*HEADER    TOXIN                                   14-MAR-03   1ORL              
*TITLE     1H NMR STRUCTURE DETERMINATION OF VISCOTOXIN C1                       
*COMPND    MOL_ID: 1;                                                            
*COMPND   2 MOLECULE: VISCOTOXIN C1;                                             
*COMPND   3 CHAIN: A                                                             
*SOURCE    MOL_ID: 1;                                                            
*SOURCE   2 ORGANISM_SCIENTIFIC: VISCUM ALBUM;                                   
*SOURCE   3 ORGANISM_COMMON: EUROPEAN MISTLETOE;                                 
*SOURCE   4 OTHER_DETAILS: VISCOTOXIN C1 HAS BEEN ISOLATED FROM                  
*SOURCE   5 EUROPEAN MISTLETOE LEAVES                                            
*KEYWDS    HELIX-TURN-HELIX, BETA-SHEET,   CONCENTRIC MOTIF OF                   
*KEYWDS   2 DISULPHIDE BRIDGES                                                   
*EXPDTA    NMR, 10 STRUCTURES                                                    
*AUTHOR    H.MOLINARI, S.ROMAGNOLI, F.FOGOLARI, M.CATALANO, K.URECH,             
*AUTHOR   2 M.GIANNATTASIO, L.RAGONA                                             
*REVDAT   1   29-MAR-17 1ORL    0                                                

!BIOSYM restraint 1
!
#NOE_distance
1:LY+N_1:HA       1:LY+N_1:HG*    1.800     3.780    10.000    10.000     2.000   100.000  0.00
1:LY+N_1:HA       1:SER_2:HN    1.800     2.800    10.000    10.000     2.000   100.000  0.00
1:LY+N_1:HG1       1:SER_2:HN    1.800     4.300    10.000    10.000     2.000   100.000  0.00
1:LY+N_1:HG2       1:SER_2:HN    1.800     4.300    10.000    10.000     2.000   100.000  0.00
1:LY+N_1:HG2       1:LY+N_1:HZ*    1.800     6.440    10.000    10.000     2.000   100.000  0.00
1:LY+N_1:HB*       1:SER_2:HN    1.800     4.500    10.000    10.000     2.000   100.000  0.00
1:LY+N_1:HE*       1:THR_39:HA    1.800     4.780    10.000    10.000     2.000   100.000  0.00
1:LY+N_1:HE*       1:CYS_40:HN    1.800     5.220    10.000    10.000     2.000   100.000  0.00
1:SER_2:HA       1:CYS_3:HN    1.800     2.660    10.000    10.000     2.000   100.000  0.00
1:SER_2:HA       1:ILE_34:HA    1.800     2.500    10.000    10.000     2.000   100.000  0.00
1:SER_2:HA       1:ILE_34:HG2*    1.800     5.570    10.000    10.000     2.000   100.000  0.00
1:SER_2:HA       1:ILE_34:HD1*    1.800     4.810    10.000    10.000     2.000   100.000  0.00
1:SER_2:HA       1:ILE_35:HN    1.800     4.100    10.000    10.000     2.000   100.000  0.00
1:SER_2:HB1       1:CYS_3:HN    1.800     4.140    10.000    10.000     2.000   100.000  0.00
1:SER_2:HB1       1:ILE_34:HD1*    1.800     5.250    10.000    10.000     2.000   100.000  0.00
1:SER_2:HB2       1:CYS_3:HN    1.800     4.140    10.000    10.000     2.000   100.000  0.00
1:SER_2:HB2       1:ILE_34:HD1*    1.800     5.250    10.000    10.000     2.000   100.000  0.00
1:SER_2:HB*       1:CYS_3:HN    1.800     3.830    10.000    10.000     2.000   100.000  0.00
1:SER_2:HB*       1:ILE_34:HD1*    1.800     5.070    10.000    10.000     2.000   100.000  0.00
1:CYS_3:HN       1:CYS_3:HB1    1.800     3.940    10.000    10.000     2.000   100.000  0.00
