279   2HZ   LYS  35          2HZ       LYS  35  47.521  39.144  -6.456
  280   3HZ   LYS  35          3HZ       LYS  35  48.800  38.945  -7.478
  281    H    THR  36           H        THR  36  44.914  35.298 -12.942
  282    HA   THR  36           HA       THR  36  42.636  37.183 -13.048
  283    HB   THR  36           HB       THR  36  41.405  35.299 -13.994
  284    HG1  THR  36           HG1      THR  36  42.392  33.595 -12.976
  285   1HG2  THR  36          1HG2      THR  36  42.639  35.097 -16.095
  286   2HG2  THR  36          2HG2      THR  36  42.756  36.761 -15.482
  287   3HG2  THR  36          3HG2      THR  36  44.135  35.649 -15.313
  288    H    CYS  37           H        CYS  37  44.275  35.873 -10.611
  289    HA   CYS  37           HA       CYS  37  41.834  35.805  -8.930
  290   1HB   CYS  37          1HB       CYS  37  44.176  33.881  -8.758
  291   2HB   CYS  37          2HB       CYS  37  42.999  34.145  -7.467
  292    HXT  CYS  37           HO        OH  38  43.717  37.418  -6.432
  Start of MODEL    2
    1   1H    GLY   1          1H        GLY   1  67.390  55.327  10.316
    2   2H    GLY   1          2H        GLY   1  67.962  54.415  11.566
    3   3H    GLY   1          3H        GLY   1  67.119  53.700  10.341
    4   1HA   GLY   1          1HA       GLY   1  65.764  53.893  12.290
    5   2HA   GLY   1          2HA       GLY   1  66.051  55.643  12.265
    6    H    ILE   2           H        ILE   2  65.504  56.714  10.061
    7    HA   ILE   2           HA       ILE   2  62.770  56.381   9.518
    8    HB   ILE   2           HB       ILE   2  64.015  58.472   9.238
    9   1HG1  ILE   2          1HG1      ILE   2  63.179  59.175   7.024
   10   2HG1  ILE   2          2HG1      ILE   2  62.872  57.483   6.603
   11   1HG2  ILE   2          1HG2      ILE   2  65.530  58.846   7.366
   12   2HG2  ILE   2          2HG2      ILE   2  66.152  57.521   8.362
   13   3HG2  ILE   2          3HG2      ILE   2  65.337  57.171   6.820
   14   1HD1  ILE   2          1HD1      ILE   2  60.830  58.729   7.356
   15   2HD1  ILE   2          2HD1      ILE   2  61.174  57.329   8.384
   16   3HD1  ILE   2          3HD1      ILE   2  61.589  58.967   8.944
   17    H    LEU   3           H        LEU   3  65.651  54.919   8.089
   18    HA   LEU   3           HA       LEU   3  64.326  53.908   5.730
   19   1HB   LEU   3          1HB       LEU   3  66.906  53.046   7.097
   20   2HB   LEU   3          2HB       LEU   3  66.407  52.620   5.453
   21    HG   LEU   3           HG       LEU   3  67.029  55.435   6.467
   22   1HD1  LEU   3          1HD2      LEU   3  69.007  53.977   6.247
   23   2HD1  LEU   3          2HD2      LEU   3  68.537  53.583   4.578
   24   3HD1  LEU   3          3HD2      LEU   3  68.999  55.246   5.004
   25   1HD2  LEU   3          1HD1      LEU   3  65.338  55.545   4.687
   26   2HD2  LEU   3          2HD1      LEU   3  66.910  56.046   4.045
   27   3HD2  LEU   3          3HD1      LEU   3  66.286  54.421   3.685
   28    H    ASP   4           H        ASP   4  64.361  52.902   9.048
   29    HA   ASP   4           HA       ASP   4  63.670  50.103   8.387
   30   1HB   ASP   4          2HB       ASP   4  65.301  50.577  10.219
   31   2HB   ASP   4          1HB       ASP   4  64.061  51.521  11.057
   32    HD2  ASP   4           HD2      ASP   4  63.631  47.469  10.802
   33    H    THR   5           H        THR   5  62.466  53.282   9.196
   34    HA   THR   5           HA       THR   5  60.062  52.428  10.415
   35    HB   THR   5           HB       THR   5  60.711  55.084   9.073
   36    HG1  THR   5           HG1      THR   5  62.067  54.500  10.820
   37   1HG2  THR   5          1HG2      THR   5  58.281  54.811   9.366
   38   2HG2  THR   5          2HG2      THR   5  58.529  54.322  11.059
   39   3HG2  THR   5          3HG2      THR   5  58.919  55.977  10.540
   40    H    LEU   6           H        LEU   6  60.742  53.774   7.139
   41    HA   LEU   6           HA       LEU   6  58.196  53.111   6.021
   42   1HB   LEU   6          2HB       LEU   6  59.250  53.595   3.886
   43   2HB   LEU   6          1HB       LEU   6  59.650  54.805   5.108
   44    HG   LEU   6           HG       LEU   6  61.825  53.238   5.420
   45   1HD1  LEU   6          1HD2      LEU   6  61.110  51.596   3.642
   46   2HD1  LEU   6          2HD2      LEU   6  61.076  52.928   2.473
   47   3HD1  LEU   6          3HD2      LEU   6  62.609  52.442   3.225
   48   1HD2  LEU   6          1HD1      LEU   6  62.977  54.775   3.858
   49   2HD2  LEU   6          2HD1      LEU   6  61.404  55.284   3.206
   50   3HD2  LEU   6          3HD1      LEU   6  61.824  55.636   4.898
   51    H    LYS   7           H        LYS   7  61.233  51.322   6.448
   52    HA   LYS   7           HA       LYS   7  60.788  49.152   4.773
   53   1HB   LYS   7          2HB       LYS   7  62.813  49.903   6.303
   54   2HB   LYS   7          1HB       LYS   7  62.025  48.883   7.517
   55   1HG   LYS   7          1HG       LYS   7  63.577  47.454   6.438
   56   2HG   LYS   7          2HG       LYS   7  61.997  47.041   5.749
   57   1HD   LYS   7          1HD       LYS   7  63.416  47.188   3.870
   58   2HD   LYS   7          2HD       LYS   7  62.553  48.736   3.879
   59   1HE   LYS   7          1HE       LYS   7  64.892  49.116   3.388
   60   2HE   LYS   7          2HE       LYS   7  64.547  49.790   4.988
   61   1HZ   LYS   7          1HZ       LYS   7  65.499  47.817   5.943
   62   2HZ   LYS   7          2HZ       LYS   7  66.579  48.547   4.935
   63   3HZ   LYS   7          3HZ       LYS   7  65.790  47.184   4.448
   64    H    GLN   8           H        GLN   8  59.826  49.654   8.187
   65    HA   GLN   8           HA       GLN   8  58.745  47.213   8.844
   66   1HB   GLN   8          1HB       GLN   8  59.112  49.168  10.311
   67   2HB   GLN   8          2HB       GLN   8  57.715  49.986   9.602
   68   1HG   GLN   8          2HG       GLN   8  57.592  47.292  11.006
   69   2HG   GLN   8          1HG       GLN   8  57.341  48.848  11.816
   70   1HE2  GLN   8          2HE2      GLN   8  55.632  46.311  10.699
   71   2HE2  GLN   8          1HE2      GLN   8  54.160  47.114  10.197
   72    H    PHE   9           H        PHE   9  56.986  49.995   7.386
   73    HA   PHE   9           HA       PHE   9  54.516  48.598   7.077
   74   1HB   PHE   9          2HB       PHE   9  55.609  51.055   5.666
   75   2HB   PHE   9          1HB       PHE   9  53.929  50.509   5.617
   76    HD1  PHE   9           HD1      PHE   9  56.375  52.421   7.458
   77    HD2  PHE   9           HD2      PHE   9  52.622  50.347   7.815
   78    HE1  PHE   9           HE1      PHE   9  55.927  53.598   9.595
   79    HE2  PHE   9           HE2      PHE   9  52.167  51.541   9.942
   80    HZ   PHE   9           HZ       PHE   9  53.823  53.159  10.838
   81    H    ALA  10           H        ALA  10  57.267  49.191   4.841
   82    HA   ALA  10           HA       ALA  10  56.074  48.026   2.535
   83   1HB   ALA  10          1HB       ALA  10  58.065  49.481   2.481
   84   2HB   ALA  10          2HB       ALA  10  59.009  48.232   3.324
   85   3HB   ALA  10          3HB       ALA  10  58.379  47.920   1.692
   86    H    LYS  11           H        LYS  11  57.971  46.624   5.234
   87    HA   LYS  11           HA       LYS  11  57.978  43.927   4.160
   88   1HB   LYS  11          1HB       LYS  11  58.426  45.083   6.937
   89   2HB   LYS  11          2HB       LYS  11  58.529  43.351   6.555
   90   1HG   LYS  11          2HG       LYS  11  60.322  43.730   4.959
   91   2HG   LYS  11          1HG       LYS  11  60.164  45.484   5.125
   92   1HD   LYS  11          1HD       LYS  11  62.077  44.730   6.399
   93   2HD   LYS  11          2HD       LYS  11  60.831  45.323   7.514
   94   1HE   LYS  11          1HE       LYS  11  60.156  43.007   8.020
   95   2HE   LYS  11          2HE       LYS  11  61.310  42.391   6.817
   96   1HZ   LYS  11          1HZ       LYS  11  63.066  43.320   8.129
   97   2HZ   LYS  11          2HZ       LYS  11  61.992  43.896   9.240
   98   3HZ   LYS  11          3HZ       LYS  11  62.166  42.270   9.029
   99    H    GLY  12           H        GLY  12  55.705  45.911   6.016
  100   1HA   GLY  12          1HA       GLY  12  53.957  43.660   6.620
  101   2HA   GLY  12          2HA       GLY  12  53.579  45.397   6.821
  102    H    VAL  13           H        VAL  13  54.413  45.934   3.949
  103    HA   VAL  13           HA       VAL  13  52.236  44.565   2.504
  104    HB   VAL  13           HB       VAL  13  54.228  46.686   1.591
  105   1HG1  VAL  13          1HG2      VAL  13  52.525  47.124  -0.194
  106   2HG1  VAL  13          2HG2      VAL  13  53.230  45.513  -0.341
  107   3HG1  VAL  13          3HG2      VAL  13  51.611  45.706   0.371
  108   1HG2  VAL  13          1HG1      VAL  13  52.325  48.288   1.811
  109   2HG2  VAL  13          2HG1      VAL  13  52.777  47.604   3.377
  110   3HG2  VAL  13          3HG1      VAL  13  51.339  46.996   2.529
  111    H    GLY  14           H        GLY  14  54.101  43.036   3.676
  112   1HA   GLY  14          1HA       GLY  14  55.156  41.555   1.345
  113   2HA   GLY  14          2HA       GLY  14  56.240  41.871   2.722
  114    H    LYS  15           H        LYS  15  54.083  41.884   4.695
  115    HA   LYS  15           HA       LYS  15  53.697  39.017   5.159
  116   1HB   LYS  15          2HB       LYS  15  52.701  41.489   6.604
  117   2HB   LYS  15          1HB       LYS  15  52.537  39.813   7.172
  118   1HG   LYS  15          1HG       LYS  15  54.999  39.592   7.314
  119   2HG   LYS  15          2HG       LYS  15  55.193  41.185   6.569
  120   1HD   LYS  15          2HD       LYS  15  55.507  41.772   8.710
  121   2HD   LYS  15          1HD       LYS  15  53.765  42.049   8.603
  122   1HE   LYS  15          2HE       LYS  15  55.135  39.559   9.737
  123   2HE   LYS  15          1HE       LYS  15  54.418  40.873  10.686
  124   1HZ   LYS  15          1HZ       LYS  15  52.930  39.067  10.537
  125   2HZ   LYS  15          2HZ       LYS  15  52.303  40.335   9.689
  126   3HZ   LYS  15          3HZ       LYS  15  52.982  39.058   8.892
  127    H    ASP  16           H        ASP  16  51.862  41.896   4.141
  128    HA   ASP  16           HA       ASP  16  49.276  40.653   3.985
  129   1HB   ASP  16          1HB       ASP  16  49.685  43.110   4.085
  130   2HB   ASP  16          2HB       ASP  16  50.451  43.029   2.489
  131    HD2  ASP  16           HD2      ASP  16  46.418  42.460   2.779
  132    H    LEU  17           H        LEU  17  52.175  40.531   2.058
  133    HA   LEU  17           HA       LEU  17  50.796  39.608  -0.394
  134   1HB   LEU  17          2HB       LEU  17  53.724  40.122   0.269
  135   2HB   LEU  17          1HB       LEU  17  53.114  39.556  -1.282
  136    HG   LEU  17           HG       LEU  17  52.510  42.242   0.053
  137   1HD1  LEU  17          1HD2      LEU  17  53.787  43.169  -1.835
  138   2HD1  LEU  17          2HD2      LEU  17  54.782  42.007  -0.933
  139   3HD1  LEU  17          3HD2      LEU  17  54.051  41.534  -2.481
  140   1HD2  LEU  17          1HD1      LEU  17  51.411  42.809  -2.132
  141   2HD2  LEU  17          2HD1      LEU  17  51.535  41.100  -2.603
  142   3HD2  LEU  17          3HD1      LEU  17  50.528  41.581  -1.215
  143    H    VAL  18           H        VAL  18  53.128  38.568   2.139
  144    HA   VAL  18           HA       VAL  18  53.234  35.857   1.127
  145    HB   VAL  18           HB       VAL  18  53.994  37.149   3.771
  146   1HG1  VAL  18          1HG2      VAL  18  54.272  34.227   2.946
  147   2HG1  VAL  18          2HG2      VAL  18  53.332  34.856   4.320
  148   3HG1  VAL  18          3HG2      VAL  18  55.098  34.980   4.328
  149   1HG2  VAL  18          1HG1      VAL  18  55.631  35.819   1.561
  150   2HG2  VAL  18          2HG1      VAL  18  56.272  36.646   2.997
  151   3HG2  VAL  18          3HG1      VAL  18  55.427  37.571   1.740
  152    H    LYS  19           H        LYS  19  51.089  37.773   3.120
  153    HA   LYS  19           HA       LYS  19  49.571  35.549   4.235
  154   1HB   LYS  19          2HB       LYS  19  49.705  37.731   5.332
  155   2HB   LYS  19          1HB       LYS  19  48.905  38.494   3.940
  156   1HG   LYS  19          2HG       LYS  19  46.894  37.141   4.308
  157   2HG   LYS  19          1HG       LYS  19  47.699  36.250   5.621
  158   1HD   LYS  19          1HD       LYS  19  47.947  38.337   6.901
  159   2HD   LYS  19          2HD       LYS  19  47.153  39.246   5.596
  160   1HE   LYS  19          2HE       LYS  19  45.885  36.982   7.205
  161   2HE   LYS  19          1HE       LYS  19  45.599  38.713   7.468
  162   1HZ   LYS  19          1HZ       LYS  19  44.967  37.228   5.019
  163   2HZ   LYS  19          2HZ       LYS  19  43.888  37.750   6.150
  164   3HZ   LYS  19          3HZ       LYS  19  44.730  38.844   5.249
  165    H    GLY  20           H        GLY  20  49.441  37.686   1.401
  166   1HA   GLY  20          1HA       GLY  20  46.780  36.978   0.547
  167   2HA   GLY  20          2HA       GLY  20  48.013  37.864  -0.373
  168    H    ALA  21           H        ALA  21  50.119  36.107  -0.457
  169    HA   ALA  21           HA       ALA  21  49.433  34.142  -2.398
  170   1HB   ALA  21          1HB       ALA  21  51.697  35.096  -2.147
  171   2HB   ALA  21          2HB       ALA  21  51.844  34.339  -0.544
  172   3HB   ALA  21          3HB       ALA  21  51.732  33.325  -2.001
  173    H    ALA  22           H        ALA  22  49.643  34.127   1.133
  174    HA   ALA  22           HA       ALA  22  49.292  31.228   1.308
  175   1HB   ALA  22          1HB       ALA  22  49.334  31.604   3.723
  176   2HB   ALA  22          2HB       ALA  22  49.290  33.361   3.466
  177   3HB   ALA  22          3HB       ALA  22  50.695  32.416   2.921
  178    H    GLN  23           H        GLN  23  47.160  33.983   1.016
  179    HA   GLN  23           HA       GLN  23  45.013  32.936   2.621
  180   1HB   GLN  23          2HB       GLN  23  45.417  35.339   2.222
  181   2HB   GLN  23          1HB       GLN  23  45.040  35.118   0.500
  182   1HG   GLN  23          1HG       GLN  23  42.769  34.375   1.078
  183   2HG   GLN  23          2HG       GLN  23  43.146  34.508   2.808
  184   1HE2  GLN  23          1HE2      GLN  23  43.989  36.757   3.504
  185   2HE2  GLN  23          2HE2      GLN  23  43.160  38.137   2.816
  186    H    GLY  24           H        GLY  24  45.826  32.958  -0.865
  187   1HA   GLY  24          2HA       GLY  24  43.669  30.956  -1.379
  188   2HA   GLY  24          1HA       GLY  24  43.935  32.351  -2.450
  189    H    VAL  25           H        VAL  25  45.644  29.626  -0.876
  190    HA   VAL  25           HA       VAL  25  48.074  30.026  -2.105
  191    HB   VAL  25           HB       VAL  25  46.941  27.338  -1.188
  192   1HG1  VAL  25          1HG1      VAL  25  49.311  26.896  -0.626
  193   2HG1  VAL  25          2HG1      VAL  25  49.115  27.223  -2.363
  194   3HG1  VAL  25          3HG1      VAL  25  49.762  28.485  -1.286
  195   1HG2  VAL  25          1HG2      VAL  25  48.250  29.565   0.415
  196   2HG2  VAL  25          2HG2      VAL  25  47.948  27.924   1.020
  197   3HG2  VAL  25          3HG2      VAL  25  46.584  28.974   0.614
  198    H    LEU  26           H        LEU  26  45.507  27.689  -3.034
  199    HA   LEU  26           HA       LEU  26  46.859  26.654  -5.317
  200   1HB   LEU  26          1HB       LEU  26  43.900  26.715  -4.643
  201   2HB   LEU  26          2HB       LEU  26  44.672  25.659  -5.836
  202    HG   LEU  26           HG       LEU  26  45.208  25.632  -2.828
  203   1HD1  LEU  26          1HD1      LEU  26  42.973  24.793  -3.452
  204   2HD1  LEU  26          2HD1      LEU  26  43.713  23.686  -4.631
  205   3HD1  LEU  26          3HD1      LEU  26  44.026  23.475  -2.893
  206   1HD2  LEU  26          1HD2      LEU  26  46.414  23.505  -3.343
  207   2HD2  LEU  26          2HD2      LEU  26  47.213  24.916  -4.052
  208   3HD2  LEU  26          3HD2      LEU  26  46.232  23.842  -5.078
  209    H    SER  27           H        SER  27  44.469  29.308  -4.924
  210    HA   SER  27           HA       SER  27  44.013  29.642  -7.716
  211   1HB   SER  27          2HB       SER  27  42.947  31.743  -7.074
  212   2HB   SER  27          1HB       SER  27  42.455  30.422  -5.994
  213    HG   SER  27           HG       SER  27  43.007  32.334  -4.865
  214    H    THR  28           H        THR  28  46.304  31.203  -5.444
  215    HA   THR  28           HA       THR  28  47.265  33.247  -7.092
  216    HB   THR  28           HB       THR  28  48.676  31.611  -4.951
  217    HG1  THR  28           HG1      THR  28  46.798  32.796  -4.346
  218   1HG2  THR  28          1HG2      THR  28  50.377  32.770  -6.282
  219   2HG2  THR  28          2HG2      THR  28  49.426  34.273  -6.236
  220   3HG2  THR  28          3HG2      THR  28  50.151  33.626  -4.749
  221    H    VAL  29           H        VAL  29  47.957  29.770  -7.205
  222    HA   VAL  29           HA       VAL  29  50.290  29.903  -8.814
  223    HB   VAL  29           HB       VAL  29  48.126  27.765  -8.655
  224   1HG1  VAL  29          1HG1      VAL  29  49.570  27.475 -10.614
  225   2HG1  VAL  29          2HG1      VAL  29  49.950  26.256  -9.381
  226   3HG1  VAL  29          3HG1      VAL  29  51.018  27.665  -9.592
  227   1HG2  VAL  29          1HG2      VAL  29  49.674  26.687  -7.033
  228   2HG2  VAL  29          2HG2      VAL  29  49.089  28.245  -6.427
  229   3HG2  VAL  29          3HG2      VAL  29  50.730  28.115  -7.101
  230    H    SER  30           H        SER  30  46.788  29.863  -9.585
  231    HA   SER  30           HA       SER  30  47.258  29.893 -12.451
  232   1HB   SER  30          1HB       SER  30  45.229  28.883 -11.462
  233   2HB   SER  30          2HB       SER  30  44.746  30.464 -10.814
  234    HG   SER  30           HG       SER  30  44.695  31.225 -12.976
  235    H    CYS  31           H        CYS  31  45.803  32.306 -10.202
  236    HA   CYS  31           HA       CYS  31  46.252  34.439 -12.136
  237   1HB   CYS  31          1HB       CYS  31  45.335  35.885 -10.320
  238   2HB   CYS  31          2HB       CYS  31  44.289  34.589 -10.888
  239    H    LYS  32           H        LYS  32  48.681  32.963 -11.197
  240    HA   LYS  32           HA       LYS  32  50.130  35.052  -9.699
  241   1HB   LYS  32          1HB       LYS  32  51.701  33.617  -9.253
  242   2HB   LYS  32          2HB       LYS  32  50.334  32.490  -9.414
  243   1HG   LYS  32          2HG       LYS  32  51.065  32.127 -11.822
  244   2HG   LYS  32          1HG       LYS  32  52.465  33.165 -11.490
  245   1HD   LYS  32          2HD       LYS  32  51.893  30.431 -10.322
  246   2HD   LYS  32          1HD       LYS  32  53.206  31.044 -11.338
  247   1HE   LYS  32          1HE       LYS  32  54.209  30.851  -9.245
  248   2HE   LYS  32          2HE       LYS  32  53.836  32.578  -9.366
  249   1HZ   LYS  32          1HZ       LYS  32  53.242  31.640  -7.248
  250   2HZ   LYS  32          2HZ       LYS  32  51.873  32.123  -8.025
  251   3HZ   LYS  32          3HZ       LYS  32  52.261  30.524  -7.960
  252    H    LEU  33           H        LEU  33  49.619  33.983 -13.000
  253    HA   LEU  33           HA       LEU  33  52.017  34.940 -14.135
  254   1HB   LEU  33          2HB       LEU  33  50.782  34.768 -16.291
  255   2HB   LEU  33          1HB       LEU  33  50.756  33.330 -15.270
  256    HG   LEU  33           HG       LEU  33  48.448  33.825 -14.550
  257   1HD1  LEU  33          1HD2      LEU  33  47.144  35.518 -15.882
  258   2HD1  LEU  33          2HD2      LEU  33  48.283  36.240 -14.743
  259   3HD1  LEU  33          3HD2      LEU  33  48.683  36.175 -16.480
  260   1HD2  LEU  33          1HD1      LEU  33  47.398  33.293 -16.702
  261   2HD2  LEU  33          2HD1      LEU  33  48.917  32.397 -16.503
  262   3HD2  LEU  33          3HD1      LEU  33  48.861  33.824 -17.563
  263    H    ALA  34           H        ALA  34  49.862  36.862 -12.583
  264    HA   ALA  34           HA       ALA  34  50.892  39.237 -14.003
  265   1HB   ALA  34          1HB       ALA  34  47.944  38.771 -13.397
  266   2HB   ALA  34          2HB       ALA  34  48.685  38.817 -15.012
  267   3HB   ALA  34          3HB       ALA  34  48.655  40.283 -14.011
  268    H    LYS  35           H        LYS  35  50.619  37.524 -11.209
  269    HA   LYS  35           HA       LYS  35  50.595  37.929  -9.010
  270   1HB   LYS  35          1HB       LYS  35  52.134  40.393  -9.901
  271   2HB   LYS  35          2HB       LYS  35  52.168  39.655  -8.294
  272   1HG   LYS  35          2HG       LYS  35  53.106  38.365 -10.891
  273   2HG   LYS  35          1HG       LYS  35  54.138  39.015  -9.618
  274   1HD   LYS  35          2HD       LYS  35  52.276  36.606  -9.384
  275   2HD   LYS  35          1HD       LYS  35  54.039  36.586  -9.480
  276   1HE   LYS  35          2HE       LYS  35  52.386  37.752  -7.199
  277   2HE   LYS  35          1HE       LYS  35  53.314  36.246  -7.182
  278   1HZ   LYS  35          1HZ       LYS  35  54.512  38.009  -6.157
  279   2HZ   LYS  35          2HZ       LYS  35  55.297  37.521  -7.523
  280   3HZ   LYS  35          3HZ       LYS  35  54.440  38.931  -7.521
  281    H    THR  36           H        THR  36  48.229  38.891 -10.356
  282    HA   THR  36           HA       THR  36  47.284  41.214  -8.874
  283    HB   THR  36           HB       THR  36  45.052  40.321  -9.562
  284    HG1  THR  36           HG1      THR  36  45.085  38.512 -10.965
  285   1HG2  THR  36          1HG2      THR  36  47.116  40.441 -11.806
  286   2HG2  THR  36          2HG2      THR  36  46.312  41.837 -11.054
  287   3HG2  THR  36          3HG2      THR  36  45.362  40.656 -11.981
  288    H    CYS  37           H        CYS  37  47.782  37.782  -8.373
  289    HA   CYS  37           HA       CYS  37  46.365  37.810  -5.754
  290   1HB   CYS  37          1HB       CYS  37  47.331  35.608  -7.597
  291   2HB   CYS  37          2HB       CYS  37  46.655  35.328  -5.989
  292    HXT  CYS  37           HO        OH  38  50.345  36.925  -5.934
  Start of MODEL    3
    1   1H    GLY   1          1H        GLY   1  67.664  57.733  16.040
    2   2H    GLY   1          2H        GLY   1  67.476  58.669  14.696
    3   3H    GLY   1          3H        GLY   1  68.962  58.523  15.397
    4   1HA   GLY   1          2HA       GLY   1  68.868  57.217  13.415
    5   2HA   GLY   1          1HA       GLY   1  69.071  56.214  14.863
    6    H    ILE   2           H        ILE   2  66.452  57.674  12.874
    7    HA   ILE   2           HA       ILE   2  64.623  55.483  13.522
    8    HB   ILE   2           HB       ILE   2  63.109  56.837  11.979
    9   1HG1  ILE   2          1HG1      ILE   2  63.608  59.191  11.678
   10   2HG1  ILE   2          2HG1      ILE   2  65.216  59.009  12.375
   11   1HG2  ILE   2          1HG2      ILE   2  62.989  56.854  14.430
   12   2HG2  ILE   2          2HG2      ILE   2  64.228  58.128  14.492
   13   3HG2  ILE   2          3HG2      ILE   2  62.642  58.461  13.763
   14   1HD1  ILE   2          1HD1      ILE   2  65.888  57.588  10.460
   15   2HD1  ILE   2          2HD1      ILE   2  64.233  57.701   9.800
   16   3HD1  ILE   2          3HD1      ILE   2  65.255  59.146   9.907
   17    H    LEU   3           H        LEU   3  66.984  54.647  12.238
   18    HA   LEU   3           HA       LEU   3  66.502  54.351   9.395
   19   1HB   LEU   3          2HB       LEU   3  68.588  53.155  11.264
   20   2HB   LEU   3          1HB       LEU   3  68.645  53.122   9.498
   21    HG   LEU   3           HG       LEU   3  68.717  55.637  11.234
   22   1HD1  LEU   3          1HD2      LEU   3  71.065  55.774  10.512
   23   2HD1  LEU   3          2HD2      LEU   3  70.759  54.264  11.396
   24   3HD1  LEU   3          3HD2      LEU   3  70.892  54.243   9.623
   25   1HD2  LEU   3          1HD1      LEU   3  69.353  56.765   9.097
   26   2HD2  LEU   3          2HD1      LEU   3  69.004  55.260   8.219
   27   3HD2  LEU   3          3HD1      LEU   3  67.699  56.138   9.054
   28    H    ASP   4           H        ASP   4  66.066  52.374  12.298
   29    HA   ASP   4           HA       ASP   4  65.385  49.979  10.693
   30   1HB   ASP   4          1HB       ASP   4  66.838  49.745  12.700
   31   2HB   ASP   4          2HB       ASP   4  65.556  50.451  13.698
   32    HD2  ASP   4           HD2      ASP   4  65.023  46.716  12.129
   33    H    THR   5           H        THR   5  64.117  52.823  12.197
   34    HA   THR   5           HA       THR   5  61.648  51.769  13.062
   35    HB   THR   5           HB       THR   5  62.424  54.627  12.373
   36    HG1  THR   5           HG1      THR   5  62.763  54.691  14.641
   37   1HG2  THR   5          1HG2      THR   5  60.139  53.526  14.066
   38   2HG2  THR   5          2HG2      THR   5  59.970  54.376  12.511
   39   3HG2  THR   5          3HG2      THR   5  60.591  55.239  13.931
   40    H    LEU   6           H        LEU   6  62.533  53.755  10.177
   41    HA   LEU   6           HA       LEU   6  60.016  53.598   8.891
   42   1HB   LEU   6          2HB       LEU   6  61.189  54.367   6.919
   43   2HB   LEU   6          1HB       LEU   6  61.739  55.223   8.362
   44    HG   LEU   6           HG       LEU   6  63.641  53.308   8.318
   45   1HD1  LEU   6          1HD2      LEU   6  64.345  52.878   5.995
   46   2HD1  LEU   6          2HD2      LEU   6  62.721  52.211   6.232
   47   3HD1  LEU   6          3HD2      LEU   6  62.927  53.750   5.378
   48   1HD2  LEU   6          1HD1      LEU   6  65.060  54.932   7.121
   49   2HD2  LEU   6          2HD1      LEU   6  63.608  55.804   6.576
   50   3HD2  LEU   6          3HD1      LEU   6  64.013  55.738   8.306
   51    H    LYS   7           H        LYS   7  62.799  51.369   8.948
   52    HA   LYS   7           HA       LYS   7  62.006  49.657   6.849
   53   1HB   LYS   7          2HB       LYS   7  64.234  49.783   7.837
   54   2HB   LYS   7          1HB       LYS   7  63.614  49.116   9.361
   55   1HG   LYS   7          2HG       LYS   7  62.991  47.032   8.242
   56   2HG   LYS   7          1HG       LYS   7  63.463  47.709   6.661
   57   1HD   LYS   7          1HD       LYS   7  65.769  47.988   7.451
   58   2HD   LYS   7          2HD       LYS   7  65.310  47.367   9.054
   59   1HE   LYS   7          2HE       LYS   7  64.675  45.194   8.027
   60   2HE   LYS   7          1HE       LYS   7  65.138  45.814   6.428
   61   1HZ   LYS   7          1HZ       LYS   7  66.932  45.485   8.726
   62   2HZ   LYS   7          2HZ       LYS   7  67.364  46.060   7.242
   63   3HZ   LYS   7          3HZ       LYS   7  66.858  44.499   7.406
   64    H    GLN   8           H        GLN   8  61.292  49.660  10.373
   65    HA   GLN   8           HA       GLN   8  60.010  47.188  10.563
   66   1HB   GLN   8          1HB       GLN   8  60.772  48.639  12.415
   67   2HB   GLN   8          2HB       GLN   8  59.432  49.752  12.116
   68   1HG   GLN   8          2HG       GLN   8  59.091  46.800  12.773
   69   2HG   GLN   8          1HG       GLN   8  59.117  48.090  13.989
   70   1HE2  GLN   8          1HE2      GLN   8  57.016  46.154  12.374
   71   2HE2  GLN   8          2HE2      GLN   8  55.616  47.203  12.317
   72    H    PHE   9           H        PHE   9  58.500  50.434  10.105
   73    HA   PHE   9           HA       PHE   9  55.873  49.360   9.646
   74   1HB   PHE   9          2HB       PHE   9  57.095  52.073   9.021
   75   2HB   PHE   9          1HB       PHE   9  55.375  51.687   8.901
   76    HD1  PHE   9           HD1      PHE   9  57.945  52.889  11.077
   77    HD2  PHE   9           HD2      PHE   9  54.196  50.776  11.029
   78    HE1  PHE   9           HE1      PHE   9  57.637  53.376  13.488
   79    HE2  PHE   9           HE2      PHE   9  53.883  51.281  13.436
   80    HZ   PHE   9           HZ       PHE   9  55.608  52.572  14.670
   81    H    ALA  10           H        ALA  10  58.610  50.123   7.495
   82    HA   ALA  10           HA       ALA  10  57.091  49.918   5.068
   83   1HB   ALA  10          1HB       ALA  10  59.318  50.972   5.153
   84   2HB   ALA  10          2HB       ALA  10  59.293  49.624   3.996
   85   3HB   ALA  10          3HB       ALA  10  60.051  49.410   5.588
   86    H    LYS  11           H        LYS  11  58.966  47.597   7.063
   87    HA   LYS  11           HA       LYS  11  57.938  45.284   5.535
   88   1HB   LYS  11          1HB       LYS  11  59.638  45.487   8.054
   89   2HB   LYS  11          2HB       LYS  11  59.189  43.983   7.221
   90   1HG   LYS  11          1HG       LYS  11  60.366  44.723   5.187
   91   2HG   LYS  11          2HG       LYS  11  60.755  46.273   5.952
   92   1HD   LYS  11          2HD       LYS  11  62.700  44.881   6.061
   93   2HD   LYS  11          1HD       LYS  11  62.058  45.067   7.704
   94   1HE   LYS  11          1HE       LYS  11  61.037  42.825   7.575
   95   2HE   LYS  11          2HE       LYS  11  61.568  42.667   5.886
   96   1HZ   LYS  11          1HZ       LYS  11  63.028  41.554   7.393
   97   2HZ   LYS  11          2HZ       LYS  11  63.322  42.951   8.219
   98   3HZ   LYS  11          3HZ       LYS  11  63.818  42.799   6.654
   99    H    GLY  12           H        GLY  12  55.865  46.734   6.203
  100   1HA   GLY  12          2HA       GLY  12  54.397  45.344   8.377
  101   2HA   GLY  12          1HA       GLY  12  54.825  47.066   8.488
  102    H    VAL  13           H        VAL  13  54.430  48.421   6.466
  103    HA   VAL  13           HA       VAL  13  51.798  47.959   5.299
  104    HB   VAL  13           HB       VAL  13  53.243  50.175   5.627
  105   1HG1  VAL  13          1HG2      VAL  13  54.540  50.858   3.754
  106   2HG1  VAL  13          2HG2      VAL  13  55.166  49.290   4.301
  107   3HG1  VAL  13          3HG2      VAL  13  54.156  49.389   2.842
  108   1HG2  VAL  13          1HG1      VAL  13  52.019  51.203   3.733
  109   2HG2  VAL  13          2HG1      VAL  13  50.977  50.082   4.634
  110   3HG2  VAL  13          3HG1      VAL  13  51.673  49.589   3.073
  111    H    GLY  14           H        GLY  14  54.558  46.275   5.433
  112   1HA   GLY  14          2HA       GLY  14  54.713  45.455   2.577
  113   2HA   GLY  14          1HA       GLY  14  56.029  45.347   3.759
  114    H    LYS  15           H        LYS  15  53.867  44.713   5.877
  115    HA   LYS  15           HA       LYS  15  53.518  41.817   5.373
  116   1HB   LYS  15          2HB       LYS  15  52.951  43.540   7.795
  117   2HB   LYS  15          1HB       LYS  15  52.723  41.784   7.688
  118   1HG   LYS  15          1HG       LYS  15  55.389  43.227   7.359
  119   2HG   LYS  15          2HG       LYS  15  54.842  42.378   8.817
  120   1HD   LYS  15          1HD       LYS  15  54.700  40.258   7.514
  121   2HD   LYS  15          2HD       LYS  15  55.256  41.127   6.068
  122   1HE   LYS  15          2HE       LYS  15  57.131  39.955   7.064
  123   2HE   LYS  15          1HE       LYS  15  57.373  41.703   7.236
  124   1HZ   LYS  15          1HZ       LYS  15  56.608  41.517   9.489
  125   2HZ   LYS  15          2HZ       LYS  15  57.886  40.508   9.235
  126   3HZ   LYS  15          3HZ       LYS  15  56.357  39.896   9.317
  127    H    ASP  16           H        ASP  16  51.873  44.892   5.232
  128    HA   ASP  16           HA       ASP  16  49.180  43.781   5.070
  129   1HB   ASP  16          1HB       ASP  16  49.642  46.114   5.762
  130   2HB   ASP  16          2HB       ASP  16  50.347  46.445   4.169
  131    HD2  ASP  16           HD2      ASP  16  49.001  46.423   2.391
  132    H    LEU  17           H        LEU  17  51.990  44.280   2.996
  133    HA   LEU  17           HA       LEU  17  50.477  43.806   0.501
  134   1HB   LEU  17          1HB       LEU  17  53.368  44.505   1.113
  135   2HB   LEU  17          2HB       LEU  17  52.751  44.171  -0.500
  136    HG   LEU  17           HG       LEU  17  51.662  46.418   1.242
  137   1HD1  LEU  17          1HD1      LEU  17  53.670  46.513  -1.052
  138   2HD1  LEU  17          2HD1      LEU  17  52.977  47.919  -0.213
  139   3HD1  LEU  17          3HD1      LEU  17  54.043  46.801   0.662
  140   1HD2  LEU  17          1HD2      LEU  17  50.760  47.238  -0.932
  141   2HD2  LEU  17          2HD2      LEU  17  51.332  45.750  -1.715
  142   3HD2  LEU  17          3HD2      LEU  17  50.063  45.679  -0.470
  143    H    VAL  18           H        VAL  18  53.083  42.499   2.660
  144    HA   VAL  18           HA       VAL  18  53.292  40.119   0.988
  145    HB   VAL  18           HB       VAL  18  54.300  40.795   3.748
  146   1HG1  VAL  18          1HG1      VAL  18  54.425  38.109   2.360
  147   2HG1  VAL  18          2HG1      VAL  18  55.419  38.598   3.756
  148   3HG1  VAL  18          3HG1      VAL  18  53.659  38.476   3.930
  149   1HG2  VAL  18          1HG2      VAL  18  56.463  40.502   2.643
  150   2HG2  VAL  18          2HG2      VAL  18  55.667  39.926   1.163
  151   3HG2  VAL  18          3HG2      VAL  18  55.486  41.617   1.664
  152    H    LYS  19           H        LYS  19  51.199  41.281   3.535
  153    HA   LYS  19           HA       LYS  19  49.905  38.766   4.153
  154   1HB   LYS  19          2HB       LYS  19  49.849  40.707   5.636
  155   2HB   LYS  19          1HB       LYS  19  48.975  41.655   4.422
  156   1HG   LYS  19          2HG       LYS  19  47.900  39.042   5.565
  157   2HG   LYS  19          1HG       LYS  19  47.607  40.622   6.314
  158   1HD   LYS  19          1HD       LYS  19  46.569  41.448   4.224
  159   2HD   LYS  19          2HD       LYS  19  46.775  39.842   3.492
  160   1HE   LYS  19          2HE       LYS  19  45.376  38.843   5.265
  161   2HE   LYS  19          1HE       LYS  19  45.196  40.435   6.030
  162   1HZ   LYS  19          1HZ       LYS  19  44.102  41.196   4.057
  163   2HZ   LYS  19          2HZ       LYS  19  44.266  39.718   3.343
  164   3HZ   LYS  19          3HZ       LYS  19  43.320  39.885   4.684
  165    H    GLY  20           H        GLY  20  49.467  41.401   1.817
  166   1HA   GLY  20          2HA       GLY  20  46.964  40.480   0.705
  167   2HA   GLY  20          1HA       GLY  20  48.062  41.707   0.038
  168    H    ALA  21           H        ALA  21  50.447  40.199  -0.141
  169    HA   ALA  21           HA       ALA  21  50.066  38.593  -2.491
  170   1HB   ALA  21          1HB       ALA  21  52.179  39.781  -1.954
  171   2HB   ALA  21          2HB       ALA  21  52.410  38.707  -0.553
  172   3HB   ALA  21          3HB       ALA  21  52.433  38.038  -2.198
  173    H    ALA  22           H        ALA  22  50.107  37.983   0.992
  174    HA   ALA  22           HA       ALA  22  50.099  35.069   0.591
  175   1HB   ALA  22          1HB       ALA  22  50.207  34.950   3.025
  176   2HB   ALA  22          2HB       ALA  22  51.459  36.038   2.396
  177   3HB   ALA  22          3HB       ALA  22  49.990  36.710   3.141
  178    H    GLN  23           H        GLN  23  47.881  36.515  -0.562
  179    HA   GLN  23           HA       GLN  23  45.591  35.994   1.216
  180   1HB   GLN  23          2HB       GLN  23  45.621  38.047  -0.084
  181   2HB   GLN  23          1HB       GLN  23  45.807  37.135  -1.597
  182   1HG   GLN  23          1HG       GLN  23  43.610  36.070  -1.233
  183   2HG   GLN  23          2HG       GLN  23  43.466  36.889   0.336
  184   1HE2  GLN  23          1HE2      GLN  23  44.054  37.641  -3.153
  185   2HE2  GLN  23          2HE2      GLN  23  43.081  39.096  -3.177
  186    H    GLY  24           H        GLY  24  46.599  35.074  -2.149
  187   1HA   GLY  24          1HA       GLY  24  46.153  32.280  -1.730
  188   2HA   GLY  24          2HA       GLY  24  44.769  33.019  -2.573
  189    H    VAL  25           H        VAL  25  48.345  33.415  -2.605
  190    HA   VAL  25           HA       VAL  25  48.289  33.922  -5.463
  191    HB   VAL  25           HB       VAL  25  49.619  35.245  -3.892
  192   1HG1  VAL  25          1HG1      VAL  25  50.380  33.412  -2.373
  193   2HG1  VAL  25          2HG1      VAL  25  51.474  32.847  -3.661
  194   3HG1  VAL  25          3HG1      VAL  25  51.694  34.454  -2.952
  195   1HG2  VAL  25          1HG2      VAL  25  50.191  35.135  -6.296
  196   2HG2  VAL  25          2HG2      VAL  25  51.636  35.365  -5.290
  197   3HG2  VAL  25          3HG2      VAL  25  51.280  33.766  -5.976
  198    H    LEU  26           H        LEU  26  49.576  31.467  -3.233
  199    HA   LEU  26           HA       LEU  26  50.999  29.857  -5.032
  200   1HB   LEU  26          2HB       LEU  26  49.383  29.034  -2.590
  201   2HB   LEU  26          1HB       LEU  26  50.659  28.078  -3.356
  202    HG   LEU  26           HG       LEU  26  51.046  30.797  -2.021
  203   1HD1  LEU  26          1HD2      LEU  26  51.829  27.988  -1.146
  204   2HD1  LEU  26          2HD2      LEU  26  52.223  29.499  -0.295
  205   3HD1  LEU  26          3HD2      LEU  26  50.531  28.977  -0.438
  206   1HD2  LEU  26          1HD1      LEU  26  52.697  30.478  -3.816
  207   2HD2  LEU  26          2HD1      LEU  26  53.046  28.834  -3.231