1:CYS_3:HN       1:CYS_3:HB2    1.800     3.940    10.000    10.000     2.000   100.000  0.00
1:CYS_3:HN       1:CYS_3:HB*    1.800     3.490    10.000    10.000     2.000   100.000  0.00
1:CYS_3:HN       1:CYS_32:HB1    1.800     4.560    10.000    10.000     2.000   100.000  0.00
1:CYS_3:HN       1:CYS_32:HB2    1.800     4.380    10.000    10.000     2.000   100.000  0.00
1:CYS_3:HN       1:CYS_32:HB*    1.800     4.150    10.000    10.000     2.000   100.000  0.00
1:CYS_3:HN       1:LYS_33:HN    1.800     3.300    10.000    10.000     2.000   100.000  0.00
1:CYS_3:HN       1:ILE_34:HA    1.800     3.900    10.000    10.000     2.000   100.000  0.00
1:CYS_3:HN       1:ILE_34:HD1*    1.800     5.850    10.000    10.000     2.000   100.000  0.00
1:CYS_3:HA       1:CYS_4:HN    1.800     2.780    10.000    10.000     2.000   100.000  0.00
1:CYS_3:CB       1:CYS_40:SG    1.800     3.100    10.000    10.000     2.000   100.000  0.00
1:CYS_3:HB1       1:CYS_40:HB1    1.800     5.810    10.000    10.000     2.000   100.000  0.00
1:CYS_3:HB1       1:CYS_40:HB2    1.800     5.810    10.000    10.000     2.000   100.000  0.00
1:CYS_3:HB2       1:CYS_40:HB1    1.800     5.810    10.000    10.000     2.000   100.000  0.00
1:CYS_3:HB2       1:CYS_40:HB2    1.800     5.810    10.000    10.000     2.000   100.000  0.00
1:CYS_3:HB*       1:CYS_4:HN    1.800     4.980    10.000    10.000     2.000   100.000  0.00
1:CYS_3:HB*       1:LYS_33:HB*    1.800     6.290    10.000    10.000     2.000   100.000  0.00
1:CYS_3:HB*       1:CYS_40:HB*    1.800     4.510    10.000    10.000     2.000   100.000  0.00
1:CYS_3:SG       1:CYS_40:CB    1.800     3.100    10.000    10.000     2.000   100.000  0.00
1:CYS_3:SG       1:CYS_40:SG    1.800     2.100    10.000    10.000     2.000   100.000  0.00
1:CYS_4:HN       1:CYS_4:HB1    1.800     3.300    10.000    10.000     2.000   100.000  0.00
1:CYS_4:HN       1:CYS_4:HB2    1.800     4.020    10.000    10.000     2.000   100.000  0.00
1:CYS_4:HN       1:TYR_44:HB1    1.800     4.340    10.000    10.000     2.000   100.000  0.00
1:CYS_4:HN       1:TYR_44:HB2    1.800     4.340    10.000    10.000     2.000   100.000  0.00
1:CYS_4:HN       1:TYR_44:HB*    1.800     4.130    10.000    10.000     2.000   100.000  0.00
1:CYS_4:HN       1:LYSC_46:HN    1.800     3.500    10.000    10.000     2.000   100.000  0.00
1:CYS_4:HA       1:PRO_5:HD1    1.800     3.500    10.000    10.000     2.000   100.000  0.00
1:CYS_4:HA       1:PRO_5:HD2    1.800     3.500    10.000    10.000     2.000   100.000  0.00
1:CYS_4:HA       1:PRO_5:HD*    1.800     3.330    10.000    10.000     2.000   100.000  0.00
1:CYS_4:HA       1:CYS_32:HA    1.800     2.220    10.000    10.000     2.000   100.000  0.00
1:CYS_4:HA       1:CYS_32:HB*    1.800     4.860    10.000    10.000     2.000   100.000  0.00
1:CYS_4:HA       1:LYS_33:HN    1.800     3.900    10.000    10.000     2.000   100.000  0.00
1:CYS_4:HA       1:TYR_44:HD*    1.800     5.800    10.000    10.000     2.000   100.000  0.00
1:CYS_4:HA       1:TYR_44:HE*    1.800     5.880    10.000    10.000     2.000   100.000  0.00
1:CYS_4:CB       1:CYS_32:SG    1.800     3.100    10.000    10.000     2.000   100.000  0.00
1:CYS_4:HB1       1:PRO_5:HD1    1.800     5.450    10.000    10.000     2.000   100.000  0.00
1:CYS_4:HB1       1:PRO_5:HD2    1.800     5.450    10.000    10.000     2.000   100.000  0.00
1:CYS_4:HB1       1:ASN_6:HN    1.800     3.580    10.000    10.000     2.000   100.000  0.00
1:CYS_4:HB1       1:ARG_10:HN    1.800     3.980    10.000    10.000     2.000   100.000  0.00
1:CYS_4:HB1       1:ARG_10:HG1    1.800     5.490    10.000    10.000     2.000   100.000  0.00
1:CYS_4:HB1       1:ARG_10:HG2    1.800     5.490    10.000    10.000     2.000   100.000  0.00
1:CYS_4:HB1       1:ARG_10:HE    1.800     4.140    10.000    10.000     2.000   100.000  0.00
1:CYS_4:HB1       1:LYSC_46:HB*    1.800     5.220    10.000    10.000     2.000   100.000  0.00
1:CYS_4:HB2       1:PRO_5:HD1    1.800     5.450    10.000    10.000     2.000   100.000  0.00
1:CYS_4:HB2       1:PRO_5:HD2    1.800     5.450    10.000    10.000     2.000   100.000  0.00
1:CYS_4:HB2       1:ASN_6:HN    1.800     3.580    10.000    10.000     2.000   100.000  0.00
1:CYS_4:HB2       1:ARG_10:HN    1.800     3.980    10.000    10.000     2.000   100.000  0.00
1:CYS_4:HB2       1:ARG_10:HG1    1.800     5.490    10.000    10.000     2.000   100.000  0.00
1:CYS_4:HB2       1:ARG_10:HG2    1.800     5.490    10.000    10.000     2.000   100.000  0.00
1:CYS_4:HB2       1:ARG_10:HE    1.800     4.140    10.000    10.000     2.000   100.000  0.00
1:CYS_4:HB2       1:LYSC_46:HB*    1.800     5.220    10.000    10.000     2.000   100.000  0.00
1:CYS_4:HB*       1:PRO_5:HD*    1.800     4.310    10.000    10.000     2.000   100.000  0.00
1:CYS_4:HB*       1:ASN_6:HN    1.800     3.330    10.000    10.000     2.000   100.000  0.00
1:CYS_4:HB*       1:ARG_10:HN    1.800     3.700    10.000    10.000     2.000   100.000  0.00
1:CYS_4:HB*       1:ARG_10:HG*    1.800     4.490    10.000    10.000     2.000   100.000  0.00
1:CYS_4:HB*       1:ARG_10:HE    1.800     3.750    10.000    10.000     2.000   100.000  0.00
1:CYS_4:HB*       1:LYSC_46:HB*    1.800     5.080    10.000    10.000     2.000   100.000  0.00
1:CYS_4:SG       1:CYS_32:CB    1.800     3.100    10.000    10.000     2.000   100.000  0.00
1:CYS_4:SG       1:CYS_32:SG    1.800     2.100    10.000    10.000     2.000   100.000  0.00
1:PRO_5:HA       1:TYR_44:HD*    1.800     6.040    10.000    10.000     2.000   100.000  0.00
1:PRO_5:HA       1:PRO_45:HD*    1.800     4.340    10.000    10.000     2.000   100.000  0.00
1:PRO_5:HA       1:LYSC_46:HN    1.800     4.620    10.000    10.000     2.000   100.000  0.00
1:PRO_5:HB1       1:ASN_6:HN    1.800     3.500    10.000    10.000     2.000   100.000  0.00
1:PRO_5:HB1       1:ASN_6:HD21    1.800     4.300    10.000    10.000     2.000   100.000  0.00
1:PRO_5:HB1       1:ASN_6:HD22    1.800     4.300    10.000    10.000     2.000   100.000  0.00
1:PRO_5:HB1       1:TYR_44:HD*    1.800     6.640    10.000    10.000     2.000   100.000  0.00
1:PRO_5:HB2       1:ASN_6:HN    1.800     4.300    10.000    10.000     2.000   100.000  0.00
1:PRO_5:HB2       1:ASN_6:HD21    1.800     4.300    10.000    10.000     2.000   100.000  0.00
1:PRO_5:HB2       1:ASN_6:HD22    1.800     4.300    10.000    10.000     2.000   100.000  0.00
1:PRO_5:HB2       1:TYR_44:HD*    1.800     6.320    10.000    10.000     2.000   100.000  0.00
1:PRO_5:HB*       1:ASN_6:HD2*    1.800     3.930    10.000    10.000     2.000   100.000  0.00