  208   3HD2  LEU  26          3HD1      LEU  26  53.472  30.248  -2.242
  209    H    SER  27           H        SER  27  47.508  29.898  -4.267
  210    HA   SER  27           HA       SER  27  46.854  27.570  -5.819
  211   1HB   SER  27          1HB       SER  27  44.538  28.394  -5.548
  212   2HB   SER  27          2HB       SER  27  45.427  28.372  -4.010
  213    HG   SER  27           HG       SER  27  44.272  30.319  -4.332
  214    H    THR  28           H        THR  28  46.798  31.109  -6.470
  215    HA   THR  28           HA       THR  28  45.594  31.058  -8.983
  216    HB   THR  28           HB       THR  28  47.758  32.935  -7.967
  217    HG1  THR  28           HG1      THR  28  45.882  32.798  -6.674
  218   1HG2  THR  28          1HG2      THR  28  45.724  33.214 -10.224
  219   2HG2  THR  28          2HG2      THR  28  46.731  34.531  -9.587
  220   3HG2  THR  28          3HG2      THR  28  47.491  33.155 -10.401
  221    H    VAL  29           H        VAL  29  49.052  30.621  -8.145
  222    HA   VAL  29           HA       VAL  29  50.184  30.633 -10.690
  223    HB   VAL  29           HB       VAL  29  50.890  28.956  -8.254
  224   1HG1  VAL  29          1HG2      VAL  29  52.507  29.573 -10.764
  225   2HG1  VAL  29          2HG2      VAL  29  51.949  27.968 -10.236
  226   3HG1  VAL  29          3HG2      VAL  29  53.158  28.840  -9.282
  227   1HG2  VAL  29          1HG1      VAL  29  52.586  30.721  -7.896
  228   2HG2  VAL  29          2HG1      VAL  29  51.985  31.598  -9.320
  229   3HG2  VAL  29          3HG1      VAL  29  50.955  31.414  -7.885
  230    H    SER  30           H        SER  30  48.435  27.987  -9.027
  231    HA   SER  30           HA       SER  30  48.967  26.052 -11.103
  232   1HB   SER  30          1HB       SER  30  48.482  25.401  -8.774
  233   2HB   SER  30          2HB       SER  30  46.863  26.119  -8.891
  234    HG   SER  30           HG       SER  30  46.433  24.630 -10.581
  235    H    CYS  31           H        CYS  31  45.949  27.735 -10.122
  236    HA   CYS  31           HA       CYS  31  44.683  27.094 -12.672
  237   1HB   CYS  31          1HB       CYS  31  42.807  28.458 -11.713
  238   2HB   CYS  31          2HB       CYS  31  43.287  27.026 -10.811
  239    H    LYS  32           H        LYS  32  47.187  28.743 -12.719
  240    HA   LYS  32           HA       LYS  32  46.313  31.366 -13.676
  241   1HB   LYS  32          2HB       LYS  32  48.385  30.740 -12.282
  242   2HB   LYS  32          1HB       LYS  32  49.050  30.055 -13.778
  243   1HG   LYS  32          1HG       LYS  32  48.257  32.921 -13.195
  244   2HG   LYS  32          2HG       LYS  32  49.887  32.237 -13.424
  245   1HD   LYS  32          1HD       LYS  32  49.268  31.667 -15.780
  246   2HD   LYS  32          2HD       LYS  32  47.726  32.511 -15.544
  247   1HE   LYS  32          2HE       LYS  32  48.884  34.607 -15.034
  248   2HE   LYS  32          1HE       LYS  32  50.456  33.799 -15.164
  249   1HZ   LYS  32          1HZ       LYS  32  48.510  34.123 -17.338
  250   2HZ   LYS  32          2HZ       LYS  32  49.973  33.372 -17.463
  251   3HZ   LYS  32          3HZ       LYS  32  49.901  34.989 -17.148
  252    H    LEU  33           H        LEU  33  48.088  28.518 -14.932
  253    HA   LEU  33           HA       LEU  33  48.300  29.172 -17.598
  254   1HB   LEU  33          1HB       LEU  33  49.346  27.218 -16.563
  255   2HB   LEU  33          2HB       LEU  33  47.763  26.456 -16.337
  256    HG   LEU  33           HG       LEU  33  47.460  26.348 -18.803
  257   1HD1  LEU  33          1HD1      LEU  33  50.295  27.477 -18.871
  258   2HD1  LEU  33          2HD1      LEU  33  48.834  28.257 -19.524
  259   3HD1  LEU  33          3HD1      LEU  33  49.444  26.767 -20.260
  260   1HD2  LEU  33          1HD2      LEU  33  50.080  25.166 -17.798
  261   2HD2  LEU  33          2HD2      LEU  33  48.463  24.465 -17.564
  262   3HD2  LEU  33          3HD2      LEU  33  49.144  24.597 -19.199
  263    H    ALA  34           H        ALA  34  45.612  27.173 -16.211
  264    HA   ALA  34           HA       ALA  34  43.983  27.458 -18.567
  265   1HB   ALA  34          1HB       ALA  34  42.238  26.394 -17.169
  266   2HB   ALA  34          2HB       ALA  34  43.255  26.624 -15.728
  267   3HB   ALA  34          3HB       ALA  34  43.783  25.527 -17.026
  268    H    LYS  35           H        LYS  35  44.684  29.411 -15.946
  269    HA   LYS  35           HA       LYS  35  44.028  31.395 -15.161
  270   1HB   LYS  35          1HB       LYS  35  44.683  31.696 -17.664
  271   2HB   LYS  35          2HB       LYS  35  42.954  31.969 -17.917
  272   1HG   LYS  35          2HG       LYS  35  43.924  34.116 -17.546
  273   2HG   LYS  35          1HG       LYS  35  43.122  33.709 -16.012
  274   1HD   LYS  35          2HD       LYS  35  45.367  32.875 -15.150
  275   2HD   LYS  35          1HD       LYS  35  46.084  33.438 -16.675
  276   1HE   LYS  35          2HE       LYS  35  44.592  35.207 -14.692
  277   2HE   LYS  35          1HE       LYS  35  46.356  35.057 -14.800
  278   1HZ   LYS  35          1HZ       LYS  35  45.577  36.951 -15.984
  279   2HZ   LYS  35          2HZ       LYS  35  44.597  36.027 -16.935
  280   3HZ   LYS  35          3HZ       LYS  35  46.235  35.865 -17.037
  281    H    THR  36           H        THR  36  42.274  29.750 -14.187
  282    HA   THR  36           HA       THR  36  39.665  31.183 -14.430
  283    HB   THR  36           HB       THR  36  38.781  29.414 -12.979
  284    HG1  THR  36           HG1      THR  36  40.128  27.616 -12.565
  285   1HG2  THR  36          1HG2      THR  36  40.278  28.283 -15.385
  286   2HG2  THR  36          2HG2      THR  36  38.856  27.575 -14.593
  287   3HG2  THR  36          3HG2      THR  36  38.713  29.127 -15.444
  288    H    CYS  37           H        CYS  37  42.524  31.892 -13.235
  289    HA   CYS  37           HA       CYS  37  41.455  33.079 -10.737
  290   1HB   CYS  37          2HB       CYS  37  44.009  31.473 -11.035
  291   2HB   CYS  37          1HB       CYS  37  43.579  32.429  -9.613
  292    HXT  CYS  37           HO        OH  38  43.017  34.643  -9.943
  Start of MODEL    4
    1   1H    GLY   1          1H        GLY   1  66.424  55.356  13.310
    2   2H    GLY   1          2H        GLY   1  65.663  56.390  12.274
    3   3H    GLY   1          3H        GLY   1  64.782  55.312  13.159
    4   1HA   GLY   1          2HA       GLY   1  66.725  54.627  11.069
    5   2HA   GLY   1          1HA       GLY   1  65.779  53.470  12.024
    6    H    ILE   2           H        ILE   2  65.264  56.422  10.019
    7    HA   ILE   2           HA       ILE   2  62.595  55.897   9.321
    8    HB   ILE   2           HB       ILE   2  64.141  57.983   9.134
    9   1HG1  ILE   2          2HG1      ILE   2  61.812  58.130   8.763
   10   2HG1  ILE   2          1HG1      ILE   2  62.681  59.060   7.536
   11   1HG2  ILE   2          1HG2      ILE   2  64.497  56.896   6.314
   12   2HG2  ILE   2          2HG2      ILE   2  64.962  58.500   6.907
   13   3HG2  ILE   2          3HG2      ILE   2  65.760  57.057   7.555
   14   1HD1  ILE   2          1HD1      ILE   2  62.323  57.121   5.930
   15   2HD1  ILE   2          2HD1      ILE   2  61.261  56.399   7.171
   16   3HD1  ILE   2          3HD1      ILE   2  60.853  57.962   6.456
   17    H    LEU   3           H        LEU   3  65.672  54.776   7.938
   18    HA   LEU   3           HA       LEU   3  64.560  53.618   5.557
   19   1HB   LEU   3          1HB       LEU   3  67.118  52.987   7.078
   20   2HB   LEU   3          2HB       LEU   3  66.748  52.479   5.424
   21    HG   LEU   3           HG       LEU   3  67.059  55.366   6.373
   22   1HD1  LEU   3          1HD1      LEU   3  68.847  53.597   4.657
   23   2HD1  LEU   3          2HD1      LEU   3  69.131  55.309   5.047
   24   3HD1  LEU   3          3HD1      LEU   3  69.169  54.088   6.336
   25   1HD2  LEU   3          1HD2      LEU   3  67.053  55.882   3.926
   26   2HD2  LEU   3          2HD2      LEU   3  66.596  54.197   3.591
   27   3HD2  LEU   3          3HD2      LEU   3  65.490  55.268   4.485
   28    H    ASP   4           H        ASP   4  64.521  52.599   8.890
   29    HA   ASP   4           HA       ASP   4  64.082  49.759   8.192
   30   1HB   ASP   4          2HB       ASP   4  64.306  51.198  10.871
   31   2HB   ASP   4          1HB       ASP   4  64.129  49.456  10.626
   32    HD2  ASP   4           HD2      ASP   4  67.456  49.084   9.365
   33    H    THR   5           H        THR   5  62.560  52.824   8.905
   34    HA   THR   5           HA       THR   5  60.223  51.732  10.067
   35    HB   THR   5           HB       THR   5  60.641  54.448   8.755
   36    HG1  THR   5           HG1      THR   5  61.997  54.000  10.538
   37   1HG2  THR   5          1HG2      THR   5  58.491  53.456  10.675
   38   2HG2  THR   5          2HG2      THR   5  58.242  53.922   8.976
   39   3HG2  THR   5          3HG2      THR   5  58.726  55.144  10.168
   40    H    LEU   6           H        LEU   6  60.944  53.086   6.812
   41    HA   LEU   6           HA       LEU   6  58.492  52.282   5.593
   42   1HB   LEU   6          2HB       LEU   6  59.607  52.797   3.500
   43   2HB   LEU   6          1HB       LEU   6  59.903  54.036   4.724
   44    HG   LEU   6           HG       LEU   6  62.135  52.589   5.137
   45   1HD1  LEU   6          1HD1      LEU   6  63.041  51.792   2.987
   46   2HD1  LEU   6          2HD1      LEU   6  61.577  50.874   3.373
   47   3HD1  LEU   6          3HD1      LEU   6  61.510  52.177   2.173
   48   1HD2  LEU   6          1HD2      LEU   6  62.040  54.970   4.561
   49   2HD2  LEU   6          2HD2      LEU   6  63.265  54.146   3.574
   50   3HD2  LEU   6          3HD2      LEU   6  61.691  54.565   2.864
   51    H    LYS   7           H        LYS   7  61.576  50.635   6.203
   52    HA   LYS   7           HA       LYS   7  61.218  48.393   4.537
   53   1HB   LYS   7          2HB       LYS   7  63.310  49.152   5.752
   54   2HB   LYS   7          1HB       LYS   7  62.589  48.533   7.248
   55   1HG   LYS   7          1HG       LYS   7  64.081  46.868   6.365
   56   2HG   LYS   7          2HG       LYS   7  62.420  46.268   6.166
   57   1HD   LYS   7          1HD       LYS   7  62.445  47.027   3.801
   58   2HD   LYS   7          2HD       LYS   7  64.089  47.665   4.026
   59   1HE   LYS   7          2HE       LYS   7  64.898  45.377   4.555
   60   2HE   LYS   7          1HE       LYS   7  63.256  44.744   4.316
   61   1HZ   LYS   7          1HZ       LYS   7  64.610  44.454   2.385
   62   2HZ   LYS   7          2HZ       LYS   7  63.368  45.487   2.054
   63   3HZ   LYS   7          3HZ       LYS   7  64.893  46.075   2.277
   64    H    GLN   8           H        GLN   8  60.303  49.020   7.952
   65    HA   GLN   8           HA       GLN   8  59.136  46.516   8.525
   66   1HB   GLN   8          1HB       GLN   8  59.828  48.302  10.129
   67   2HB   GLN   8          2HB       GLN   8  58.425  49.265   9.651
   68   1HG   GLN   8          2HG       GLN   8  58.317  46.450  10.810
   69   2HG   GLN   8          1HG       GLN   8  58.151  47.939  11.758
   70   1HE2  GLN   8          2HE2      GLN   8  56.313  45.518  10.706
   71   2HE2  GLN   8          1HE2      GLN   8  54.825  46.359  10.328
   72    H    PHE   9           H        PHE   9  57.685  49.611   7.401
   73    HA   PHE   9           HA       PHE   9  55.020  48.697   7.174
   74   1HB   PHE   9          1HB       PHE   9  55.661  51.056   7.166
   75   2HB   PHE   9          2HB       PHE   9  56.512  50.847   5.633
   76    HD1  PHE   9           HD1      PHE   9  55.338  50.893   3.541
   77    HD2  PHE   9           HD2      PHE   9  53.147  50.768   7.244
   78    HE1  PHE   9           HE1      PHE   9  53.232  51.337   2.311
   79    HE2  PHE   9           HE2      PHE   9  51.041  51.211   6.010
   80    HZ   PHE   9           HZ       PHE   9  51.082  51.497   3.543
   81    H    ALA  10           H        ALA  10  57.645  48.879   4.711
   82    HA   ALA  10           HA       ALA  10  56.186  47.740   2.564
   83   1HB   ALA  10          1HB       ALA  10  58.318  48.939   2.293
   84   2HB   ALA  10          2HB       ALA  10  59.169  47.648   3.172
   85   3HB   ALA  10          3HB       ALA  10  58.413  47.305   1.600
   86    H    LYS  11           H        LYS  11  58.160  46.273   5.175
   87    HA   LYS  11           HA       LYS  11  57.859  43.557   4.293
   88   1HB   LYS  11          2HB       LYS  11  59.642  44.353   5.804
   89   2HB   LYS  11          1HB       LYS  11  58.432  44.726   7.048
   90   1HG   LYS  11          1HG       LYS  11  57.804  42.347   7.183
   91   2HG   LYS  11          2HG       LYS  11  58.936  41.959   5.865
   92   1HD   LYS  11          1HD       LYS  11  60.820  42.768   7.247
   93   2HD   LYS  11          2HD       LYS  11  59.690  43.174   8.558
   94   1HE   LYS  11          2HE       LYS  11  59.018  40.795   8.721
   95   2HE   LYS  11          1HE       LYS  11  60.136  40.385   7.403
   96   1HZ   LYS  11          1HZ       LYS  11  60.891  41.522  10.000
   97   2HZ   LYS  11          2HZ       LYS  11  61.930  41.141   8.777
   98   3HZ   LYS  11          3HZ       LYS  11  61.081  39.950   9.539
   99    H    GLY  12           H        GLY  12  55.910  45.775   6.293
  100   1HA   GLY  12          1HA       GLY  12  54.088  43.663   7.126
  101   2HA   GLY  12          2HA       GLY  12  53.894  45.418   7.409
  102    H    VAL  13           H        VAL  13  54.262  45.994   4.471
  103    HA   VAL  13           HA       VAL  13  51.806  44.743   3.368
  104    HB   VAL  13           HB       VAL  13  53.627  46.822   2.106
  105   1HG1  VAL  13          1HG1      VAL  13  51.606  47.312   0.710
  106   2HG1  VAL  13          2HG1      VAL  13  50.745  45.983   1.512
  107   3HG1  VAL  13          3HG1      VAL  13  52.142  45.646   0.472
  108   1HG2  VAL  13          1HG2      VAL  13  51.042  47.226   3.680
  109   2HG2  VAL  13          2HG2      VAL  13  52.656  47.790   4.163
  110   3HG2  VAL  13          3HG2      VAL  13  51.870  48.485   2.739
  111    H    GLY  14           H        GLY  14  53.827  43.145   4.166
  112   1HA   GLY  14          2HA       GLY  14  54.608  41.804   1.644
  113   2HA   GLY  14          1HA       GLY  14  55.847  42.119   2.876
  114    H    LYS  15           H        LYS  15  53.887  41.916   5.091
  115    HA   LYS  15           HA       LYS  15  53.606  38.978   5.327
  116   1HB   LYS  15          1HB       LYS  15  52.999  41.240   7.261
  117   2HB   LYS  15          2HB       LYS  15  52.870  39.505   7.610
  118   1HG   LYS  15          1HG       LYS  15  55.435  40.994   6.893
  119   2HG   LYS  15          2HG       LYS  15  54.959  40.439   8.506
  120   1HD   LYS  15          1HD       LYS  15  54.964  38.089   7.698
  121   2HD   LYS  15          2HD       LYS  15  55.483  38.651   6.092
  122   1HE   LYS  15          2HE       LYS  15  57.523  39.634   7.088
  123   2HE   LYS  15          1HE       LYS  15  57.010  39.077   8.695
  124   1HZ   LYS  15          1HZ       LYS  15  57.596  37.357   6.393
  125   2HZ   LYS  15          2HZ       LYS  15  58.575  37.594   7.699
  126   3HZ   LYS  15          3HZ       LYS  15  57.120  36.839   7.884
  127    H    ASP  16           H        ASP  16  51.730  42.019   5.197
  128    HA   ASP  16           HA       ASP  16  49.118  40.853   5.277
  129   1HB   ASP  16          1HB       ASP  16  49.722  43.259   5.702
  130   2HB   ASP  16          2HB       ASP  16  50.043  43.441   3.972
  131    HD2  ASP  16           HD2      ASP  16  48.350  43.391   2.569
  132    H    LEU  17           H        LEU  17  51.626  40.836   2.905
  133    HA   LEU  17           HA       LEU  17  49.871  40.525   0.574
  134   1HB   LEU  17          2HB       LEU  17  51.953  41.866   0.383
  135   2HB   LEU  17          1HB       LEU  17  52.874  40.486   1.029
  136    HG   LEU  17           HG       LEU  17  52.303  39.125  -0.879
  137   1HD1  LEU  17          1HD2      LEU  17  50.934  41.640  -1.947
  138   2HD1  LEU  17          2HD2      LEU  17  51.288  40.192  -2.915
  139   3HD1  LEU  17          3HD2      LEU  17  50.142  40.092  -1.569
  140   1HD2  LEU  17          1HD1      LEU  17  54.358  40.485  -0.895
  141   2HD2  LEU  17          2HD1      LEU  17  53.701  40.318  -2.537
  142   3HD2  LEU  17          3HD1      LEU  17  53.470  41.835  -1.638
  143    H    VAL  18           H        VAL  18  52.229  38.835   2.689
  144    HA   VAL  18           HA       VAL  18  51.848  36.251   1.467
  145    HB   VAL  18           HB       VAL  18  52.917  37.136   4.167
  146   1HG1  VAL  18          1HG2      VAL  18  53.716  34.786   4.418
  147   2HG1  VAL  18          2HG2      VAL  18  52.732  34.321   3.014
  148   3HG1  VAL  18          3HG2      VAL  18  51.952  34.910   4.502
  149   1HG2  VAL  18          1HG1      VAL  18  54.236  35.861   1.724
  150   2HG2  VAL  18          2HG1      VAL  18  54.296  37.591   2.112
  151   3HG2  VAL  18          3HG1      VAL  18  55.059  36.413   3.199
  152    H    LYS  19           H        LYS  19  50.194  38.216   3.896
  153    HA   LYS  19           HA       LYS  19  48.416  36.140   4.865
  154   1HB   LYS  19          2HB       LYS  19  48.973  38.211   6.101
  155   2HB   LYS  19          1HB       LYS  19  48.083  39.156   4.887
  156   1HG   LYS  19          2HG       LYS  19  46.009  37.974   5.434
  157   2HG   LYS  19          1HG       LYS  19  46.883  36.889   6.542
  158   1HD   LYS  19          2HD       LYS  19  47.533  38.817   7.932
  159   2HD   LYS  19          1HD       LYS  19  46.649  39.910   6.844
  160   1HE   LYS  19          2HE       LYS  19  45.417  37.618   8.442
  161   2HE   LYS  19          1HE       LYS  19  45.349  39.334   8.889
  162   1HZ   LYS  19          1HZ       LYS  19  43.372  38.652   7.783
  163   2HZ   LYS  19          2HZ       LYS  19  44.174  39.756   6.858
  164   3HZ   LYS  19          3HZ       LYS  19  44.213  38.157   6.455
  165    H    GLY  20           H        GLY  20  48.503  38.417   2.173
  166   1HA   GLY  20          1HA       GLY  20  45.748  38.091   1.332
  167   2HA   GLY  20          2HA       GLY  20  47.085  38.822   0.417
  168    H    ALA  21           H        ALA  21  48.964  36.827   0.307
  169    HA   ALA  21           HA       ALA  21  47.964  35.012  -1.655
  170   1HB   ALA  21          1HB       ALA  21  50.539  34.942  -0.035
  171   2HB   ALA  21          2HB       ALA  21  50.303  35.805  -1.573
  172   3HB   ALA  21          3HB       ALA  21  50.212  34.030  -1.525
  173    H    ALA  22           H        ALA  22  48.319  34.863   1.859
  174    HA   ALA  22           HA       ALA  22  48.310  32.051   2.188
  175   1HB   ALA  22          1HB       ALA  22  47.575  32.490   4.471
  176   2HB   ALA  22          2HB       ALA  22  48.842  33.638   3.997
  177   3HB   ALA  22          3HB       ALA  22  47.139  34.154   4.042
  178    H    GLN  23           H        GLN  23  45.690  34.307   1.466
  179    HA   GLN  23           HA       GLN  23  43.451  32.791   2.179
  180   1HB   GLN  23          2HB       GLN  23  43.474  35.161   1.460
  181   2HB   GLN  23          1HB       GLN  23  43.831  34.653  -0.203
  182   1HG   GLN  23          2HG       GLN  23  41.708  33.397  -0.281
  183   2HG   GLN  23          1HG       GLN  23  41.368  33.847   1.402
  184   1HE2  GLN  23          2HE2      GLN  23  41.395  36.308   1.833
  185   2HE2  GLN  23          1HE2      GLN  23  40.635  37.313   0.619
  186    H    GLY  24           H        GLY  24  45.570  32.576  -0.711
  187   1HA   GLY  24          2HA       GLY  24  44.685  29.884  -1.274
  188   2HA   GLY  24          1HA       GLY  24  44.061  31.067  -2.447
  189    H    VAL  25           H        VAL  25  47.030  29.797  -0.912
  190    HA   VAL  25           HA       VAL  25  48.876  31.324  -2.343
  191    HB   VAL  25           HB       VAL  25  50.501  29.606  -1.669
  192   1HG1  VAL  25          1HG1      VAL  25  49.754  31.347  -0.088
  193   2HG1  VAL  25          2HG1      VAL  25  48.475  30.257   0.504
  194   3HG1  VAL  25          3HG1      VAL  25  50.184  29.839   0.745
  195   1HG2  VAL  25          1HG2      VAL  25  49.755  27.708  -0.224
  196   2HG2  VAL  25          2HG2      VAL  25  48.085  28.001  -0.747
  197   3HG2  VAL  25          3HG2      VAL  25  49.330  27.513  -1.925
  198    H    LEU  26           H        LEU  26  47.583  28.073  -3.022
  199    HA   LEU  26           HA       LEU  26  48.940  27.570  -5.457
  200   1HB   LEU  26          1HB       LEU  26  46.148  26.717  -4.613
  201   2HB   LEU  26          2HB       LEU  26  47.129  25.968  -5.881
  202    HG   LEU  26           HG       LEU  26  47.788  26.023  -2.901
  203   1HD1  LEU  26          1HD1      LEU  26  46.925  23.764  -4.750
  204   2HD1  LEU  26          2HD1      LEU  26  47.352  23.607  -3.031
  205   3HD1  LEU  26          3HD1      LEU  26  45.916  24.537  -3.507
  206   1HD2  LEU  26          1HD2      LEU  26  49.243  24.730  -5.253
  207   2HD2  LEU  26          2HD2      LEU  26  49.591  24.414  -3.539
  208   3HD2  LEU  26          3HD2      LEU  26  49.870  26.028  -4.209
  209    H    SER  27           H        SER  27  45.917  29.344  -4.753
  210    HA   SER  27           HA       SER  27  45.204  29.789  -7.496
  211   1HB   SER  27          1HB       SER  27  43.595  29.929  -5.632
  212   2HB   SER  27          2HB       SER  27  44.460  31.338  -4.980
  213    HG   SER  27           HG       SER  27  42.682  31.921  -6.298
  214    H    THR  28           H        THR  28  47.173  31.603  -5.102
  215    HA   THR  28           HA       THR  28  47.485  33.942  -6.699
  216    HB   THR  28           HB       THR  28  49.325  32.853  -4.539
  217    HG1  THR  28           HG1      THR  28  47.089  34.599  -4.432
  218   1HG2  THR  28          1HG2      THR  28  48.880  35.660  -5.660
  219   2HG2  THR  28          2HG2      THR  28  49.888  35.265  -4.251
  220   3HG2  THR  28          3HG2      THR  28  50.349  34.679  -5.860
  221    H    VAL  29           H        VAL  29  49.317  30.865  -6.501
  222    HA   VAL  29           HA       VAL  29  51.466  31.623  -8.215
  223    HB   VAL  29           HB       VAL  29  50.199  28.947  -7.523
  224   1HG1  VAL  29          1HG1      VAL  29  52.768  29.559  -9.033
  225   2HG1  VAL  29          2HG1      VAL  29  51.343  28.693  -9.664
  226   3HG1  VAL  29          3HG1      VAL  29  52.321  27.966  -8.378
  227   1HG2  VAL  29          1HG2      VAL  29  52.771  30.314  -6.614
  228   2HG2  VAL  29          2HG2      VAL  29  51.291  30.173  -5.644
  229   3HG2  VAL  29          3HG2      VAL  29  52.195  28.716  -6.093
  230    H    SER  30           H        SER  30  48.117  30.601  -8.809
  231    HA   SER  30           HA       SER  30  48.551  30.290 -11.685
  232   1HB   SER  30          2HB       SER  30  46.855  28.963 -10.369
  233   2HB   SER  30          1HB       SER  30  45.961  30.461 -10.073
  234    HG   SER  30           HG       SER  30  45.187  29.323 -11.902
  235    H    CYS  31           H        CYS  31  46.688  32.455  -9.573
  236    HA   CYS  31           HA       CYS  31  46.029  34.471 -11.432
  237   1HB   CYS  31          1HB       CYS  31  45.075  34.128  -9.157
  238   2HB   CYS  31          2HB       CYS  31  46.609  34.651  -8.461
  239    H    LYS  32           H        LYS  32  49.149  33.566 -10.282
  240    HA   LYS  32           HA       LYS  32  50.331  36.172 -10.007
  241   1HB   LYS  32          1HB       LYS  32  51.067  34.124  -8.818
  242   2HB   LYS  32          2HB       LYS  32  51.415  33.362 -10.380
  243   1HG   LYS  32          2HG       LYS  32  53.498  33.996  -9.738
  244   2HG   LYS  32          1HG       LYS  32  53.030  35.329 -10.791
  245   1HD   LYS  32          2HD       LYS  32  53.965  36.409  -8.906
  246   2HD   LYS  32          1HD       LYS  32  52.213  36.513  -8.627
  247   1HE   LYS  32          1HE       LYS  32  52.376  34.503  -7.133
  248   2HE   LYS  32          2HE       LYS  32  54.122  34.444  -7.440
  249   1HZ   LYS  32          1HZ       LYS  32  52.672  36.651  -6.167
  250   2HZ   LYS  32          2HZ       LYS  32  54.295  36.610  -6.457
  251   3HZ   LYS  32          3HZ       LYS  32  53.617  35.539  -5.401
  252    H    LEU  33           H        LEU  33  50.265  33.586 -12.465
  253    HA   LEU  33           HA       LEU  33  51.991  34.470 -14.406
  254   1HB   LEU  33          1HB       LEU  33  49.191  33.351 -14.827
  255   2HB   LEU  33          2HB       LEU  33  50.482  33.370 -16.040
  256    HG   LEU  33           HG       LEU  33  50.602  31.879 -13.373
  257   1HD1  LEU  33          1HD1      LEU  33  48.930  30.945 -14.923
  258   2HD1  LEU  33          2HD1      LEU  33  50.331  29.866 -14.757
  259   3HD1  LEU  33          3HD1      LEU  33  50.155  30.876 -16.211
  260   1HD2  LEU  33          1HD2      LEU  33  52.854  32.486 -14.156
  261   2HD2  LEU  33          2HD2      LEU  33  52.467  31.891 -15.789
  262   3HD2  LEU  33          3HD2      LEU  33  52.569  30.759 -14.423
  263    H    ALA  34           H        ALA  34  48.524  35.464 -14.194
  264    HA   ALA  34           HA       ALA  34  48.991  37.659 -16.056
  265   1HB   ALA  34          1HB       ALA  34  46.543  36.901 -14.413
  266   2HB   ALA  34          2HB       ALA  34  46.854  36.406 -16.093
  267   3HB   ALA  34          3HB       ALA  34  46.586  38.120 -15.707
  268    H    LYS  35           H        LYS  35  48.911  37.096 -12.734
  269    HA   LYS  35           HA       LYS  35  49.401  38.268 -10.880
  270   1HB   LYS  35          2HB       LYS  35  51.378  38.838 -12.301
  271   2HB   LYS  35          1HB       LYS  35  50.564  40.344 -12.756
  272   1HG   LYS  35          2HG       LYS  35  52.012  40.860 -10.931
  273   2HG   LYS  35          1HG       LYS  35  50.379  40.816 -10.234
  274   1HD   LYS  35          2HD       LYS  35  50.855  38.429  -9.470
  275   2HD   LYS  35          1HD       LYS  35  52.501  38.629 -10.107
  276   1HE   LYS  35          1HE       LYS  35  52.844  40.585  -8.616
  277   2HE   LYS  35          2HE       LYS  35  51.207  40.370  -7.963
  278   1HZ   LYS  35          1HZ       LYS  35  53.395  38.424  -7.788
  279   2HZ   LYS  35          2HZ       LYS  35  52.857  39.392  -6.566
  280   3HZ   LYS  35          3HZ       LYS  35  51.874  38.220  -7.182
  281    H    THR  36           H        THR  36  47.115  38.473 -10.579
  282    HA   THR  36           HA       THR  36  46.632  41.332 -10.039
  283    HB   THR  36           HB       THR  36  45.153  40.751 -11.916
  284    HG1  THR  36           HG1      THR  36  43.271  41.482 -10.871
  285   1HG2  THR  36          1HG2      THR  36  43.268  39.230 -11.604
  286   2HG2  THR  36          2HG2      THR  36  44.795  38.344 -11.436
  287   3HG2  THR  36          3HG2      THR  36  43.849  38.787  -9.989
  288    H    CYS  37           H        CYS  37  47.657  38.639  -8.755
  289    HA   CYS  37           HA       CYS  37  46.276  39.234  -6.176
  290   1HB   CYS  37          2HB       CYS  37  47.232  36.502  -7.065
  291   2HB   CYS  37          1HB       CYS  37  46.435  36.924  -5.545
  292    HXT  CYS  37           HO        OH  38  50.223  38.281  -6.509
  Start of MODEL    5
    1   1H    GLY   1          1H        GLY   1  64.392  52.790  14.469
    2   2H    GLY   1          2H        GLY   1  62.773  53.106  14.409
    3   3H    GLY   1          3H        GLY   1  63.735  53.921  15.473
    4   1HA   GLY   1          1HA       GLY   1  63.855  54.096  12.552
    5   2HA   GLY   1          2HA       GLY   1  63.162  55.315  13.648
    6    H    ILE   2           H        ILE   2  66.595  56.523  12.887
    7    HA   ILE   2           HA       ILE   2  63.882  56.538  11.860
    8    HB   ILE   2           HB       ILE   2  65.775  58.374  12.062
    9   1HG1  ILE   2          2HG1      ILE   2  63.554  58.899  11.465
   10   2HG1  ILE   2          1HG1      ILE   2  64.678  59.731  10.382
   11   1HG2  ILE   2          1HG2      ILE   2  66.915  58.844   9.974
   12   2HG2  ILE   2          2HG2      ILE   2  66.270  57.370   9.231
   13   3HG2  ILE   2          3HG2      ILE   2  67.396  57.259  10.603
   14   1HD1  ILE   2          1HD1      ILE   2  62.813  58.955   9.083
   15   2HD1  ILE   2          2HD1      ILE   2  62.948  57.318   9.732
   16   3HD1  ILE   2          3HD1      ILE   2  64.207  57.953   8.638
   17    H    LEU   3           H        LEU   3  66.911  54.861  11.223
   18    HA   LEU   3           HA       LEU   3  66.530  54.196   8.501
   19   1HB   LEU   3          2HB       LEU   3  68.026  52.767  10.732
   20   2HB   LEU   3          1HB       LEU   3  68.232  52.467   9.004
   21    HG   LEU   3           HG       LEU   3  68.826  55.103  10.432
   22   1HD1  LEU   3          1HD1      LEU   3  70.671  52.978   9.270
   23   2HD1  LEU   3          2HD1      LEU   3  71.176  54.522   9.993
   24   3HD1  LEU   3          3HD1      LEU   3  70.393  53.285  11.000
   25   1HD2  LEU   3          1HD2      LEU   3  69.938  55.703   8.273
   26   2HD2  LEU   3          2HD2      LEU   3  69.260  54.234   7.538
   27   3HD2  LEU   3          3HD2      LEU   3  68.185  55.537   8.101
   28    H    ASP   4           H        ASP   4  65.065  52.848  11.408
   29    HA   ASP   4           HA       ASP   4  64.410  50.291  10.089
   30   1HB   ASP   4          2HB       ASP   4  63.955  51.338  12.911
   31   2HB   ASP   4          1HB       ASP   4  63.557  49.718  12.325
   32    HD2  ASP   4           HD2      ASP   4  67.410  50.734  13.105
   33    H    THR   5           H        THR   5  63.189  53.470  10.521
   34    HA   THR   5           HA       THR   5  60.545  52.957  11.130
   35    HB   THR   5           HB       THR   5  61.749  55.239   9.517
   36    HG1  THR   5           HG1      THR   5  61.652  56.242  11.565
   37   1HG2  THR   5          1HG2      THR   5  59.740  56.517  10.244
   38   2HG2  THR   5          2HG2      THR   5  59.049  55.026  10.923
   39   3HG2  THR   5          3HG2      THR   5  59.304  55.177   9.168
   40    H    LEU   6           H        LEU   6  62.047  53.480   7.889
   41    HA   LEU   6           HA       LEU   6  59.703  52.932   6.358
   42   1HB   LEU   6          2HB       LEU   6  62.651  52.662   5.658
   43   2HB   LEU   6          1HB       LEU   6  61.312  52.730   4.504
   44    HG   LEU   6           HG       LEU   6  62.118  54.970   6.417
   45   1HD1  LEU   6          1HD2      LEU   6  63.744  54.576   4.604
   46   2HD1  LEU   6          2HD2      LEU   6  62.436  54.678   3.403
   47   3HD1  LEU   6          3HD2      LEU   6  62.873  56.105   4.369
   48   1HD2  LEU   6          1HD1      LEU   6  60.012  54.857   4.211
   49   2HD2  LEU   6          2HD1      LEU   6  59.708  55.075   5.952
   50   3HD2  LEU   6          3HD1      LEU   6  60.547  56.337   5.037
   51    H    LYS   7           H        LYS   7  62.317  50.888   7.662
   52    HA   LYS   7           HA       LYS   7  61.748  48.523   6.216
   53   1HB   LYS   7          1HB       LYS   7  62.837  48.781   9.039
   54   2HB   LYS   7          2HB       LYS   7  62.987  47.381   7.972
   55   1HG   LYS   7          1HG       LYS   7  64.196  50.140   7.479
   56   2HG   LYS   7          2HG       LYS   7  65.058  48.681   7.995
   57   1HD   LYS   7          2HD       LYS   7  64.382  47.543   5.892
   58   2HD   LYS   7          1HD       LYS   7  63.572  49.036   5.359
   59   1HE   LYS   7          1HE       LYS   7  65.727  50.248   5.479
   60   2HE   LYS   7          2HE       LYS   7  66.537  48.761   6.014
   61   1HZ   LYS   7          1HZ       LYS   7  65.924  47.755   3.944
   62   2HZ   LYS   7          2HZ       LYS   7  65.171  49.136   3.445
   63   3HZ   LYS   7          3HZ       LYS   7  66.803  49.126   3.682
   64    H    GLN   8           H        GLN   8  60.396  49.852   9.245
   65    HA   GLN   8           HA       GLN   8  58.920  47.641  10.109
   66   1HB   GLN   8          1HB       GLN   8  59.423  49.764  11.328
   67   2HB   GLN   8          2HB       GLN   8  58.195  50.594  10.364
   68   1HG   GLN   8          2HG       GLN   8  57.682  48.166  12.128
   69   2HG   GLN   8          1HG       GLN   8  57.460  49.848  12.642
   70   1HE2  GLN   8          1HE2      GLN   8  56.085  51.208  10.966
   71   2HE2  GLN   8          2HE2      GLN   8  54.594  50.437  10.470
   72    H    PHE   9           H        PHE   9  57.810  50.432   8.107
   73    HA   PHE   9           HA       PHE   9  55.245  49.273   7.542
   74   1HB   PHE   9          1HB       PHE   9  56.803  51.480   6.146
   75   2HB   PHE   9          2HB       PHE   9  55.100  51.099   5.868
   76    HD1  PHE   9           HD1      PHE   9  57.387  53.029   7.839
   77    HD2  PHE   9           HD2      PHE   9  53.489  51.206   7.890
   78    HE1  PHE   9           HE1      PHE   9  56.736  54.471   9.749
   79    HE2  PHE   9           HE2      PHE   9  52.831  52.669   9.781
   80    HZ   PHE   9           HZ       PHE   9  54.458  54.292  10.721
   81    H    ALA  10           H        ALA  10  58.401  49.157   5.871
   82    HA   ALA  10           HA       ALA  10  57.428  47.949   3.468
   83   1HB   ALA  10          1HB       ALA  10  60.127  47.635   4.844
   84   2HB   ALA  10          2HB       ALA  10  59.692  48.925   3.698
   85   3HB   ALA  10          3HB       ALA  10  59.753  47.234   3.156
   86    H    LYS  11           H        LYS  11  58.497  46.657   6.632
   87    HA   LYS  11           HA       LYS  11  57.648  43.915   5.938
   88   1HB   LYS  11          2HB       LYS  11  58.685  45.168   8.511
   89   2HB   LYS  11          1HB       LYS  11  58.317  43.448   8.288
   90   1HG   LYS  11          1HG       LYS  11  60.405  45.006   6.701
   91   2HG   LYS  11          2HG       LYS  11  60.725  43.913   8.060
   92   1HD   LYS  11          2HD       LYS  11  59.695  42.039   6.788
   93   2HD   LYS  11          1HD       LYS  11  59.440  43.132   5.408
   94   1HE   LYS  11          2HE       LYS  11  61.877  43.539   5.275
   95   2HE   LYS  11          1HE       LYS  11  62.136  42.454   6.658
   96   1HZ   LYS  11          1HZ       LYS  11  60.976  41.687   4.075
   97   2HZ   LYS  11          2HZ       LYS  11  61.217  40.681   5.360
   98   3HZ   LYS  11          3HZ       LYS  11  62.508  41.354   4.586
   99    H    GLY  12           H        GLY  12  55.617  45.519   5.411
  100   1HA   GLY  12          2HA       GLY  12  53.488  44.906   7.372
  101   2HA   GLY  12          1HA       GLY  12  54.006  46.580   7.114
  102    H    VAL  13           H        VAL  13  54.458  47.150   4.744
  103    HA   VAL  13           HA       VAL  13  52.351  46.071   2.985
  104    HB   VAL  13           HB       VAL  13  54.725  47.833   2.261
  105   1HG1  VAL  13          1HG1      VAL  13  51.994  47.402   0.952
  106   2HG1  VAL  13          2HG1      VAL  13  53.539  46.783   0.335
  107   3HG1  VAL  13          3HG1      VAL  13  53.241  48.524   0.372
  108   1HG2  VAL  13          1HG2      VAL  13  53.168  49.782   2.369
  109   2HG2  VAL  13          2HG2      VAL  13  51.949  48.737   3.131
  110   3HG2  VAL  13          3HG2      VAL  13  53.484  49.083   3.962
  111    H    GLY  14           H        GLY  14  54.348  44.601   4.642
  112   1HA   GLY  14          1HA       GLY  14  55.409  42.901   2.432
  113   2HA   GLY  14          2HA       GLY  14  56.263  43.136   3.967
  114    H    LYS  15           H        LYS  15  53.690  43.384   5.486
  115    HA   LYS  15           HA       LYS  15  53.114  40.547   5.929
  116   1HB   LYS  15          1HB       LYS  15  52.008  43.067   7.199
  117   2HB   LYS  15          2HB       LYS  15  51.720  41.398   7.731
  118   1HG   LYS  15          2HG       LYS  15  54.405  42.847   7.710
  119   2HG   LYS  15          1HG       LYS  15  53.437  42.395   9.128
  120   1HD   LYS  15          2HD       LYS  15  53.632  39.982   8.284
  121   2HD   LYS  15          1HD       LYS  15  54.886  40.564   7.174
  122   1HE   LYS  15          2HE       LYS  15  54.937  40.842  10.211
  123   2HE   LYS  15          1HE       LYS  15  55.859  39.659   9.264
  124   1HZ   LYS  15          1HZ       LYS  15  56.124  42.575   9.067
  125   2HZ   LYS  15          2HZ       LYS  15  56.974  41.466   8.191
  126   3HZ   LYS  15          3HZ       LYS  15  57.174  41.554   9.826
  127    H    ASP  16           H        ASP  16  51.703  43.407   4.384
  128    HA   ASP  16           HA       ASP  16  49.105  42.216   3.909
  129   1HB   ASP  16          1HB       ASP  16  49.592  44.668   3.951
  130   2HB   ASP  16          2HB       ASP  16  50.521  44.484   2.454
  131    HD2  ASP  16           HD2      ASP  16  49.395  43.826   0.606
  132    H    LEU  17           H        LEU  17  52.328  42.019   2.472
  133    HA   LEU  17           HA       LEU  17  51.372  40.865  -0.066
  134   1HB   LEU  17          1HB       LEU  17  54.035  41.722   1.107
  135   2HB   LEU  17          2HB       LEU  17  53.920  40.740  -0.347