1:PRO_5:HB*       1:TYR_44:HD*    1.800     6.000    10.000    10.000     2.000   100.000  0.00
1:PRO_5:HB*       1:TYR_44:HE*    1.800     7.070    10.000    10.000     2.000   100.000  0.00
1:PRO_5:HG*       1:TYR_44:HD*    1.800     7.560    10.000    10.000     2.000   100.000  0.00
1:PRO_5:HD1       1:ASN_6:HN    1.800     4.460    10.000    10.000     2.000   100.000  0.00
1:PRO_5:HD1       1:CYS_32:HA    1.800     3.230    10.000    10.000     2.000   100.000  0.00
1:PRO_5:HD1       1:TYR_44:HD*    1.800     6.000    10.000    10.000     2.000   100.000  0.00
1:PRO_5:HD1       1:TYR_44:HE*    1.800     5.840    10.000    10.000     2.000   100.000  0.00
1:PRO_5:HD2       1:ASN_6:HN    1.800     4.460    10.000    10.000     2.000   100.000  0.00
1:PRO_5:HD2       1:TYR_44:HD*    1.800     6.000    10.000    10.000     2.000   100.000  0.00
1:PRO_5:HD2       1:TYR_44:HE*    1.800     5.840    10.000    10.000     2.000   100.000  0.00
1:PRO_5:HD2       1:CYS_32:HA    1.800     3.230    10.000    10.000     2.000   100.000  0.00
1:PRO_5:HD*       1:ASN_6:HN    1.800     3.910    10.000    10.000     2.000   100.000  0.00
1:PRO_5:HD*       1:TYR_44:HB*    1.800     5.290    10.000    10.000     2.000   100.000  0.00
1:PRO_5:HD*       1:TYR_44:HD*    1.800     5.680    10.000    10.000     2.000   100.000  0.00
1:PRO_5:HD*       1:TYR_44:HE*    1.800     6.550    10.000    10.000     2.000   100.000  0.00
1:ASN_6:HN       1:THR_7:HN    1.800     4.340    10.000    10.000     2.000   100.000  0.00
1:ASN_6:HN       1:GLY_9:HN    1.800     4.140    10.000    10.000     2.000   100.000  0.00
1:ASN_6:HN       1:ARG_10:HN    1.800     4.490    10.000    10.000     2.000   100.000  0.00
1:ASN_6:HN       1:LYSC_46:HB*    1.800     4.940    10.000    10.000     2.000   100.000  0.00
1:ASN_6:HA       1:THR_7:HN    1.800     2.700    10.000    10.000     2.000   100.000  0.00
1:ASN_6:HA       1:THR_8:HN    1.800     4.340    10.000    10.000     2.000   100.000  0.00
1:ASN_6:HA       1:LYSC_46:HB*    1.800     4.340    10.000    10.000     2.000   100.000  0.00
1:ASN_6:HB*       1:THR_7:HN    1.800     3.940    10.000    10.000     2.000   100.000  0.00
1:ASN_6:HB*       1:THR_8:HN    1.800     4.660    10.000    10.000     2.000   100.000  0.00
1:THR_7:HN       1:THR_7:HB    1.800     2.940    10.000    10.000     2.000   100.000  0.00
1:THR_7:HN       1:THR_8:HN    1.800     3.140    10.000    10.000     2.000   100.000  0.00
1:THR_7:HN       1:GLY_9:HN    1.800     4.180    10.000    10.000     2.000   100.000  0.00
1:THR_7:HN       1:LYSC_46:HB*    1.800     4.940    10.000    10.000     2.000   100.000  0.00
1:THR_7:HA       1:THR_7:HB    1.800     3.020    10.000    10.000     2.000   100.000  0.00
1:THR_7:HA       1:ARG_10:HN    1.800     3.380    10.000    10.000     2.000   100.000  0.00
1:THR_7:HA       1:ARG_10:HB*    1.800     4.420    10.000    10.000     2.000   100.000  0.00
1:THR_7:HA       1:ARG_10:HG*    1.800     4.500    10.000    10.000     2.000   100.000  0.00
1:THR_7:HB       1:THR_8:HN    1.800     2.940    10.000    10.000     2.000   100.000  0.00
1:THR_8:HN       1:THR_8:HA    1.800     2.860    10.000    10.000     2.000   100.000  0.00
1:THR_8:HN       1:THR_8:HB    1.800     2.780    10.000    10.000     2.000   100.000  0.00