  136    HG   LEU  17           HG       LEU  17  52.636  42.385  -1.523
  137   1HD1  LEU  17          1HD1      LEU  17  51.280  43.466   0.068
  138   2HD1  LEU  17          2HD1      LEU  17  52.670  43.979   1.046
  139   3HD1  LEU  17          3HD1      LEU  17  52.368  44.716  -0.545
  140   1HD2  LEU  17          1HD2      LEU  17  55.093  42.532  -1.594
  141   2HD2  LEU  17          2HD2      LEU  17  55.082  43.614  -0.185
  142   3HD2  LEU  17          3HD2      LEU  17  54.366  44.147  -1.723
  143    H    VAL  18           H        VAL  18  53.206  40.160   2.964
  144    HA   VAL  18           HA       VAL  18  53.554  37.372   2.235
  145    HB   VAL  18           HB       VAL  18  53.849  38.942   4.792
  146   1HG1  VAL  18          1HG1      VAL  18  54.656  36.867   5.870
  147   2HG1  VAL  18          2HG1      VAL  18  54.030  35.932   4.489
  148   3HG1  VAL  18          3HG1      VAL  18  52.914  36.841   5.544
  149   1HG2  VAL  18          1HG2      VAL  18  56.182  38.239   4.548
  150   2HG2  VAL  18          2HG2      VAL  18  55.646  38.960   3.016
  151   3HG2  VAL  18          3HG2      VAL  18  55.757  37.197   3.173
  152    H    LYS  19           H        LYS  19  51.022  39.372   3.583
  153    HA   LYS  19           HA       LYS  19  49.345  37.201   4.550
  154   1HB   LYS  19          1HB       LYS  19  49.190  39.521   5.396
  155   2HB   LYS  19          2HB       LYS  19  48.692  40.071   3.786
  156   1HG   LYS  19          2HG       LYS  19  46.760  39.809   5.270
  157   2HG   LYS  19          1HG       LYS  19  46.659  38.672   3.916
  158   1HD   LYS  19          1HD       LYS  19  47.507  36.854   5.364
  159   2HD   LYS  19          2HD       LYS  19  47.683  38.001   6.713
  160   1HE   LYS  19          2HE       LYS  19  45.243  38.437   6.651
  161   2HE   LYS  19          1HE       LYS  19  45.072  37.287   5.308
  162   1HZ   LYS  19          1HZ       LYS  19  45.881  35.575   6.756
  163   2HZ   LYS  19          2HZ       LYS  19  46.039  36.644   8.002
  164   3HZ   LYS  19          3HZ       LYS  19  44.544  36.294   7.401
  165    H    GLY  20           H        GLY  20  49.831  39.024   1.563
  166   1HA   GLY  20          2HA       GLY  20  47.537  38.024   0.121
  167   2HA   GLY  20          1HA       GLY  20  48.942  38.888  -0.537
  168    H    ALA  21           H        ALA  21  51.040  37.228   0.324
  169    HA   ALA  21           HA       ALA  21  50.968  34.996  -1.474
  170   1HB   ALA  21          1HB       ALA  21  52.791  35.576   0.895
  171   2HB   ALA  21          2HB       ALA  21  53.056  36.127  -0.776
  172   3HB   ALA  21          3HB       ALA  21  53.093  34.392  -0.395
  173    H    ALA  22           H        ALA  22  50.223  35.492   1.951
  174    HA   ALA  22           HA       ALA  22  49.827  32.610   2.385
  175   1HB   ALA  22          1HB       ALA  22  49.524  34.943   4.299
  176   2HB   ALA  22          2HB       ALA  22  49.497  33.218   4.722
  177   3HB   ALA  22          3HB       ALA  22  50.985  33.950   4.094
  178    H    GLN  23           H        GLN  23  48.056  34.143   0.494
  179    HA   GLN  23           HA       GLN  23  45.473  34.235   1.886
  180   1HB   GLN  23          1HB       GLN  23  46.128  35.942   0.222
  181   2HB   GLN  23          2HB       GLN  23  46.206  34.692  -1.036
  182   1HG   GLN  23          2HG       GLN  23  43.814  34.175  -0.672
  183   2HG   GLN  23          1HG       GLN  23  43.748  35.394   0.617
  184   1HE2  GLN  23          1HE2      GLN  23  44.508  37.673  -0.086
  185   2HE2  GLN  23          2HE2      GLN  23  43.963  38.217  -1.658
  186    H    GLY  24           H        GLY  24  46.815  32.603  -1.034
  187   1HA   GLY  24          1HA       GLY  24  45.862  29.990  -0.354
  188   2HA   GLY  24          2HA       GLY  24  44.734  30.796  -1.470
  189    H    VAL  25           H        VAL  25  48.116  29.809  -0.989
  190    HA   VAL  25           HA       VAL  25  49.228  30.676  -3.392
  191    HB   VAL  25           HB       VAL  25  49.904  28.182  -1.769
  192   1HG1  VAL  25          1HG2      VAL  25  52.174  28.483  -2.736
  193   2HG1  VAL  25          2HG2      VAL  25  50.974  28.132  -3.992
  194   3HG1  VAL  25          3HG2      VAL  25  51.557  29.797  -3.761
  195   1HG2  VAL  25          1HG1      VAL  25  51.594  29.651  -0.710
  196   2HG2  VAL  25          2HG1      VAL  25  50.946  31.039  -1.614
  197   3HG2  VAL  25          3HG1      VAL  25  49.948  30.221  -0.388
  198    H    LEU  26           H        LEU  26  47.829  27.472  -2.611
  199    HA   LEU  26           HA       LEU  26  48.084  26.234  -5.114
  200   1HB   LEU  26          2HB       LEU  26  45.872  25.952  -3.047
  201   2HB   LEU  26          1HB       LEU  26  46.249  24.788  -4.325
  202    HG   LEU  26           HG       LEU  26  48.109  25.562  -2.030
  203   1HD1  LEU  26          1HD1      LEU  26  46.148  24.243  -1.323
  204   2HD1  LEU  26          2HD1      LEU  26  46.512  23.027  -2.569
  205   3HD1  LEU  26          3HD1      LEU  26  47.641  23.287  -1.221
  206   1HD2  LEU  26          1HD2      LEU  26  49.420  24.918  -4.005
  207   2HD2  LEU  26          2HD2      LEU  26  49.443  23.603  -2.821
  208   3HD2  LEU  26          3HD2      LEU  26  48.391  23.486  -4.249
  209    H    SER  27           H        SER  27  45.730  28.629  -3.986
  210    HA   SER  27           HA       SER  27  44.007  28.322  -6.333
  211   1HB   SER  27          1HB       SER  27  43.060  28.917  -4.144
  212   2HB   SER  27          2HB       SER  27  44.053  30.391  -4.099
  213    HG   SER  27           HG       SER  27  42.113  29.736  -6.067
  214    H    THR  28           H        THR  28  46.394  30.687  -5.047
  215    HA   THR  28           HA       THR  28  46.078  32.608  -7.096
  216    HB   THR  28           HB       THR  28  48.474  32.036  -5.314
  217    HG1  THR  28           HG1      THR  28  46.519  32.455  -4.210
  218   1HG2  THR  28          1HG2      THR  28  49.092  33.510  -7.177
  219   2HG2  THR  28          2HG2      THR  28  48.953  34.463  -5.692
  220   3HG2  THR  28          3HG2      THR  28  47.650  34.512  -6.898
  221    H    VAL  29           H        VAL  29  48.669  30.140  -6.637
  222    HA   VAL  29           HA       VAL  29  50.191  30.657  -8.851
  223    HB   VAL  29           HB       VAL  29  50.556  29.083  -6.911
  224   1HG1  VAL  29          1HG2      VAL  29  49.978  26.750  -7.125
  225   2HG1  VAL  29          2HG2      VAL  29  49.195  27.024  -8.691
  226   3HG1  VAL  29          3HG2      VAL  29  48.490  27.712  -7.210
  227   1HG2  VAL  29          1HG1      VAL  29  52.083  27.639  -8.178
  228   2HG2  VAL  29          2HG1      VAL  29  52.132  29.307  -8.789
  229   3HG2  VAL  29          3HG1      VAL  29  51.244  28.055  -9.691
  230    H    SER  30           H        SER  30  47.183  28.818  -8.696
  231    HA   SER  30           HA       SER  30  47.347  27.705 -11.323
  232   1HB   SER  30          1HB       SER  30  45.927  26.763  -9.532
  233   2HB   SER  30          2HB       SER  30  44.916  28.223  -9.549
  234    HG   SER  30           HG       SER  30  45.344  26.451 -11.728
  235    H    CYS  31           H        CYS  31  45.231  30.364 -10.122
  236    HA   CYS  31           HA       CYS  31  44.497  31.203 -12.762
  237   1HB   CYS  31          2HB       CYS  31  43.656  33.236 -11.598
  238   2HB   CYS  31          1HB       CYS  31  43.051  31.716 -10.944
  239    H    LYS  32           H        LYS  32  47.567  31.309 -11.485
  240    HA   LYS  32           HA       LYS  32  48.169  33.995 -12.591
  241   1HB   LYS  32          2HB       LYS  32  49.782  31.983 -11.021
  242   2HB   LYS  32          1HB       LYS  32  50.545  33.373 -11.820
  243   1HG   LYS  32          2HG       LYS  32  48.100  33.861 -10.166
  244   2HG   LYS  32          1HG       LYS  32  49.648  33.550  -9.329
  245   1HD   LYS  32          2HD       LYS  32  50.718  35.373 -10.598
  246   2HD   LYS  32          1HD       LYS  32  49.185  35.719 -11.418
  247   1HE   LYS  32          1HE       LYS  32  49.671  35.880  -8.412
  248   2HE   LYS  32          2HE       LYS  32  49.609  37.261  -9.524
  249   1HZ   LYS  32          1HZ       LYS  32  47.354  36.681 -10.028
  250   2HZ   LYS  32          2HZ       LYS  32  47.402  35.406  -8.982
  251   3HZ   LYS  32          3HZ       LYS  32  47.542  36.946  -8.412
  252    H    LEU  33           H        LEU  33  47.089  32.560 -14.460
  253    HA   LEU  33           HA       LEU  33  49.047  31.140 -16.110
  254   1HB   LEU  33          1HB       LEU  33  46.679  30.545 -16.238
  255   2HB   LEU  33          2HB       LEU  33  46.248  32.209 -16.659
  256    HG   LEU  33           HG       LEU  33  47.527  32.009 -18.782
  257   1HD1  LEU  33          1HD2      LEU  33  49.207  30.326 -18.151
  258   2HD1  LEU  33          2HD2      LEU  33  47.927  29.119 -17.886
  259   3HD1  LEU  33          3HD2      LEU  33  48.252  29.737 -19.520
  260   1HD2  LEU  33          1HD1      LEU  33  45.957  30.471 -19.891
  261   2HD2  LEU  33          2HD1      LEU  33  45.118  31.484 -18.697
  262   3HD2  LEU  33          3HD1      LEU  33  45.496  29.788 -18.315
  263    H    ALA  34           H        ALA  34  47.138  34.147 -16.480
  264    HA   ALA  34           HA       ALA  34  49.597  35.619 -17.237
  265   1HB   ALA  34          1HB       ALA  34  46.892  35.873 -18.625
  266   2HB   ALA  34          2HB       ALA  34  48.365  35.180 -19.341
  267   3HB   ALA  34          3HB       ALA  34  48.316  36.903 -18.911
  268    H    LYS  35           H        LYS  35  48.633  35.283 -14.712
  269    HA   LYS  35           HA       LYS  35  47.629  36.136 -12.899
  270   1HB   LYS  35          1HB       LYS  35  48.290  38.800 -14.198
  271   2HB   LYS  35          2HB       LYS  35  47.991  38.480 -12.478
  272   1HG   LYS  35          2HG       LYS  35  50.314  37.453 -14.150
  273   2HG   LYS  35          1HG       LYS  35  50.371  38.647 -12.843
  274   1HD   LYS  35          2HD       LYS  35  49.554  36.846 -11.250
  275   2HD   LYS  35          1HD       LYS  35  49.713  35.682 -12.581
  276   1HE   LYS  35          2HE       LYS  35  51.976  37.398 -11.485
  277   2HE   LYS  35          1HE       LYS  35  51.684  35.697 -11.075
  278   1HZ   LYS  35          1HZ       LYS  35  52.270  36.727 -13.757
  279   2HZ   LYS  35          2HZ       LYS  35  53.314  35.909 -12.778
  280   3HZ   LYS  35          3HZ       LYS  35  51.978  35.149 -13.375
  281    H    THR  36           H        THR  36  45.740  35.109 -14.149
  282    HA   THR  36           HA       THR  36  43.566  36.765 -14.980
  283    HB   THR  36           HB       THR  36  43.494  34.031 -13.633
  284    HG1  THR  36           HG1      THR  36  43.737  34.755 -16.366
  285   1HG2  THR  36          1HG2      THR  36  41.409  33.767 -14.941
  286   2HG2  THR  36          2HG2      THR  36  41.285  35.124 -13.804
  287   3HG2  THR  36          3HG2      THR  36  41.566  35.435 -15.534
  288    H    CYS  37           H        CYS  37  44.690  35.472 -11.833
  289    HA   CYS  37           HA       CYS  37  42.644  36.861 -10.269
  290   1HB   CYS  37          2HB       CYS  37  45.260  35.483  -9.646
  291   2HB   CYS  37          1HB       CYS  37  44.381  36.418  -8.430
  292    HXT  CYS  37           HO        OH  38  46.044  37.302 -10.993
  Start of MODEL    6
    1   1H    GLY   1          1H        GLY   1  66.196  53.375  10.958
    2   2H    GLY   1          2H        GLY   1  65.216  54.104  12.066
    3   3H    GLY   1          3H        GLY   1  66.851  54.309  12.149
    4   1HA   GLY   1          1HA       GLY   1  65.836  56.269  11.278
    5   2HA   GLY   1          2HA       GLY   1  66.882  55.477  10.083
    6    H    ILE   2           H        ILE   2  65.400  56.978   8.748
    7    HA   ILE   2           HA       ILE   2  62.707  56.349   8.253
    8    HB   ILE   2           HB       ILE   2  64.254  58.346   7.610
    9   1HG1  ILE   2          2HG1      ILE   2  61.920  58.456   7.301
   10   2HG1  ILE   2          1HG1      ILE   2  62.738  59.093   5.869
   11   1HG2  ILE   2          1HG2      ILE   2  65.809  57.111   6.186
   12   2HG2  ILE   2          2HG2      ILE   2  64.992  58.409   5.298
   13   3HG2  ILE   2          3HG2      ILE   2  64.499  56.725   5.047
   14   1HD1  ILE   2          1HD1      ILE   2  62.299  56.855   4.734
   15   2HD1  ILE   2          2HD1      ILE   2  61.283  56.442   6.142
   16   3HD1  ILE   2          3HD1      ILE   2  60.861  57.818   5.120
   17    H    LEU   3           H        LEU   3  65.741  54.944   7.027
   18    HA   LEU   3           HA       LEU   3  64.560  53.366   4.945
   19   1HB   LEU   3          2HB       LEU   3  67.155  53.088   6.516
   20   2HB   LEU   3          1HB       LEU   3  66.759  52.208   5.037
   21    HG   LEU   3           HG       LEU   3  67.042  55.241   5.276
   22   1HD1  LEU   3          1HD2      LEU   3  68.851  53.146   4.008
   23   2HD1  LEU   3          2HD2      LEU   3  69.106  54.905   3.979
   24   3HD1  LEU   3          3HD2      LEU   3  69.174  54.025   5.519
   25   1HD2  LEU   3          1HD1      LEU   3  65.464  54.679   3.479
   26   2HD2  LEU   3          2HD1      LEU   3  66.581  53.442   2.853
   27   3HD2  LEU   3          3HD1      LEU   3  67.013  55.164   2.776
   28    H    ASP   4           H        ASP   4  64.635  52.996   8.407
   29    HA   ASP   4           HA       ASP   4  64.166  50.076   8.265
   30   1HB   ASP   4          1HB       ASP   4  65.785  50.960   9.953
   31   2HB   ASP   4          2HB       ASP   4  64.490  51.952  10.644
   32    HD2  ASP   4           HD2      ASP   4  64.333  47.896  11.084
   33    H    THR   5           H        THR   5  62.724  53.252   8.473
   34    HA   THR   5           HA       THR   5  60.330  52.390   9.736
   35    HB   THR   5           HB       THR   5  60.801  54.859   8.019
   36    HG1  THR   5           HG1      THR   5  60.927  54.430  10.822
   37   1HG2  THR   5          1HG2      THR   5  58.402  54.380   8.312
   38   2HG2  THR   5          2HG2      THR   5  58.643  54.202  10.066
   39   3HG2  THR   5          3HG2      THR   5  58.885  55.781   9.287
   40    H    LEU   6           H        LEU   6  61.380  52.965   6.365
   41    HA   LEU   6           HA       LEU   6  58.997  52.105   5.038
   42   1HB   LEU   6          2HB       LEU   6  61.926  52.065   4.213
   43   2HB   LEU   6          1HB       LEU   6  60.557  51.828   3.119
   44    HG   LEU   6           HG       LEU   6  61.074  54.365   4.734
   45   1HD1  LEU   6          1HD2      LEU   6  62.790  53.978   3.008
   46   2HD1  LEU   6          2HD2      LEU   6  61.519  53.755   1.785
   47   3HD1  LEU   6          3HD2      LEU   6  61.734  55.336   2.569
   48   1HD2  LEU   6          1HD1      LEU   6  59.382  55.346   3.185
   49   2HD2  LEU   6          2HD1      LEU   6  58.683  54.095   4.223
   50   3HD2  LEU   6          3HD1      LEU   6  59.068  53.726   2.525
   51    H    LYS   7           H        LYS   7  61.938  50.434   6.243
   52    HA   LYS   7           HA       LYS   7  61.463  47.906   5.147
   53   1HB   LYS   7          2HB       LYS   7  63.559  48.752   6.243
   54   2HB   LYS   7          1HB       LYS   7  62.748  48.612   7.812
   55   1HG   LYS   7          2HG       LYS   7  64.132  46.664   7.436
   56   2HG   LYS   7          1HG       LYS   7  62.426  46.168   7.397
   57   1HD   LYS   7          1HD       LYS   7  62.471  46.224   4.920
   58   2HD   LYS   7          2HD       LYS   7  64.160  46.780   4.960
   59   1HE   LYS   7          1HE       LYS   7  64.819  44.679   6.105
   60   2HE   LYS   7          2HE       LYS   7  63.131  44.127   6.066
   61   1HZ   LYS   7          1HZ       LYS   7  64.800  44.702   3.722
   62   2HZ   LYS   7          2HZ       LYS   7  64.410  43.203   4.289
   63   3HZ   LYS   7          3HZ       LYS   7  63.234  44.189   3.686
   64    H    GLN   8           H        GLN   8  60.441  49.324   8.291
   65    HA   GLN   8           HA       GLN   8  59.115  47.053   9.314
   66   1HB   GLN   8          2HB       GLN   8  59.799  49.037  10.627
   67   2HB   GLN   8          1HB       GLN   8  58.627  50.030   9.754
   68   1HG   GLN   8          1HG       GLN   8  57.752  49.412  11.929
   69   2HG   GLN   8          2HG       GLN   8  56.770  48.676  10.654
   70   1HE2  GLN   8          2HE2      GLN   8  56.825  46.382  10.365
   71   2HE2  GLN   8          1HE2      GLN   8  57.512  45.319  11.575
   72    H    PHE   9           H        PHE   9  57.946  49.871   7.438
   73    HA   PHE   9           HA       PHE   9  55.222  49.072   7.251
   74   1HB   PHE   9          1HB       PHE   9  56.037  51.348   6.820
   75   2HB   PHE   9          2HB       PHE   9  56.925  50.781   5.403
   76    HD1  PHE   9           HD1      PHE   9  55.842  50.531   3.285
   77    HD2  PHE   9           HD2      PHE   9  53.504  51.215   6.834
   78    HE1  PHE   9           HE1      PHE   9  53.835  50.932   1.887
   79    HE2  PHE   9           HE2      PHE   9  51.496  51.609   5.432
   80    HZ   PHE   9           HZ       PHE   9  51.661  51.476   2.958
   81    H    ALA  10           H        ALA  10  58.067  48.457   5.146
   82    HA   ALA  10           HA       ALA  10  56.645  47.006   3.133
   83   1HB   ALA  10          1HB       ALA  10  58.892  47.960   2.788
   84   2HB   ALA  10          2HB       ALA  10  59.564  46.836   3.991
   85   3HB   ALA  10          3HB       ALA  10  58.879  46.210   2.476
   86    H    LYS  11           H        LYS  11  58.322  46.042   6.160
   87    HA   LYS  11           HA       LYS  11  57.412  43.249   5.904
   88   1HB   LYS  11          1HB       LYS  11  58.837  44.755   8.135
   89   2HB   LYS  11          2HB       LYS  11  58.441  43.023   8.148
   90   1HG   LYS  11          1HG       LYS  11  59.835  42.643   6.166
   91   2HG   LYS  11          2HG       LYS  11  60.184  44.376   6.046
   92   1HD   LYS  11          2HD       LYS  11  62.067  43.277   7.067
   93   2HD   LYS  11          1HD       LYS  11  61.282  44.305   8.280
   94   1HE   LYS  11          1HE       LYS  11  60.186  42.330   9.270
   95   2HE   LYS  11          2HE       LYS  11  60.857  41.297   7.989
   96   1HZ   LYS  11          1HZ       LYS  11  63.033  41.844   8.789
   97   2HZ   LYS  11          2HZ       LYS  11  62.404  42.805   9.972
   98   3HZ   LYS  11          3HZ       LYS  11  62.123  41.180   9.994
   99    H    GLY  12           H        GLY  12  55.350  45.065   5.640
  100   1HA   GLY  12          1HA       GLY  12  53.583  44.140   7.724
  101   2HA   GLY  12          2HA       GLY  12  53.777  45.921   7.700
  102    H    VAL  13           H        VAL  13  54.163  46.124   4.849
  103    HA   VAL  13           HA       VAL  13  51.743  44.877   3.657
  104    HB   VAL  13           HB       VAL  13  53.765  46.695   2.307
  105   1HG1  VAL  13          1HG1      VAL  13  51.882  47.123   0.736
  106   2HG1  VAL  13          2HG1      VAL  13  50.844  46.038   1.683
  107   3HG1  VAL  13          3HG1      VAL  13  52.241  45.391   0.801
  108   1HG2  VAL  13          1HG2      VAL  13  52.115  48.551   2.630
  109   2HG2  VAL  13          2HG2      VAL  13  52.848  48.015   4.149
  110   3HG2  VAL  13          3HG2      VAL  13  51.195  47.503   3.731
  111    H    GLY  14           H        GLY  14  53.640  43.312   4.832
  112   1HA   GLY  14          1HA       GLY  14  54.943  41.914   2.542
  113   2HA   GLY  14          2HA       GLY  14  55.759  42.162   4.101
  114    H    LYS  15           H        LYS  15  53.327  41.943   5.695
  115    HA   LYS  15           HA       LYS  15  52.955  39.005   5.669
  116   1HB   LYS  15          2HB       LYS  15  52.022  39.269   7.853
  117   2HB   LYS  15          1HB       LYS  15  53.586  40.105   7.758
  118   1HG   LYS  15          2HG       LYS  15  52.337  42.267   7.395
  119   2HG   LYS  15          1HG       LYS  15  50.815  41.385   7.649
  120   1HD   LYS  15          1HD       LYS  15  51.574  40.739   9.917
  121   2HD   LYS  15          2HD       LYS  15  53.121  41.566   9.631
  122   1HE   LYS  15          2HE       LYS  15  51.635  42.983  10.966
  123   2HE   LYS  15          1HE       LYS  15  51.936  43.723   9.383
  124   1HZ   LYS  15          1HZ       LYS  15  49.551  42.182  10.126
  125   2HZ   LYS  15          2HZ       LYS  15  49.640  43.824  10.013
  126   3HZ   LYS  15          3HZ       LYS  15  49.821  42.895   8.663
  127    H    ASP  16           H        ASP  16  51.331  42.033   4.931
  128    HA   ASP  16           HA       ASP  16  48.688  40.886   4.536
  129   1HB   ASP  16          1HB       ASP  16  49.126  43.308   4.920
  130   2HB   ASP  16          2HB       ASP  16  50.000  43.378   3.380
  131    HD2  ASP  16           HD2      ASP  16  48.850  43.094   1.495
  132    H    LEU  17           H        LEU  17  51.773  41.016   2.853
  133    HA   LEU  17           HA       LEU  17  50.675  40.441   0.216
  134   1HB   LEU  17          2HB       LEU  17  52.577  42.054   0.851
  135   2HB   LEU  17          1HB       LEU  17  53.545  40.618   1.211
  136    HG   LEU  17           HG       LEU  17  54.044  41.597  -0.900
  137   1HD1  LEU  17          1HD2      LEU  17  54.278  39.120  -0.600
  138   2HD1  LEU  17          2HD2      LEU  17  54.084  39.628  -2.291
  139   3HD1  LEU  17          3HD2      LEU  17  52.714  38.914  -1.428
  140   1HD2  LEU  17          1HD1      LEU  17  51.801  42.513  -1.461
  141   2HD2  LEU  17          2HD1      LEU  17  51.244  40.869  -1.856
  142   3HD2  LEU  17          3HD1      LEU  17  52.534  41.622  -2.811
  143    H    VAL  18           H        VAL  18  52.905  39.040   2.693
  144    HA   VAL  18           HA       VAL  18  53.046  36.463   1.389
  145    HB   VAL  18           HB       VAL  18  53.726  37.427   4.184
  146   1HG1  VAL  18          1HG2      VAL  18  54.832  35.212   4.489
  147   2HG1  VAL  18          2HG2      VAL  18  53.068  35.081   4.420
  148   3HG1  VAL  18          3HG2      VAL  18  54.048  34.637   3.002
  149   1HG2  VAL  18          1HG1      VAL  18  55.426  36.393   1.866
  150   2HG2  VAL  18          2HG1      VAL  18  55.201  38.109   2.250
  151   3HG2  VAL  18          3HG1      VAL  18  56.025  37.044   3.407
  152    H    LYS  19           H        LYS  19  50.847  38.099   3.602
  153    HA   LYS  19           HA       LYS  19  49.328  35.780   4.410
  154   1HB   LYS  19          1HB       LYS  19  49.269  37.891   5.624
  155   2HB   LYS  19          2HB       LYS  19  48.582  38.725   4.220
  156   1HG   LYS  19          2HG       LYS  19  47.215  36.353   5.557
  157   2HG   LYS  19          1HG       LYS  19  46.973  38.029   6.081
  158   1HD   LYS  19          2HD       LYS  19  46.180  38.653   3.827
  159   2HD   LYS  19          1HD       LYS  19  46.354  36.968   3.295
  160   1HE   LYS  19          1HE       LYS  19  44.740  36.248   5.023
  161   2HE   LYS  19          2HE       LYS  19  44.572  37.928   5.571
  162   1HZ   LYS  19          1HZ       LYS  19  43.724  38.482   3.414
  163   2HZ   LYS  19          2HZ       LYS  19  42.813  37.294   4.107
  164   3HZ   LYS  19          3HZ       LYS  19  43.879  36.921   2.904
  165    H    GLY  20           H        GLY  20  49.272  38.065   1.704
  166   1HA   GLY  20          2HA       GLY  20  46.757  37.233   0.562
  167   2HA   GLY  20          1HA       GLY  20  48.013  38.235  -0.194
  168    H    ALA  21           H        ALA  21  50.233  36.574  -0.068
  169    HA   ALA  21           HA       ALA  21  49.830  34.659  -2.159
  170   1HB   ALA  21          1HB       ALA  21  51.998  35.764  -1.708
  171   2HB   ALA  21          2HB       ALA  21  52.143  33.994  -1.648
  172   3HB   ALA  21          3HB       ALA  21  52.093  34.931  -0.139
  173    H    ALA  22           H        ALA  22  49.783  34.539   1.378
  174    HA   ALA  22           HA       ALA  22  49.692  31.618   1.461
  175   1HB   ALA  22          1HB       ALA  22  50.799  32.886   3.239
  176   2HB   ALA  22          2HB       ALA  22  49.252  33.663   3.655
  177   3HB   ALA  22          3HB       ALA  22  49.456  31.913   3.870
  178    H    GLN  23           H        GLN  23  47.338  34.169   1.065
  179    HA   GLN  23           HA       GLN  23  45.132  33.097   2.408
  180   1HB   GLN  23          2HB       GLN  23  45.398  35.375   1.453
  181   2HB   GLN  23          1HB       GLN  23  45.167  34.718  -0.174
  182   1HG   GLN  23          2HG       GLN  23  43.155  34.447   2.103
  183   2HG   GLN  23          1HG       GLN  23  43.145  35.764   0.919
  184   1HE2  GLN  23          2HE2      GLN  23  41.279  33.355   1.561
  185   2HE2  GLN  23          1HE2      GLN  23  40.950  32.682  -0.021
  186    H    GLY  24           H        GLY  24  46.379  32.459  -0.902
  187   1HA   GLY  24          1HA       GLY  24  44.980  29.898  -0.997
  188   2HA   GLY  24          2HA       GLY  24  44.400  31.115  -2.159
  189    H    VAL  25           H        VAL  25  47.297  29.409  -0.970
  190    HA   VAL  25           HA       VAL  25  49.158  30.463  -2.768
  191    HB   VAL  25           HB       VAL  25  49.078  27.678  -1.508
  192   1HG1  VAL  25          1HG2      VAL  25  51.403  29.313  -2.614
  193   2HG1  VAL  25          2HG2      VAL  25  50.756  27.810  -3.311
  194   3HG1  VAL  25          3HG2      VAL  25  51.551  27.781  -1.727
  195   1HG2  VAL  25          1HG1      VAL  25  48.902  29.462   0.187
  196   2HG2  VAL  25          2HG1      VAL  25  50.316  30.277  -0.523
  197   3HG2  VAL  25          3HG1      VAL  25  50.493  28.684   0.246
  198    H    LEU  26           H        LEU  26  47.259  27.435  -2.964
  199    HA   LEU  26           HA       LEU  26  48.104  26.545  -5.502
  200   1HB   LEU  26          1HB       LEU  26  45.399  26.239  -4.153
  201   2HB   LEU  26          2HB       LEU  26  46.008  25.247  -5.486
  202    HG   LEU  26           HG       LEU  26  47.237  25.410  -2.694
  203   1HD1  LEU  26          1HD2      LEU  26  45.627  23.220  -4.065
  204   2HD1  LEU  26          2HD2      LEU  26  46.370  23.121  -2.452
  205   3HD1  LEU  26          3HD2      LEU  26  45.050  24.271  -2.751
  206   1HD2  LEU  26          1HD1      LEU  26  47.922  23.672  -5.107
  207   2HD2  LEU  26          2HD1      LEU  26  48.557  23.433  -3.465
  208   3HD2  LEU  26          3HD1      LEU  26  48.969  24.902  -4.361
  209    H    SER  27           H        SER  27  45.426  28.753  -4.578
  210    HA   SER  27           HA       SER  27  44.471  29.177  -7.251
  211   1HB   SER  27          1HB       SER  27  44.280  30.965  -4.790
  212   2HB   SER  27          2HB       SER  27  43.303  31.090  -6.266
  213    HG   SER  27           HG       SER  27  42.256  29.914  -4.602
  214    H    THR  28           H        THR  28  46.786  30.988  -5.142
  215    HA   THR  28           HA       THR  28  47.435  32.766  -7.375
  216    HB   THR  28           HB       THR  28  48.924  32.666  -4.748
  217    HG1  THR  28           HG1      THR  28  46.461  33.962  -5.276
  218   1HG2  THR  28          1HG2      THR  28  49.034  35.134  -5.216
  219   2HG2  THR  28          2HG2      THR  28  49.764  34.202  -6.536
  220   3HG2  THR  28          3HG2      THR  28  48.138  34.868  -6.723
  221    H    VAL  29           H        VAL  29  47.852  29.962  -7.814
  222    HA   VAL  29           HA       VAL  29  50.634  30.282  -8.807
  223    HB   VAL  29           HB       VAL  29  48.687  27.940  -9.085
  224   1HG1  VAL  29          1HG2      VAL  29  50.619  26.782 -10.138
  225   2HG1  VAL  29          2HG2      VAL  29  50.097  28.183 -11.089
  226   3HG1  VAL  29          3HG2      VAL  29  51.551  28.294 -10.070
  227   1HG2  VAL  29          1HG1      VAL  29  49.682  28.075  -6.821
  228   2HG2  VAL  29          2HG1      VAL  29  51.305  28.193  -7.537
  229   3HG2  VAL  29          3HG1      VAL  29  50.351  26.704  -7.724
  230    H    SER  30           H        SER  30  47.187  30.005  -9.618
  231    HA   SER  30           HA       SER  30  47.579  30.691 -12.395
  232   1HB   SER  30          2HB       SER  30  45.123  30.609 -10.571
  233   2HB   SER  30          1HB       SER  30  45.073  30.832 -12.337
  234    HG   SER  30           HG       SER  30  44.794  28.648 -11.703
  235    H    CYS  31           H        CYS  31  46.066  32.447  -9.619
  236    HA   CYS  31           HA       CYS  31  46.204  34.933 -11.141
  237   1HB   CYS  31          1HB       CYS  31  45.195  35.959  -9.209
  238   2HB   CYS  31          2HB       CYS  31  44.297  34.561  -9.780
  239    H    LYS  32           H        LYS  32  48.849  33.623 -10.699
  240    HA   LYS  32           HA       LYS  32  50.244  35.579  -9.025
  241   1HB   LYS  32          2HB       LYS  32  51.123  33.699 -11.255
  242   2HB   LYS  32          1HB       LYS  32  52.245  34.676 -10.301
  243   1HG   LYS  32          2HG       LYS  32  50.339  32.605  -9.207
  244   2HG   LYS  32          1HG       LYS  32  52.042  32.287  -9.554
  245   1HD   LYS  32          1HD       LYS  32  50.979  34.255  -7.478
  246   2HD   LYS  32          2HD       LYS  32  51.692  32.671  -7.154
  247   1HE   LYS  32          2HE       LYS  32  53.130  35.075  -8.356
  248   2HE   LYS  32          1HE       LYS  32  53.327  34.414  -6.729
  249   1HZ   LYS  32          1HZ       LYS  32  55.054  33.683  -8.167
  250   2HZ   LYS  32          2HZ       LYS  32  53.978  33.016  -9.222
  251   3HZ   LYS  32          3HZ       LYS  32  54.137  32.394  -7.703
  252    H    LEU  33           H        LEU  33  50.291  34.894 -12.473
  253    HA   LEU  33           HA       LEU  33  51.997  36.384 -13.542
  254   1HB   LEU  33          1HB       LEU  33  50.366  34.975 -14.748
  255   2HB   LEU  33          2HB       LEU  33  49.203  36.304 -14.724
  256    HG   LEU  33           HG       LEU  33  50.814  37.684 -16.082
  257   1HD1  LEU  33          1HD1      LEU  33  52.690  36.478 -17.203
  258   2HD1  LEU  33          2HD1      LEU  33  52.415  35.087 -16.131
  259   3HD1  LEU  33          3HD1      LEU  33  52.952  36.647 -15.461
  260   1HD2  LEU  33          1HD2      LEU  33  50.467  36.432 -18.169
  261   2HD2  LEU  33          2HD2      LEU  33  50.110  34.958 -17.240
  262   3HD2  LEU  33          3HD2      LEU  33  49.021  36.361 -17.140
  263    H    ALA  34           H        ALA  34  52.183  38.028 -11.931
  264    HA   ALA  34           HA       ALA  34  52.544  40.237 -11.465
  265   1HB   ALA  34          1HB       ALA  34  52.231  41.942 -13.164
  266   2HB   ALA  34          2HB       ALA  34  51.238  40.852 -14.149
  267   3HB   ALA  34          3HB       ALA  34  52.959  40.494 -13.887
  268    H    LYS  35           H        LYS  35  50.721  39.232 -10.022
  269    HA   LYS  35           HA       LYS  35  48.400  41.035  -9.871
  270   1HB   LYS  35          2HB       LYS  35  48.424  38.026  -9.764
  271   2HB   LYS  35          1HB       LYS  35  47.003  39.041  -9.480
  272   1HG   LYS  35          1HG       LYS  35  46.847  39.660 -11.769
  273   2HG   LYS  35          2HG       LYS  35  48.484  39.072 -12.129
  274   1HD   LYS  35          2HD       LYS  35  47.844  36.772 -11.604
  275   2HD   LYS  35          1HD       LYS  35  46.179  37.305 -11.252
  276   1HE   LYS  35          1HE       LYS  35  45.875  38.071 -13.549
  277   2HE   LYS  35          2HE       LYS  35  47.568  37.709 -13.935
  278   1HZ   LYS  35          1HZ       LYS  35  47.115  35.410 -13.511
  279   2HZ   LYS  35          2HZ       LYS  35  45.537  35.741 -13.161
  280   3HZ   LYS  35          3HZ       LYS  35  46.114  35.993 -14.686
  281    H    THR  36           H        THR  36  50.036  38.248  -8.437
  282    HA   THR  36           HA       THR  36  50.122  37.387  -6.391
  283    HB   THR  36           HB       THR  36  50.476  38.643  -4.421
  284    HG1  THR  36           HG1      THR  36  49.713  40.977  -5.816
  285   1HG2  THR  36          1HG2      THR  36  51.775  40.177  -6.710
  286   2HG2  THR  36          2HG2      THR  36  52.350  40.073  -5.034
  287   3HG2  THR  36          3HG2      THR  36  52.341  38.621  -6.058
  288    H    CYS  37           H        CYS  37  47.665  38.247  -7.956
  289    HA   CYS  37           HA       CYS  37  45.524  37.588  -7.883
  290   1HB   CYS  37          1HB       CYS  37  46.527  36.073  -5.892
  291   2HB   CYS  37          2HB       CYS  37  45.421  37.070  -4.955
  292    HXT  CYS  37           HO        OH  38  45.033  40.469  -5.053
  Start of MODEL    7
    1   1H    GLY   1          1H        GLY   1  65.446  53.443  13.500
    2   2H    GLY   1          2H        GLY   1  64.889  54.553  14.584
    3   3H    GLY   1          3H        GLY   1  63.845  53.479  13.894
    4   1HA   GLY   1          1HA       GLY   1  64.172  54.421  11.749
    5   2HA   GLY   1          2HA       GLY   1  63.579  55.621  12.922
    6    H    ILE   2           H        ILE   2  66.391  57.273  11.117
    7    HA   ILE   2           HA       ILE   2  63.553  56.670  10.905
    8    HB   ILE   2           HB       ILE   2  64.367  58.932  10.544
    9   1HG1  ILE   2          1HG1      ILE   2  63.395  59.415   8.348
   10   2HG1  ILE   2          2HG1      ILE   2  63.480  57.703   7.910
   11   1HG2  ILE   2          1HG2      ILE   2  66.648  58.460   9.693
   12   2HG2  ILE   2          2HG2      ILE   2  65.753  59.522   8.600
   13   3HG2  ILE   2          3HG2      ILE   2  65.951  57.809   8.192
   14   1HD1  ILE   2          1HD1      ILE   2  61.201  58.437   8.627
   15   2HD1  ILE   2          2HD1      ILE   2  61.853  58.848  10.229
   16   3HD1  ILE   2          3HD1      ILE   2  61.836  57.158   9.671
   17    H    LEU   3           H        LEU   3  66.599  55.600   9.504
   18    HA   LEU   3           HA       LEU   3  65.587  54.603   7.039
   19   1HB   LEU   3          1HB       LEU   3  68.009  53.754   8.669
   20   2HB   LEU   3          2HB       LEU   3  67.732  53.380   6.962
   21    HG   LEU   3           HG       LEU   3  68.075  56.183   8.132
   22   1HD1  LEU   3          1HD2      LEU   3  69.937  54.461   6.447
   23   2HD1  LEU   3          2HD2      LEU   3  70.243  56.133   6.969
   24   3HD1  LEU   3          3HD2      LEU   3  70.139  54.833   8.175
   25   1HD2  LEU   3          1HD1      LEU   3  68.279  56.857   5.734
   26   2HD2  LEU   3          2HD1      LEU   3  67.804  55.214   5.250
   27   3HD2  LEU   3          3HD1      LEU   3  66.659  56.260   6.123
   28    H    ASP   4           H        ASP   4  65.207  53.341  10.257
   29    HA   ASP   4           HA       ASP   4  64.886  50.553   9.322
   30   1HB   ASP   4          1HB       ASP   4  66.205  51.032  11.383
   31   2HB   ASP   4          2HB       ASP   4  64.774  51.791  12.101
   32    HD2  ASP   4           HD2      ASP   4  65.746  48.827  10.507
   33    H    THR   5           H        THR   5  63.170  53.500   9.993
   34    HA   THR   5           HA       THR   5  60.841  52.426  11.067
   35    HB   THR   5           HB       THR   5  61.204  54.952   9.408
   36    HG1  THR   5           HG1      THR   5  61.251  54.460  12.204
   37   1HG2  THR   5          1HG2      THR   5  58.827  54.413   9.588
   38   2HG2  THR   5          2HG2      THR   5  58.993  54.139  11.340
   39   3HG2  THR   5          3HG2      THR   5  59.213  55.769  10.663
   40    H    LEU   6           H        LEU   6  61.672  53.228   7.661
   41    HA   LEU   6           HA       LEU   6  59.249  52.342   6.462
   42   1HB   LEU   6          2HB       LEU   6  62.094  52.405   5.384
   43   2HB   LEU   6          1HB       LEU   6  60.621  52.276   4.413
   44    HG   LEU   6           HG       LEU   6  61.377  54.654   6.173
   45   1HD1  LEU   6          1HD2      LEU   6  62.805  54.403   4.178
   46   2HD1  LEU   6          2HD2      LEU   6  61.358  54.309   3.148
   47   3HD1  LEU   6          3HD2      LEU   6  61.730  55.808   4.029
   48   1HD2  LEU   6          1HD1      LEU   6  59.047  54.221   4.249
   49   2HD2  LEU   6          2HD1      LEU   6  59.491  55.779   4.980
   50   3HD2  LEU   6          3HD1      LEU   6  58.933  54.452   6.010
   51    H    LYS   7           H        LYS   7  62.277  50.670   7.346
   52    HA   LYS   7           HA       LYS   7  61.746  48.211   6.025
   53   1HB   LYS   7          1HB       LYS   7  63.346  48.641   8.571
   54   2HB   LYS   7          2HB       LYS   7  63.502  47.306   7.427
   55   1HG   LYS   7          2HG       LYS   7  64.153  50.235   6.894
   56   2HG   LYS   7          1HG       LYS   7  65.309  48.915   7.125
   57   1HD   LYS   7          1HD       LYS   7  64.402  47.782   5.105
   58   2HD   LYS   7          2HD       LYS   7  63.312  49.161   4.833
   59   1HE   LYS   7          2HE       LYS   7  66.354  49.316   4.923
   60   2HE   LYS   7          1HE       LYS   7  65.368  49.289   3.449
   61   1HZ   LYS   7          1HZ       LYS   7  65.963  51.499   4.047
   62   2HZ   LYS   7          2HZ       LYS   7  64.330  51.309   4.175
   63   3HZ   LYS   7          3HZ       LYS   7  65.265  51.350   5.533
   64    H    GLN   8           H        GLN   8  61.056  49.370   9.331
   65    HA   GLN   8           HA       GLN   8  59.962  47.038  10.448
   66   1HB   GLN   8          1HB       GLN   8  60.624  49.073  11.675
   67   2HB   GLN   8          2HB       GLN   8  59.293  49.973  10.930
   68   1HG   GLN   8          2HG       GLN   8  57.653  48.495  11.996
   69   2HG   GLN   8          1HG       GLN   8  58.969  47.513  12.680
   70   1HE2  GLN   8          1HE2      GLN   8  57.936  50.979  12.510
   71   2HE2  GLN   8          2HE2      GLN   8  58.299  51.342  14.183
   72    H    PHE   9           H        PHE   9  58.450  49.710   8.606
   73    HA   PHE   9           HA       PHE   9  55.795  48.516   8.678
   74   1HB   PHE   9          2HB       PHE   9  56.916  50.742   6.947
   75   2HB   PHE   9          1HB       PHE   9  55.209  50.369   7.199
   76    HD1  PHE   9           HD1      PHE   9  56.461  53.070   7.566
   77    HD2  PHE   9           HD2      PHE   9  55.771  49.867  10.370
   78    HE1  PHE   9           HE1      PHE   9  56.303  54.709   9.417
   79    HE2  PHE   9           HE2      PHE   9  55.656  51.504  12.207
   80    HZ   PHE   9           HZ       PHE   9  55.921  53.928  11.743
   81    H    ALA  10           H        ALA  10  58.579  48.388   6.484
   82    HA   ALA  10           HA       ALA  10  57.160  47.436   4.205
   83   1HB   ALA  10          1HB       ALA  10  59.354  46.702   3.411
   84   2HB   ALA  10          2HB       ALA  10  60.041  46.901   5.035
   85   3HB   ALA  10          3HB       ALA  10  59.472  48.323   4.128
   86    H    LYS  11           H        LYS  11  58.609  45.760   7.025
   87    HA   LYS  11           HA       LYS  11  57.637  43.147   6.067
   88   1HB   LYS  11          2HB       LYS  11  58.619  42.277   8.130
   89   2HB   LYS  11          1HB       LYS  11  59.773  43.220   7.175
   90   1HG   LYS  11          2HG       LYS  11  59.488  45.152   8.693
   91   2HG   LYS  11          1HG       LYS  11  58.268  44.266   9.615
   92   1HD   LYS  11          2HD       LYS  11  60.348  44.162  10.806
   93   2HD   LYS  11          1HD       LYS  11  59.942  42.546  10.207
   94   1HE   LYS  11          1HE       LYS  11  62.333  43.035   9.931
   95   2HE   LYS  11          2HE       LYS  11  61.567  42.821   8.352
   96   1HZ   LYS  11          1HZ       LYS  11  62.175  45.391   9.640
   97   2HZ   LYS  11          2HZ       LYS  11  61.473  45.207   8.160
   98   3HZ   LYS  11          3HZ       LYS  11  63.024  44.704   8.404
   99    H    GLY  12           H        GLY  12  55.638  45.002   6.157
  100   1HA   GLY  12          2HA       GLY  12  53.759  43.993   8.231
  101   2HA   GLY  12          1HA       GLY  12  54.259  45.697   8.148
  102    H    VAL  13           H        VAL  13  54.343  46.650   5.865
  103    HA   VAL  13           HA       VAL  13  51.921  46.141   4.317
  104    HB   VAL  13           HB       VAL  13  54.538  47.650   3.835
  105   1HG1  VAL  13          1HG2      VAL  13  53.674  47.102   1.655
  106   2HG1  VAL  13          2HG2      VAL  13  53.245  48.780   1.990
  107   3HG1  VAL  13          3HG2      VAL  13  52.009  47.510   2.154
  108   1HG2  VAL  13          1HG1      VAL  13  53.135  48.671   5.597
  109   2HG2  VAL  13          2HG1      VAL  13  51.734  48.642   4.503
  110   3HG2  VAL  13          3HG1      VAL  13  53.135  49.671   4.137
  111    H    GLY  14           H        GLY  14  54.386  44.282   5.315
  112   1HA   GLY  14          2HA       GLY  14  54.817  42.857   2.729
  113   2HA   GLY  14          1HA       GLY  14  55.964  42.886   4.074
  114    H    LYS  15           H        LYS  15  53.425  42.925   5.917
  115    HA   LYS  15           HA       LYS  15  52.964  40.001   6.012
  116   1HB   LYS  15          2HB       LYS  15  52.185  42.283   7.844
  117   2HB   LYS  15          1HB       LYS  15  51.775  40.573   8.104
  118   1HG   LYS  15          1HG       LYS  15  54.127  39.958   8.241
  119   2HG   LYS  15          2HG       LYS  15  54.629  41.610   7.827
  120   1HD   LYS  15          2HD       LYS  15  53.550  42.468   9.871
  121   2HD   LYS  15          1HD       LYS  15  53.047  40.818  10.309
  122   1HE   LYS  15          2HE       LYS  15  55.423  40.118  10.392
  123   2HE   LYS  15          1HE       LYS  15  55.925  41.764   9.952
  124   1HZ   LYS  15          1HZ       LYS  15  56.044  41.398  12.296
  125   2HZ   LYS  15          2HZ       LYS  15  54.907  42.545  11.959
  126   3HZ   LYS  15          3HZ       LYS  15  54.441  41.017  12.369
  127    H    ASP  16           H        ASP  16  51.450  43.106   5.230
  128    HA   ASP  16           HA       ASP  16  48.804  42.039   4.686
  129   1HB   ASP  16          1HB       ASP  16  49.270  44.431   5.166
  130   2HB   ASP  16          2HB       ASP  16  50.231  44.535   3.681
  131    HD2  ASP  16           HD2      ASP  16  49.180  44.349   1.726
  132    H    LEU  17           H        LEU  17  51.938  42.167   3.119
  133    HA   LEU  17           HA       LEU  17  50.914  41.549   0.450
  134   1HB   LEU  17          2HB       LEU  17  53.018  43.028   1.342
  135   2HB   LEU  17          1HB       LEU  17  53.840  41.476   1.090
  136    HG   LEU  17           HG       LEU  17  52.124  43.008  -0.896
  137   1HD1  LEU  17          1HD2      LEU  17  54.265  44.133  -0.397
  138   2HD1  LEU  17          2HD2      LEU  17  54.267  43.490  -2.053
  139   3HD1  LEU  17          3HD2      LEU  17  55.149  42.635  -0.767
  140   1HD2  LEU  17          1HD1      LEU  17  53.815  40.489  -1.263
  141   2HD2  LEU  17          2HD1      LEU  17  52.047  40.614  -1.424
  142   3HD2  LEU  17          3HD1      LEU  17  53.099  41.421  -2.596
  143    H    VAL  18           H        VAL  18  52.944  40.166   3.103
  144    HA   VAL  18           HA       VAL  18  53.091  37.559   1.791
  145    HB   VAL  18           HB       VAL  18  53.655  38.480   4.614
  146   1HG1  VAL  18          1HG2      VAL  18  52.739  36.233   4.877
  147   2HG1  VAL  18          2HG2      VAL  18  53.742  35.636   3.531
  148   3HG1  VAL  18          3HG2      VAL  18  54.500  36.178   5.044
  149   1HG2  VAL  18          1HG1      VAL  18  55.375  37.170   2.456
  150   2HG2  VAL  18          2HG1      VAL  18  55.940  37.851   3.996
  151   3HG2  VAL  18          3HG1      VAL  18  55.305  38.920   2.728
  152    H    LYS  19           H        LYS  19  50.750  39.309   3.714
  153    HA   LYS  19           HA       LYS  19  49.066  37.029   4.372
  154   1HB   LYS  19          2HB       LYS  19  49.115  39.202   5.584
  155   2HB   LYS  19          1HB       LYS  19  48.325  39.956   4.180
  156   1HG   LYS  19          1HG       LYS  19  46.458  38.313   4.381
  157   2HG   LYS  19          2HG       LYS  19  47.239  37.603   5.807
  158   1HD   LYS  19          1HD       LYS  19  46.320  40.495   5.551
  159   2HD   LYS  19          2HD       LYS  19  45.406  39.189   6.338
  160   1HE   LYS  19          2HE       LYS  19  47.289  38.863   7.943
  161   2HE   LYS  19          1HE       LYS  19  48.121  40.257   7.220
  162   1HZ   LYS  19          1HZ       LYS  19  46.902  40.868   9.154
  163   2HZ   LYS  19          2HZ       LYS  19  46.263  41.608   7.825
  164   3HZ   LYS  19          3HZ       LYS  19  45.489  40.318   8.503
  165    H    GLY  20           H        GLY  20  49.369  39.399   1.755
  166   1HA   GLY  20          1HA       GLY  20  46.962  38.683   0.326
  167   2HA   GLY  20          2HA       GLY  20  48.315  39.677  -0.254
  168    H    ALA  21           H        ALA  21  50.464  37.893   0.093
  169    HA   ALA  21           HA       ALA  21  50.240  36.081  -2.115
  170   1HB   ALA  21          1HB       ALA  21  52.430  35.278  -1.353
  171   2HB   ALA  21          2HB       ALA  21  52.383  37.055  -1.340
  172   3HB   ALA  21          3HB       ALA  21  52.234  36.148   0.184
  173    H    ALA  22           H        ALA  22  49.688  35.859   1.373
  174    HA   ALA  22           HA       ALA  22  49.355  32.941   1.245
  175   1HB   ALA  22          1HB       ALA  22  49.111  34.852   3.588
  176   2HB   ALA  22          2HB       ALA  22  50.571  33.943   3.130
  177   3HB   ALA  22          3HB       ALA  22  49.121  33.077   3.670
  178    H    GLN  23           H        GLN  23  47.451  34.854  -0.181
  179    HA   GLN  23           HA       GLN  23  44.948  34.615   1.276
  180   1HB   GLN  23          2HB       GLN  23  45.498  36.495  -0.208
  181   2HB   GLN  23          1HB       GLN  23  45.559  35.408  -1.606
  182   1HG   GLN  23          2HG       GLN  23  43.124  35.810   0.188
  183   2HG   GLN  23          1HG       GLN  23  43.432  36.724  -1.298
  184   1HE2  GLN  23          1HE2      GLN  23  41.499  34.371  -0.233
  185   2HE2  GLN  23          2HE2      GLN  23  41.382  33.363  -1.659
  186    H    GLY  24           H        GLY  24  46.385  33.177  -1.709
  187   1HA   GLY  24          2HA       GLY  24  45.215  30.577  -1.209
  188   2HA   GLY  24          1HA       GLY  24  44.383  31.474  -2.501
  189    H    VAL  25           H        VAL  25  47.572  30.335  -1.377
  190    HA   VAL  25           HA       VAL  25  49.097  31.125  -3.591
  191    HB   VAL  25           HB       VAL  25  49.487  28.736  -1.729
  192   1HG1  VAL  25          1HG2      VAL  25  50.921  28.565  -3.731
  193   2HG1  VAL  25          2HG2      VAL  25  51.460  30.245  -3.500
  194   3HG1  VAL  25          3HG2      VAL  25  51.887  28.997  -2.309
  195   1HG2  VAL  25          1HG1      VAL  25  50.498  31.604  -1.570
  196   2HG2  VAL  25          2HG1      VAL  25  50.963  30.277  -0.480
  197   3HG2  VAL  25          3HG1      VAL  25  49.290  30.861  -0.494
  198    H    LEU  26           H        LEU  26  47.762  27.872  -2.851
  199    HA   LEU  26           HA       LEU  26  48.369  26.655  -5.331
  200   1HB   LEU  26          2HB       LEU  26  46.098  26.092  -3.388
  201   2HB   LEU  26          1HB       LEU  26  46.697  24.987  -4.632
  202    HG   LEU  26           HG       LEU  26  48.298  25.996  -2.235
  203   1HD1  LEU  26          1HD1      LEU  26  48.089  23.677  -1.443
  204   2HD1  LEU  26          2HD1      LEU  26  46.491  24.425  -1.642
  205   3HD1  LEU  26          3HD1      LEU  26  47.089  23.272  -2.857
  206   1HD2  LEU  26          1HD2      LEU  26  49.927  24.234  -2.933
  207   2HD2  LEU  26          2HD2      LEU  26  49.802  25.539  -4.122
  208   3HD2  LEU  26          3HD2      LEU  26  48.990  23.983  -4.421
  209    H    SER  27           H        SER  27  45.646  28.700  -4.311
  210    HA   SER  27           HA       SER  27  44.022  28.187  -6.641
  211   1HB   SER  27          1HB       SER  27  43.100  29.020  -4.508
  212   2HB   SER  27          2HB       SER  27  44.023  30.528  -4.693
  213    HG   SER  27           HG       SER  27  41.877  30.703  -5.465
  214    H    THR  28           H        THR  28  46.537  30.619  -5.790
  215    HA   THR  28           HA       THR  28  46.042  32.257  -8.049
  216    HB   THR  28           HB       THR  28  48.592  31.972  -6.428
  217    HG1  THR  28           HG1      THR  28  47.704  33.831  -5.429
  218   1HG2  THR  28          1HG2      THR  28  47.607  34.067  -8.423
  219   2HG2  THR  28          2HG2      THR  28  49.057  33.058  -8.581
  220   3HG2  THR  28          3HG2      THR  28  48.985  34.307  -7.329
  221    H    VAL  29           H        VAL  29  48.076  29.355  -7.597
  222    HA   VAL  29           HA       VAL  29  49.639  29.444  -9.906
  223    HB   VAL  29           HB       VAL  29  48.307  27.087  -8.522
  224   1HG1  VAL  29          1HG1      VAL  29  49.029  26.406 -10.751
  225   2HG1  VAL  29          2HG1      VAL  29  50.611  27.190 -10.505
  226   3HG1  VAL  29          3HG1      VAL  29  50.153  25.766  -9.540
  227   1HG2  VAL  29          1HG2      VAL  29  51.092  28.308  -8.265
  228   2HG2  VAL  29          2HG2      VAL  29  50.524  26.840  -7.441
  229   3HG2  VAL  29          3HG2      VAL  29  49.803  28.409  -7.046
  230    H    SER  30           H        SER  30  46.171  28.826  -9.525
  231    HA   SER  30           HA       SER  30  45.867  27.615 -12.096
  232   1HB   SER  30          1HB       SER  30  44.353  27.112 -10.215
  233   2HB   SER  30          2HB       SER  30  43.822  28.802 -10.154
  234    HG   SER  30           HG       SER  30  42.389  27.461 -11.339
  235    H    CYS  31           H        CYS  31  44.624  30.800 -10.947
  236    HA   CYS  31           HA       CYS  31  44.093  31.860 -13.535
  237   1HB   CYS  31          2HB       CYS  31  44.443  34.071 -12.456
  238   2HB   CYS  31          1HB       CYS  31  43.337  33.024 -11.575
  239    H    LYS  32           H        LYS  32  47.133  31.035 -12.017
  240    HA   LYS  32           HA       LYS  32  48.506  33.362 -12.979
  241   1HB   LYS  32          1HB       LYS  32  48.838  32.407 -10.824
  242   2HB   LYS  32          2HB       LYS  32  49.531  30.936 -11.558
  243   1HG   LYS  32          2HG       LYS  32  51.287  32.312 -12.619
  244   2HG   LYS  32          1HG       LYS  32  50.541  33.792 -11.986
  245   1HD   LYS  32          2HD       LYS  32  50.974  33.134  -9.693
  246   2HD   LYS  32          1HD       LYS  32  51.399  31.500 -10.228
  247   1HE   LYS  32          1HE       LYS  32  53.424  32.805  -9.635
  248   2HE   LYS  32          2HE       LYS  32  53.408  32.345 -11.348
  249   1HZ   LYS  32          1HZ       LYS  32  54.054  34.612 -11.044
  250   2HZ   LYS  32          2HZ       LYS  32  52.627  34.538 -11.867
  251   3HZ   LYS  32          3HZ       LYS  32  52.640  34.965 -10.274
  252    H    LEU  33           H        LEU  33  47.682  32.682 -15.113
  253    HA   LEU  33           HA       LEU  33  49.662  31.171 -16.745
  254   1HB   LEU  33          1HB       LEU  33  47.256  32.843 -17.580
  255   2HB   LEU  33          2HB       LEU  33  48.251  31.837 -18.646
  256    HG   LEU  33           HG       LEU  33  46.539  30.825 -16.325
  257   1HD1  LEU  33          1HD2      LEU  33  46.162  30.635 -19.342
  258   2HD1  LEU  33          2HD2      LEU  33  45.116  29.897 -18.107
  259   3HD1  LEU  33          3HD2      LEU  33  45.224  31.665 -18.237
  260   1HD2  LEU  33          1HD1      LEU  33  48.467  29.341 -16.674
  261   2HD2  LEU  33          2HD1      LEU  33  47.005  28.581 -17.321
  262   3HD2  LEU  33          3HD1      LEU  33  48.172  29.334 -18.430
  263    H    ALA  34           H        ALA  34  48.339  34.501 -16.428
  264    HA   ALA  34           HA       ALA  34  51.033  35.619 -16.645
  265   1HB   ALA  34          1HB       ALA  34  50.349  35.391 -19.014
  266   2HB   ALA  34          2HB       ALA  34  50.462  37.097 -18.535
  267   3HB   ALA  34          3HB       ALA  34  48.870  36.317 -18.673
  268    H    LYS  35           H        LYS  35  48.059  35.566 -15.220
  269    HA   LYS  35           HA       LYS  35  47.785  38.420 -14.645
  270   1HB   LYS  35          2HB       LYS  35  45.834  37.626 -13.332
  271   2HB   LYS  35          1HB       LYS  35  45.748  37.428 -15.087
  272   1HG   LYS  35          1HG       LYS  35  46.105  35.126 -15.021
  273   2HG   LYS  35          2HG       LYS  35  46.799  35.168 -13.393
  274   1HD   LYS  35          2HD       LYS  35  44.878  34.402 -12.708
  275   2HD   LYS  35          1HD       LYS  35  44.326  36.085 -12.805
  276   1HE   LYS  35          2HE       LYS  35  43.976  33.987 -14.994
  277   2HE   LYS  35          1HE       LYS  35  42.704  34.625 -13.937
  278   1HZ   LYS  35          1HZ       LYS  35  43.077  36.780 -14.903
  279   2HZ   LYS  35          2HZ       LYS  35  44.243  36.173 -15.899
  280   3HZ   LYS  35          3HZ       LYS  35  42.681  35.675 -16.061
  281    H    THR  36           H        THR  36  48.579  35.409 -12.883
  282    HA   THR  36           HA       THR  36  49.189  35.069 -10.746
  283    HB   THR  36           HB       THR  36  49.987  37.993 -10.453
  284    HG1  THR  36           HG1      THR  36  50.966  37.122 -12.306
  285   1HG2  THR  36          1HG2      THR  36  51.704  36.975  -8.956
  286   2HG2  THR  36          2HG2      THR  36  50.927  35.394  -9.177
  287   3HG2  THR  36          3HG2      THR  36  50.056  36.711  -8.366
  288    H    CYS  37           H        CYS  37  46.646  36.554 -11.906
  289    HA   CYS  37           HA       CYS  37  44.513  36.769 -11.053
  290   1HB   CYS  37          2HB       CYS  37  45.892  35.942  -8.525
  291   2HB   CYS  37          1HB       CYS  37  44.361  36.795  -8.402
  292    HXT  CYS  37           HO        OH  38  44.030  39.946  -9.618
  Start of MODEL    8
    1   1H    GLY   1          1H        GLY   1  65.070  53.362  12.869
    2   2H    GLY   1          2H        GLY   1  66.687  53.297  13.189
    3   3H    GLY   1          3H        GLY   1  66.038  52.329  12.022
    4   1HA   GLY   1          2HA       GLY   1  66.190  55.256  11.952
    5   2HA   GLY   1          1HA       GLY   1  67.220  54.142  11.033
    6    H    ILE   2           H        ILE   2  66.004  55.935   9.517
    7    HA   ILE   2           HA       ILE   2  63.385  55.292   8.638
    8    HB   ILE   2           HB       ILE   2  64.912  57.389   8.374
    9   1HG1  ILE   2          2HG1      ILE   2  62.614  57.409   7.797
   10   2HG1  ILE   2          1HG1      ILE   2  63.568  58.251   6.571
   11   1HG2  ILE   2          1HG2      ILE   2  65.519  56.002   5.740
   12   2HG2  ILE   2          2HG2      ILE   2  66.673  56.348   7.052
   13   3HG2  ILE   2          3HG2      ILE   2  65.900  57.679   6.173
   14   1HD1  ILE   2          1HD1      ILE   2  63.407  56.171   5.122
   15   2HD1  ILE   2          2HD1      ILE   2  61.871  56.995   5.445
   16   3HD1  ILE   2          3HD1      ILE   2  62.265  55.518   6.328
   17    H    LEU   3           H        LEU   3  66.598  54.002   7.873
   18    HA   LEU   3           HA       LEU   3  65.878  52.483   5.562
   19   1HB   LEU   3          1HB       LEU   3  68.029  52.274   7.700
   20   2HB   LEU   3          2HB       LEU   3  67.877  51.047   6.443
   21    HG   LEU   3           HG       LEU   3  69.605  52.714   5.969
   22   1HD1  LEU   3          1HD1      LEU   3  68.495  51.442   4.154
   23   2HD1  LEU   3          2HD1      LEU   3  67.326  52.766   3.948
   24   3HD1  LEU   3          3HD1      LEU   3  69.047  53.044   3.624
   25   1HD2  LEU   3          1HD2      LEU   3  69.094  54.964   5.281
   26   2HD2  LEU   3          2HD2      LEU   3  68.455  54.714   6.919
   27   3HD2  LEU   3          3HD2      LEU   3  67.358  54.695   5.510
   28    H    ASP   4           H        ASP   4  65.121  52.036   8.967
   29    HA   ASP   4           HA       ASP   4  64.602  49.146   8.617
   30   1HB   ASP   4          2HB       ASP   4  64.463  50.979  11.050
   31   2HB   ASP   4          1HB       ASP   4  64.188  49.234  11.030
   32    HD2  ASP   4           HD2      ASP   4  66.548  51.710  10.414
   33    H    THR   5           H        THR   5  63.201  52.324   8.511
   34    HA   THR   5           HA       THR   5  60.635  51.548   9.456
   35    HB   THR   5           HB       THR   5  61.474  54.025   7.906
   36    HG1  THR   5           HG1      THR   5  61.144  53.504  10.678
   37   1HG2  THR   5          1HG2      THR   5  59.446  55.033   8.919
   38   2HG2  THR   5          2HG2      THR   5  59.033  53.706   7.817
   39   3HG2  THR   5          3HG2      THR   5  58.992  53.446   9.577
   40    H    LEU   6           H        LEU   6  62.086  52.161   6.246
   41    HA   LEU   6           HA       LEU   6  59.812  51.630   4.624
   42   1HB   LEU   6          1HB       LEU   6  62.767  51.148   4.076
   43   2HB   LEU   6          2HB       LEU   6  61.487  51.238   2.855
   44    HG   LEU   6           HG       LEU   6  62.335  53.519   4.702
   45   1HD1  LEU   6          1HD2      LEU   6  64.037  52.936   3.016
   46   2HD1  LEU   6          2HD2      LEU   6  63.278  54.501   2.653
   47   3HD1  LEU   6          3HD2      LEU   6  62.812  53.053   1.732
   48   1HD2  LEU   6          1HD1      LEU   6  60.361  53.425   2.377
   49   2HD2  LEU   6          2HD1      LEU   6  60.936  54.908   3.170
   50   3HD2  LEU   6          3HD1      LEU   6  59.966  53.742   4.083
   51    H    LYS   7           H        LYS   7  62.311  49.525   6.062
   52    HA   LYS   7           HA       LYS   7  61.477  47.081   4.826
   53   1HB   LYS   7          1HB       LYS   7  63.046  47.766   7.334
   54   2HB   LYS   7          2HB       LYS   7  62.685  46.100   6.865
   55   1HG   LYS   7          2HG       LYS   7  64.890  46.694   6.093
   56   2HG   LYS   7          1HG       LYS   7  63.820  46.408   4.710
   57   1HD   LYS   7          1HD       LYS   7  63.619  48.810   4.310
   58   2HD   LYS   7          2HD       LYS   7  64.478  49.168   5.826
   59   1HE   LYS   7          2HE       LYS   7  65.977  49.440   3.919
   60   2HE   LYS   7          1HE       LYS   7  66.512  48.080   4.925
   61   1HZ   LYS   7          1HZ       LYS   7  64.957  47.872   2.442
   62   2HZ   LYS   7          2HZ       LYS   7  65.470  46.605   3.365
   63   3HZ   LYS   7          3HZ       LYS   7  66.570  47.565   2.600
   64    H    GLN   8           H        GLN   8  60.711  48.627   7.983
   65    HA   GLN   8           HA       GLN   8  58.956  46.619   8.944
   66   1HB   GLN   8          1HB       GLN   8  60.008  48.385  10.311
   67   2HB   GLN   8          2HB       GLN   8  59.017  49.615   9.503
   68   1HG   GLN   8          1HG       GLN   8  56.967  48.526  10.333
   69   2HG   GLN   8          2HG       GLN   8  57.944  47.261  11.109
   70   1HE2  GLN   8          1HE2      GLN   8  59.687  48.130  12.677
   71   2HE2  GLN   8          2HE2      GLN   8  59.196  49.445  13.723
   72    H    PHE   9           H        PHE   9  58.394  49.643   7.098
   73    HA   PHE   9           HA       PHE   9  55.569  49.422   6.887
   74   1HB   PHE   9          2HB       PHE   9  56.819  51.473   6.418
   75   2HB   PHE   9          1HB       PHE   9  57.609  50.706   5.038
   76    HD1  PHE   9           HD1      PHE   9  54.351  51.938   6.351
   77    HD2  PHE   9           HD2      PHE   9  56.502  50.508   2.907
   78    HE1  PHE   9           HE1      PHE   9  52.483  52.653   4.884
   79    HE2  PHE   9           HE2      PHE   9  54.631  51.222   1.445
   80    HZ   PHE   9           HZ       PHE   9  52.624  52.301   2.431
   81    H    ALA  10           H        ALA  10  58.200  48.392   4.650
   82    HA   ALA  10           HA       ALA  10  56.485  47.167   2.728
   83   1HB   ALA  10          1HB       ALA  10  59.413  46.645   3.382
   84   2HB   ALA  10          2HB       ALA  10  58.795  47.873   2.252
   85   3HB   ALA  10          3HB       ALA  10  58.567  46.146   1.900
   86    H    LYS  11           H        LYS  11  57.852  46.033   5.809
   87    HA   LYS  11           HA       LYS  11  57.313  43.254   5.349
   88   1HB   LYS  11          2HB       LYS  11  59.000  44.122   6.969
   89   2HB   LYS  11          1HB       LYS  11  57.703  44.860   7.912
   90   1HG   LYS  11          2HG       LYS  11  58.425  42.746   8.918
   91   2HG   LYS  11          1HG       LYS  11  56.736  42.676   8.410
   92   1HD   LYS  11          2HD       LYS  11  57.894  40.605   7.855
   93   2HD   LYS  11          1HD       LYS  11  57.357  41.422   6.385
   94   1HE   LYS  11          2HE       LYS  11  59.620  40.491   6.134
   95   2HE   LYS  11          1HE       LYS  11  59.656  42.254   5.993
   96   1HZ   LYS  11          1HZ       LYS  11  60.389  42.349   8.266
   97   2HZ   LYS  11          2HZ       LYS  11  61.410  41.415   7.371
   98   3HZ   LYS  11          3HZ       LYS  11  60.331  40.706   8.397
   99    H    GLY  12           H        GLY  12  55.552  45.978   6.884
  100   1HA   GLY  12          1HA       GLY  12  53.315  44.236   7.565
  101   2HA   GLY  12          2HA       GLY  12  53.418  45.997   7.858
  102    H    VAL  13           H        VAL  13  54.156  46.493   4.982
  103    HA   VAL  13           HA       VAL  13  51.686  45.620   3.593
  104    HB   VAL  13           HB       VAL  13  53.953  47.456   2.696
  105   1HG1  VAL  13          1HG2      VAL  13  52.680  46.557   0.775
  106   2HG1  VAL  13          2HG2      VAL  13  52.274  48.259   1.021
  107   3HG1  VAL  13          3HG2      VAL  13  51.153  46.994   1.577
  108   1HG2  VAL  13          1HG1      VAL  13  52.337  49.327   3.098
  109   2HG2  VAL  13          2HG1      VAL  13  52.777  48.502   4.600
  110   3HG2  VAL  13          3HG1      VAL  13  51.210  48.167   3.831
  111    H    GLY  14           H        GLY  14  53.274  43.703   4.584
  112   1HA   GLY  14          1HA       GLY  14  54.308  42.396   2.126
  113   2HA   GLY  14          2HA       GLY  14  55.310  42.447   3.589
  114    H    LYS  15           H        LYS  15  52.953  42.374   5.392
  115    HA   LYS  15           HA       LYS  15  52.399  39.465   5.271
  116   1HB   LYS  15          1HB       LYS  15  51.618  39.668   7.504
  117   2HB   LYS  15          2HB       LYS  15  53.193  40.479   7.365
  118   1HG   LYS  15          1HG       LYS  15  51.881  42.654   7.028
  119   2HG   LYS  15          2HG       LYS  15  50.431  41.773   7.531
  120   1HD   LYS  15          1HD       LYS  15  52.991  42.032   9.176
  121   2HD   LYS  15          2HD       LYS  15  51.560  43.063   9.345
  122   1HE   LYS  15          1HE       LYS  15  50.186  41.054   9.883
  123   2HE   LYS  15          2HE       LYS  15  51.641  40.041   9.769
  124   1HZ   LYS  15          1HZ       LYS  15  52.587  41.308  11.547
  125   2HZ   LYS  15          2HZ       LYS  15  51.236  42.247  11.656
  126   3HZ   LYS  15          3HZ       LYS  15  51.153  40.639  12.011
  127    H    ASP  16           H        ASP  16  50.978  42.564   4.563
  128    HA   ASP  16           HA       ASP  16  48.231  41.617   4.363
  129   1HB   ASP  16          1HB       ASP  16  48.919  44.008   4.706
  130   2HB   ASP  16          2HB       ASP  16  49.602  44.011   3.076
  131    HD2  ASP  16           HD2      ASP  16  48.166  43.664   1.345
  132    H    LEU  17           H        LEU  17  51.211  41.551   2.475
  133    HA   LEU  17           HA       LEU  17  49.897  40.935  -0.082
  134   1HB   LEU  17          1HB       LEU  17  52.740  41.320   0.909
  135   2HB   LEU  17          2HB       LEU  17  52.378  40.769  -0.713
  136    HG   LEU  17           HG       LEU  17  52.878  43.231  -0.441
  137   1HD1  LEU  17          1HD1      LEU  17  51.861  42.257  -2.469
  138   2HD1  LEU  17          2HD1      LEU  17  51.228  43.883  -2.148
  139   3HD1  LEU  17          3HD1      LEU  17  50.242  42.457  -1.763
  140   1HD2  LEU  17          1HD2      LEU  17  50.007  43.419   0.529
  141   2HD2  LEU  17          2HD2      LEU  17  51.121  44.752   0.193
  142   3HD2  LEU  17          3HD2      LEU  17  51.444  43.662   1.555
  143    H    VAL  18           H        VAL  18  52.153  39.545   2.375
  144    HA   VAL  18           HA       VAL  18  52.136  36.942   1.110
  145    HB   VAL  18           HB       VAL  18  53.013  37.910   3.845
  146   1HG1  VAL  18          1HG2      VAL  18  53.138  35.093   2.693
  147   2HG1  VAL  18          2HG2      VAL  18  52.261  35.603   4.156
  148   3HG1  VAL  18          3HG2      VAL  18  54.030  35.651   4.125
  149   1HG2  VAL  18          1HG1      VAL  18  54.529  36.769   1.453
  150   2HG2  VAL  18          2HG1      VAL  18  55.243  37.408   2.948
  151   3HG2  VAL  18          3HG1      VAL  18  54.406  38.498   1.825
  152    H    LYS  19           H        LYS  19  50.113  38.728   3.359
  153    HA   LYS  19           HA       LYS  19  48.519  36.474   4.248
  154   1HB   LYS  19          1HB       LYS  19  48.653  38.597   5.500
  155   2HB   LYS  19          2HB       LYS  19  47.934  39.456   4.125
  156   1HG   LYS  19          2HG       LYS  19  46.271  39.034   5.863
  157   2HG   LYS  19          1HG       LYS  19  45.846  38.170   4.378
  158   1HD   LYS  19          2HD       LYS  19  46.712  36.063   5.333
  159   2HD   LYS  19          1HD       LYS  19  47.294  36.937   6.767
  160   1HE   LYS  19          1HE       LYS  19  45.195  35.805   7.273
  161   2HE   LYS  19          2HE       LYS  19  44.957  37.563   7.323
  162   1HZ   LYS  19          1HZ       LYS  19  43.202  36.440   6.164
  163   2HZ   LYS  19          2HZ       LYS  19  44.265  35.799   5.078
  164   3HZ   LYS  19          3HZ       LYS  19  44.022  37.430   5.132
  165    H    GLY  20           H        GLY  20  48.565  38.717   1.527
  166   1HA   GLY  20          2HA       GLY  20  45.967  38.046   0.442
  167   2HA   GLY  20          1HA       GLY  20  47.288  38.922  -0.363
  168    H    ALA  21           H        ALA  21  49.389  37.121  -0.204
  169    HA   ALA  21           HA       ALA  21  48.786  35.183  -2.223
  170   1HB   ALA  21          1HB       ALA  21  51.176  35.404  -0.352
  171   2HB   ALA  21          2HB       ALA  21  51.015  36.215  -1.928
  172   3HB   ALA  21          3HB       ALA  21  51.095  34.441  -1.844
  173    H    ALA  22           H        ALA  22  48.772  35.156   1.310
  174    HA   ALA  22           HA       ALA  22  48.911  32.311   1.640
  175   1HB   ALA  22          1HB       ALA  22  49.380  33.902   3.462
  176   2HB   ALA  22          2HB       ALA  22  48.127  32.727   3.907
  177   3HB   ALA  22          3HB       ALA  22  47.666  34.384   3.477
  178    H    GLN  23           H        GLN  23  46.373  34.377   0.485
  179    HA   GLN  23           HA       GLN  23  44.058  33.040   1.301
  180   1HB   GLN  23          2HB       GLN  23  44.153  35.215   0.139
  181   2HB   GLN  23          1HB       GLN  23  44.671  34.403  -1.354
  182   1HG   GLN  23          2HG       GLN  23  42.552  33.152  -1.424
  183   2HG   GLN  23          1HG       GLN  23  42.067  33.861   0.129
  184   1HE2  GLN  23          1HE2      GLN  23  43.243  34.930  -3.127
  185   2HE2  GLN  23          2HE2      GLN  23  42.130  36.272  -3.269
  186    H    GLY  24           H        GLY  24  46.321  32.314  -1.403
  187   1HA   GLY  24          1HA       GLY  24  45.596  29.533  -1.425
  188   2HA   GLY  24          2HA       GLY  24  44.873  30.403  -2.798
  189    H    VAL  25           H        VAL  25  47.961  29.788  -1.087
  190    HA   VAL  25           HA       VAL  25  49.712  31.037  -2.821
  191    HB   VAL  25           HB       VAL  25  51.398  29.484  -1.920
  192   1HG1  VAL  25          1HG1      VAL  25  51.134  30.115   0.427
  193   2HG1  VAL  25          2HG1      VAL  25  50.634  31.453  -0.631
  194   3HG1  VAL  25          3HG1      VAL  25  49.407  30.442   0.173
  195   1HG2  VAL  25          1HG2      VAL  25  50.739  27.823  -0.186
  196   2HG2  VAL  25          2HG2      VAL  25  50.229  27.361  -1.811
  197   3HG2  VAL  25          3HG2      VAL  25  49.042  28.022  -0.660
  198    H    LEU  26           H        LEU  26  48.382  27.769  -2.965
  199    HA   LEU  26           HA       LEU  26  49.812  26.700  -5.121
  200   1HB   LEU  26          1HB       LEU  26  46.904  26.246  -4.373
  201   2HB   LEU  26          2HB       LEU  26  47.899  25.173  -5.369
  202    HG   LEU  26           HG       LEU  26  48.385  25.827  -2.426
  203   1HD1  LEU  26          1HD2      LEU  26  47.392  23.300  -3.802
  204   2HD1  LEU  26          2HD2      LEU  26  46.405  24.415  -2.829
  205   3HD1  LEU  26          3HD2      LEU  26  47.714  23.490  -2.063
  206   1HD2  LEU  26          1HD1      LEU  26  49.818  23.920  -4.331
  207   2HD2  LEU  26          2HD1      LEU  26  50.045  23.966  -2.569
  208   3HD2  LEU  26          3HD1      LEU  26  50.521  25.358  -3.553
  209    H    SER  27           H        SER  27  46.959  28.855  -5.158
  210    HA   SER  27           HA       SER  27  46.819  28.708  -8.099
  211   1HB   SER  27          2HB       SER  27  44.809  30.069  -7.835
  212   2HB   SER  27          1HB       SER  27  44.739  28.623  -6.810
  213    HG   SER  27           HG       SER  27  44.100  30.526  -5.712
  214    H    THR  28           H        THR  28  47.538  31.103  -5.511
  215    HA   THR  28           HA       THR  28  47.810  33.405  -7.010
  216    HB   THR  28           HB       THR  28  49.536  32.457  -4.688
  217    HG1  THR  28           HG1      THR  28  48.023  33.665  -3.501
  218   1HG2  THR  28          1HG2      THR  28  49.068  35.252  -5.818
  219   2HG2  THR  28          2HG2      THR  28  50.606  34.362  -5.820
  220   3HG2  THR  28          3HG2      THR  28  49.898  34.892  -4.289
  221    H    VAL  29           H        VAL  29  50.411  31.030  -6.301
  222    HA   VAL  29           HA       VAL  29  52.502  32.194  -7.685
  223    HB   VAL  29           HB       VAL  29  52.543  30.202  -6.202
  224   1HG1  VAL  29          1HG1      VAL  29  52.150  27.977  -7.074
  225   2HG1  VAL  29          2HG1      VAL  29  50.678  28.954  -7.239
  226   3HG1  VAL  29          3HG1      VAL  29  51.697  28.625  -8.661
  227   1HG2  VAL  29          1HG2      VAL  29  54.503  30.837  -7.586
  228   2HG2  VAL  29          2HG2      VAL  29  54.404  29.080  -7.348
  229   3HG2  VAL  29          3HG2      VAL  29  53.911  29.793  -8.898
  230    H    SER  30           H        SER  30  49.773  30.397  -8.938
  231    HA   SER  30           HA       SER  30  50.825  30.401 -11.673
  232   1HB   SER  30          2HB       SER  30  49.452  28.492 -10.630
  233   2HB   SER  30          1HB       SER  30  48.059  29.575 -10.655
  234    HG   SER  30           HG       SER  30  49.605  28.802 -12.908
  235    H    CYS  31           H        CYS  31  47.866  31.650 -10.117
  236    HA   CYS  31           HA       CYS  31  46.977  33.129 -12.330
  237   1HB   CYS  31          2HB       CYS  31  46.610  33.874  -9.424
  238   2HB   CYS  31          1HB       CYS  31  45.558  34.307 -10.774
  239    H    LYS  32           H        LYS  32  49.873  33.745 -10.573
  240    HA   LYS  32           HA       LYS  32  49.297  36.527 -10.102
  241   1HB   LYS  32          2HB       LYS  32  51.375  36.770  -9.118
  242   2HB   LYS  32          1HB       LYS  32  50.601  35.274  -8.584
  243   1HG   LYS  32          2HG       LYS  32  51.980  34.140 -10.477
  244   2HG   LYS  32          1HG       LYS  32  52.970  35.613 -10.479
  245   1HD   LYS  32          1HD       LYS  32  52.280  34.122  -7.937
  246   2HD   LYS  32          2HD       LYS  32  53.657  33.611  -8.943
  247   1HE   LYS  32          1HE       LYS  32  54.551  34.959  -7.209
  248   2HE   LYS  32          2HE       LYS  32  54.628  35.921  -8.695
  249   1HZ   LYS  32          1HZ       LYS  32  52.537  36.151  -6.646
  250   2HZ   LYS  32          2HZ       LYS  32  52.745  37.133  -7.957
  251   3HZ   LYS  32          3HZ       LYS  32  53.862  37.126  -6.753
  252    H    LEU  33           H        LEU  33  49.235  35.689 -12.952
  253    HA   LEU  33           HA       LEU  33  51.252  37.137 -14.398
  254   1HB   LEU  33          2HB       LEU  33  48.296  36.722 -15.008
  255   2HB   LEU  33          1HB       LEU  33  49.530  37.248 -16.164
  256    HG   LEU  33           HG       LEU  33  49.472  34.546 -14.738
  257   1HD1  LEU  33          1HD1      LEU  33  47.673  34.823 -16.404
  258   2HD1  LEU  33          2HD1      LEU  33  48.871  35.315 -17.622
  259   3HD1  LEU  33          3HD1      LEU  33  48.898  33.664 -16.963
  260   1HD2  LEU  33          1HD2      LEU  33  51.246  33.950 -16.392
  261   2HD2  LEU  33          2HD2      LEU  33  51.308  35.648 -16.914
  262   3HD2  LEU  33          3HD2      LEU  33  51.785  35.198 -15.259
  263    H    ALA  34           H        ALA  34  48.178  38.013 -12.810
  264    HA   ALA  34           HA       ALA  34  49.176  40.766 -12.484
  265   1HB   ALA  34          1HB       ALA  34  47.780  40.850 -14.525
  266   2HB   ALA  34          2HB       ALA  34  46.429  40.113 -13.634
  267   3HB   ALA  34          3HB       ALA  34  47.020  41.731 -13.183
  268    H    LYS  35           H        LYS  35  49.247  38.738 -10.643
  269    HA   LYS  35           HA       LYS  35  48.576  38.006  -8.625
  270   1HB   LYS  35          1HB       LYS  35  49.045  40.650  -8.538
  271   2HB   LYS  35          2HB       LYS  35  47.364  40.658  -7.994
  272   1HG   LYS  35          2HG       LYS  35  49.726  39.131  -6.809
  273   2HG   LYS  35          1HG       LYS  35  48.884  40.514  -6.084
  274   1HD   LYS  35          1HD       LYS  35  46.806  39.128  -5.933
  275   2HD   LYS  35          2HD       LYS  35  47.719  37.748  -6.601
  276   1HE   LYS  35          1HE       LYS  35  49.278  37.844  -4.689
  277   2HE   LYS  35          2HE       LYS  35  48.404  39.244  -4.032
  278   1HZ   LYS  35          1HZ       LYS  35  46.477  37.865  -3.813
  279   2HZ   LYS  35          2HZ       LYS  35  47.747  37.218  -2.984
  280   3HZ   LYS  35          3HZ       LYS  35  47.284  36.562  -4.424
  281    H    THR  36           H        THR  36  46.797  37.148 -10.492
  282    HA   THR  36           HA       THR  36  44.142  38.108 -10.117
  283    HB   THR  36           HB       THR  36  45.160  35.599 -11.492
  284    HG1  THR  36           HG1      THR  36  45.079  36.992 -13.300
  285   1HG2  THR  36          1HG2      THR  36  42.735  35.459 -11.184
  286   2HG2  THR  36          2HG2      THR  36  43.095  35.868 -12.868
  287   3HG2  THR  36          3HG2      THR  36  42.540  37.136 -11.753
  288    H    CYS  37           H        CYS  37  45.990  35.808  -8.293
  289    HA   CYS  37           HA       CYS  37  43.542  35.154  -6.746
  290   1HB   CYS  37          2HB       CYS  37  45.604  33.058  -7.449
  291   2HB   CYS  37          1HB       CYS  37  44.114  32.840  -6.530
  292    HXT  CYS  37           HO        OH  38  44.052  34.437  -4.658
  Start of MODEL    9
    1   1H    GLY   1          1H        GLY   1  68.267  58.156   8.220
    2   2H    GLY   1          2H        GLY   1  68.958  57.194   9.367
    3   3H    GLY   1          3H        GLY   1  69.385  58.783   9.258
    4   1HA   GLY   1          1HA       GLY   1  67.950  58.453  11.121
    5   2HA   GLY   1          2HA       GLY   1  67.213  59.495   9.889
    6    H    ILE   2           H        ILE   2  66.171  57.933   8.029
    7    HA   ILE   2           HA       ILE   2  63.972  56.601   9.388
    8    HB   ILE   2           HB       ILE   2  63.128  56.374   7.049
    9   1HG1  ILE   2          1HG1      ILE   2  65.472  58.132   6.228
   10   2HG1  ILE   2          2HG1      ILE   2  65.437  56.382   5.959
   11   1HG2  ILE   2          1HG2      ILE   2  62.595  58.282   8.545
   12   2HG2  ILE   2          2HG2      ILE   2  63.971  59.181   7.871
   13   3HG2  ILE   2          3HG2      ILE   2  62.589  58.753   6.840
   14   1HD1  ILE   2          1HD1      ILE   2  64.677  57.484   3.954
   15   2HD1  ILE   2          2HD1      ILE   2  63.300  56.642   4.695
   16   3HD1  ILE   2          3HD1      ILE   2  63.456  58.407   4.851
   17    H    LEU   3           H        LEU   3  66.033  55.179  10.160
   18    HA   LEU   3           HA       LEU   3  66.753  53.083   8.291
   19   1HB   LEU   3          2HB       LEU   3  67.354  53.416  11.256
   20   2HB   LEU   3          1HB       LEU   3  68.168  52.315  10.136
   21    HG   LEU   3           HG       LEU   3  68.216  55.364  10.021
   22   1HD1  LEU   3          1HD2      LEU   3  69.519  54.395  11.875
   23   2HD1  LEU   3          2HD2      LEU   3  70.581  55.096  10.635
   24   3HD1  LEU   3          3HD2      LEU   3  70.369  53.333  10.728
   25   1HD2  LEU   3          1HD1      LEU   3  68.382  54.458   7.745
   26   2HD2  LEU   3          2HD1      LEU   3  69.972  55.023   8.279
   27   3HD2  LEU   3          3HD1      LEU   3  69.609  53.283   8.279
   28    H    ASP   4           H        ASP   4  64.791  53.335  11.249
   29    HA   ASP   4           HA       ASP   4  63.988  50.489  11.059
   30   1HB   ASP   4          2HB       ASP   4  63.479  52.674  13.121
   31   2HB   ASP   4          1HB       ASP   4  62.854  51.021  13.204
   32    HD2  ASP   4           HD2      ASP   4  66.780  51.759  13.951
   33    H    THR   5           H        THR   5  63.165  53.605   9.945
   34    HA   THR   5           HA       THR   5  60.362  53.484  10.358
   35    HB   THR   5           HB       THR   5  62.046  55.191   8.497
   36    HG1  THR   5           HG1      THR   5  61.807  56.677  10.221
   37   1HG2  THR   5          1HG2      THR   5  59.178  55.555   9.467
   38   2HG2  THR   5          2HG2      THR   5  60.125  56.775   8.586
   39   3HG2  THR   5          3HG2      THR   5  59.693  55.250   7.790
   40    H    LEU   6           H        LEU   6  62.328  53.319   7.324
   41    HA   LEU   6           HA       LEU   6  60.279  52.346   5.621
   42   1HB   LEU   6          1HB       LEU   6  63.280  51.829   5.559
   43   2HB   LEU   6          2HB       LEU   6  62.160  51.571   4.212
   44    HG   LEU   6           HG       LEU   6  62.774  54.266   5.510
   45   1HD1  LEU   6          1HD1      LEU   6  63.946  54.719   3.382
   46   2HD1  LEU   6          2HD1      LEU   6  64.663  53.334   4.231
   47   3HD1  LEU   6          3HD1      LEU   6  63.596  53.065   2.834
   48   1HD2  LEU   6          1HD2      LEU   6  61.562  55.175   3.518
   49   2HD2  LEU   6          2HD2      LEU   6  60.495  54.257   4.592
   50   3HD2  LEU   6          3HD2      LEU   6  61.082  53.521   3.081
   51    H    LYS   7           H        LYS   7  62.576  50.666   7.800
   52    HA   LYS   7           HA       LYS   7  62.089  48.020   7.062
   53   1HB   LYS   7          2HB       LYS   7  63.905  48.835   8.466
   54   2HB   LYS   7          1HB       LYS   7  62.759  49.223   9.764
   55   1HG   LYS   7          2HG       LYS   7  62.172  46.877  10.021
   56   2HG   LYS   7          1HG       LYS   7  63.149  46.436   8.593
   57   1HD   LYS   7          1HD       LYS   7  65.174  47.270   9.679
   58   2HD   LYS   7          2HD       LYS   7  64.240  47.771  11.103
   59   1HE   LYS   7          1HE       LYS   7  64.487  44.896  10.097
   60   2HE   LYS   7          2HE       LYS   7  65.445  45.591  11.419
   61   1HZ   LYS   7          1HZ       LYS   7  62.525  45.339  11.390
   62   2HZ   LYS   7          2HZ       LYS   7  63.574  44.392  12.238
   63   3HZ   LYS   7          3HZ       LYS   7  63.425  45.992  12.607
   64    H    GLN   8           H        GLN   8  60.391  50.105   9.474
   65    HA   GLN   8           HA       GLN   8  58.653  48.149  10.494
   66   1HB   GLN   8          1HB       GLN   8  59.060  50.361  11.515
   67   2HB   GLN   8          2HB       GLN   8  58.269  51.153  10.146
   68   1HG   GLN   8          2HG       GLN   8  56.765  51.035  12.036
   69   2HG   GLN   8          1HG       GLN   8  56.138  50.056  10.702
   70   1HE2  GLN   8          2HE2      GLN   8  56.101  47.748  10.911
   71   2HE2  GLN   8          1HE2      GLN   8  56.318  46.964  12.461
   72    H    PHE   9           H        PHE   9  58.150  50.548   7.860
   73    HA   PHE   9           HA       PHE   9  55.561  49.577   7.117
   74   1HB   PHE   9          1HB       PHE   9  57.626  51.157   5.540
   75   2HB   PHE   9          2HB       PHE   9  55.940  50.920   5.067
   76    HD1  PHE   9           HD1      PHE   9  58.034  53.317   6.340
   77    HD2  PHE   9           HD2      PHE   9  54.239  51.469   7.195
   78    HE1  PHE   9           HE1      PHE   9  57.322  55.339   7.585
   79    HE2  PHE   9           HE2      PHE   9  53.548  53.480   8.464
   80    HZ   PHE   9           HZ       PHE   9  55.090  55.416   8.664
   81    H    ALA  10           H        ALA  10  58.870  48.800   5.975
   82    HA   ALA  10           HA       ALA  10  58.071  47.096   3.830
   83   1HB   ALA  10          1HB       ALA  10  60.348  46.191   4.012
   84   2HB   ALA  10          2HB       ALA  10  60.364  47.965   4.110
   85   3HB   ALA  10          3HB       ALA  10  60.558  46.989   5.585
   86    H    LYS  11           H        LYS  11  58.519  46.566   7.343
   87    HA   LYS  11           HA       LYS  11  57.715  43.740   7.141
   88   1HB   LYS  11          1HB       LYS  11  58.271  45.574   9.503
   89   2HB   LYS  11          2HB       LYS  11  57.810  43.861   9.629
   90   1HG   LYS  11          1HG       LYS  11  59.791  43.172   8.380
   91   2HG   LYS  11          2HG       LYS  11  60.247  44.859   8.098
   92   1HD   LYS  11          1HD       LYS  11  61.599  43.978   9.883
   93   2HD   LYS  11          2HD       LYS  11  60.497  45.199  10.550
   94   1HE   LYS  11          1HE       LYS  11  59.025  43.422  11.416
   95   2HE   LYS  11          2HE       LYS  11  60.041  42.183  10.647
   96   1HZ   LYS  11          1HZ       LYS  11  60.888  44.036  12.756
   97   2HZ   LYS  11          2HZ       LYS  11  61.833  42.884  12.050
   98   3HZ   LYS  11          3HZ       LYS  11  60.529  42.439  12.956
   99    H    GLY  12           H        GLY  12  55.933  45.445   5.890
  100   1HA   GLY  12          1HA       GLY  12  53.502  44.574   7.091
  101   2HA   GLY  12          2HA       GLY  12  53.657  46.358   7.200
  102    H    VAL  13           H        VAL  13  55.159  46.664   4.747
  103    HA   VAL  13           HA       VAL  13  53.433  45.527   2.636
  104    HB   VAL  13           HB       VAL  13  55.894  47.323   2.464
  105   1HG1  VAL  13          1HG2      VAL  13  55.394  46.153   0.332
  106   2HG1  VAL  13          2HG2      VAL  13  55.012  47.874   0.200
  107   3HG1  VAL  13          3HG2      VAL  13  53.703  46.692   0.438
  108   1HG2  VAL  13          1HG1      VAL  13  54.118  48.547   3.660
  109   2HG2  VAL  13          2HG1      VAL  13  52.943  48.097   2.404
  110   3HG2  VAL  13          3HG1      VAL  13  54.290  49.190   2.021
  111    H    GLY  14           H        GLY  14  54.490  43.823   4.348
  112   1HA   GLY  14          2HA       GLY  14  56.196  42.133   2.654
  113   2HA   GLY  14          1HA       GLY  14  56.812  42.525   4.273
  114    H    LYS  15           H        LYS  15  54.059  42.793   5.372
  115    HA   LYS  15           HA       LYS  15  53.443  39.972   5.923
  116   1HB   LYS  15          2HB       LYS  15  52.166  42.575   6.818
  117   2HB   LYS  15          1HB       LYS  15  51.735  40.946   7.388
  118   1HG   LYS  15          1HG       LYS  15  53.977  40.633   8.333
  119   2HG   LYS  15          2HG       LYS  15  54.517  42.178   7.651
  120   1HD   LYS  15          1HD       LYS  15  54.061  42.479   9.998
  121   2HD   LYS  15          2HD       LYS  15  52.872  43.388   9.044
  122   1HE   LYS  15          2HE       LYS  15  51.192  41.622   9.423
  123   2HE   LYS  15          1HE       LYS  15  52.401  40.633  10.271
  124   1HZ   LYS  15          1HZ       LYS  15  51.434  43.269  11.119
  125   2HZ   LYS  15          2HZ       LYS  15  50.996  41.819  11.773
  126   3HZ   LYS  15          3HZ       LYS  15  52.551  42.351  11.913
  127    H    ASP  16           H        ASP  16  52.111  42.860   4.306
  128    HA   ASP  16           HA       ASP  16  49.690  41.720   3.319
  129   1HB   ASP  16          2HB       ASP  16  50.211  44.146   3.492
  130   2HB   ASP  16          1HB       ASP  16  51.426  43.968   2.218
  131    HD2  ASP  16           HD2      ASP  16  50.750  43.594   0.154
  132    H    LEU  17           H        LEU  17  53.038  41.276   2.452
  133    HA   LEU  17           HA       LEU  17  52.462  40.382  -0.304
  134   1HB   LEU  17          1HB       LEU  17  55.063  40.569   1.265
  135   2HB   LEU  17          2HB       LEU  17  54.878  40.211  -0.454
  136    HG   LEU  17           HG       LEU  17  54.259  42.855   0.924
  137   1HD1  LEU  17          1HD1      LEU  17  56.656  42.368   0.441
  138   2HD1  LEU  17          2HD1      LEU  17  56.241  42.080  -1.261
  139   3HD1  LEU  17          3HD1      LEU  17  56.037  43.699  -0.559
  140   1HD2  LEU  17          1HD2      LEU  17  53.801  42.019  -1.972
  141   2HD2  LEU  17          2HD2      LEU  17  53.756  43.693  -1.378
  142   3HD2  LEU  17          3HD2      LEU  17  52.557  42.526  -0.803
  143    H    VAL  18           H        VAL  18  53.587  39.313   2.922
  144    HA   VAL  18           HA       VAL  18  53.795  36.532   2.208
  145    HB   VAL  18           HB       VAL  18  53.554  38.087   4.795
  146   1HG1  VAL  18          1HG1      VAL  18  52.350  36.021   5.226
  147   2HG1  VAL  18          2HG1      VAL  18  53.651  35.070   4.462
  148   3HG1  VAL  18          3HG1      VAL  18  53.950  35.944   5.984
  149   1HG2  VAL  18          1HG2      VAL  18  55.739  38.032   3.547
  150   2HG2  VAL  18          2HG2      VAL  18  55.718  36.261   3.653
  151   3HG2  VAL  18          3HG2      VAL  18  55.833  37.238   5.132
  152    H    LYS  19           H        LYS  19  51.235  38.787   3.129
  153    HA   LYS  19           HA       LYS  19  49.177  36.791   3.561
  154   1HB   LYS  19          1HB       LYS  19  49.077  39.074   4.501
  155   2HB   LYS  19          2HB       LYS  19  49.003  39.745   2.862
  156   1HG   LYS  19          2HG       LYS  19  46.783  39.656   3.879
  157   2HG   LYS  19          1HG       LYS  19  46.856  38.592   2.464
  158   1HD   LYS  19          1HD       LYS  19  47.208  36.637   3.950
  159   2HD   LYS  19          2HD       LYS  19  47.144  37.698   5.372
  160   1HE   LYS  19          1HE       LYS  19  44.891  37.309   3.351
  161   2HE   LYS  19          2HE       LYS  19  44.996  36.515   4.933
  162   1HZ   LYS  19          1HZ       LYS  19  43.606  38.425   5.022
  163   2HZ   LYS  19          2HZ       LYS  19  44.943  38.666   5.956
  164   3HZ   LYS  19          3HZ       LYS  19  44.817  39.407   4.487
  165    H    GLY  20           H        GLY  20  50.473  38.652   0.854
  166   1HA   GLY  20          1HA       GLY  20  48.442  37.955  -1.085
  167   2HA   GLY  20          2HA       GLY  20  50.025  38.701  -1.390
  168    H    ALA  21           H        ALA  21  51.735  36.788  -0.216
  169    HA   ALA  21           HA       ALA  21  51.826  34.656  -2.131
  170   1HB   ALA  21          1HB       ALA  21  53.821  35.520  -0.948
  171   2HB   ALA  21          2HB       ALA  21  53.156  34.932   0.594
  172   3HB   ALA  21          3HB       ALA  21  53.605  33.776  -0.679
  173    H    ALA  22           H        ALA  22  50.442  35.084   1.099
  174    HA   ALA  22           HA       ALA  22  49.647  32.256   1.250
  175   1HB   ALA  22          1HB       ALA  22  50.568  33.357   3.245
  176   2HB   ALA  22          2HB       ALA  22  49.227  34.525   3.218
  177   3HB   ALA  22          3HB       ALA  22  48.904  32.802   3.507
  178    H    GLN  23           H        GLN  23  48.496  33.625  -0.942
  179    HA   GLN  23           HA       GLN  23  45.764  34.383  -0.162
  180   1HB   GLN  23          2HB       GLN  23  46.899  35.744  -1.788
  181   2HB   GLN  23          1HB       GLN  23  47.257  34.338  -2.807
  182   1HG   GLN  23          1HG       GLN  23  44.811  33.985  -3.141
  183   2HG   GLN  23          2HG       GLN  23  44.486  35.406  -2.129
  184   1HE2  GLN  23          1HE2      GLN  23  45.684  37.483  -2.895
  185   2HE2  GLN  23          2HE2      GLN  23  45.694  37.767  -4.623
  186    H    GLY  24           H        GLY  24  47.305  32.013  -2.433
  187   1HA   GLY  24          2HA       GLY  24  44.777  30.547  -2.655
  188   2HA   GLY  24          1HA       GLY  24  46.270  30.255  -3.553
  189    H    VAL  25           H        VAL  25  47.676  28.117  -0.976
  190    HA   VAL  25           HA       VAL  25  48.464  30.287  -2.771
  191    HB   VAL  25           HB       VAL  25  49.959  27.816  -1.811
  192   1HG1  VAL  25          1HG2      VAL  25  50.909  30.457  -3.008
  193   2HG1  VAL  25          2HG2      VAL  25  50.965  28.869  -3.806
  194   3HG1  VAL  25          3HG2      VAL  25  51.959  29.173  -2.371
  195   1HG2  VAL  25          1HG1      VAL  25  50.987  29.378  -0.171
  196   2HG2  VAL  25          2HG1      VAL  25  49.835  30.637  -0.676
  197   3HG2  VAL  25          3HG1      VAL  25  49.252  29.153   0.115
  198    H    LEU  26           H        LEU  26  47.969  26.761  -2.839
  199    HA   LEU  26           HA       LEU  26  48.879  26.134  -5.384
  200   1HB   LEU  26          2HB       LEU  26  46.529  24.959  -3.856
  201   2HB   LEU  26          1HB       LEU  26  47.384  24.176  -5.191
  202    HG   LEU  26           HG       LEU  26  48.615  24.917  -2.496
  203   1HD1  LEU  26          1HD2      LEU  26  47.826  22.228  -3.685
  204   2HD1  LEU  26          2HD2      LEU  26  46.979  23.075  -2.370
  205   3HD1  LEU  26          3HD2      LEU  26  48.636  22.486  -2.123
  206   1HD2  LEU  26          1HD1      LEU  26  49.752  23.409  -4.893
  207   2HD2  LEU  26          2HD1      LEU  26  50.328  24.968  -4.256
  208   3HD2  LEU  26          3HD1      LEU  26  50.512  23.496  -3.290
  209    H    SER  27           H        SER  27  46.035  27.976  -4.585
  210    HA   SER  27           HA       SER  27  44.711  27.436  -7.152
  211   1HB   SER  27          2HB       SER  27  44.061  29.360  -4.878
  212   2HB   SER  27          1HB       SER  27  43.015  28.985  -6.265
  213    HG   SER  27           HG       SER  27  43.036  26.801  -5.562
  214    H    THR  28           H        THR  28  46.290  30.213  -5.478
  215    HA   THR  28           HA       THR  28  45.871  32.206  -7.324
  216    HB   THR  28           HB       THR  28  48.389  31.665  -5.703
  217    HG1  THR  28           HG1      THR  28  47.324  33.018  -4.234
  218   1HG2  THR  28          1HG2      THR  28  47.328  34.231  -6.973
  219   2HG2  THR  28          2HG2      THR  28  48.822  33.379  -7.423
  220   3HG2  THR  28          3HG2      THR  28  48.685  34.139  -5.829
  221    H    VAL  29           H        VAL  29  48.639  29.905  -7.310
  222    HA   VAL  29           HA       VAL  29  50.052  30.813  -9.486
  223    HB   VAL  29           HB       VAL  29  50.779  28.429  -9.705
  224   1HG1  VAL  29          1HG2      VAL  29  51.894  30.052  -8.210
  225   2HG1  VAL  29          2HG2      VAL  29  51.926  28.416  -7.523
  226   3HG1  VAL  29          3HG2      VAL  29  50.776  29.617  -6.898
  227   1HG2  VAL  29          1HG1      VAL  29  48.919  27.954  -7.350
  228   2HG2  VAL  29          2HG1      VAL  29  48.718  27.275  -8.984
  229   3HG2  VAL  29          3HG1      VAL  29  50.113  26.816  -7.996
  230    H    SER  30           H        SER  30  47.175  28.669  -9.547
  231    HA   SER  30           HA       SER  30  47.379  28.210 -12.363
  232   1HB   SER  30          1HB       SER  30  45.420  26.949 -12.134
  233   2HB   SER  30          2HB       SER  30  46.181  26.803 -10.534
  234    HG   SER  30           HG       SER  30  44.777  28.427  -9.809
  235    H    CYS  31           H        CYS  31  45.109  30.185 -10.454
  236    HA   CYS  31           HA       CYS  31  44.202  31.638 -12.831
  237   1HB   CYS  31          1HB       CYS  31  42.837  32.895 -11.146
  238   2HB   CYS  31          2HB       CYS  31  42.561  31.157 -11.218
  239    H    LYS  32           H        LYS  32  47.127  31.795 -12.010
  240    HA   LYS  32           HA       LYS  32  47.428  34.513 -11.034
  241   1HB   LYS  32          1HB       LYS  32  48.824  32.560 -10.387
  242   2HB   LYS  32          2HB       LYS  32  49.497  32.504 -12.035
  243   1HG   LYS  32          2HG       LYS  32  49.510  34.996 -10.344
  244   2HG   LYS  32          1HG       LYS  32  50.760  33.746 -10.161
  245   1HD   LYS  32          2HD       LYS  32  51.411  34.018 -12.520
  246   2HD   LYS  32          1HD       LYS  32  50.149  35.254 -12.741
  247   1HE   LYS  32          1HE       LYS  32  51.216  36.702 -11.084
  248   2HE   LYS  32          2HE       LYS  32  52.407  35.445 -10.703
  249   1HZ   LYS  32          1HZ       LYS  32  52.115  36.805 -13.291
  250   2HZ   LYS  32          2HZ       LYS  32  53.227  35.638 -12.938
  251   3HZ   LYS  32          3HZ       LYS  32  53.291  37.097 -12.172
  252    H    LEU  33           H        LEU  33  47.985  32.734 -14.051
  253    HA   LEU  33           HA       LEU  33  49.391  34.524 -15.556
  254   1HB   LEU  33          1HB       LEU  33  48.825  32.264 -16.280
  255   2HB   LEU  33          2HB       LEU  33  47.121  32.709 -16.448
  256    HG   LEU  33           HG       LEU  33  47.709  34.306 -18.260
  257   1HD1  LEU  33          1HD2      LEU  33  50.528  33.203 -17.870
  258   2HD1  LEU  33          2HD2      LEU  33  50.014  34.891 -17.633
  259   3HD1  LEU  33          3HD2      LEU  33  49.996  34.181 -19.255
  260   1HD2  LEU  33          1HD1      LEU  33  48.800  31.491 -18.659
  261   2HD2  LEU  33          2HD1      LEU  33  47.092  31.973 -18.777
  262   3HD2  LEU  33          3HD1      LEU  33  48.275  32.602 -19.943
  263    H    ALA  34           H        ALA  34  45.779  34.317 -15.823
  264    HA   ALA  34           HA       ALA  34  45.624  36.964 -16.989
  265   1HB   ALA  34          1HB       ALA  34  43.461  35.133 -15.872
  266   2HB   ALA  34          2HB       ALA  34  43.187  36.579 -16.871
  267   3HB   ALA  34          3HB       ALA  34  44.021  35.169 -17.560
  268    H    LYS  35           H        LYS  35  46.079  35.849 -13.895
  269    HA   LYS  35           HA       LYS  35  45.867  36.593 -11.820
  270   1HB   LYS  35          1HB       LYS  35  47.590  38.028 -13.088
  271   2HB   LYS  35          2HB       LYS  35  46.390  39.321 -12.999
  272   1HG   LYS  35          1HG       LYS  35  48.033  39.430 -11.173
  273   2HG   LYS  35          2HG       LYS  35  46.406  39.145 -10.521
  274   1HD   LYS  35          1HD       LYS  35  46.878  36.784 -10.200
  275   2HD   LYS  35          2HD       LYS  35  48.448  36.922 -11.012
  276   1HE   LYS  35          1HE       LYS  35  47.663  38.366  -8.440
  277   2HE   LYS  35          2HE       LYS  35  48.592  36.856  -8.517
  278   1HZ   LYS  35          1HZ       LYS  35  49.423  39.424  -9.662
  279   2HZ   LYS  35          2HZ       LYS  35  50.268  38.010  -9.752
  280   3HZ   LYS  35          3HZ       LYS  35  50.015  38.729  -8.290
  281    H    THR  36           H        THR  36  43.376  36.179 -12.563
  282    HA   THR  36           HA       THR  36  41.717  38.389 -11.563
  283    HB   THR  36           HB       THR  36  40.742  36.702 -13.058
  284    HG1  THR  36           HG1      THR  36  39.483  37.727 -11.453
  285   1HG2  THR  36          1HG2      THR  36  42.057  34.712 -12.378
  286   2HG2  THR  36          2HG2      THR  36  41.253  34.728 -10.789
  287   3HG2  THR  36          3HG2      THR  36  40.313  34.416 -12.261
  288    H    CYS  37           H        CYS  37  43.977  36.077 -10.388
  289    HA   CYS  37           HA       CYS  37  43.004  36.301  -7.579
  290   1HB   CYS  37          1HB       CYS  37  44.865  34.365  -8.987
  291   2HB   CYS  37          2HB       CYS  37  44.588  34.387  -7.243
  292    HXT  CYS  37           HO        OH  38  45.522  38.810  -7.591
  Start of MODEL   10
    1   1H    GLY   1          1H        GLY   1  64.058  55.134  11.424
    2   2H    GLY   1          2H        GLY   1  65.599  55.134  10.834
    3   3H    GLY   1          3H        GLY   1  64.785  56.557  11.011
    4   1HA   GLY   1          2HA       GLY   1  64.067  54.390   9.177
    5   2HA   GLY   1          1HA       GLY   1  63.194  55.927   9.360
    6    H    ILE   2           H        ILE   2  65.340  56.433   6.401
    7    HA   ILE   2           HA       ILE   2  62.841  55.185   7.312
    8    HB   ILE   2           HB       ILE   2  62.360  55.220   4.850
    9   1HG1  ILE   2          2HG1      ILE   2  63.571  56.764   3.431
   10   2HG1  ILE   2          1HG1      ILE   2  64.768  57.087   4.687
   11   1HG2  ILE   2          1HG2      ILE   2  62.955  57.857   6.239
   12   2HG2  ILE   2          2HG2      ILE   2  61.831  57.617   4.884
   13   3HG2  ILE   2          3HG2      ILE   2  61.496  56.864   6.455
   14   1HD1  ILE   2          1HD1      ILE   2  65.606  54.791   4.524
   15   2HD1  ILE   2          2HD1      ILE   2  65.545  55.509   2.908
   16   3HD1  ILE   2          3HD1      ILE   2  64.286  54.360   3.404
   17    H    LEU   3           H        LEU   3  65.721  53.938   7.387
   18    HA   LEU   3           HA       LEU   3  65.488  51.677   5.585
   19   1HB   LEU   3          1HB       LEU   3  67.342  52.224   7.937
   20   2HB   LEU   3          2HB       LEU   3  67.541  50.916   6.762
   21    HG   LEU   3           HG       LEU   3  67.605  53.899   6.100
   22   1HD1  LEU   3          1HD2      LEU   3  69.531  53.166   7.456
   23   2HD1  LEU   3          2HD2      LEU   3  70.021  53.535   5.789
   24   3HD1  LEU   3          3HD2      LEU   3  69.842  51.843   6.309
   25   1HD2  LEU   3          1HD1      LEU   3  68.188  51.427   4.406
   26   2HD2  LEU   3          2HD1      LEU   3  66.854  52.578   4.161
   27   3HD2  LEU   3          3HD1      LEU   3  68.527  53.102   3.919
   28    H    ASP   4           H        ASP   4  64.198  52.405   8.690
   29    HA   ASP   4           HA       ASP   4  63.661  49.550   9.295
   30   1HB   ASP   4          2HB       ASP   4  64.350  51.066  11.149
   31   2HB   ASP   4          1HB       ASP   4  62.988  52.132  10.775
   32    HD2  ASP   4           HD2      ASP   4  63.685  48.768  11.451
   33    H    THR   5           H        THR   5  62.406  52.535   7.962
   34    HA   THR   5           HA       THR   5  59.701  52.030   8.591
   35    HB   THR   5           HB       THR   5  60.929  53.985   6.610
   36    HG1  THR   5           HG1      THR   5  60.175  54.221   9.338
   37   1HG2  THR   5          1HG2      THR   5  58.522  53.757   6.215
   38   2HG2  THR   5          2HG2      THR   5  58.195  53.946   7.955
   39   3HG2  THR   5          3HG2      THR   5  58.860  55.302   7.017
   40    H    LEU   6           H        LEU   6  61.377  52.019   5.377
   41    HA   LEU   6           HA       LEU   6  59.152  51.008   3.909
   42   1HB   LEU   6          2HB       LEU   6  62.141  50.769   3.396
   43   2HB   LEU   6          1HB       LEU   6  60.860  50.516   2.203
   44    HG   LEU   6           HG       LEU   6  61.467  53.148   3.629
   45   1HD1  LEU   6          1HD1      LEU   6  62.267  53.872   1.420
   46   2HD1  LEU   6          2HD1      LEU   6  63.191  52.467   1.996
   47   3HD1  LEU   6          3HD1      LEU   6  61.934  52.256   0.755
   48   1HD2  LEU   6          1HD2      LEU   6  59.898  54.108   1.936
   49   2HD2  LEU   6          2HD2      LEU   6  59.471  52.461   1.425
   50   3HD2  LEU   6          3HD2      LEU   6  59.080  53.022   3.069
   51    H    LYS   7           H        LYS   7  61.762  49.491   5.763
   52    HA   LYS   7           HA       LYS   7  61.359  46.793   4.928
   53   1HB   LYS   7          2HB       LYS   7  62.673  48.204   7.265
   54   2HB   LYS   7          1HB       LYS   7  62.627  46.444   7.162
   55   1HG   LYS   7          2HG       LYS   7  64.721  47.416   6.240
   56   2HG   LYS   7          1HG       LYS   7  63.828  46.446   5.057
   57   1HD   LYS   7          2HD       LYS   7  62.988  48.412   3.940
   58   2HD   LYS   7          1HD       LYS   7  63.605  49.480   5.218
   59   1HE   LYS   7          2HE       LYS   7  65.927  48.785   4.654
   60   2HE   LYS   7          1HE       LYS   7  65.290  47.764   3.348
   61   1HZ   LYS   7          1HZ       LYS   7  64.989  50.677   3.556
   62   2HZ   LYS   7          2HZ       LYS   7  64.398  49.734   2.339
   63   3HZ   LYS   7          3HZ       LYS   7  66.027  49.881   2.552
   64    H    GLN   8           H        GLN   8  60.037  48.799   7.591
   65    HA   GLN   8           HA       GLN   8  58.567  46.736   8.906
   66   1HB   GLN   8          2HB       GLN   8  59.107  48.893   9.933
   67   2HB   GLN   8          1HB       GLN   8  58.128  49.750   8.731
   68   1HG   GLN   8          1HG       GLN   8  56.109  48.590   9.522
   69   2HG   GLN   8          2HG       GLN   8  57.083  47.703  10.717
   70   1HE2  GLN   8          2HE2      GLN   8  58.428  49.166  12.229
   71   2HE2  GLN   8          1HE2      GLN   8  57.634  50.609  12.821
   72    H    PHE   9           H        PHE   9  57.733  49.145   6.389
   73    HA   PHE   9           HA       PHE   9  55.015  48.299   6.063
   74   1HB   PHE   9          2HB       PHE   9  56.868  49.713   4.113
   75   2HB   PHE   9          1HB       PHE   9  55.109  49.623   3.995
   76    HD1  PHE   9           HD1      PHE   9  56.377  52.180   3.776
   77    HD2  PHE   9           HD2      PHE   9  55.198  50.068   7.348
   78    HE1  PHE   9           HE1      PHE   9  56.101  54.332   4.973
   79    HE2  PHE   9           HE2      PHE   9  54.977  52.209   8.538
   80    HZ   PHE   9           HZ       PHE   9  55.408  54.350   7.357
   81    H    ALA  10           H        ALA  10  58.030  47.485   4.281
   82    HA   ALA  10           HA       ALA  10  56.815  45.653   2.455
   83   1HB   ALA  10          1HB       ALA  10  59.085  46.576   2.160
   84   2HB   ALA  10          2HB       ALA  10  59.634  45.713   3.615
   85   3HB   ALA  10          3HB       ALA  10  59.113  44.799   2.181
   86    H    LYS  11           H        LYS  11  58.127  45.323   5.788
   87    HA   LYS  11           HA       LYS  11  57.424  42.496   5.955
   88   1HB   LYS  11          1HB       LYS  11  59.385  43.682   7.046
   89   2HB   LYS  11          2HB       LYS  11  58.225  44.460   8.136
   90   1HG   LYS  11          2HG       LYS  11  57.491  42.178   8.893
   91   2HG   LYS  11          1HG       LYS  11  58.705  41.452   7.825
   92   1HD   LYS  11          2HD       LYS  11  59.342  43.486  10.004
   93   2HD   LYS  11          1HD       LYS  11  59.365  41.728  10.257
   94   1HE   LYS  11          1HE       LYS  11  61.070  41.505   8.453
   95   2HE   LYS  11          2HE       LYS  11  61.117  43.274   8.300
   96   1HZ   LYS  11          1HZ       LYS  11  61.765  41.752  10.716
   97   2HZ   LYS  11          2HZ       LYS  11  62.847  42.467   9.698
   98   3HZ   LYS  11          3HZ       LYS  11  61.801  43.394  10.573
   99    H    GLY  12           H        GLY  12  55.299  44.095   5.082
  100   1HA   GLY  12          1HA       GLY  12  53.262  43.300   6.926
  101   2HA   GLY  12          2HA       GLY  12  53.403  45.086   6.829
  102    H    VAL  13           H        VAL  13  54.209  45.210   4.071
  103    HA   VAL  13           HA       VAL  13  52.044  43.889   2.551
  104    HB   VAL  13           HB       VAL  13  54.360  45.656   1.641
  105   1HG1  VAL  13          1HG2      VAL  13  53.380  44.330  -0.213
  106   2HG1  VAL  13          2HG2      VAL  13  51.755  44.866   0.268
  107   3HG1  VAL  13          3HG2      VAL  13  52.936  46.034  -0.370
  108   1HG2  VAL  13          1HG1      VAL  13  52.904  46.973   3.137
  109   2HG2  VAL  13          2HG1      VAL  13  52.664  47.484   1.461
  110   3HG2  VAL  13          3HG1      VAL  13  51.469  46.427   2.242
  111    H    GLY  14           H        GLY  14  53.558  42.335   4.092
  112   1HA   GLY  14          1HA       GLY  14  54.835  40.518   2.151
  113   2HA   GLY  14          2HA       GLY  14  55.749  40.980   3.606
  114    H    LYS  15           H        LYS  15  53.347  41.351   5.238
  115    HA   LYS  15           HA       LYS  15  52.710  38.581   5.987
  116   1HB   LYS  15          1HB       LYS  15  51.780  41.270   7.047
  117   2HB   LYS  15          2HB       LYS  15  51.413  39.683   7.761
  118   1HG   LYS  15          1HG       LYS  15  53.810  39.284   8.169
  119   2HG   LYS  15          2HG       LYS  15  54.221  40.839   7.410
  120   1HD   LYS  15          2HD       LYS  15  52.903  42.039   9.108
  121   2HD   LYS  15          1HD       LYS  15  52.481  40.496   9.888
  122   1HE   LYS  15          2HE       LYS  15  54.884  40.053  10.308
  123   2HE   LYS  15          1HE       LYS  15  55.304  41.593   9.527
  124   1HZ   LYS  15          1HZ       LYS  15  53.661  41.289  11.938
  125   2HZ   LYS  15          2HZ       LYS  15  55.232  41.788  11.894
  126   3HZ   LYS  15          3HZ       LYS  15  54.052  42.718  11.213
  127    H    ASP  16           H        ASP  16  51.228  41.516   4.600
  128    HA   ASP  16           HA       ASP  16  48.605  40.437   4.132
  129   1HB   ASP  16          2HB       ASP  16  50.210  42.756   3.009
  130   2HB   ASP  16          1HB       ASP  16  48.571  42.404   2.468
  131    HD2  ASP  16           HD2      ASP  16  47.161  43.120   5.713
  132    H    LEU  17           H        LEU  17  51.674  39.820   2.678
  133    HA   LEU  17           HA       LEU  17  50.497  38.949   0.090
  134   1HB   LEU  17          2HB       LEU  17  53.355  39.092   1.131
  135   2HB   LEU  17          1HB       LEU  17  52.881  38.400  -0.417
  136    HG   LEU  17           HG       LEU  17  52.532  41.308   0.462
  137   1HD1  LEU  17          1HD1      LEU  17  54.280  40.034  -1.688
  138   2HD1  LEU  17          2HD1      LEU  17  54.858  40.624  -0.116
  139   3HD1  LEU  17          3HD1      LEU  17  54.190  41.766  -1.300
  140   1HD2  LEU  17          1HD2      LEU  17  50.672  40.763  -1.020
  141   2HD2  LEU  17          2HD2      LEU  17  51.770  39.933  -2.152
  142   3HD2  LEU  17          3HD2      LEU  17  51.867  41.693  -1.931
  143    H    VAL  18           H        VAL  18  52.153  37.844   3.064
  144    HA   VAL  18           HA       VAL  18  51.990  35.056   2.366
  145    HB   VAL  18           HB       VAL  18  52.412  36.613   4.938
  146   1HG1  VAL  18          1HG1      VAL  18  52.275  33.597   4.591
  147   2HG1  VAL  18          2HG1      VAL  18  51.219  34.605   5.616
  148   3HG1  VAL  18          3HG1      VAL  18  52.938  34.437   6.015
  149   1HG2  VAL  18          1HG2      VAL  18  54.662  35.634   4.780
  150   2HG2  VAL  18          2HG2      VAL  18  54.275  36.464   3.259
  151   3HG2  VAL  18          3HG2      VAL  18  54.179  34.694   3.351
  152    H    LYS  19           H        LYS  19  49.869  37.495   3.782
  153    HA   LYS  19           HA       LYS  19  47.802  35.685   4.701
  154   1HB   LYS  19          2HB       LYS  19  48.129  37.971   5.548
  155   2HB   LYS  19          1HB       LYS  19  47.710  38.641   3.964
  156   1HG   LYS  19          1HG       LYS  19  45.808  36.834   5.507
  157   2HG   LYS  19          2HG       LYS  19  45.906  38.579   5.805
  158   1HD   LYS  19          1HD       LYS  19  45.374  39.056   3.445
  159   2HD   LYS  19          2HD       LYS  19  45.270  37.319   3.111
  160   1HE   LYS  19          2HE       LYS  19  43.036  38.167   3.407
  161   2HE   LYS  19          1HE       LYS  19  43.427  37.133   4.793
  162   1HZ   LYS  19          1HZ       LYS  19  42.354  39.162   5.441
  163   2HZ   LYS  19          2HZ       LYS  19  43.541  40.069   4.744
  164   3HZ   LYS  19          3HZ       LYS  19  43.887  39.117   6.045
  165    H    GLY  20           H        GLY  20  48.659  37.320   1.688
  166   1HA   GLY  20          1HA       GLY  20  46.204  36.792   0.257
  167   2HA   GLY  20          2HA       GLY  20  47.776  37.270  -0.423
  168    H    ALA  21           H        ALA  21  49.478  35.319   0.420
  169    HA   ALA  21           HA       ALA  21  48.885  33.066  -1.243
  170   1HB   ALA  21          1HB       ALA  21  50.993  32.180  -0.352
  171   2HB   ALA  21          2HB       ALA  21  51.171  33.891  -0.792
  172   3HB   ALA  21          3HB       ALA  21  50.999  33.425   0.916
  173    H    ALA  22           H        ALA  22  48.367  33.792   2.180
  174    HA   ALA  22           HA       ALA  22  48.114  31.107   3.106
  175   1HB   ALA  22          1HB       ALA  22  46.729  33.597   4.165
  176   2HB   ALA  22          2HB       ALA  22  46.939  32.058   5.018
  177   3HB   ALA  22          3HB       ALA  22  48.359  33.043   4.617
  178    H    GLN  23           H        GLN  23  45.849  33.286   1.453
  179    HA   GLN  23           HA       GLN  23  43.448  31.876   1.884
  180   1HB   GLN  23          1HB       GLN  23  43.743  34.176   0.925
  181   2HB   GLN  23          2HB       GLN  23  44.306  33.441  -0.586
  182   1HG   GLN  23          2HG       GLN  23  42.158  32.230  -0.803
  183   2HG   GLN  23          1HG       GLN  23  41.596  32.950   0.718
  184   1HE2  GLN  23          1HE2      GLN  23  41.726  35.456   0.768
  185   2HE2  GLN  23          2HE2      GLN  23  41.197  36.278  -0.684
  186    H    GLY  24           H        GLY  24  45.940  31.597  -0.703
  187   1HA   GLY  24          1HA       GLY  24  45.521  28.799  -1.114
  188   2HA   GLY  24          2HA       GLY  24  44.672  29.744  -2.361
  189    H    VAL  25           H        VAL  25  47.746  28.660  -1.163
  190    HA   VAL  25           HA       VAL  25  49.439  30.634  -2.134
  191    HB   VAL  25           HB       VAL  25  49.975  27.633  -1.896
  192   1HG1  VAL  25          1HG2      VAL  25  52.341  28.327  -1.604
  193   2HG1  VAL  25          2HG2      VAL  25  51.732  28.761  -3.210
  194   3HG1  VAL  25          3HG2      VAL  25  51.885  30.009  -1.953
  195   1HG2  VAL  25          1HG1      VAL  25  50.401  29.886   0.105
  196   2HG2  VAL  25          2HG1      VAL  25  49.164  28.612   0.225
  197   3HG2  VAL  25          3HG1      VAL  25  50.881  28.190   0.319
  198    H    LEU  26           H        LEU  26  48.732  27.469  -3.683
  199    HA   LEU  26           HA       LEU  26  49.976  27.938  -6.158
  200   1HB   LEU  26          1HB       LEU  26  47.497  26.296  -5.544
  201   2HB   LEU  26          2HB       LEU  26  48.514  26.135  -6.983
  202    HG   LEU  26           HG       LEU  26  49.411  25.607  -4.110
  203   1HD1  LEU  26          1HD2      LEU  26  47.811  23.941  -4.977
  204   2HD1  LEU  26          2HD2      LEU  26  49.440  23.252  -4.821
  205   3HD1  LEU  26          3HD2      LEU  26  48.821  23.716  -6.423
  206   1HD2  LEU  26          1HD1      LEU  26  51.417  24.610  -5.216
  207   2HD2  LEU  26          2HD1      LEU  26  50.849  25.241  -6.777
  208   3HD2  LEU  26          3HD1      LEU  26  51.313  26.358  -5.472
  209    H    SER  27           H        SER  27  46.686  28.767  -5.030
  210    HA   SER  27           HA       SER  27  45.692  29.675  -7.540
  211   1HB   SER  27          1HB       SER  27  44.247  29.121  -5.632
  212   2HB   SER  27          2HB       SER  27  44.915  30.486  -4.710
  213    HG   SER  27           HG       SER  27  42.961  31.011  -5.776
  214    H    THR  28           H        THR  28  47.151  31.463  -4.755
  215    HA   THR  28           HA       THR  28  47.073  34.018  -5.968
  216    HB   THR  28           HB       THR  28  49.025  32.961  -3.893
  217    HG1  THR  28           HG1      THR  28  46.824  32.741  -3.321
  218   1HG2  THR  28          1HG2      THR  28  49.735  35.119  -4.886
  219   2HG2  THR  28          2HG2      THR  28  49.142  35.362  -3.233
  220   3HG2  THR  28          3HG2      THR  28  48.112  35.787  -4.617
  221    H    VAL  29           H        VAL  29  49.699  31.564  -5.824
  222    HA   VAL  29           HA       VAL  29  51.598  32.935  -7.425
  223    HB   VAL  29           HB       VAL  29  51.092  29.989  -6.907
  224   1HG1  VAL  29          1HG2      VAL  29  53.450  31.339  -8.291
  225   2HG1  VAL  29          2HG2      VAL  29  53.429  29.656  -7.720
  226   3HG1  VAL  29          3HG2      VAL  29  52.332  30.158  -9.016
  227   1HG2  VAL  29          1HG1      VAL  29  51.766  31.407  -4.947
  228   2HG2  VAL  29          2HG1      VAL  29  53.188  31.947  -5.859
  229   3HG2  VAL  29          3HG1      VAL  29  53.023  30.239  -5.398
  230    H    SER  30           H        SER  30  48.746  30.971  -8.290
  231    HA   SER  30           HA       SER  30  49.421  30.859 -11.095
  232   1HB   SER  30          2HB       SER  30  47.921  29.225  -9.935
  233   2HB   SER  30          1HB       SER  30  46.718  30.504  -9.717
  234    HG   SER  30           HG       SER  30  47.760  29.592 -12.195
  235    H    CYS  31           H        CYS  31  46.828  32.611  -9.343
  236    HA   CYS  31           HA       CYS  31  46.403  34.451 -11.558
  237   1HB   CYS  31          1HB       CYS  31  44.725  35.394 -10.205
  238   2HB   CYS  31          2HB       CYS  31  44.632  33.649  -9.973
  239    H    LYS  32           H        LYS  32  49.166  34.320 -10.098
  240    HA   LYS  32           HA       LYS  32  49.384  37.030  -8.979
  241   1HB   LYS  32          1HB       LYS  32  50.428  35.079  -7.931
  242   2HB   LYS  32          2HB       LYS  32  51.441  34.834  -9.384
  243   1HG   LYS  32          2HG       LYS  32  52.365  37.069  -9.156
  244   2HG   LYS  32          1HG       LYS  32  51.274  37.396  -7.789
  245   1HD   LYS  32          2HD       LYS  32  53.503  35.320  -7.806
  246   2HD   LYS  32          1HD       LYS  32  53.559  36.962  -7.122
  247   1HE   LYS  32          2HE       LYS  32  51.726  36.403  -5.563
  248   2HE   LYS  32          1HE       LYS  32  51.700  34.742  -6.187
  249   1HZ   LYS  32          1HZ       LYS  32  53.976  36.035  -4.878
  250   2HZ   LYS  32          2HZ       LYS  32  53.948  34.494  -5.465
  251   3HZ   LYS  32          3HZ       LYS  32  52.973  34.914  -4.203
  252    H    LEU  33           H        LEU  33  50.272  35.212 -11.920
  253    HA   LEU  33           HA       LEU  33  52.055  37.087 -13.073
  254   1HB   LEU  33          1HB       LEU  33  51.764  34.804 -13.925
  255   2HB   LEU  33          2HB       LEU  33  50.074  35.144 -14.332
  256    HG   LEU  33           HG       LEU  33  50.810  36.839 -15.996
  257   1HD1  LEU  33          1HD1      LEU  33  52.963  37.531 -15.026
  258   2HD1  LEU  33          2HD1      LEU  33  53.610  35.887 -15.238
  259   3HD1  LEU  33          3HD1      LEU  33  53.218  36.885 -16.655
  260   1HD2  LEU  33          1HD2      LEU  33  50.420  34.495 -16.659
  261   2HD2  LEU  33          2HD2      LEU  33  52.120  34.107 -16.309
  262   3HD2  LEU  33          3HD2      LEU  33  51.715  35.231 -17.626
  263    H    ALA  34           H        ALA  34  48.530  36.590 -13.509
  264    HA   ALA  34           HA       ALA  34  48.097  39.431 -14.220
  265   1HB   ALA  34          1HB       ALA  34  46.669  37.730 -15.273
  266   2HB   ALA  34          2HB       ALA  34  45.715  38.763 -14.187
  267   3HB   ALA  34          3HB       ALA  34  46.179  37.122 -13.676
  268    H    LYS  35           H        LYS  35  49.254  40.109 -12.311
  269    HA   LYS  35           HA       LYS  35  48.788  39.310  -9.682
  270   1HB   LYS  35          2HB       LYS  35  50.760  40.491 -10.701
  271   2HB   LYS  35          1HB       LYS  35  49.827  41.989 -10.673
  272   1HG   LYS  35          2HG       LYS  35  51.386  41.888  -8.822
  273   2HG   LYS  35          1HG       LYS  35  49.751  41.856  -8.174
  274   1HD   LYS  35          2HD       LYS  35  49.965  39.322  -7.968
  275   2HD   LYS  35          1HD       LYS  35  51.647  39.505  -8.523
  276   1HE   LYS  35          2HE       LYS  35  52.120  41.011  -6.619
  277   2HE   LYS  35          1HE       LYS  35  50.438  40.859  -6.071
  278   1HZ   LYS  35          1HZ       LYS  35  51.889  39.414  -4.877
  279   2HZ   LYS  35          2HZ       LYS  35  50.816  38.528  -5.762
  280   3HZ   LYS  35          3HZ       LYS  35  52.380  38.672  -6.264
  281    H    THR  36           H        THR  36  46.299  40.193 -11.222
  282    HA   THR  36           HA       THR  36  45.232  42.258  -9.396
  283    HB   THR  36           HB       THR  36  44.520  42.173 -11.755
  284    HG1  THR  36           HG1      THR  36  42.308  42.331 -11.260
  285   1HG2  THR  36          1HG2      THR  36  43.172  39.541 -10.993
  286   2HG2  THR  36          2HG2      THR  36  42.945  40.440 -12.505
  287   3HG2  THR  36          3HG2      THR  36  44.524  39.729 -12.132
  288    H    CYS  37           H        CYS  37  46.367  39.420  -8.557
  289    HA   CYS  37           HA       CYS  37  44.335  38.839  -6.575
  290   1HB   CYS  37          2HB       CYS  37  43.085  37.982  -8.359
  291   2HB   CYS  37          1HB       CYS  37  44.502  37.328  -9.170
  292    HXT  CYS  37           HO        OH  38  48.006  37.254  -6.997
  Start of MODEL   11
    1   1H    GLY   1          1H        GLY   1  65.967  56.066  10.727
    2   2H    GLY   1          2H        GLY   1  66.566  57.022   9.524
    3   3H    GLY   1          3H        GLY   1  67.596  56.169  10.490
    4   1HA   GLY   1          2HA       GLY   1  67.427  55.126   8.361
    5   2HA   GLY   1          1HA       GLY   1  66.785  54.101   9.658
    6    H    ILE   2           H        ILE   2  65.695  56.688   7.404
    7    HA   ILE   2           HA       ILE   2  62.964  56.064   7.429
    8    HB   ILE   2           HB       ILE   2  64.367  58.071   6.533
    9   1HG1  ILE   2          2HG1      ILE   2  62.013  58.184   6.716
   10   2HG1  ILE   2          1HG1      ILE   2  62.534  58.878   5.177
   11   1HG2  ILE   2          1HG2      ILE   2  64.066  56.511   3.937
   12   2HG2  ILE   2          2HG2      ILE   2  64.613  58.187   4.119
   13   3HG2  ILE   2          3HG2      ILE   2  65.585  56.867   4.791
   14   1HD1  ILE   2          1HD1      ILE   2  61.149  56.211   5.620
   15   2HD1  ILE   2          2HD1      ILE   2  60.532  57.634   4.777
   16   3HD1  ILE   2          3HD1      ILE   2  61.856  56.702   4.055
   17    H    LEU   3           H        LEU   3  65.682  54.674   5.611
   18    HA   LEU   3           HA       LEU   3  64.132  53.169   3.738
   19   1HB   LEU   3          2HB       LEU   3  66.947  52.789   4.837
   20   2HB   LEU   3          1HB       LEU   3  66.287  51.972   3.418
   21    HG   LEU   3           HG       LEU   3  66.686  54.986   3.706
   22   1HD1  LEU   3          1HD2      LEU   3  68.794  53.716   3.539
   23   2HD1  LEU   3          2HD2      LEU   3  68.489  54.656   2.063
   24   3HD1  LEU   3          3HD2      LEU   3  68.193  52.902   2.076
   25   1HD2  LEU   3          1HD1      LEU   3  65.767  53.291   1.340
   26   2HD2  LEU   3          2HD1      LEU   3  66.229  55.005   1.246
   27   3HD2  LEU   3          3HD1      LEU   3  64.810  54.529   2.189
   28    H    ASP   4           H        ASP   4  64.856  52.672   7.120
   29    HA   ASP   4           HA       ASP   4  64.254  49.781   6.974
   30   1HB   ASP   4          1HB       ASP   4  66.201  50.566   8.333
   31   2HB   ASP   4          2HB       ASP   4  65.100  51.565   9.295
   32    HD2  ASP   4           HD2      ASP   4  65.433  50.535  11.152
   33    H    THR   5           H        THR   5  62.959  52.968   7.538
   34    HA   THR   5           HA       THR   5  60.945  52.148   9.368
   35    HB   THR   5           HB       THR   5  61.106  54.650   7.638
   36    HG1  THR   5           HG1      THR   5  61.907  55.522   9.591
   37   1HG2  THR   5          1HG2      THR   5  59.579  55.620   9.338
   38   2HG2  THR   5          2HG2      THR   5  58.814  54.299   8.437
   39   3HG2  THR   5          3HG2      THR   5  59.414  54.018  10.090
   40    H    LEU   6           H        LEU   6  60.935  52.954   5.853
   41    HA   LEU   6           HA       LEU   6  58.235  52.107   5.396
   42   1HB   LEU   6          2HB       LEU   6  58.814  52.227   3.046
   43   2HB   LEU   6          1HB       LEU   6  59.421  53.627   3.935
   44    HG   LEU   6           HG       LEU   6  61.661  52.133   4.040
   45   1HD1  LEU   6          1HD2      LEU   6  60.324  51.310   1.417
   46   2HD1  LEU   6          2HD2      LEU   6  60.646  50.203   2.764
   47   3HD1  LEU   6          3HD2      LEU   6  61.996  50.958   1.900
   48   1HD2  LEU   6          1HD1      LEU   6  60.714  53.757   1.646
   49   2HD2  LEU   6          2HD1      LEU   6  61.474  54.398   3.121
   50   3HD2  LEU   6          3HD1      LEU   6  62.405  53.361   2.021
   51    H    LYS   7           H        LYS   7  61.374  50.447   5.493
   52    HA   LYS   7           HA       LYS   7  60.627  47.993   4.360
   53   1HB   LYS   7          2HB       LYS   7  62.946  48.848   4.899
   54   2HB   LYS   7          1HB       LYS   7  62.611  48.507   6.605
   55   1HG   LYS   7          2HG       LYS   7  63.856  46.674   5.685
   56   2HG   LYS   7          1HG       LYS   7  62.201  46.104   5.992
   57   1HD   LYS   7          1HD       LYS   7  61.646  46.506   3.596
   58   2HD   LYS   7          2HD       LYS   7  63.312  47.045   3.307
   59   1HE   LYS   7          2HE       LYS   7  62.492  44.272   4.292
   60   2HE   LYS   7          1HE       LYS   7  62.920  44.679   2.619
   61   1HZ   LYS   7          1HZ       LYS   7  64.758  43.741   3.776
   62   2HZ   LYS   7          2HZ       LYS   7  65.086  45.309   3.386
   63   3HZ   LYS   7          3HZ       LYS   7  64.699  44.909   4.938
   64    H    GLN   8           H        GLN   8  60.507  49.186   7.737
   65    HA   GLN   8           HA       GLN   8  59.733  46.913   9.111
   66   1HB   GLN   8          2HB       GLN   8  60.335  49.145  10.058
   67   2HB   GLN   8          1HB       GLN   8  58.757  49.768   9.542
   68   1HG   GLN   8          1HG       GLN   8  57.633  48.072  10.947
   69   2HG   GLN   8          2HG       GLN   8  59.224  47.494  11.494
   70   1HE2  GLN   8          2HE2      GLN   8  60.693  49.308  12.417
   71   2HE2  GLN   8          1HE2      GLN   8  59.912  50.465  13.472
   72    H    PHE   9           H        PHE   9  57.631  49.369   7.561
   73    HA   PHE   9           HA       PHE   9  55.208  47.892   8.146
   74   1HB   PHE   9          2HB       PHE   9  55.682  50.314   6.383
   75   2HB   PHE   9          1HB       PHE   9  54.118  49.740   6.976
   76    HD1  PHE   9           HD1      PHE   9  54.197  49.308   9.712
   77    HD2  PHE   9           HD2      PHE   9  56.504  52.194   7.498
   78    HE1  PHE   9           HE1      PHE   9  54.543  50.624  11.782
   79    HE2  PHE   9           HE2      PHE   9  56.830  53.514   9.571
   80    HZ   PHE   9           HZ       PHE   9  55.866  52.724  11.716
   81    H    ALA  10           H        ALA  10  57.382  48.191   5.349
   82    HA   ALA  10           HA       ALA  10  55.631  47.198   3.354
   83   1HB   ALA  10          1HB       ALA  10  58.647  46.889   3.612
   84   2HB   ALA  10          2HB       ALA  10  57.796  48.265   2.872
   85   3HB   ALA  10          3HB       ALA  10  57.693  46.654   2.133
   86    H    LYS  11           H        LYS  11  57.757  45.532   5.706
   87    HA   LYS  11           HA       LYS  11  57.228  42.856   4.804
   88   1HB   LYS  11          1HB       LYS  11  58.065  43.996   7.494
   89   2HB   LYS  11          2HB       LYS  11  58.052  42.265   7.096
   90   1HG   LYS  11          2HG       LYS  11  59.636  42.639   5.254
   91   2HG   LYS  11          1HG       LYS  11  59.690  44.372   5.612
   92   1HD   LYS  11          1HD       LYS  11  60.535  42.155   7.529
   93   2HD   LYS  11          2HD       LYS  11  61.627  43.133   6.528
   94   1HE   LYS  11          2HE       LYS  11  60.755  45.195   7.665
   95   2HE   LYS  11          1HE       LYS  11  59.829  44.153   8.766
   96   1HZ   LYS  11          1HZ       LYS  11  61.907  44.792   9.699
   97   2HZ   LYS  11          2HZ       LYS  11  61.876  43.162   9.454
   98   3HZ   LYS  11          3HZ       LYS  11  62.738  44.132   8.437
   99    H    GLY  12           H        GLY  12  55.478  45.148   6.872
  100   1HA   GLY  12          1HA       GLY  12  53.596  43.135   7.812
  101   2HA   GLY  12          2HA       GLY  12  53.475  44.904   8.035
  102    H    VAL  13           H        VAL  13  53.835  45.376   5.089
  103    HA   VAL  13           HA       VAL  13  51.286  44.272   4.060
  104    HB   VAL  13           HB       VAL  13  53.232  46.144   2.667
  105   1HG1  VAL  13          1HG1      VAL  13  51.529  45.091   1.166
  106   2HG1  VAL  13          2HG1      VAL  13  51.190  46.811   1.382
  107   3HG1  VAL  13          3HG1      VAL  13  50.245  45.604   2.277
  108   1HG2  VAL  13          1HG2      VAL  13  52.520  47.265   4.738
  109   2HG2  VAL  13          2HG2      VAL  13  51.696  47.997   3.355
  110   3HG2  VAL  13          3HG2      VAL  13  50.823  46.855   4.398
  111    H    GLY  14           H        GLY  14  53.390  42.608   4.852
  112   1HA   GLY  14          2HA       GLY  14  53.869  41.137   2.306
  113   2HA   GLY  14          1HA       GLY  14  55.088  41.202   3.592
  114    H    LYS  15           H        LYS  15  53.195  41.323   5.783
  115    HA   LYS  15           HA       LYS  15  52.470  38.524   6.111
  116   1HB   LYS  15          2HB       LYS  15  51.805  40.949   7.814
  117   2HB   LYS  15          1HB       LYS  15  51.662  39.239   8.270
  118   1HG   LYS  15          2HG       LYS  15  54.223  40.801   7.717
  119   2HG   LYS  15          1HG       LYS  15  53.684  40.098   9.253
  120   1HD   LYS  15          2HD       LYS  15  53.777  37.827   8.148
  121   2HD   LYS  15          1HD       LYS  15  54.516  38.599   6.730
  122   1HE   LYS  15          2HE       LYS  15  56.365  39.444   8.145
  123   2HE   LYS  15          1HE       LYS  15  55.637  38.665   9.565
  124   1HZ   LYS  15          1HZ       LYS  15  55.914  36.564   8.477
  125   2HZ   LYS  15          2HZ       LYS  15  56.592  37.286   7.158
  126   3HZ   LYS  15          3HZ       LYS  15  57.363  37.339   8.615
  127    H    ASP  16           H        ASP  16  50.809  41.675   5.696
  128    HA   ASP  16           HA       ASP  16  48.142  40.633   5.536
  129   1HB   ASP  16          1HB       ASP  16  48.784  43.016   6.013
  130   2HB   ASP  16          2HB       ASP  16  49.329  43.163   4.335
  131    HD2  ASP  16           HD2      ASP  16  46.547  42.123   6.188
  132    H    LEU  17           H        LEU  17  50.866  40.528   3.423
  133    HA   LEU  17           HA       LEU  17  49.334  40.277   0.938
  134   1HB   LEU  17          2HB       LEU  17  51.736  41.404   1.540
  135   2HB   LEU  17          1HB       LEU  17  52.290  39.775   1.102
  136    HG   LEU  17           HG       LEU  17  50.530  41.638  -0.531
  137   1HD1  LEU  17          1HD1      LEU  17  53.455  40.851  -0.893
  138   2HD1  LEU  17          2HD1      LEU  17  52.860  42.430  -0.332
  139   3HD1  LEU  17          3HD1      LEU  17  52.523  41.894  -1.991
  140   1HD2  LEU  17          1HD2      LEU  17  51.004  40.040  -2.423
  141   2HD2  LEU  17          2HD2      LEU  17  50.030  39.316  -1.136
  142   3HD2  LEU  17          3HD2      LEU  17  51.766  38.939  -1.255
  143    H    VAL  18           H        VAL  18  51.457  38.497   3.215
  144    HA   VAL  18           HA       VAL  18  51.147  35.919   1.954
  145    HB   VAL  18           HB       VAL  18  52.007  36.914   4.678
  146   1HG1  VAL  18          1HG1      VAL  18  50.816  34.857   5.176
  147   2HG1  VAL  18          2HG1      VAL  18  52.562  34.565   5.255
  148   3HG1  VAL  18          3HG1      VAL  18  51.639  34.021   3.832
  149   1HG2  VAL  18          1HG2      VAL  18  53.580  37.014   2.713
  150   2HG2  VAL  18          2HG2      VAL  18  53.399  35.259   2.524
  151   3HG2  VAL  18          3HG2      VAL  18  54.145  35.922   3.994
  152    H    LYS  19           H        LYS  19  49.293  37.924   4.216
  153    HA   LYS  19           HA       LYS  19  47.380  35.867   4.925
  154   1HB   LYS  19          1HB       LYS  19  47.834  37.901   6.315
  155   2HB   LYS  19          2HB       LYS  19  47.193  38.899   5.010
  156   1HG   LYS  19          1HG       LYS  19  45.537  38.582   6.780
  157   2HG   LYS  19          2HG       LYS  19  44.984  37.931   5.237
  158   1HD   LYS  19          2HD       LYS  19  44.351  36.489   7.062
  159   2HD   LYS  19          1HD       LYS  19  45.473  35.623   6.014
  160   1HE   LYS  19          1HE       LYS  19  46.420  37.086   8.514
  161   2HE   LYS  19          2HE       LYS  19  45.728  35.456   8.596
  162   1HZ   LYS  19          1HZ       LYS  19  48.083  36.182   7.018
  163   2HZ   LYS  19          2HZ       LYS  19  48.071  35.360   8.444
  164   3HZ   LYS  19          3HZ       LYS  19  47.388  34.691   7.102
  165    H    GLY  20           H        GLY  20  47.793  38.239   2.357
  166   1HA   GLY  20          1HA       GLY  20  45.140  38.030   1.222
  167   2HA   GLY  20          2HA       GLY  20  46.591  38.729   0.471
  168    H    ALA  21           H        ALA  21  48.389  36.636   0.541
  169    HA   ALA  21           HA       ALA  21  47.521  34.899  -1.569
  170   1HB   ALA  21          1HB       ALA  21  49.865  35.614  -1.260
  171   2HB   ALA  21          2HB       ALA  21  49.714  33.843  -1.248
  172   3HB   ALA  21          3HB       ALA  21  49.932  34.725   0.280
  173    H    ALA  22           H        ALA  22  47.503  34.703   1.962
  174    HA   ALA  22           HA       ALA  22  47.343  31.870   2.206
  175   1HB   ALA  22          1HB       ALA  22  46.449  32.289   4.434
  176   2HB   ALA  22          2HB       ALA  22  47.812  33.376   4.103
  177   3HB   ALA  22          3HB       ALA  22  46.141  33.987   4.025
  178    H    GLN  23           H        GLN  23  44.884  34.350   1.520
  179    HA   GLN  23           HA       GLN  23  42.567  32.797   1.906
  180   1HB   GLN  23          2HB       GLN  23  42.669  35.261   1.674
  181   2HB   GLN  23          1HB       GLN  23  43.117  35.078  -0.031
  182   1HG   GLN  23          2HG       GLN  23  40.736  35.583   0.221
  183   2HG   GLN  23          1HG       GLN  23  40.976  33.995  -0.518
  184   1HE2  GLN  23          1HE2      GLN  23  40.585  35.509   2.746
  185   2HE2  GLN  23          2HE2      GLN  23  39.552  34.254   3.395
  186    H    GLY  24           H        GLY  24  44.928  32.883  -0.758
  187   1HA   GLY  24          2HA       GLY  24  43.727  30.543  -1.995
  188   2HA   GLY  24          1HA       GLY  24  43.565  32.034  -2.953
  189    H    VAL  25           H        VAL  25  45.841  29.773  -1.437
  190    HA   VAL  25           HA       VAL  25  48.183  31.233  -2.139
  191    HB   VAL  25           HB       VAL  25  47.821  28.295  -1.393
  192   1HG1  VAL  25          1HG2      VAL  25  50.210  28.429  -0.723
  193   2HG1  VAL  25          2HG2      VAL  25  50.301  30.072  -1.394
  194   3HG1  VAL  25          3HG2      VAL  25  50.011  28.682  -2.465
  195   1HG2  VAL  25          1HG1      VAL  25  46.980  29.840   0.341
  196   2HG2  VAL  25          2HG1      VAL  25  48.523  30.729   0.295
  197   3HG2  VAL  25          3HG1      VAL  25  48.477  29.044   0.860
  198    H    LEU  26           H        LEU  26  46.932  28.097  -3.369
  199    HA   LEU  26           HA       LEU  26  48.734  27.733  -5.459
  200   1HB   LEU  26          2HB       LEU  26  45.812  26.902  -5.311
  201   2HB   LEU  26          1HB       LEU  26  47.042  26.189  -6.365
  202    HG   LEU  26           HG       LEU  26  47.061  26.114  -3.312
  203   1HD1  LEU  26          1HD1      LEU  26  45.312  24.712  -4.342
  204   2HD1  LEU  26          2HD1      LEU  26  46.532  23.951  -5.388
  205   3HD1  LEU  26          3HD1      LEU  26  46.598  23.720  -3.626
  206   1HD2  LEU  26          1HD2      LEU  26  49.363  26.094  -4.167
  207   2HD2  LEU  26          2HD2      LEU  26  48.928  24.859  -5.373
  208   3HD2  LEU  26          3HD2      LEU  26  48.910  24.467  -3.640
  209    H    SER  27           H        SER  27  45.700  29.629  -5.431
  210    HA   SER  27           HA       SER  27  45.641  30.076  -8.257
  211   1HB   SER  27          1HB       SER  27  44.006  31.825  -7.697
  212   2HB   SER  27          2HB       SER  27  43.660  30.297  -6.865
  213    HG   SER  27           HG       SER  27  44.950  32.571  -5.764
  214    H    THR  28           H        THR  28  46.885  32.049  -5.498
  215    HA   THR  28           HA       THR  28  47.793  34.248  -7.014
  216    HB   THR  28           HB       THR  28  48.828  33.065  -4.409
  217    HG1  THR  28           HG1      THR  28  47.036  35.171  -5.047
  218   1HG2  THR  28          1HG2      THR  28  49.337  35.787  -5.687
  219   2HG2  THR  28          2HG2      THR  28  50.553  34.528  -5.372
  220   3HG2  THR  28          3HG2      THR  28  49.753  35.343  -4.017
  221    H    VAL  29           H        VAL  29  49.491  31.223  -6.059
  222    HA   VAL  29           HA       VAL  29  51.995  31.749  -7.201
  223    HB   VAL  29           HB       VAL  29  50.424  29.184  -6.779
  224   1HG1  VAL  29          1HG1      VAL  29  52.090  28.728  -8.501
  225   2HG1  VAL  29          2HG1      VAL  29  53.343  29.561  -7.545
  226   3HG1  VAL  29          3HG1      VAL  29  52.627  28.040  -6.959
  227   1HG2  VAL  29          1HG2      VAL  29  52.742  30.462  -5.261
  228   2HG2  VAL  29          2HG2      VAL  29  51.919  28.946  -4.837
  229   3HG2  VAL  29          3HG2      VAL  29  51.048  30.487  -4.735
  230    H    SER  30           H        SER  30  48.919  30.795  -8.725
  231    HA   SER  30           HA       SER  30  50.246  30.325 -11.298
  232   1HB   SER  30          2HB       SER  30  47.310  30.219 -10.472
  233   2HB   SER  30          1HB       SER  30  47.983  29.680 -12.024
  234    HG   SER  30           HG       SER  30  47.724  27.968 -10.519
  235    H    CYS  31           H        CYS  31  47.832  32.599  -9.911
  236    HA   CYS  31           HA       CYS  31  47.463  34.207 -12.201
  237   1HB   CYS  31          1HB       CYS  31  47.537  34.994  -9.265
  238   2HB   CYS  31          2HB       CYS  31  46.895  35.968 -10.588
  239    H    LYS  32           H        LYS  32  50.331  33.792 -10.258
  240    HA   LYS  32           HA       LYS  32  50.901  36.573 -10.047
  241   1HB   LYS  32          1HB       LYS  32  52.747  36.000  -8.762
  242   2HB   LYS  32          2HB       LYS  32  51.466  34.840  -8.400
  243   1HG   LYS  32          1HG       LYS  32  53.043  33.277  -8.714
  244   2HG   LYS  32          2HG       LYS  32  52.775  33.542 -10.445
  245   1HD   LYS  32          2HD       LYS  32  55.127  33.687 -10.132
  246   2HD   LYS  32          1HD       LYS  32  54.571  35.373 -10.276
  247   1HE   LYS  32          1HE       LYS  32  54.716  35.671  -7.855
  248   2HE   LYS  32          2HE       LYS  32  54.994  33.938  -7.614
  249   1HZ   LYS  32          1HZ       LYS  32  57.006  35.189  -7.474
  250   2HZ   LYS  32          2HZ       LYS  32  57.064  34.171  -8.770
  251   3HZ   LYS  32          3HZ       LYS  32  56.805  35.784  -8.999
  252    H    LEU  33           H        LEU  33  50.773  35.475 -12.877
  253    HA   LEU  33           HA       LEU  33  53.336  35.776 -14.084
  254   1HB   LEU  33          1HB       LEU  33  51.398  34.817 -15.246
  255   2HB   LEU  33          2HB       LEU  33  50.523  36.350 -15.102
  256    HG   LEU  33           HG       LEU  33  52.218  37.459 -16.543
  257   1HD1  LEU  33          1HD2      LEU  33  53.815  36.021 -17.815
  258   2HD1  LEU  33          2HD2      LEU  33  53.378  34.645 -16.779
  259   3HD1  LEU  33          3HD2      LEU  33  54.195  36.066 -16.086
  260   1HD2  LEU  33          1HD1      LEU  33  50.176  36.472 -17.513
  261   2HD2  LEU  33          2HD1      LEU  33  51.546  36.352 -18.637
  262   3HD2  LEU  33          3HD1      LEU  33  51.019  34.920 -17.723
  263    H    ALA  34           H        ALA  34  50.654  38.065 -13.433
  264    HA   ALA  34           HA       ALA  34  52.621  40.233 -13.046
  265   1HB   ALA  34          1HB       ALA  34  51.254  41.804 -14.365
  266   2HB   ALA  34          2HB       ALA  34  50.161  40.479 -14.830
  267   3HB   ALA  34          3HB       ALA  34  51.850  40.478 -15.385
  268    H    LYS  35           H        LYS  35  51.485  38.699 -11.102
  269    HA   LYS  35           HA       LYS  35  50.092  38.541  -9.367
  270   1HB   LYS  35          1HB       LYS  35  51.623  40.536  -8.935
  271   2HB   LYS  35          2HB       LYS  35  50.232  41.556  -9.341
  272   1HG   LYS  35          2HG       LYS  35  50.357  41.306  -6.950
  273   2HG   LYS  35          1HG       LYS  35  48.937  40.397  -7.510
  274   1HD   LYS  35          1HD       LYS  35  50.181  38.283  -7.311
  275   2HD   LYS  35          2HD       LYS  35  51.675  39.171  -6.950
  276   1HE   LYS  35          1HE       LYS  35  50.725  38.287  -4.893
  277   2HE   LYS  35          2HE       LYS  35  50.630  40.058  -4.878
  278   1HZ   LYS  35          1HZ       LYS  35  48.612  39.034  -4.131
  279   2HZ   LYS  35          2HZ       LYS  35  48.440  38.225  -5.559
  280   3HZ   LYS  35          3HZ       LYS  35  48.341  39.871  -5.525
  281    H    THR  36           H        THR  36  48.539  37.990 -11.324
  282    HA   THR  36           HA       THR  36  46.294  39.754 -11.704
  283    HB   THR  36           HB       THR  36  46.582  36.765 -12.200
  284    HG1  THR  36           HG1      THR  36  46.967  39.028 -13.866
  285   1HG2  THR  36          1HG2      THR  36  44.792  37.164 -13.884
  286   2HG2  THR  36          2HG2      THR  36  44.607  38.823 -13.275
  287   3HG2  THR  36          3HG2      THR  36  44.220  37.435 -12.229
  288    H    CYS  37           H        CYS  37  47.279  37.556  -9.174
  289    HA   CYS  37           HA       CYS  37  45.148  38.450  -7.528
  290   1HB   CYS  37          2HB       CYS  37  43.832  36.599  -7.210
  291   2HB   CYS  37          1HB       CYS  37  43.954  36.689  -8.964
  292    HXT  CYS  37           HO        OH  38  46.788  36.779  -4.867
  Start of MODEL   12
    1   1H    GLY   1          1H        GLY   1  65.322  55.248  15.584
    2   2H    GLY   1          2H        GLY   1  65.560  56.443  16.696
    3   3H    GLY   1          3H        GLY   1  64.092  56.280  15.960
    4   1HA   GLY   1          1HA       GLY   1  65.285  58.132  15.049
    5   2HA   GLY   1          2HA       GLY   1  66.606  57.018  14.645
    6    H    ILE   2           H        ILE   2  66.006  58.181  12.491
    7    HA   ILE   2           HA       ILE   2  63.715  57.491  11.036
    8    HB   ILE   2           HB       ILE   2  65.233  59.308  10.444
    9   1HG1  ILE   2          1HG1      ILE   2  65.493  58.904   8.025
   10   2HG1  ILE   2          2HG1      ILE   2  65.177  57.180   8.276
   11   1HG2  ILE   2          1HG2      ILE   2  67.423  58.918   9.446
   12   2HG2  ILE   2          2HG2      ILE   2  67.392  58.220  11.073
   13   3HG2  ILE   2          3HG2      ILE   2  67.249  57.166   9.647
   14   1HD1  ILE   2          1HD1      ILE   2  62.883  57.692   9.023
   15   2HD1  ILE   2          2HD1      ILE   2  63.230  59.437   8.945
   16   3HD1  ILE   2          3HD1      ILE   2  63.187  58.464   7.458
   17    H    LEU   3           H        LEU   3  66.703  55.708  11.693
   18    HA   LEU   3           HA       LEU   3  66.359  53.728   9.649
   19   1HB   LEU   3          2HB       LEU   3  67.926  53.721  12.264
   20   2HB   LEU   3          1HB       LEU   3  68.120  52.557  10.951
   21    HG   LEU   3           HG       LEU   3  68.677  55.556  10.776
   22   1HD1  LEU   3          1HD2      LEU   3  71.033  54.857  10.642
   23   2HD1  LEU   3          2HD2      LEU   3  70.551  53.157  10.840
   24   3HD1  LEU   3          3HD2      LEU   3  70.295  54.316  12.164
   25   1HD2  LEU   3          1HD1      LEU   3  69.735  54.961   8.589
   26   2HD2  LEU   3          2HD1      LEU   3  69.086  53.314   8.744
   27   3HD2  LEU   3          3HD1      LEU   3  67.984  54.702   8.578
   28    H    ASP   4           H        ASP   4  64.826  54.195  12.722
   29    HA   ASP   4           HA       ASP   4  64.048  51.346  12.959
   30   1HB   ASP   4          1HB       ASP   4  64.792  52.573  14.987
   31   2HB   ASP   4          2HB       ASP   4  63.503  53.762  14.736
   32    HD2  ASP   4           HD2      ASP   4  60.966  51.690  15.944
   33    H    THR   5           H        THR   5  63.135  54.539  11.851
   34    HA   THR   5           HA       THR   5  60.333  54.143  12.109
   35    HB   THR   5           HB       THR   5  61.892  56.200  10.499
   36    HG1  THR   5           HG1      THR   5  61.456  57.466  12.349
   37   1HG2  THR   5          1HG2      THR   5  58.980  56.153  11.393
   38   2HG2  THR   5          2HG2      THR   5  59.572  56.083   9.715
   39   3HG2  THR   5          3HG2      THR   5  59.813  57.552  10.679
   40    H    LEU   6           H        LEU   6  62.615  54.112   9.327
   41    HA   LEU   6           HA       LEU   6  60.683  53.350   7.347
   42   1HB   LEU   6          1HB       LEU   6  63.688  52.877   7.496
   43   2HB   LEU   6          2HB       LEU   6  62.693  52.712   6.040
   44    HG   LEU   6           HG       LEU   6  63.098  55.305   7.607
   45   1HD1  LEU   6          1HD1      LEU   6  64.485  55.973   5.688
   46   2HD1  LEU   6          2HD1      LEU   6  64.257  54.370   4.951
   47   3HD1  LEU   6          3HD1      LEU   6  65.150  54.529   6.481
   48   1HD2  LEU   6          1HD2      LEU   6  61.721  54.732   4.944
   49   2HD2  LEU   6          2HD2      LEU   6  62.086  56.351   5.580
   50   3HD2  LEU   6          3HD2      LEU   6  60.938  55.310   6.434
   51    H    LYS   7           H        LYS   7  62.760  51.544   9.622
   52    HA   LYS   7           HA       LYS   7  62.296  48.929   8.609
   53   1HB   LYS   7          2HB       LYS   7  63.155  50.123  11.253
   54   2HB   LYS   7          1HB       LYS   7  62.825  48.401  11.102
   55   1HG   LYS   7          2HG       LYS   7  65.164  48.776  10.861
   56   2HG   LYS   7          1HG       LYS   7  64.518  48.163   9.339
   57   1HD   LYS   7          1HD       LYS   7  64.779  51.153   9.723
   58   2HD   LYS   7          2HD       LYS   7  66.252  50.206   9.495
   59   1HE   LYS   7          1HE       LYS   7  63.929  50.144   7.529
   60   2HE   LYS   7          2HE       LYS   7  65.381  51.144   7.374
   61   1HZ   LYS   7          1HZ       LYS   7  65.577  49.137   6.152
   62   2HZ   LYS   7          2HZ       LYS   7  66.685  49.158   7.373
   63   3HZ   LYS   7          3HZ       LYS   7  65.335  48.218   7.498
   64    H    GLN   8           H        GLN   8  60.551  50.950  11.005
   65    HA   GLN   8           HA       GLN   8  58.755  49.096  12.031
   66   1HB   GLN   8          1HB       GLN   8  59.089  51.470  12.755
   67   2HB   GLN   8          2HB       GLN   8  58.197  52.005  11.318
   68   1HG   GLN   8          2HG       GLN   8  56.220  50.731  12.068
   69   2HG   GLN   8          1HG       GLN   8  57.110  50.227  13.523
   70   1HE2  GLN   8          1HE2      GLN   8  58.085  52.136  14.825
   71   2HE2  GLN   8          2HE2      GLN   8  57.056  53.538  15.021
   72    H    PHE   9           H        PHE   9  58.567  51.010   9.026
   73    HA   PHE   9           HA       PHE   9  55.963  49.861   8.316
   74   1HB   PHE   9          1HB       PHE   9  57.750  51.831   6.861
   75   2HB   PHE   9          2HB       PHE   9  56.069  51.452   6.467
   76    HD1  PHE   9           HD1      PHE   9  54.531  51.566   8.831
   77    HD2  PHE   9           HD2      PHE   9  57.978  53.944   7.823
   78    HE1  PHE   9           HE1      PHE   9  53.813  53.297  10.448
   79    HE2  PHE   9           HE2      PHE   9  57.233  55.688   9.419
   80    HZ   PHE   9           HZ       PHE   9  55.166  55.357  10.750
   81    H    ALA  10           H        ALA  10  59.361  49.698   7.198
   82    HA   ALA  10           HA       ALA  10  58.933  48.405   4.751
   83   1HB   ALA  10          1HB       ALA  10  61.277  48.130   6.671
   84   2HB   ALA  10          2HB       ALA  10  61.284  47.703   4.946
   85   3HB   ALA  10          3HB       ALA  10  61.074  49.397   5.437
   86    H    LYS  11           H        LYS  11  59.221  46.991   8.042
   87    HA   LYS  11           HA       LYS  11  59.132  44.259   7.111
   88   1HB   LYS  11          2HB       LYS  11  58.758  43.679   9.420
   89   2HB   LYS  11          1HB       LYS  11  60.049  44.889   9.304
   90   1HG   LYS  11          1HG       LYS  11  58.359  46.665   9.865
   91   2HG   LYS  11          2HG       LYS  11  57.156  45.390  10.143
   92   1HD   LYS  11          1HD       LYS  11  59.810  45.677  11.621
   93   2HD   LYS  11          2HD       LYS  11  58.227  46.201  12.228
   94   1HE   LYS  11          1HE       LYS  11  57.409  43.848  12.073
   95   2HE   LYS  11          2HE       LYS  11  59.039  43.335  11.585
   96   1HZ   LYS  11          1HZ       LYS  11  59.860  44.178  13.650
   97   2HZ   LYS  11          2HZ       LYS  11  58.686  43.049  13.908
   98   3HZ   LYS  11          3HZ       LYS  11  58.348  44.650  14.109
   99    H    GLY  12           H        GLY  12  56.659  46.678   7.957
  100   1HA   GLY  12          1HA       GLY  12  54.464  44.796   7.667
  101   2HA   GLY  12          2HA       GLY  12  54.347  46.579   7.740
  102    H    VAL  13           H        VAL  13  56.420  46.731   5.469
  103    HA   VAL  13           HA       VAL  13  54.783  45.708   3.237
  104    HB   VAL  13           HB       VAL  13  57.420  47.233   3.224
  105   1HG1  VAL  13          1HG2      VAL  13  55.332  46.770   1.052
  106   2HG1  VAL  13          2HG2      VAL  13  56.764  47.812   0.892
  107   3HG1  VAL  13          3HG2      VAL  13  56.964  46.065   1.083
  108   1HG2  VAL  13          1HG1      VAL  13  56.050  49.237   2.629
  109   2HG2  VAL  13          2HG1      VAL  13  55.677  48.651   4.256
  110   3HG2  VAL  13          3HG1      VAL  13  54.574  48.289   2.910
  111    H    GLY  14           H        GLY  14  55.422  43.891   4.957
  112   1HA   GLY  14          1HA       GLY  14  57.058  42.027   3.367
  113   2HA   GLY  14          2HA       GLY  14  57.476  42.228   5.084
  114    H    LYS  15           H        LYS  15  54.771  42.853   5.932
  115    HA   LYS  15           HA       LYS  15  53.520  40.194   6.069
  116   1HB   LYS  15          2HB       LYS  15  52.784  42.959   7.059
  117   2HB   LYS  15          1HB       LYS  15  51.627  41.621   7.047
  118   1HG   LYS  15          2HG       LYS  15  52.562  41.776   9.222
  119   2HG   LYS  15          1HG       LYS  15  53.099  40.260   8.489
  120   1HD   LYS  15          1HD       LYS  15  54.866  42.678   8.226
  121   2HD   LYS  15          2HD       LYS  15  54.728  41.940   9.823
  122   1HE   LYS  15          2HE       LYS  15  55.448  39.779   9.010
  123   2HE   LYS  15          1HE       LYS  15  55.529  40.370   7.344
  124   1HZ   LYS  15          1HZ       LYS  15  57.211  41.911   8.037
  125   2HZ   LYS  15          2HZ       LYS  15  57.662  40.359   8.369
  126   3HZ   LYS  15          3HZ       LYS  15  57.144  41.347   9.585
  127    H    ASP  16           H        ASP  16  52.984  43.363   4.488
  128    HA   ASP  16           HA       ASP  16  50.606  42.674   3.084
  129   1HB   ASP  16          2HB       ASP  16  51.397  44.980   3.496
  130   2HB   ASP  16          1HB       ASP  16  52.786  44.692   2.432
  131    HD2  ASP  16           HD2      ASP  16  49.058  44.986   0.793
  132    H    LEU  17           H        LEU  17  53.962  41.804   2.584
  133    HA   LEU  17           HA       LEU  17  53.600  41.153  -0.272
  134   1HB   LEU  17          1HB       LEU  17  55.959  40.752   1.600
  135   2HB   LEU  17          2HB       LEU  17  55.946  40.566  -0.153
  136    HG   LEU  17           HG       LEU  17  55.598  43.176   1.378
  137   1HD1  LEU  17          1HD1      LEU  17  57.743  42.181  -0.550
  138   2HD1  LEU  17          2HD1      LEU  17  57.710  43.771   0.240
  139   3HD1  LEU  17          3HD1      LEU  17  57.920  42.299   1.213
  140   1HD2  LEU  17          1HD2      LEU  17  55.609  44.242  -0.883
  141   2HD2  LEU  17          2HD2      LEU  17  54.159  43.267  -0.601
  142   3HD2  LEU  17          3HD2      LEU  17  55.474  42.630  -1.619
  143    H    VAL  18           H        VAL  18  53.990  39.733   2.983
  144    HA   VAL  18           HA       VAL  18  53.787  36.997   2.061
  145    HB   VAL  18           HB       VAL  18  53.474  38.432   4.716
  146   1HG1  VAL  18          1HG1      VAL  18  53.269  36.215   5.787
  147   2HG1  VAL  18          2HG1      VAL  18  53.065  35.472   4.183
  148   3HG1  VAL  18          3HG1      VAL  18  51.851  36.621   4.805
  149   1HG2  VAL  18          1HG2      VAL  18  55.474  37.126   5.292
  150   2HG2  VAL  18          2HG2      VAL  18  55.408  36.290   3.725
  151   3HG2  VAL  18          3HG2      VAL  18  55.768  38.027   3.791
  152    H    LYS  19           H        LYS  19  51.635  39.703   2.754
  153    HA   LYS  19           HA       LYS  19  49.194  38.090   2.619
  154   1HB   LYS  19          1HB       LYS  19  49.867  40.544   3.704
  155   2HB   LYS  19          2HB       LYS  19  48.989  41.025   2.252
  156   1HG   LYS  19          2HG       LYS  19  48.039  39.104   4.429
  157   2HG   LYS  19          1HG       LYS  19  47.541  40.794   4.276
  158   1HD   LYS  19          1HD       LYS  19  46.989  38.643   2.186
  159   2HD   LYS  19          2HD       LYS  19  45.859  39.147   3.449
  160   1HE   LYS  19          1HE       LYS  19  45.855  41.452   2.593
  161   2HE   LYS  19          2HE       LYS  19  46.974  40.992   1.296
  162   1HZ   LYS  19          1HZ       LYS  19  45.332  39.462   0.503
  163   2HZ   LYS  19          2HZ       LYS  19  44.288  39.895   1.704
  164   3HZ   LYS  19          3HZ       LYS  19  44.725  40.995   0.555
  165    H    GLY  20           H        GLY  20  51.468  38.876   0.383
  166   1HA   GLY  20          1HA       GLY  20  49.524  39.243  -1.861
  167   2HA   GLY  20          2HA       GLY  20  51.175  39.886  -1.826
  168    H    ALA  21           H        ALA  21  52.948  38.175  -1.484
  169    HA   ALA  21           HA       ALA  21  52.910  36.222  -3.489
  170   1HB   ALA  21          1HB       ALA  21  54.953  37.180  -2.531
  171   2HB   ALA  21          2HB       ALA  21  54.606  36.413  -0.967
  172   3HB   ALA  21          3HB       ALA  21  54.972  35.408  -2.387
  173    H    ALA  22           H        ALA  22  52.898  35.647   0.022
  174    HA   ALA  22           HA       ALA  22  51.889  32.921  -0.381
  175   1HB   ALA  22          1HB       ALA  22  52.401  32.647   2.004
  176   2HB   ALA  22          2HB       ALA  22  52.768  34.383   2.133
  177   3HB   ALA  22          3HB       ALA  22  53.785  33.330   1.126
  178    H    GLN  23           H        GLN  23  50.013  34.934  -1.122
  179    HA   GLN  23           HA       GLN  23  48.106  35.283   1.045
  180   1HB   GLN  23          1HB       GLN  23  48.542  36.902  -0.798
  181   2HB   GLN  23          2HB       GLN  23  47.835  35.775  -1.957
  182   1HG   GLN  23          2HG       GLN  23  46.413  36.923   0.487
  183   2HG   GLN  23          1HG       GLN  23  46.302  37.583  -1.153
  184   1HE2  GLN  23          1HE2      GLN  23  45.738  35.786  -2.888
  185   2HE2  GLN  23          2HE2      GLN  23  44.383  34.766  -2.454
  186    H    GLY  24           H        GLY  24  48.066  33.622  -2.150
  187   1HA   GLY  24          2HA       GLY  24  46.851  31.208  -1.106
  188   2HA   GLY  24          1HA       GLY  24  45.703  32.232  -2.002
  189    H    VAL  25           H        VAL  25  48.953  30.744  -2.203
  190    HA   VAL  25           HA       VAL  25  49.414  31.277  -4.936
  191    HB   VAL  25           HB       VAL  25  50.493  29.020  -3.192
  192   1HG1  VAL  25          1HG2      VAL  25  50.937  28.631  -5.588
  193   2HG1  VAL  25          2HG2      VAL  25  52.426  29.099  -4.750
  194   3HG1  VAL  25          3HG2      VAL  25  51.564  30.287  -5.752
  195   1HG2  VAL  25          1HG1      VAL  25  52.401  30.562  -2.830
  196   2HG2  VAL  25          2HG1      VAL  25  50.896  31.219  -2.167
  197   3HG2  VAL  25          3HG1      VAL  25  51.528  31.837  -3.711
  198    H    LEU  26           H        LEU  26  48.200  28.354  -3.287
  199    HA   LEU  26           HA       LEU  26  47.955  26.601  -5.410
  200   1HB   LEU  26          1HB       LEU  26  46.074  26.935  -3.052
  201   2HB   LEU  26          2HB       LEU  26  46.224  25.486  -4.057
  202    HG   LEU  26           HG       LEU  26  48.428  26.657  -2.295
  203   1HD1  LEU  26          1HD1      LEU  26  48.033  24.659  -0.917
  204   2HD1  LEU  26          2HD1      LEU  26  46.564  25.651  -1.031
  205   3HD1  LEU  26          3HD1      LEU  26  46.708  24.163  -1.994
  206   1HD2  LEU  26          1HD2      LEU  26  49.579  24.493  -2.783
  207   2HD2  LEU  26          2HD2      LEU  26  48.324  24.116  -3.982
  208   3HD2  LEU  26          3HD2      LEU  26  49.413  25.502  -4.227
  209    H    SER  27           H        SER  27  45.657  29.181  -4.460
  210    HA   SER  27           HA       SER  27  43.717  28.373  -6.481
  211   1HB   SER  27          2HB       SER  27  42.498  30.373  -5.720
  212   2HB   SER  27          1HB       SER  27  42.955  29.307  -4.376
  213    HG   SER  27           HG       SER  27  44.316  31.660  -5.191
  214    H    THR  28           H        THR  28  46.176  30.955  -6.066
  215    HA   THR  28           HA       THR  28  45.496  32.460  -8.366
  216    HB   THR  28           HB       THR  28  48.159  32.152  -6.930
  217    HG1  THR  28           HG1      THR  28  47.409  34.047  -5.899
  218   1HG2  THR  28          1HG2      THR  28  47.122  34.313  -8.820
  219   2HG2  THR  28          2HG2      THR  28  48.458  33.186  -9.154
  220   3HG2  THR  28          3HG2      THR  28  48.625  34.405  -7.877
  221    H    VAL  29           H        VAL  29  48.040  29.939  -7.879
  222    HA   VAL  29           HA       VAL  29  48.926  29.948 -10.563
  223    HB   VAL  29           HB       VAL  29  50.051  29.089  -8.450
  224   1HG1  VAL  29          1HG2      VAL  29  49.808  26.760  -7.854
  225   2HG1  VAL  29          2HG2      VAL  29  48.231  27.555  -7.704
  226   3HG1  VAL  29          3HG2      VAL  29  48.574  26.508  -9.101
  227   1HG2  VAL  29          1HG1      VAL  29  51.354  27.420  -9.703
  228   2HG2  VAL  29          2HG1      VAL  29  50.071  27.332 -10.934
  229   3HG2  VAL  29          3HG1      VAL  29  50.990  28.841 -10.708
  230    H    SER  30           H        SER  30  46.421  28.148  -8.851
  231    HA   SER  30           HA       SER  30  45.851  26.250 -10.898
  232   1HB   SER  30          1HB       SER  30  45.204  25.975  -8.524
  233   2HB   SER  30          2HB       SER  30  44.064  27.328  -8.673
  234    HG   SER  30           HG       SER  30  43.063  25.291  -8.967
  235    H    CYS  31           H        CYS  31  44.102  29.260  -9.966
  236    HA   CYS  31           HA       CYS  31  42.298  29.115 -12.190
  237   1HB   CYS  31          1HB       CYS  31  41.518  31.242 -11.431
  238   2HB   CYS  31          2HB       CYS  31  41.911  30.285  -9.996
  239    H    LYS  32           H        LYS  32  45.553  29.459 -12.506
  240    HA   LYS  32           HA       LYS  32  45.671  31.989 -13.880
  241   1HB   LYS  32          2HB       LYS  32  47.463  31.173 -12.465
  242   2HB   LYS  32          1HB       LYS  32  47.755  29.797 -13.557
  243   1HG   LYS  32          1HG       LYS  32  48.613  31.152 -15.239
  244   2HG   LYS  32          2HG       LYS  32  47.626  32.539 -14.746
  245   1HD   LYS  32          2HD       LYS  32  49.984  32.995 -14.256
  246   2HD   LYS  32          1HD       LYS  32  49.022  32.881 -12.769
  247   1HE   LYS  32          2HE       LYS  32  51.179  31.714 -12.519
  248   2HE   LYS  32          1HE       LYS  32  49.840  30.557 -12.426
  249   1HZ   LYS  32          1HZ       LYS  32  51.484  31.081 -14.798
  250   2HZ   LYS  32          2HZ       LYS  32  51.616  29.774 -13.801
  251   3HZ   LYS  32          3HZ       LYS  32  50.252  29.988 -14.701
  252    H    LEU  33           H        LEU  33  43.783  30.913 -15.171
  253    HA   LEU  33           HA       LEU  33  44.790  29.712 -17.714
  254   1HB   LEU  33          1HB       LEU  33  41.995  30.416 -16.725
  255   2HB   LEU  33          2HB       LEU  33  42.364  29.859 -18.359
  256    HG   LEU  33           HG       LEU  33  41.486  28.058 -17.063
  257   1HD1  LEU  33          1HD2      LEU  33  43.246  27.567 -18.754
  258   2HD1  LEU  33          2HD2      LEU  33  44.464  27.570 -17.456
  259   3HD1  LEU  33          3HD2      LEU  33  43.164  26.366 -17.449
  260   1HD2  LEU  33          1HD1      LEU  33  43.844  28.240 -15.156
  261   2HD2  LEU  33          2HD1      LEU  33  42.470  27.128 -15.096
  262   3HD2  LEU  33          3HD1      LEU  33  42.209  28.859 -14.803
  263    H    ALA  34           H        ALA  34  46.204  31.612 -17.815
  264    HA   ALA  34           HA       ALA  34  46.841  33.631 -18.570
  265   1HB   ALA  34          1HB       ALA  34  45.526  34.840 -20.208
  266   2HB   ALA  34          2HB       ALA  34  44.078  33.887 -19.832
  267   3HB   ALA  34          3HB       ALA  34  45.490  33.104 -20.577
  268    H    LYS  35           H        LYS  35  46.244  33.477 -15.997
  269    HA   LYS  35           HA       LYS  35  45.724  34.606 -14.124
  270   1HB   LYS  35          1HB       LYS  35  46.010  36.984 -15.998
  271   2HB   LYS  35          2HB       LYS  35  46.063  37.029 -14.226
  272   1HG   LYS  35          2HG       LYS  35  48.012  35.478 -15.983
  273   2HG   LYS  35          1HG       LYS  35  48.312  37.066 -15.254
  274   1HD   LYS  35          1HD       LYS  35  48.003  36.101 -12.990
  275   2HD   LYS  35          2HD       LYS  35  47.693  34.510 -13.711
  276   1HE   LYS  35          2HE       LYS  35  49.994  34.606 -12.954
  277   2HE   LYS  35          1HE       LYS  35  49.967  34.539 -14.726
  278   1HZ   LYS  35          1HZ       LYS  35  51.514  36.153 -13.897
  279   2HZ   LYS  35          2HZ       LYS  35  50.317  36.962 -13.103
  280   3HZ   LYS  35          3HZ       LYS  35  50.319  36.900 -14.751
  281    H    THR  36           H        THR  36  43.531  33.526 -14.462
  282    HA   THR  36           HA       THR  36  41.314  35.297 -15.103
  283    HB   THR  36           HB       THR  36  41.354  32.575 -13.749
  284    HG1  THR  36           HG1      THR  36  40.814  31.914 -15.883
  285   1HG2  THR  36          1HG2      THR  36  39.115  34.155 -15.086
  286   2HG2  THR  36          2HG2      THR  36  39.000  32.470 -14.533
  287   3HG2  THR  36          3HG2      THR  36  39.238  33.772 -13.352
  288    H    CYS  37           H        CYS  37  43.006  34.162 -12.163
  289    HA   CYS  37           HA       CYS  37  41.553  36.254 -10.640
  290   1HB   CYS  37          1HB       CYS  37  40.859  34.911  -8.963
  291   2HB   CYS  37          2HB       CYS  37  40.623  33.833 -10.336
  292    HXT  CYS  37           HO        OH  38  45.420  35.351 -10.215
  Start of MODEL   13
    1   1H    GLY   1          1H        GLY   1  69.182  56.152  15.642
    2   2H    GLY   1          2H        GLY   1  69.656  57.576  16.328
    3   3H    GLY   1          3H        GLY   1  68.314  56.796  16.888
    4   1HA   GLY   1          1HA       GLY   1  67.699  58.682  15.564
    5   2HA   GLY   1          2HA       GLY   1  68.633  57.983  14.227
    6    H    ILE   2           H        ILE   2  66.445  58.286  13.180
    7    HA   ILE   2           HA       ILE   2  64.388  56.327  13.864
    8    HB   ILE   2           HB       ILE   2  63.322  57.339  11.771
    9   1HG1  ILE   2          1HG1      ILE   2  64.029  59.551  11.096
   10   2HG1  ILE   2          2HG1      ILE   2  65.423  59.514  12.175
   11   1HG2  ILE   2          1HG2      ILE   2  62.596  59.316  13.037
   12   2HG2  ILE   2          2HG2      ILE   2  63.966  59.114  14.152
   13   3HG2  ILE   2          3HG2      ILE   2  62.686  57.882  14.077
   14   1HD1  ILE   2          1HD1      ILE   2  66.032  59.102   9.814
   15   2HD1  ILE   2          2HD1      ILE   2  66.428  57.700  10.821
   16   3HD1  ILE   2          3HD1      ILE   2  64.979  57.676   9.781
   17    H    LEU   3           H        LEU   3  66.861  55.133  13.340
   18    HA   LEU   3           HA       LEU   3  66.982  54.254  10.585
   19   1HB   LEU   3          2HB       LEU   3  68.476  53.362  13.086
   20   2HB   LEU   3          1HB       LEU   3  68.922  52.972  11.420
   21    HG   LEU   3           HG       LEU   3  68.850  55.776  12.635
   22   1HD1  LEU   3          1HD2      LEU   3  70.660  54.359  13.526
   23   2HD1  LEU   3          2HD2      LEU   3  71.301  55.642  12.479
   24   3HD1  LEU   3          3HD2      LEU   3  71.183  53.976  11.870
   25   1HD2  LEU   3          1HD1      LEU   3  69.765  54.790   9.896
   26   2HD2  LEU   3          2HD1      LEU   3  68.396  55.880  10.222
   27   3HD2  LEU   3          3HD1      LEU   3  70.050  56.421  10.542
   28    H    ASP   4           H        ASP   4  65.802  52.939  13.657
   29    HA   ASP   4           HA       ASP   4  65.199  50.311  12.438
   30   1HB   ASP   4          1HB       ASP   4  64.577  49.735  14.744
   31   2HB   ASP   4          2HB       ASP   4  66.228  50.383  14.672
   32    HD2  ASP   4           HD2      ASP   4  63.315  52.396  16.640
   33    H    THR   5           H        THR   5  63.956  53.455  13.055
   34    HA   THR   5           HA       THR   5  61.282  52.717  13.635
   35    HB   THR   5           HB       THR   5  62.411  55.362  12.647
   36    HG1  THR   5           HG1      THR   5  61.874  54.347  15.245
   37   1HG2  THR   5          1HG2      THR   5  59.957  55.286  12.389
   38   2HG2  THR   5          2HG2      THR   5  59.791  54.706  14.063
   39   3HG2  THR   5          3HG2      THR   5  60.408  56.342  13.742
   40    H    LEU   6           H        LEU   6  62.862  54.048  10.674
   41    HA   LEU   6           HA       LEU   6  60.594  53.683   8.947
   42   1HB   LEU   6          2HB       LEU   6  63.577  53.852   8.372
   43   2HB   LEU   6          1HB       LEU   6  62.286  53.997   7.172
   44    HG   LEU   6           HG       LEU   6  62.745  55.901   9.513
   45   1HD1  LEU   6          1HD1      LEU   6  63.225  56.220   6.522
   46   2HD1  LEU   6          2HD1      LEU   6  64.483  56.038   7.765
   47   3HD1  LEU   6          3HD1      LEU   6  63.446  57.481   7.755
   48   1HD2  LEU   6          1HD2      LEU   6  60.763  55.988   7.194
   49   2HD2  LEU   6          2HD2      LEU   6  60.363  55.842   8.923
   50   3HD2  LEU   6          3HD2      LEU   6  61.089  57.334   8.307
   51    H    LYS   7           H        LYS   7  63.369  51.668   9.951
   52    HA   LYS   7           HA       LYS   7  63.136  49.581   8.116
   53   1HB   LYS   7          2HB       LYS   7  64.970  50.022   9.799
   54   2HB   LYS   7          1HB       LYS   7  63.883  49.414  11.059
   55   1HG   LYS   7          2HG       LYS   7  65.367  47.641  10.389
   56   2HG   LYS   7          1HG       LYS   7  63.736  47.236   9.811
   57   1HD   LYS   7          2HD       LYS   7  64.334  48.101   7.561
   58   2HD   LYS   7          1HD       LYS   7  65.948  48.542   8.163
   59   1HE   LYS   7          2HE       LYS   7  66.399  46.157   8.685
   60   2HE   LYS   7          1HE       LYS   7  64.790  45.720   8.072
   61   1HZ   LYS   7          1HZ       LYS   7  65.449  46.553   5.938
   62   2HZ   LYS   7          2HZ       LYS   7  66.486  45.375   6.444
   63   3HZ   LYS   7          3HZ       LYS   7  66.942  46.959   6.509
   64    H    GLN   8           H        GLN   8  61.543  50.064  11.300
   65    HA   GLN   8           HA       GLN   8  60.103  47.658  11.442
   66   1HB   GLN   8          1HB       GLN   8  60.436  49.222  13.316
   67   2HB   GLN   8          2HB       GLN   8  59.460  50.444  12.495
   68   1HG   GLN   8          1HG       GLN   8  58.181  49.282  14.238
   69   2HG   GLN   8          2HG       GLN   8  57.473  49.053  12.631
   70   1HE2  GLN   8          1HE2      GLN   8  59.938  47.481  14.773
   71   2HE2  GLN   8          2HE2      GLN   8  59.409  45.843  14.459
   72    H    PHE   9           H        PHE   9  59.174  50.864  10.146
   73    HA   PHE   9           HA       PHE   9  56.572  50.091   9.270
   74   1HB   PHE   9          1HB       PHE   9  57.258  52.409   9.699
   75   2HB   PHE   9          2HB       PHE   9  58.419  52.333   8.372
   76    HD1  PHE   9           HD1      PHE   9  54.762  52.093   9.153
   77    HD2  PHE   9           HD2      PHE   9  57.756  52.879   6.161
   78    HE1  PHE   9           HE1      PHE   9  53.002  52.891   7.598
   79    HE2  PHE   9           HE2      PHE   9  55.995  53.688   4.615
   80    HZ   PHE   9           HZ       PHE   9  53.618  53.698   5.332
   81    H    ALA  10           H        ALA  10  59.756  50.222   7.625
   82    HA   ALA  10           HA       ALA  10  58.819  49.719   5.010
   83   1HB   ALA  10          1HB       ALA  10  61.503  49.031   6.276
   84   2HB   ALA  10          2HB       ALA  10  61.161  49.128   4.534
   85   3HB   ALA  10          3HB       ALA  10  61.061  50.589   5.540
   86    H    LYS  11           H        LYS  11  59.772  47.427   7.624
   87    HA   LYS  11           HA       LYS  11  59.271  45.145   5.840
   88   1HB   LYS  11          2HB       LYS  11  59.914  43.749   7.642
   89   2HB   LYS  11          1HB       LYS  11  61.095  45.058   7.491
   90   1HG   LYS  11          2HG       LYS  11  60.079  46.209   9.426
   91   2HG   LYS  11          1HG       LYS  11  58.838  44.938   9.542
   92   1HD   LYS  11          1HD       LYS  11  60.617  43.240   9.894
   93   2HD   LYS  11          2HD       LYS  11  61.849  44.512   9.782
   94   1HE   LYS  11          2HE       LYS  11  61.411  43.948  12.117
   95   2HE   LYS  11          1HE       LYS  11  60.900  45.612  11.787
   96   1HZ   LYS  11          1HZ       LYS  11  59.136  43.264  11.877
   97   2HZ   LYS  11          2HZ       LYS  11  59.300  44.388  13.072
   98   3HZ   LYS  11          3HZ       LYS  11  58.658  44.822  11.619
   99    H    GLY  12           H        GLY  12  57.445  47.173   7.989
  100   1HA   GLY  12          1HA       GLY  12  55.247  45.256   8.183
  101   2HA   GLY  12          2HA       GLY  12  55.239  46.950   8.758
  102    H    VAL  13           H        VAL  13  56.328  47.893   6.111
  103    HA   VAL  13           HA       VAL  13  54.090  47.250   4.278
  104    HB   VAL  13           HB       VAL  13  56.431  49.194   4.059
  105   1HG1  VAL  13          1HG2      VAL  13  55.061  50.228   2.224
  106   2HG1  VAL  13          2HG2      VAL  13  55.633  48.614   1.804
  107   3HG1  VAL  13          3HG2      VAL  13  53.948  48.844   2.326
  108   1HG2  VAL  13          1HG1      VAL  13  54.831  49.919   5.811
  109   2HG2  VAL  13          2HG1      VAL  13  53.483  49.701   4.676
  110   3HG2  VAL  13          3HG1      VAL  13  54.697  50.963   4.389
  111    H    GLY  14           H        GLY  14  55.500  45.180   5.172
  112   1HA   GLY  14          2HA       GLY  14  56.781  44.193   2.696
  113   2HA   GLY  14          1HA       GLY  14  57.686  44.064   4.215
  114    H    LYS  15           H        LYS  15  55.128  43.783   5.777
  115    HA   LYS  15           HA       LYS  15  54.642  40.906   5.261
  116   1HB   LYS  15          2HB       LYS  15  53.710  40.781   7.427
  117   2HB   LYS  15          1HB       LYS  15  55.258  41.634   7.507
  118   1HG   LYS  15          1HG       LYS  15  53.974  42.943   8.898
  119   2HG   LYS  15          2HG       LYS  15  53.766  43.805   7.364
  120   1HD   LYS  15          2HD       LYS  15  51.573  42.648   7.047
  121   2HD   LYS  15          1HD       LYS  15  51.851  41.743   8.546
  122   1HE   LYS  15          1HE       LYS  15  50.359  43.594   9.001
  123   2HE   LYS  15          2HE       LYS  15  51.912  43.897   9.804
  124   1HZ   LYS  15          1HZ       LYS  15  51.079  45.831   8.693
  125   2HZ   LYS  15          2HZ       LYS  15  52.482  45.340   7.978
  126   3HZ   LYS  15          3HZ       LYS  15  51.035  45.044   7.245
  127    H    ASP  16           H        ASP  16  53.241  44.076   4.895
  128    HA   ASP  16           HA       ASP  16  50.550  43.183   4.252
  129   1HB   ASP  16          2HB       ASP  16  51.074  45.494   4.973
  130   2HB   ASP  16          1HB       ASP  16  52.111  45.702   3.551
  131    HD2  ASP  16           HD2      ASP  16  48.064  45.508   3.044
  132    H    LEU  17           H        LEU  17  53.709  43.271   2.711
  133    HA   LEU  17           HA       LEU  17  52.636  43.103  -0.030
  134   1HB   LEU  17          1HB       LEU  17  55.489  43.136   1.031
  135   2HB   LEU  17          2HB       LEU  17  54.974  43.261  -0.653
  136    HG   LEU  17           HG       LEU  17  54.500  45.315   1.546
  137   1HD1  LEU  17          1HD1      LEU  17  56.067  45.409  -1.070
  138   2HD1  LEU  17          2HD1      LEU  17  56.779  45.241   0.548
  139   3HD1  LEU  17          3HD1      LEU  17  55.917  46.731   0.107
  140   1HD2  LEU  17          1HD2      LEU  17  52.517  45.306   0.108
  141   2HD2  LEU  17          2HD2      LEU  17  53.514  46.716  -0.277
  142   3HD2  LEU  17          3HD2      LEU  17  53.540  45.299  -1.349
  143    H    VAL  18           H        VAL  18  54.656  41.334   2.373
  144    HA   VAL  18           HA       VAL  18  54.797  38.941   0.771
  145    HB   VAL  18           HB       VAL  18  55.326  39.604   3.677
  146   1HG1  VAL  18          1HG1      VAL  18  54.487  37.328   3.709
  147   2HG1  VAL  18          2HG1      VAL  18  56.250  37.314   3.895
  148   3HG1  VAL  18          3HG1      VAL  18  55.523  36.895   2.323
  149   1HG2  VAL  18          1HG2      VAL  18  56.966  40.322   1.908
  150   2HG2  VAL  18          2HG2      VAL  18  57.108  38.628   1.400
  151   3HG2  VAL  18          3HG2      VAL  18  57.641  39.115   3.022
  152    H    LYS  19           H        LYS  19  52.542  40.375   3.075
  153    HA   LYS  19           HA       LYS  19  50.853  38.060   3.442
  154   1HB   LYS  19          1HB       LYS  19  50.909  39.972   4.969
  155   2HB   LYS  19          2HB       LYS  19  50.288  41.043   3.703
  156   1HG   LYS  19          2HG       LYS  19  48.772  38.575   4.645
  157   2HG   LYS  19          1HG       LYS  19  48.638  40.147   5.453
  158   1HD   LYS  19          1HD       LYS  19  47.879  41.204   3.356
  159   2HD   LYS  19          2HD       LYS  19  48.000  39.645   2.522
  160   1HE   LYS  19          1HE       LYS  19  45.695  40.009   3.113
  161   2HE   LYS  19          2HE       LYS  19  46.327  38.690   4.117
  162   1HZ   LYS  19          1HZ       LYS  19  46.017  41.492   4.946
  163   2HZ   LYS  19          2HZ       LYS  19  45.023  40.246   5.367
  164   3HZ   LYS  19          3HZ       LYS  19  46.585  40.268   5.894
  165    H    GLY  20           H        GLY  20  51.063  40.756   1.152
  166   1HA   GLY  20          2HA       GLY  20  48.592  40.235  -0.250
  167   2HA   GLY  20          1HA       GLY  20  49.925  41.294  -0.756
  168    H    ALA  21           H        ALA  21  52.072  39.477  -0.741
  169    HA   ALA  21           HA       ALA  21  51.723  37.958  -3.151
  170   1HB   ALA  21          1HB       ALA  21  53.911  38.833  -2.387
  171   2HB   ALA  21          2HB       ALA  21  53.844  37.749  -0.977
  172   3HB   ALA  21          3HB       ALA  21  53.949  37.071  -2.615
  173    H    ALA  22           H        ALA  22  51.407  37.297   0.312
  174    HA   ALA  22           HA       ALA  22  50.989  34.426  -0.176
  175   1HB   ALA  22          1HB       ALA  22  50.976  35.997   2.419
  176   2HB   ALA  22          2HB       ALA  22  50.947  34.228   2.253
  177   3HB   ALA  22          3HB       ALA  22  52.375  35.141   1.727
  178    H    GLN  23           H        GLN  23  49.047  36.514  -1.208
  179    HA   GLN  23           HA       GLN  23  46.659  36.191   0.422
  180   1HB   GLN  23          1HB       GLN  23  47.092  38.211  -0.907
  181   2HB   GLN  23          2HB       GLN  23  47.057  37.261  -2.405
  182   1HG   GLN  23          2HG       GLN  23  44.714  36.610  -1.936
  183   2HG   GLN  23          1HG       GLN  23  44.769  37.516  -0.411
  184   1HE2  GLN  23          1HE2      GLN  23  45.425  39.915  -0.663
  185   2HE2  GLN  23          2HE2      GLN  23  44.722  40.770  -2.019
  186    H    GLY  24           H        GLY  24  47.543  35.220  -2.939
  187   1HA   GLY  24          2HA       GLY  24  46.804  32.483  -2.608
  188   2HA   GLY  24          1HA       GLY  24  45.481  33.380  -3.390
  189    H    VAL  25           H        VAL  25  49.076  33.568  -3.540
  190    HA   VAL  25           HA       VAL  25  49.022  34.104  -6.359
  191    HB   VAL  25           HB       VAL  25  50.665  35.038  -4.808
  192   1HG1  VAL  25          1HG1      VAL  25  51.075  33.005  -3.404
  193   2HG1  VAL  25          2HG1      VAL  25  52.550  33.802  -3.980
  194   3HG1  VAL  25          3HG1      VAL  25  52.001  32.312  -4.760
  195   1HG2  VAL  25          1HG2      VAL  25  52.610  34.800  -6.291
  196   2HG2  VAL  25          2HG2      VAL  25  51.113  34.930  -7.236
  197   3HG2  VAL  25          3HG2      VAL  25  51.897  33.348  -7.024
  198    H    LEU  26           H        LEU  26  49.963  31.322  -4.335
  199    HA   LEU  26           HA       LEU  26  50.614  29.513  -6.450
  200   1HB   LEU  26          1HB       LEU  26  49.517  28.952  -3.673
  201   2HB   LEU  26          2HB       LEU  26  50.331  27.787  -4.727
  202    HG   LEU  26           HG       LEU  26  51.595  30.286  -3.511
  203   1HD1  LEU  26          1HD1      LEU  26  51.986  27.325  -2.924
  204   2HD1  LEU  26          2HD1      LEU  26  52.876  28.669  -2.173
  205   3HD1  LEU  26          3HD1      LEU  26  51.132  28.490  -1.886
  206   1HD2  LEU  26          1HD2      LEU  26  52.645  29.788  -5.678
  207   2HD2  LEU  26          2HD2      LEU  26  52.787  28.069  -5.238
  208   3HD2  LEU  26          3HD2      LEU  26  53.726  29.299  -4.365
  209    H    SER  27           H        SER  27  47.563  30.421  -4.853
  210    HA   SER  27           HA       SER  27  45.946  28.351  -5.953
  211   1HB   SER  27          1HB       SER  27  45.183  31.163  -5.071
  212   2HB   SER  27          2HB       SER  27  44.077  29.792  -5.296
  213    HG   SER  27           HG       SER  27  44.734  30.062  -3.116
  214    H    THR  28           H        THR  28  46.651  31.716  -7.026
  215    HA   THR  28           HA       THR  28  45.002  31.752  -9.311
  216    HB   THR  28           HB       THR  28  47.660  33.144  -8.794
  217    HG1  THR  28           HG1      THR  28  46.245  34.831  -8.190
  218   1HG2  THR  28          1HG2      THR  28  46.824  34.788 -10.475
  219   2HG2  THR  28          2HG2      THR  28  45.456  33.711 -10.829
  220   3HG2  THR  28          3HG2      THR  28  47.117  33.197 -11.195
  221    H    VAL  29           H        VAL  29  48.470  30.832  -8.970
  222    HA   VAL  29           HA       VAL  29  49.013  30.230 -11.645
  223    HB   VAL  29           HB       VAL  29  50.105  29.124  -9.035
  224   1HG1  VAL  29          1HG1      VAL  29  51.157  28.794 -11.870
  225   2HG1  VAL  29          2HG1      VAL  29  50.615  27.494 -10.778
  226   3HG1  VAL  29          3HG1      VAL  29  52.072  28.424 -10.389
  227   1HG2  VAL  29          1HG2      VAL  29  51.175  31.176 -11.025
  228   2HG2  VAL  29          2HG2      VAL  29  50.434  31.567  -9.461
  229   3HG2  VAL  29          3HG2      VAL  29  51.963  30.671  -9.515
  230    H    SER  30           H        SER  30  47.314  28.305  -9.170
  231    HA   SER  30           HA       SER  30  47.366  25.877 -10.732
  232   1HB   SER  30          1HB       SER  30  47.143  25.870  -8.268
  233   2HB   SER  30          2HB       SER  30  45.586  26.715  -8.398
  234    HG   SER  30           HG       SER  30  45.352  24.444  -8.216
  235    H    CYS  31           H        CYS  31  44.640  28.065  -9.863
  236    HA   CYS  31           HA       CYS  31  43.005  27.001 -12.017
  237   1HB   CYS  31          1HB       CYS  31  41.419  28.761 -11.300
  238   2HB   CYS  31          2HB       CYS  31  41.937  27.686 -10.002
  239    H    LYS  32           H        LYS  32  45.721  28.541 -12.538
  240    HA   LYS  32           HA       LYS  32  44.755  30.791 -14.149
  241   1HB   LYS  32          2HB       LYS  32  46.668  31.089 -12.751
  242   2HB   LYS  32          1HB       LYS  32  47.528  29.735 -13.527
  243   1HG   LYS  32          2HG       LYS  32  47.788  30.876 -15.544
  244   2HG   LYS  32          1HG       LYS  32  46.437  31.987 -15.195
  245   1HD   LYS  32          1HD       LYS  32  47.688  33.028 -13.384
  246   2HD   LYS  32          2HD       LYS  32  49.098  31.989 -13.716
  247   1HE   LYS  32          2HE       LYS  32  49.252  32.950 -15.993
  248   2HE   LYS  32          1HE       LYS  32  47.845  33.982 -15.662
  249   1HZ   LYS  32          1HZ       LYS  32  50.403  34.060 -14.228
  250   2HZ   LYS  32          2HZ       LYS  32  49.892  35.149 -15.356
  251   3HZ   LYS  32          3HZ       LYS  32  49.096  35.017 -13.918
  252    H    LEU  33           H        LEU  33  46.018  27.490 -14.546
  253    HA   LEU  33           HA       LEU  33  46.847  27.503 -17.170
  254   1HB   LEU  33          1HB       LEU  33  47.108  25.610 -15.650
  255   2HB   LEU  33          2HB       LEU  33  45.360  25.337 -15.638
  256    HG   LEU  33           HG       LEU  33  45.423  24.793 -18.064
  257   1HD1  LEU  33          1HD2      LEU  33  47.378  26.103 -18.780
  258   2HD1  LEU  33          2HD2      LEU  33  48.438  25.137 -17.726
  259   3HD1  LEU  33          3HD2      LEU  33  47.645  24.389 -19.129
  260   1HD2  LEU  33          1HD1      LEU  33  47.410  23.230 -16.367
  261   2HD2  LEU  33          2HD1      LEU  33  45.644  23.022 -16.361
  262   3HD2  LEU  33          3HD1      LEU  33  46.578  22.634 -17.821
  263    H    ALA  34           H        ALA  34  43.537  26.438 -16.156
  264    HA   ALA  34           HA       ALA  34  42.500  26.942 -18.846
  265   1HB   ALA  34          1HB       ALA  34  41.112  26.111 -16.267
  266   2HB   ALA  34          2HB       ALA  34  41.722  25.007 -17.521
  267   3HB   ALA  34          3HB       ALA  34  40.383  26.116 -17.889
  268    H    LYS  35           H        LYS  35  43.227  28.838 -16.227
  269    HA   LYS  35           HA       LYS  35  42.583  30.773 -15.345
  270   1HB   LYS  35          2HB       LYS  35  43.667  31.262 -17.530
  271   2HB   LYS  35          1HB       LYS  35  42.067  31.474 -18.254
  272   1HG   LYS  35          1HG       LYS  35  43.177  33.590 -17.590
  273   2HG   LYS  35          2HG       LYS  35  41.632  33.368 -16.749
  274   1HD   LYS  35          1HD       LYS  35  42.779  32.628 -14.726
  275   2HD   LYS  35          2HD       LYS  35  44.358  32.697 -15.533
  276   1HE   LYS  35          1HE       LYS  35  42.498  35.077 -15.092
  277   2HE   LYS  35          2HE       LYS  35  43.888  34.664 -14.070
  278   1HZ   LYS  35          1HZ       LYS  35  45.299  34.936 -15.969
  279   2HZ   LYS  35          2HZ       LYS  35  44.454  36.318 -15.661
  280   3HZ   LYS  35          3HZ       LYS  35  44.014  35.348 -16.918
  281    H    THR  36           H        THR  36  40.638  29.298 -14.636
  282    HA   THR  36           HA       THR  36  38.074  30.627 -15.215
  283    HB   THR  36           HB       THR  36  38.085  28.267 -14.541
  284    HG1  THR  36           HG1      THR  36  36.551  28.544 -12.878
  285   1HG2  THR  36          1HG2      THR  36  38.621  27.629 -12.225
  286   2HG2  THR  36          2HG2      THR  36  39.195  29.273 -11.882
  287   3HG2  THR  36          3HG2      THR  36  40.063  28.246 -13.051
  288    H    CYS  37           H        CYS  37  40.994  31.122 -13.423
  289    HA   CYS  37           HA       CYS  37  39.761  33.100 -11.581
  290   1HB   CYS  37          1HB       CYS  37  42.481  31.793 -11.816
  291   2HB   CYS  37          2HB       CYS  37  42.168  33.157 -10.742
  292    HXT  CYS  37           HO        OH  38  41.055  35.063 -11.394
  Start of MODEL   14
    1   1H    GLY   1          1H        GLY   1  67.967  57.632  12.090
    2   2H    GLY   1          2H        GLY   1  67.182  58.138  13.450
    3   3H    GLY   1          3H        GLY   1  68.167  59.178  12.631
    4   1HA   GLY   1          2HA       GLY   1  65.893  59.705  12.196
    5   2HA   GLY   1          1HA       GLY   1  66.739  59.154  10.737
    6    H    ILE   2           H        ILE   2  64.425  58.810  10.068
    7    HA   ILE   2           HA       ILE   2  63.062  56.481  11.191
    8    HB   ILE   2           HB       ILE   2  61.450  57.012   9.294
    9   1HG1  ILE   2          2HG1      ILE   2  61.463  59.263   8.383
   10   2HG1  ILE   2          1HG1      ILE   2  63.014  59.628   9.134
   11   1HG2  ILE   2          1HG2      ILE   2  60.487  58.892  10.545
   12   2HG2  ILE   2          2HG2      ILE   2  61.108  57.644  11.642
   13   3HG2  ILE   2          3HG2      ILE   2  62.034  59.139  11.384
   14   1HD1  ILE   2          1HD1      ILE   2  62.527  57.512   6.990
   15   2HD1  ILE   2          2HD1      ILE   2  63.212  59.125   6.721
   16   3HD1  ILE   2          3HD1      ILE   2  64.113  57.946   7.686
   17    H    LEU   3           H        LEU   3  65.623  55.849  10.341
   18    HA   LEU   3           HA       LEU   3  65.567  54.839   7.620
   19   1HB   LEU   3          1HB       LEU   3  67.616  54.466   9.834
   20   2HB   LEU   3          2HB       LEU   3  67.866  54.151   8.109
   21    HG   LEU   3           HG       LEU   3  67.291  56.878   9.365
   22   1HD1  LEU   3          1HD1      LEU   3  69.624  57.363   8.762
   23   2HD1  LEU   3          2HD1      LEU   3  69.823  55.705   8.150
   24   3HD1  LEU   3          3HD1      LEU   3  69.531  55.987   9.881
   25   1HD2  LEU   3          1HD2      LEU   3  67.913  56.081   6.486
   26   2HD2  LEU   3          2HD2      LEU   3  67.886  57.748   7.102
   27   3HD2  LEU   3          3HD2      LEU   3  66.394  56.795   7.078
   28    H    ASP   4           H        ASP   4  65.141  53.479  10.865
   29    HA   ASP   4           HA       ASP   4  65.104  50.709   9.810
   30   1HB   ASP   4          2HB       ASP   4  66.352  51.252  11.913
   31   2HB   ASP   4          1HB       ASP   4  64.839  51.811  12.641
   32    HD2  ASP   4           HD2      ASP   4  66.158  49.050  10.933
   33    H    THR   5           H        THR   5  63.174  53.479  10.494
   34    HA   THR   5           HA       THR   5  60.839  52.170  11.383
   35    HB   THR   5           HB       THR   5  61.161  54.858  10.000
   36    HG1  THR   5           HG1      THR   5  61.162  55.570  12.182
   37   1HG2  THR   5          1HG2      THR   5  59.047  55.435  11.171
   38   2HG2  THR   5          2HG2      THR   5  58.904  53.754  11.731
   39   3HG2  THR   5          3HG2      THR   5  58.801  54.130   9.995
   40    H    LEU   6           H        LEU   6  61.924  53.334   8.162
   41    HA   LEU   6           HA       LEU   6  59.714  52.462   6.619
   42   1HB   LEU   6          2HB       LEU   6  62.666  52.719   5.935
   43   2HB   LEU   6          1HB       LEU   6  61.355  52.565   4.758
   44    HG   LEU   6           HG       LEU   6  61.660  54.867   6.739
   45   1HD1  LEU   6          1HD1      LEU   6  62.302  56.175   4.751
   46   2HD1  LEU   6          2HD1      LEU   6  62.206  54.711   3.747
   47   3HD1  LEU   6          3HD1      LEU   6  63.434  54.835   5.027
   48   1HD2  LEU   6          1HD2      LEU   6  59.303  54.535   6.124
   49   2HD2  LEU   6          2HD2      LEU   6  59.746  54.428   4.403
   50   3HD2  LEU   6          3HD2      LEU   6  59.944  55.956   5.288
   51    H    LYS   7           H        LYS   7  62.660  50.795   7.768
   52    HA   LYS   7           HA       LYS   7  62.328  48.406   6.244
   53   1HB   LYS   7          1HB       LYS   7  63.645  48.789   8.959
   54   2HB   LYS   7          2HB       LYS   7  63.889  47.429   7.859
   55   1HG   LYS   7          1HG       LYS   7  64.629  50.336   7.296
   56   2HG   LYS   7          2HG       LYS   7  65.742  49.021   7.713
   57   1HD   LYS   7          2HD       LYS   7  65.048  47.793   5.666
   58   2HD   LYS   7          1HD       LYS   7  63.981  49.150   5.230
   59   1HE   LYS   7          1HE       LYS   7  65.935  50.668   5.165
   60   2HE   LYS   7          2HE       LYS   7  67.002  49.317   5.605
   61   1HZ   LYS   7          1HZ       LYS   7  65.363  49.483   3.178
   62   2HZ   LYS   7          2HZ       LYS   7  66.993  49.715   3.263
   63   3HZ   LYS   7          3HZ       LYS   7  66.353  48.230   3.587
   64    H    GLN   8           H        GLN   8  61.420  49.261   9.614
   65    HA   GLN   8           HA       GLN   8  60.100  46.878  10.306
   66   1HB   GLN   8          2HB       GLN   8  60.845  48.737  11.798
   67   2HB   GLN   8          1HB       GLN   8  59.504  49.731  11.221
   68   1HG   GLN   8          1HG       GLN   8  59.207  47.004  12.550
   69   2HG   GLN   8          2HG       GLN   8  59.127  48.548  13.415
   70   1HE2  GLN   8          1HE2      GLN   8  57.133  46.219  12.550
   71   2HE2  GLN   8          2HE2      GLN   8  55.715  47.126  12.069
   72    H    PHE   9           H        PHE   9  58.858  49.936   8.905
   73    HA   PHE   9           HA       PHE   9  56.144  49.165   8.676
   74   1HB   PHE   9          2HB       PHE   9  56.965  51.475   8.531
   75   2HB   PHE   9          1HB       PHE   9  57.803  51.100   7.023
   76    HD1  PHE   9           HD1      PHE   9  56.659  51.163   4.926
   77    HD2  PHE   9           HD2      PHE   9  54.430  51.359   8.604
   78    HE1  PHE   9           HE1      PHE   9  54.623  51.795   3.661
   79    HE2  PHE   9           HE2      PHE   9  52.394  51.986   7.334
   80    HZ   PHE   9           HZ       PHE   9  52.491  52.215   4.863
   81    H    ALA  10           H        ALA  10  58.888  48.879   6.369
   82    HA   ALA  10           HA       ALA  10  57.366  47.702   4.254
   83   1HB   ALA  10          1HB       ALA  10  59.570  47.039   3.372
   84   2HB   ALA  10          2HB       ALA  10  60.332  47.470   4.918
   85   3HB   ALA  10          3HB       ALA  10  59.577  48.730   3.915
   86    H    LYS  11           H        LYS  11  59.201  46.348   7.026
   87    HA   LYS  11           HA       LYS  11  58.320  43.601   6.395
   88   1HB   LYS  11          1HB       LYS  11  59.851  44.773   8.752
   89   2HB   LYS  11          2HB       LYS  11  59.524  43.049   8.498
   90   1HG   LYS  11          1HG       LYS  11  61.139  44.817   6.608
   91   2HG   LYS  11          2HG       LYS  11  61.798  43.674   7.792
   92   1HD   LYS  11          1HD       LYS  11  60.627  41.807   6.639
   93   2HD   LYS  11          2HD       LYS  11  59.972  42.959   5.457
   94   1HE   LYS  11          1HE       LYS  11  61.903  41.850   4.500
   95   2HE   LYS  11          2HE       LYS  11  62.286  43.561   4.772
   96   1HZ   LYS  11          1HZ       LYS  11  63.432  42.915   6.764
   97   2HZ   LYS  11          2HZ       LYS  11  63.051  41.329   6.522
   98   3HZ   LYS  11          3HZ       LYS  11  64.047  42.109   5.464
   99    H    GLY  12           H        GLY  12  56.236  45.407   6.545
  100   1HA   GLY  12          1HA       GLY  12  54.592  44.121   8.530
  101   2HA   GLY  12          2HA       GLY  12  54.792  45.880   8.823
  102    H    VAL  13           H        VAL  13  54.992  46.633   6.056
  103    HA   VAL  13           HA       VAL  13  52.530  45.570   4.767
  104    HB   VAL  13           HB       VAL  13  54.511  47.599   3.676
  105   1HG1  VAL  13          1HG1      VAL  13  52.979  46.526   2.006
  106   2HG1  VAL  13          2HG1      VAL  13  52.594  48.240   2.222
  107   3HG1  VAL  13          3HG1      VAL  13  51.588  47.001   3.000
  108   1HG2  VAL  13          1HG2      VAL  13  52.842  49.351   4.322
  109   2HG2  VAL  13          2HG2      VAL  13  53.608  48.587   5.723
  110   3HG2  VAL  13          3HG2      VAL  13  51.955  48.123   5.252
  111    H    GLY  14           H        GLY  14  54.292  43.789   5.554
  112   1HA   GLY  14          1HA       GLY  14  55.364  42.655   3.035
  113   2HA   GLY  14          2HA       GLY  14  56.352  42.644   4.519
  114    H    LYS  15           H        LYS  15  54.215  42.433   6.387
  115    HA   LYS  15           HA       LYS  15  53.486  39.647   6.357
  116   1HB   LYS  15          2HB       LYS  15  52.318  41.960   7.918
  117   2HB   LYS  15          1HB       LYS  15  52.188  40.246   8.348
  118   1HG   LYS  15          1HG       LYS  15  54.897  41.646   8.155
  119   2HG   LYS  15          2HG       LYS  15  53.881  41.790   9.585
  120   1HD   LYS  15          2HD       LYS  15  55.594  40.100   9.819
  121   2HD   LYS  15          1HD       LYS  15  53.963  39.432  10.026
  122   1HE   LYS  15          1HE       LYS  15  54.057  38.365   7.866
  123   2HE   LYS  15          2HE       LYS  15  55.557  39.232   7.438
  124   1HZ   LYS  15          1HZ       LYS  15  55.250  37.251   9.579
  125   2HZ   LYS  15          2HZ       LYS  15  56.644  38.042   9.189
  126   3HZ   LYS  15          3HZ       LYS  15  55.963  36.993   8.114
  127    H    ASP  16           H        ASP  16  51.946  42.748   5.552
  128    HA   ASP  16           HA       ASP  16  49.342  41.770   4.888
  129   1HB   ASP  16          2HB       ASP  16  50.946  44.217   4.058
  130   2HB   ASP  16          1HB       ASP  16  49.256  43.971   3.631
  131    HD2  ASP  16           HD2      ASP  16  50.233  44.822   7.482
  132    H    LEU  17           H        LEU  17  52.441  41.660   3.241
  133    HA   LEU  17           HA       LEU  17  51.233  41.188   0.584
  134   1HB   LEU  17          1HB       LEU  17  54.136  41.286   1.476
  135   2HB   LEU  17          2HB       LEU  17  53.532  41.215  -0.178
  136    HG   LEU  17           HG       LEU  17  53.146  43.536   1.758
  137   1HD1  LEU  17          1HD2      LEU  17  54.587  44.747   0.163
  138   2HD1  LEU  17          2HD2      LEU  17  54.733  43.283  -0.834
  139   3HD1  LEU  17          3HD2      LEU  17  55.430  43.318   0.799
  140   1HD2  LEU  17          1HD1      LEU  17  52.188  44.714  -0.228
  141   2HD2  LEU  17          2HD1      LEU  17  52.203  43.176  -1.119
  142   3HD2  LEU  17          3HD1      LEU  17  51.171  43.372   0.319
  143    H    VAL  18           H        VAL  18  53.107  39.705   3.249
  144    HA   VAL  18           HA       VAL  18  53.245  37.097   2.016
  145    HB   VAL  18           HB       VAL  18  53.543  38.167   4.830
  146   1HG1  VAL  18          1HG1      VAL  18  54.276  35.892   5.496
  147   2HG1  VAL  18          2HG1      VAL  18  53.673  35.268   3.940
  148   3HG1  VAL  18          3HG1      VAL  18  52.545  35.974   5.127
  149   1HG2  VAL  18          1HG2      VAL  18  55.459  36.739   2.933
  150   2HG2  VAL  18          2HG2      VAL  18  55.395  38.497   3.162
  151   3HG2  VAL  18          3HG2      VAL  18  55.869  37.445   4.511
  152    H    LYS  19           H        LYS  19  50.877  38.989   3.814
  153    HA   LYS  19           HA       LYS  19  49.022  36.813   4.338
  154   1HB   LYS  19          1HB       LYS  19  49.102  38.893   5.651
  155   2HB   LYS  19          2HB       LYS  19  48.567  39.811   4.227
  156   1HG   LYS  19          1HG       LYS  19  46.463  38.555   4.162
  157   2HG   LYS  19          2HG       LYS  19  47.027  37.491   5.473
  158   1HD   LYS  19          1HD       LYS  19  47.134  39.404   7.011
  159   2HD   LYS  19          2HD       LYS  19  46.661  40.504   5.697
  160   1HE   LYS  19          2HE       LYS  19  44.722  40.007   7.101
  161   2HE   LYS  19          1HE       LYS  19  44.491  39.313   5.484
  162   1HZ   LYS  19          1HZ       LYS  19  45.397  37.852   7.866
  163   2HZ   LYS  19          2HZ       LYS  19  43.880  37.799   7.221
  164   3HZ   LYS  19          3HZ       LYS  19  45.158  37.201   6.369
  165    H    GLY  20           H        GLY  20  49.629  39.186   1.788
  166   1HA   GLY  20          2HA       GLY  20  47.238  38.700   0.239
  167   2HA   GLY  20          1HA       GLY  20  48.701  39.573  -0.265
  168    H    ALA  21           H        ALA  21  50.663  37.604   0.159
  169    HA   ALA  21           HA       ALA  21  50.376  35.821  -2.068
  170   1HB   ALA  21          1HB       ALA  21  52.281  35.742   0.307
  171   2HB   ALA  21          2HB       ALA  21  52.563  36.608  -1.221
  172   3HB   ALA  21          3HB       ALA  21  52.460  34.834  -1.210
  173    H    ALA  22           H        ALA  22  49.732  35.633   1.409
  174    HA   ALA  22           HA       ALA  22  49.114  32.763   1.242
  175   1HB   ALA  22          1HB       ALA  22  48.875  32.884   3.664
  176   2HB   ALA  22          2HB       ALA  22  49.031  34.654   3.612
  177   3HB   ALA  22          3HB       ALA  22  50.405  33.622   3.152
  178    H    GLN  23           H        GLN  23  47.427  34.784  -0.228
  179    HA   GLN  23           HA       GLN  23  44.907  34.884   1.210
  180   1HB   GLN  23          2HB       GLN  23  45.651  36.625  -0.342
  181   2HB   GLN  23          1HB       GLN  23  45.632  35.479  -1.693
  182   1HG   GLN  23          2HG       GLN  23  43.212  36.186   0.023
  183   2HG   GLN  23          1HG       GLN  23  43.641  37.012  -1.484
  184   1HE2  GLN  23          2HE2      GLN  23  41.491  34.857  -0.365
  185   2HE2  GLN  23          1HE2      GLN  23  41.297  33.831  -1.770
  186    H    GLY  24           H        GLY  24  46.142  33.185  -1.731
  187   1HA   GLY  24          2HA       GLY  24  44.781  30.723  -1.102
  188   2HA   GLY  24          1HA       GLY  24  43.932  31.651  -2.361
  189    H    VAL  25           H        VAL  25  47.143  30.359  -1.427
  190    HA   VAL  25           HA       VAL  25  48.523  30.897  -3.778
  191    HB   VAL  25           HB       VAL  25  50.051  29.122  -3.040
  192   1HG1  VAL  25          1HG1      VAL  25  49.009  30.826  -0.742
  193   2HG1  VAL  25          2HG1      VAL  25  50.635  30.129  -0.894
  194   3HG1  VAL  25          3HG1      VAL  25  50.100  31.384  -2.033
  195   1HG2  VAL  25          1HG2      VAL  25  49.627  27.943  -0.884
  196   2HG2  VAL  25          2HG2      VAL  25  47.936  28.477  -0.946
  197   3HG2  VAL  25          3HG2      VAL  25  48.586  27.387  -2.197
  198    H    LEU  26           H        LEU  26  46.624  28.039  -2.880
  199    HA   LEU  26           HA       LEU  26  46.999  26.456  -5.181
  200   1HB   LEU  26          1HB       LEU  26  44.516  26.747  -3.455
  201   2HB   LEU  26          2HB       LEU  26  44.883  25.389  -4.530
  202    HG   LEU  26           HG       LEU  26  46.476  26.185  -2.050
  203   1HD1  LEU  26          1HD2      LEU  26  45.576  24.094  -1.122
  204   2HD1  LEU  26          2HD2      LEU  26  44.265  25.208  -1.564
  205   3HD1  LEU  26          3HD2      LEU  26  44.643  23.820  -2.611
  206   1HD2  LEU  26          1HD1      LEU  26  47.631  24.000  -2.421
  207   2HD2  LEU  26          2HD1      LEU  26  46.803  23.848  -3.986
  208   3HD2  LEU  26          3HD1      LEU  26  47.972  25.162  -3.711
  209    H    SER  27           H        SER  27  44.772  29.180  -4.576
  210    HA   SER  27           HA       SER  27  43.399  28.856  -7.124
  211   1HB   SER  27          1HB       SER  27  43.363  31.134  -5.105
  212   2HB   SER  27          2HB       SER  27  42.239  30.902  -6.459
  213    HG   SER  27           HG       SER  27  41.649  28.904  -5.497
  214    H    THR  28           H        THR  28  45.928  30.989  -5.736
  215    HA   THR  28           HA       THR  28  46.071  32.787  -7.926
  216    HB   THR  28           HB       THR  28  48.175  32.048  -5.857
  217    HG1  THR  28           HG1      THR  28  47.291  33.872  -4.806
  218   1HG2  THR  28          1HG2      THR  28  47.859  34.510  -7.633
  219   2HG2  THR  28          2HG2      THR  28  49.036  34.337  -6.313
  220   3HG2  THR  28          3HG2      THR  28  49.158  33.299  -7.746
  221    H    VAL  29           H        VAL  29  48.098  29.917  -7.092
  222    HA   VAL  29           HA       VAL  29  49.878  30.173  -9.254
  223    HB   VAL  29           HB       VAL  29  50.126  28.795  -7.181
  224   1HG1  VAL  29          1HG1      VAL  29  47.949  27.585  -7.298
  225   2HG1  VAL  29          2HG1      VAL  29  48.565  26.667  -8.694
  226   3HG1  VAL  29          3HG1      VAL  29  49.351  26.515  -7.113
  227   1HG2  VAL  29          1HG2      VAL  29  50.675  27.386  -9.829
  228   2HG2  VAL  29          2HG2      VAL  29  51.691  28.646  -9.091
  229   3HG2  VAL  29          3HG2      VAL  29  51.501  27.074  -8.287
  230    H    SER  30           H        SER  30  46.799  28.421  -8.965
  231    HA   SER  30           HA       SER  30  46.850  27.336 -11.631
  232   1HB   SER  30          2HB       SER  30  44.537  27.834  -9.701
  233   2HB   SER  30          1HB       SER  30  44.480  26.808 -11.150
  234    HG   SER  30           HG       SER  30  46.142  25.543 -10.199
  235    H    CYS  31           H        CYS  31  45.268  30.160 -10.104
  236    HA   CYS  31           HA       CYS  31  44.089  31.191 -12.500
  237   1HB   CYS  31          2HB       CYS  31  43.420  31.757 -10.170
  238   2HB   CYS  31          1HB       CYS  31  44.957  32.606  -9.958
  239    H    LYS  32           H        LYS  32  47.404  30.900 -11.592
  240    HA   LYS  32           HA       LYS  32  48.213  33.493 -12.647
  241   1HB   LYS  32          1HB       LYS  32  49.189  32.664 -10.619
  242   2HB   LYS  32          2HB       LYS  32  49.807  31.209 -11.435
  243   1HG   LYS  32          1HG       LYS  32  51.431  32.372 -12.576
  244   2HG   LYS  32          2HG       LYS  32  50.433  33.831 -12.701
  245   1HD   LYS  32          2HD       LYS  32  52.364  34.231 -11.225
  246   2HD   LYS  32          1HD       LYS  32  50.816  34.378 -10.369
  247   1HE   LYS  32          1HE       LYS  32  52.516  33.161  -9.032
  248   2HE   LYS  32          2HE       LYS  32  51.114  32.140  -9.387
  249   1HZ   LYS  32          1HZ       LYS  32  53.173  30.995  -9.720
  250   2HZ   LYS  32          2HZ       LYS  32  53.666  32.105 -10.836
  251   3HZ   LYS  32          3HZ       LYS  32  52.366  31.139 -11.150
  252    H    LEU  33           H        LEU  33  47.039  32.617 -14.639
  253    HA   LEU  33           HA       LEU  33  48.609  31.051 -16.530
  254   1HB   LEU  33          2HB       LEU  33  46.135  31.431 -16.617
  255   2HB   LEU  33          1HB       LEU  33  46.420  33.119 -17.052
  256    HG   LEU  33           HG       LEU  33  47.443  30.721 -18.650
  257   1HD1  LEU  33          1HD2      LEU  33  44.958  32.432 -19.068
  258   2HD1  LEU  33          2HD2      LEU  33  44.979  30.735 -18.536
  259   3HD1  LEU  33          3HD2      LEU  33  45.545  31.159 -20.164
  260   1HD2  LEU  33          1HD1      LEU  33  47.203  33.693 -19.308
  261   2HD2  LEU  33          2HD1      LEU  33  48.700  32.733 -19.229
  262   3HD2  LEU  33          3HD1      LEU  33  47.526  32.427 -20.510
  263    H    ALA  34           H        ALA  34  47.823  34.535 -16.138
  264    HA   ALA  34           HA       ALA  34  50.649  35.243 -16.581
  265   1HB   ALA  34          1HB       ALA  34  49.604  35.451 -18.813
  266   2HB   ALA  34          2HB       ALA  34  48.341  36.498 -18.128
  267   3HB   ALA  34          3HB       ALA  34  50.036  37.042 -18.154
  268    H    LYS  35           H        LYS  35  49.438  35.008 -14.183
  269    HA   LYS  35           HA       LYS  35  48.685  35.995 -12.308
  270   1HB   LYS  35          1HB       LYS  35  50.297  38.308 -13.447
  271   2HB   LYS  35          2HB       LYS  35  49.741  38.169 -11.776
  272   1HG   LYS  35          2HG       LYS  35  51.554  36.149 -13.149
  273   2HG   LYS  35          1HG       LYS  35  52.166  37.503 -12.199
  274   1HD   LYS  35          1HD       LYS  35  50.239  35.520 -10.937
  275   2HD   LYS  35          2HD       LYS  35  51.953  35.151 -11.122
  276   1HE   LYS  35          1HE       LYS  35  51.604  36.025  -8.927
  277   2HE   LYS  35          2HE       LYS  35  52.572  37.178  -9.860
  278   1HZ   LYS  35          1HZ       LYS  35  50.637  38.502 -10.145
  279   2HZ   LYS  35          2HZ       LYS  35  50.836  38.192  -8.542
  280   3HZ   LYS  35          3HZ       LYS  35  49.679  37.385  -9.396
  281    H    THR  36           H        THR  36  46.604  35.850 -13.832
  282    HA   THR  36           HA       THR  36  45.314  38.407 -14.311
  283    HB   THR  36           HB       THR  36  43.290  37.020 -14.619
  284    HG1  THR  36           HG1      THR  36  43.566  34.756 -14.491
  285   1HG2  THR  36          1HG2      THR  36  44.879  37.369 -16.494
  286   2HG2  THR  36          2HG2      THR  36  44.084  35.783 -16.586
  287   3HG2  THR  36          3HG2      THR  36  45.762  35.899 -16.017
  288    H    CYS  37           H        CYS  37  45.519  36.040 -11.654
  289    HA   CYS  37           HA       CYS  37  43.787  37.694  -9.913
  290   1HB   CYS  37          2HB       CYS  37  45.358  35.142  -9.437
  291   2HB   CYS  37          1HB       CYS  37  44.470  36.028  -8.193
  292    HXT  CYS  37           HO        OH  38  47.794  37.868  -9.153
  Start of MODEL   15
    1   1H    GLY   1          1H        GLY   1  66.665  54.542  14.909
    2   2H    GLY   1          2H        GLY   1  67.013  55.204  16.379
    3   3H    GLY   1          3H        GLY   1  66.787  56.179  15.068
    4   1HA   GLY   1          2HA       GLY   1  64.754  54.483  16.328
    5   2HA   GLY   1          1HA       GLY   1  64.879  56.243  16.499
    6    H    ILE   2           H        ILE   2  64.864  57.502  14.374
    7    HA   ILE   2           HA       ILE   2  62.530  56.911  12.899
    8    HB   ILE   2           HB       ILE   2  63.817  59.107  13.397
    9   1HG1  ILE   2          2HG1      ILE   2  61.714  59.141  12.333
   10   2HG1  ILE   2          1HG1      ILE   2  62.807  60.271  11.526
   11   1HG2  ILE   2          1HG2      ILE   2  65.213  59.972  11.609
   12   2HG2  ILE   2          2HG2      ILE   2  65.931  58.517  12.322
   13   3HG2  ILE   2          3HG2      ILE   2  65.129  58.431  10.736
   14   1HD1  ILE   2          1HD1      ILE   2  63.154  58.502   9.721
   15   2HD1  ILE   2          2HD1      ILE   2  61.833  57.586  10.497
   16   3HD1  ILE   2          3HD1      ILE   2  61.524  59.191   9.830
   17    H    LEU   3           H        LEU   3  65.986  56.235  12.334
   18    HA   LEU   3           HA       LEU   3  65.619  55.260   9.640
   19   1HB   LEU   3          1HB       LEU   3  67.863  54.833  11.651
   20   2HB   LEU   3          2HB       LEU   3  67.941  54.451   9.925
   21    HG   LEU   3           HG       LEU   3  67.570  57.240  11.113
   22   1HD1  LEU   3          1HD1      LEU   3  69.951  55.929   9.742
   23   2HD1  LEU   3          2HD1      LEU   3  69.816  56.288  11.479
   24   3HD1  LEU   3          3HD1      LEU   3  69.862  57.615  10.299
   25   1HD2  LEU   3          1HD2      LEU   3  68.012  57.997   8.771
   26   2HD2  LEU   3          2HD2      LEU   3  66.487  57.110   8.910
   27   3HD2  LEU   3          3HD2      LEU   3  67.921  56.307   8.228
   28    H    ASP   4           H        ASP   4  64.817  53.900  12.683
   29    HA   ASP   4           HA       ASP   4  65.067  51.112  11.713
   30   1HB   ASP   4          1HB       ASP   4  65.809  51.644  14.024
   31   2HB   ASP   4          2HB       ASP   4  64.185  52.235  14.405
   32    HD2  ASP   4           HD2      ASP   4  62.493  50.765  14.390
   33    H    THR   5           H        THR   5  62.953  53.870  12.251
   34    HA   THR   5           HA       THR   5  60.541  52.423  12.376
   35    HB   THR   5           HB       THR   5  60.989  55.324  11.575
   36    HG1  THR   5           HG1      THR   5  60.538  55.647  13.788
   37   1HG2  THR   5          1HG2      THR   5  58.729  54.555  10.966
   38   2HG2  THR   5          2HG2      THR   5  58.663  55.629  12.376
   39   3HG2  THR   5          3HG2      THR   5  58.512  53.872  12.595
   40    H    LEU   6           H        LEU   6  62.298  54.047   9.715
   41    HA   LEU   6           HA       LEU   6  60.461  53.627   7.613
   42   1HB   LEU   6          2HB       LEU   6  63.503  53.702   7.606
   43   2HB   LEU   6          1HB       LEU   6  62.468  53.897   6.186
   44    HG   LEU   6           HG       LEU   6  62.508  55.769   8.597
   45   1HD1  LEU   6          1HD1      LEU   6  64.587  55.848   7.271
   46   2HD1  LEU   6          2HD1      LEU   6  63.636  56.097   5.789
   47   3HD1  LEU   6          3HD1      LEU   6  63.633  57.332   7.069
   48   1HD2  LEU   6          1HD2      LEU   6  61.200  57.271   7.094
   49   2HD2  LEU   6          2HD2      LEU   6  61.083  55.956   5.905
   50   3HD2  LEU   6          3HD2      LEU   6  60.308  55.797   7.500
   51    H    LYS   7           H        LYS   7  63.151  51.575   8.864
   52    HA   LYS   7           HA       LYS   7  62.929  49.481   6.992
   53   1HB   LYS   7          2HB       LYS   7  64.824  49.931   8.483
   54   2HB   LYS   7          1HB       LYS   7  63.841  49.470   9.888
   55   1HG   LYS   7          1HG       LYS   7  63.602  47.191   9.009
   56   2HG   LYS   7          2HG       LYS   7  64.460  47.654   7.515
   57   1HD   LYS   7          2HD       LYS   7  66.455  48.236   8.821
   58   2HD   LYS   7          1HD       LYS   7  65.607  47.818  10.328
   59   1HE   LYS   7          2HE       LYS   7  65.365  45.474   9.538
   60   2HE   LYS   7          1HE       LYS   7  66.211  45.894   8.033
   61   1HZ   LYS   7          1HZ       LYS   7  67.340  46.056  10.737
   62   2HZ   LYS   7          2HZ       LYS   7  67.666  44.887   9.620
   63   3HZ   LYS   7          3HZ       LYS   7  68.126  46.445   9.340
   64    H    GLN   8           H        GLN   8  61.476  49.929  10.258
   65    HA   GLN   8           HA       GLN   8  60.049  47.497  10.374
   66   1HB   GLN   8          2HB       GLN   8  60.588  49.061  12.241
   67   2HB   GLN   8          1HB       GLN   8  59.363  50.186  11.648
   68   1HG   GLN   8          2HG       GLN   8  58.847  47.294  12.475
   69   2HG   GLN   8          1HG       GLN   8  58.632  48.696  13.536
   70   1HE2  GLN   8          2HE2      GLN   8  57.277  50.563  12.325
   71   2HE2  GLN   8          1HE2      GLN   8  55.764  49.991  11.656
   72    H    PHE   9           H        PHE   9  59.024  50.797   9.382
   73    HA   PHE   9           HA       PHE   9  56.385  50.168   8.614
   74   1HB   PHE   9          2HB       PHE   9  57.199  52.445   8.929
   75   2HB   PHE   9          1HB       PHE   9  58.306  52.274   7.563
   76    HD1  PHE   9           HD1      PHE   9  57.564  52.622   5.313
   77    HD2  PHE   9           HD2      PHE   9  54.695  52.372   8.513
   78    HE1  PHE   9           HE1      PHE   9  55.772  53.357   3.766
   79    HE2  PHE   9           HE2      PHE   9  52.905  53.108   6.961
   80    HZ   PHE   9           HZ       PHE   9  53.442  53.600   4.587
   81    H    ALA  10           H        ALA  10  59.389  50.318   6.624
   82    HA   ALA  10           HA       ALA  10  58.203  49.447   4.189
   83   1HB   ALA  10          1HB       ALA  10  61.061  49.156   5.201
   84   2HB   ALA  10          2HB       ALA  10  60.527  48.983   3.514
   85   3HB   ALA  10          3HB       ALA  10  60.396  50.557   4.328
   86    H    LYS  11           H        LYS  11  59.479  47.696   7.016
   87    HA   LYS  11           HA       LYS  11  59.281  45.083   5.777
   88   1HB   LYS  11          2HB       LYS  11  60.825  45.703   7.679
   89   2HB   LYS  11          1HB       LYS  11  59.402  45.841   8.723
   90   1HG   LYS  11          1HG       LYS  11  60.456  43.681   9.034
   91   2HG   LYS  11          2HG       LYS  11  58.873  43.437   8.275
   92   1HD   LYS  11          1HD       LYS  11  59.938  43.113   6.084
   93   2HD   LYS  11          2HD       LYS  11  61.515  43.585   6.752
   94   1HE   LYS  11          1HE       LYS  11  61.398  41.164   6.528
   95   2HE   LYS  11          2HE       LYS  11  61.470  41.605   8.245
   96   1HZ   LYS  11          1HZ       LYS  11  59.038  40.907   6.754
   97   2HZ   LYS  11          2HZ       LYS  11  59.840  39.922   7.805
   98   3HZ   LYS  11          3HZ       LYS  11  59.111  41.294   8.355
   99    H    GLY  12           H        GLY  12  57.158  47.255   7.603
  100   1HA   GLY  12          1HA       GLY  12  55.041  45.269   7.873
  101   2HA   GLY  12          2HA       GLY  12  54.929  47.015   8.240
  102    H    VAL  13           H        VAL  13  55.994  47.763   5.534
  103    HA   VAL  13           HA       VAL  13  53.806  46.827   3.784
  104    HB   VAL  13           HB       VAL  13  56.093  48.771   3.256
  105   1HG1  VAL  13          1HG2      VAL  13  54.603  49.590   1.419
  106   2HG1  VAL  13          2HG2      VAL  13  55.098  47.915   1.154
  107   3HG1  VAL  13          3HG2      VAL  13  53.471  48.266   1.780
  108   1HG2  VAL  13          1HG1      VAL  13  54.377  50.568   3.529
  109   2HG2  VAL  13          2HG1      VAL  13  53.198  49.343   4.044
  110   3HG2  VAL  13          3HG1      VAL  13  54.630  49.682   5.038
  111    H    GLY  14           H        GLY  14  55.348  44.945   4.889
  112   1HA   GLY  14          2HA       GLY  14  56.501  43.652   2.496
  113   2HA   GLY  14          1HA       GLY  14  57.437  43.647   4.007
  114    H    LYS  15           H        LYS  15  55.082  43.676   5.737
  115    HA   LYS  15           HA       LYS  15  54.295  40.884   5.811
  116   1HB   LYS  15          2HB       LYS  15  53.186  43.334   7.227
  117   2HB   LYS  15          1HB       LYS  15  52.820  41.639   7.605
  118   1HG   LYS  15          1HG       LYS  15  55.532  43.019   7.874
  119   2HG   LYS  15          2HG       LYS  15  54.468  42.454   9.177
  120   1HD   LYS  15          2HD       LYS  15  54.685  40.122   8.163
  121   2HD   LYS  15          1HD       LYS  15  55.977  40.774   7.136
  122   1HE   LYS  15          1HE       LYS  15  57.211  41.503   9.171
  123   2HE   LYS  15          2HE       LYS  15  55.929  40.813  10.187
  124   1HZ   LYS  15          1HZ       LYS  15  57.768  39.328   9.955
  125   2HZ   LYS  15          2HZ       LYS  15  57.611  39.310   8.313
  126   3HZ   LYS  15          3HZ       LYS  15  56.420  38.677   9.262
  127    H    ASP  16           H        ASP  16  52.893  44.004   4.781
  128    HA   ASP  16           HA       ASP  16  50.322  43.039   3.997
  129   1HB   ASP  16          1HB       ASP  16  50.906  45.411   4.422
  130   2HB   ASP  16          2HB       ASP  16  51.956  45.406   2.995
  131    HD2  ASP  16           HD2      ASP  16  49.337  45.709   0.716
  132    H    LEU  17           H        LEU  17  53.514  42.827   2.566
  133    HA   LEU  17           HA       LEU  17  52.512  42.245  -0.146
  134   1HB   LEU  17          1HB       LEU  17  55.338  42.323   0.971
  135   2HB   LEU  17          2HB       LEU  17  54.858  42.228  -0.723
  136    HG   LEU  17           HG       LEU  17  54.414  44.596   1.143
  137   1HD1  LEU  17          1HD1      LEU  17  55.939  45.741  -0.420
  138   2HD1  LEU  17          2HD1      LEU  17  56.086  44.256  -1.386
  139   3HD1  LEU  17          3HD1      LEU  17  56.726  44.305   0.271
  140   1HD2  LEU  17          1HD2      LEU  17  52.489  44.446  -0.367
  141   2HD2  LEU  17          2HD2      LEU  17  53.569  44.199  -1.761
  142   3HD2  LEU  17          3HD2      LEU  17  53.556  45.754  -0.900
  143    H    VAL  18           H        VAL  18  54.187  40.807   2.682
  144    HA   VAL  18           HA       VAL  18  54.321  38.163   1.507
  145    HB   VAL  18           HB       VAL  18  54.517  39.218   4.342
  146   1HG1  VAL  18          1HG2      VAL  18  54.693  36.328   3.393
  147   2HG1  VAL  18          2HG2      VAL  18  55.226  36.913   4.984
  148   3HG1  VAL  18          3HG2      VAL  18  53.513  36.997   4.547
  149   1HG2  VAL  18          1HG1      VAL  18  56.506  37.810   2.501
  150   2HG2  VAL  18          2HG1      VAL  18  56.852  38.495   4.104
  151   3HG2  VAL  18          3HG1      VAL  18  56.443  39.565   2.748
  152    H    LYS  19           H        LYS  19  51.912  40.162   3.099
  153    HA   LYS  19           HA       LYS  19  50.011  38.024   3.624
  154   1HB   LYS  19          1HB       LYS  19  50.029  40.156   4.876
  155   2HB   LYS  19          2HB       LYS  19  49.647  41.033   3.384
  156   1HG   LYS  19          2HG       LYS  19  47.646  40.703   4.747
  157   2HG   LYS  19          1HG       LYS  19  47.492  39.838   3.209
  158   1HD   LYS  19          1HD       LYS  19  48.150  37.725   4.328
  159   2HD   LYS  19          2HD       LYS  19  48.317  38.586   5.872
  160   1HE   LYS  19          1HE       LYS  19  45.747  38.360   4.241
  161   2HE   LYS  19          2HE       LYS  19  46.153  37.370   5.656
  162   1HZ   LYS  19          1HZ       LYS  19  45.829  40.284   5.651
  163   2HZ   LYS  19          2HZ       LYS  19  46.235  39.363   6.959
  164   3HZ   LYS  19          3HZ       LYS  19  44.758  39.184   6.249
  165    H    GLY  20           H        GLY  20  50.759  40.298   1.023
  166   1HA   GLY  20          1HA       GLY  20  48.438  39.766  -0.616
  167   2HA   GLY  20          2HA       GLY  20  49.928  40.613  -1.085
  168    H    ALA  21           H        ALA  21  51.863  38.667  -0.508
  169    HA   ALA  21           HA       ALA  21  51.675  36.798  -2.670
  170   1HB   ALA  21          1HB       ALA  21  53.451  36.790  -0.197
  171   2HB   ALA  21          2HB       ALA  21  53.820  37.605  -1.735
  172   3HB   ALA  21          3HB       ALA  21  53.704  35.832  -1.672
  173    H    ALA  22           H        ALA  22  50.858  36.734   0.775
  174    HA   ALA  22           HA       ALA  22  50.198  33.870   0.659
  175   1HB   ALA  22          1HB       ALA  22  51.409  34.755   2.610
  176   2HB   ALA  22          2HB       ALA  22  49.841  34.062   3.063
  177   3HB   ALA  22          3HB       ALA  22  50.035  35.826   2.972
  178    H    GLN  23           H        GLN  23  48.627  35.920  -0.926
  179    HA   GLN  23           HA       GLN  23  46.032  36.053   0.385
  180   1HB   GLN  23          1HB       GLN  23  46.821  37.792  -1.161
  181   2HB   GLN  23          2HB       GLN  23  46.887  36.616  -2.488
  182   1HG   GLN  23          2HG       GLN  23  44.453  36.224  -2.261
  183   2HG   GLN  23          1HG       GLN  23  44.398  37.361  -0.899
  184   1HE2  GLN  23          1HE2      GLN  23  45.305  39.632  -1.416
  185   2HE2  GLN  23          2HE2      GLN  23  44.866  40.304  -2.971
  186    H    GLY  24           H        GLY  24  47.222  34.497  -2.642
  187   1HA   GLY  24          2HA       GLY  24  46.221  31.904  -1.989
  188   2HA   GLY  24          1HA       GLY  24  45.085  32.738  -3.075
  189    H    VAL  25           H        VAL  25  48.673  32.852  -2.841
  190    HA   VAL  25           HA       VAL  25  49.041  32.842  -5.650
  191    HB   VAL  25           HB       VAL  25  50.594  33.783  -4.009
  192   1HG1  VAL  25          1HG1      VAL  25  50.507  31.962  -2.301
  193   2HG1  VAL  25          2HG1      VAL  25  51.469  30.937  -3.395
  194   3HG1  VAL  25          3HG1      VAL  25  52.154  32.440  -2.754
  195   1HG2  VAL  25          1HG2      VAL  25  52.663  33.086  -5.133
  196   2HG2  VAL  25          2HG2      VAL  25  51.341  33.249  -6.307
  197   3HG2  VAL  25          3HG2      VAL  25  51.856  31.635  -5.766
  198    H    LEU  26           H        LEU  26  49.196  30.303  -3.177
  199    HA   LEU  26           HA       LEU  26  49.976  28.115  -4.802
  200   1HB   LEU  26          2HB       LEU  26  48.163  28.186  -2.359
  201   2HB   LEU  26          1HB       LEU  26  48.983  26.757  -3.004
  202    HG   LEU  26           HG       LEU  26  50.358  29.229  -1.855
  203   1HD1  LEU  26          1HD2      LEU  26  50.042  26.403  -0.770
  204   2HD1  LEU  26          2HD2      LEU  26  49.201  27.850  -0.170
  205   3HD1  LEU  26          3HD2      LEU  26  50.965  27.720  -0.011
  206   1HD2  LEU  26          1HD1      LEU  26  51.779  28.195  -3.574
  207   2HD2  LEU  26          2HD1      LEU  26  52.408  27.806  -1.967
  208   3HD2  LEU  26          3HD1      LEU  26  51.491  26.584  -2.873
  209    H    SER  27           H        SER  27  46.768  29.551  -4.097
  210    HA   SER  27           HA       SER  27  45.274  27.569  -5.562
  211   1HB   SER  27          2HB       SER  27  44.546  30.420  -4.774
  212   2HB   SER  27          1HB       SER  27  43.426  29.150  -5.307
  213    HG   SER  27           HG       SER  27  43.558  29.321  -3.027
  214    H    THR  28           H        THR  28  46.678  30.785  -6.366
  215    HA   THR  28           HA       THR  28  45.476  30.849  -8.969
  216    HB   THR  28           HB       THR  28  47.852  32.447  -7.980
  217    HG1  THR  28           HG1      THR  28  45.995  32.628  -6.653
  218   1HG2  THR  28          1HG2      THR  28  47.576  32.689 -10.401
  219   2HG2  THR  28          2HG2      THR  28  45.813  32.788 -10.234
  220   3HG2  THR  28          3HG2      THR  28  46.842  34.106  -9.643
  221    H    VAL  29           H        VAL  29  47.976  28.848  -7.828
  222    HA   VAL  29           HA       VAL  29  49.381  28.577 -10.353
  223    HB   VAL  29           HB       VAL  29  48.899  26.570  -8.109
  224   1HG1  VAL  29          1HG2      VAL  29  50.880  25.415  -9.070
  225   2HG1  VAL  29          2HG2      VAL  29  49.520  25.444 -10.206
  226   3HG1  VAL  29          3HG2      VAL  29  50.884  26.567 -10.423
  227   1HG2  VAL  29          1HG1      VAL  29  51.210  27.161  -7.425
  228   2HG2  VAL  29          2HG1      VAL  29  50.140  28.572  -7.337
  229   3HG2  VAL  29          3HG1      VAL  29  51.270  28.400  -8.699
  230    H    SER  30           H        SER  30  46.415  27.265  -8.882
  231    HA   SER  30           HA       SER  30  45.761  25.655 -11.215
  232   1HB   SER  30          1HB       SER  30  45.016  24.983  -8.966
  233   2HB   SER  30          2HB       SER  30  44.142  26.514  -8.766
  234    HG   SER  30           HG       SER  30  43.652  24.542 -10.756
  235    H    CYS  31           H        CYS  31  44.132  28.509  -9.714
  236    HA   CYS  31           HA       CYS  31  42.864  29.125 -12.270
  237   1HB   CYS  31          2HB       CYS  31  42.012  31.117 -11.091
  238   2HB   CYS  31          1HB       CYS  31  41.529  29.566 -10.457
  239    H    LYS  32           H        LYS  32  45.806  29.030 -12.526
  240    HA   LYS  32           HA       LYS  32  46.676  31.788 -12.651
  241   1HB   LYS  32          2HB       LYS  32  48.137  30.003 -11.941
  242   2HB   LYS  32          1HB       LYS  32  47.778  29.079 -13.405
  243   1HG   LYS  32          1HG       LYS  32  49.956  30.016 -13.636
  244   2HG   LYS  32          2HG       LYS  32  48.880  30.768 -14.806
  245   1HD   LYS  32          2HD       LYS  32  49.932  32.650 -14.079
  246   2HD   LYS  32          1HD       LYS  32  48.666  32.626 -12.848
  247   1HE   LYS  32          2HE       LYS  32  51.510  31.537 -12.591
  248   2HE   LYS  32          1HE       LYS  32  50.892  33.038 -11.879
  249   1HZ   LYS  32          1HZ       LYS  32  49.376  31.712 -10.583
  250   2HZ   LYS  32          2HZ       LYS  32  50.946  31.301 -10.286
  251   3HZ   LYS  32          3HZ       LYS  32  50.002  30.327 -11.221
  252    H    LEU  33           H        LEU  33  46.088  29.194 -15.046
  253    HA   LEU  33           HA       LEU  33  47.705  29.674 -16.881
  254   1HB   LEU  33          2HB       LEU  33  45.779  28.082 -16.924
  255   2HB   LEU  33          1HB       LEU  33  44.821  29.295 -17.773
  256    HG   LEU  33           HG       LEU  33  47.494  28.158 -18.738
  257   1HD1  LEU  33          1HD2      LEU  33  45.746  26.426 -18.590
  258   2HD1  LEU  33          2HD2      LEU  33  44.644  27.447 -19.542
  259   3HD1  LEU  33          3HD2      LEU  33  46.128  26.806 -20.281
  260   1HD2  LEU  33          1HD1      LEU  33  45.377  29.855 -20.137
  261   2HD2  LEU  33          2HD1      LEU  33  47.075  30.300 -19.831
  262   3HD2  LEU  33          3HD1      LEU  33  46.695  29.009 -20.972
  263    H    ALA  34           H        ALA  34  44.625  31.269 -17.699
  264    HA   ALA  34           HA       ALA  34  46.108  33.744 -18.490
  265   1HB   ALA  34          1HB       ALA  34  43.817  32.403 -19.990
  266   2HB   ALA  34          2HB       ALA  34  45.507  32.504 -20.533
  267   3HB   ALA  34          3HB       ALA  34  44.537  33.984 -20.381
  268    H    LYS  35           H        LYS  35  45.392  33.733 -16.043
  269    HA   LYS  35           HA       LYS  35  42.649  34.755 -15.737
  270   1HB   LYS  35          2HB       LYS  35  44.037  32.654 -14.069
  271   2HB   LYS  35          1HB       LYS  35  42.381  33.255 -13.855
  272   1HG   LYS  35          2HG       LYS  35  41.787  32.285 -16.090
  273   2HG   LYS  35          1HG       LYS  35  43.450  31.685 -16.241
  274   1HD   LYS  35          1HD       LYS  35  42.157  29.861 -15.490
  275   2HD   LYS  35          2HD       LYS  35  43.175  30.399 -14.129
  276   1HE   LYS  35          1HE       LYS  35  41.252  31.460 -13.069
  277   2HE   LYS  35          2HE       LYS  35  40.300  31.363 -14.563
  278   1HZ   LYS  35          1HZ       LYS  35  41.120  29.068 -12.943
  279   2HZ   LYS  35          2HZ       LYS  35  40.254  29.010 -14.344
  280   3HZ   LYS  35          3HZ       LYS  35  39.616  29.735 -13.008
  281    H    THR  36           H        THR  36  45.556  33.937 -13.834
  282    HA   THR  36           HA       THR  36  46.456  34.838 -12.000
  283    HB   THR  36           HB       THR  36  45.177  37.534 -12.561
  284    HG1  THR  36           HG1      THR  36  46.186  36.813 -14.460
  285   1HG2  THR  36          1HG2      THR  36  46.423  37.305 -10.429
  286   2HG2  THR  36          2HG2      THR  36  47.310  38.328 -11.572
  287   3HG2  THR  36          3HG2      THR  36  47.816  36.645 -11.316
  288    H    CYS  37           H        CYS  37  43.491  33.941 -12.500
  289    HA   CYS  37           HA       CYS  37  41.851  33.252 -11.179
  290   1HB   CYS  37          2HB       CYS  37  43.857  33.264  -9.469
  291   2HB   CYS  37          1HB       CYS  37  42.952  34.583  -8.721
  292    HXT  CYS  37           HO        OH  38  41.106  37.105 -10.106