1:THR_8:HN       1:GLY_9:HN    1.800     3.140    10.000    10.000     2.000   100.000  0.00
1:THR_8:HA       1:THR_8:HB    1.800     3.060    10.000    10.000     2.000   100.000  0.00
1:THR_8:HA       1:ASN_11:HN    1.800     3.500    10.000    10.000     2.000   100.000  0.00
1:THR_8:HA       1:ASN_11:HB1    1.800     3.660    10.000    10.000     2.000   100.000  0.00
1:THR_8:HA       1:ASN_11:HB2    1.800     3.660    10.000    10.000     2.000   100.000  0.00
1:THR_8:HA       1:ASN_11:HB*    1.800     3.470    10.000    10.000     2.000   100.000  0.00
1:THR_8:HB       1:GLY_9:HN    1.800     2.740    10.000    10.000     2.000   100.000  0.00
1:THR_8:HG2*       1:GLY_9:HN    1.800     5.730    10.000    10.000     2.000   100.000  0.00
1:THR_8:HG2*       1:ASN_11:HN    1.800     5.690    10.000    10.000     2.000   100.000  0.00
1:THR_8:HG2*       1:ASN_11:HD21    1.800     5.210    10.000    10.000     2.000   100.000  0.00
1:THR_8:HG2*       1:ASN_11:HD22    1.800     5.210    10.000    10.000     2.000   100.000  0.00
1:THR_8:HG2*       1:ASN_11:HD2*    1.800     4.980    10.000    10.000     2.000   100.000  0.00
1:THR_8:HG2*       1:ILE_12:HG1*    1.800     5.800    10.000    10.000     2.000   100.000  0.00
1:GLY_9:HN       1:GLY_9:HA1    1.800     2.900    10.000    10.000     2.000   100.000  0.00
1:GLY_9:HN       1:GLY_9:HA2    1.800     2.900    10.000    10.000     2.000   100.000  0.00
1:GLY_9:HN       1:ARG_10:HN    1.800     3.260    10.000    10.000     2.000   100.000  0.00
1:GLY_9:HA1       1:ARG_10:HN    1.800     3.540    10.000    10.000     2.000   100.000  0.00
1:GLY_9:HA1       1:ILE_12:HN    1.800     4.500    10.000    10.000     2.000   100.000  0.00
1:GLY_9:HA2       1:ARG_10:HN    1.800     3.540    10.000    10.000     2.000   100.000  0.00
1:GLY_9:HA2       1:ILE_12:HN    1.800     4.500    10.000    10.000     2.000   100.000  0.00
1:GLY_9:HA*       1:ILE_12:HN    1.800     4.080    10.000    10.000     2.000   100.000  0.00
1:ARG_10:HN       1:ARG_10:HG1    1.800     4.220    10.000    10.000     2.000   100.000  0.00
1:ARG_10:HN       1:ARG_10:HG2    1.800     4.220    10.000    10.000     2.000   100.000  0.00
1:ARG_10:HN       1:ARG_10:HG*    1.800     3.530    10.000    10.000     2.000   100.000  0.00
1:ARG_10:HN       1:ASN_11:HN    1.800     3.060    10.000    10.000     2.000   100.000  0.00
1:ARG_10:HA       1:ARG_10:HG1    1.800     4.020    10.000    10.000     2.000   100.000  0.00
1:ARG_10:HA       1:ARG_10:HG2    1.800     4.020    10.000    10.000     2.000   100.000  0.00
1:ARG_10:HA       1:ARG_10:HG*    1.800     3.460    10.000    10.000     2.000   100.000  0.00
1:ARG_10:HA       1:ARG_10:HD1    1.800     3.540    10.000    10.000     2.000   100.000  0.00
1:ARG_10:HA       1:ARG_10:HD2    1.800     3.540    10.000    10.000     2.000   100.000  0.00
1:ARG_10:HA       1:ASN_11:HN    1.800     3.510    10.000    10.000     2.000   100.000  0.00
1:ARG_10:HA       1:TYR_13:HN    1.800     3.700    10.000    10.000     2.000   100.000  0.00
1:ARG_10:HA       1:TYR_13:HB*    1.800     4.460    10.000    10.000     2.000   100.000  0.00
1:ARG_10:HA       1:ASN_14:HD21    1.800     4.500    10.000    10.000     2.000   100.000  0.00
1:ARG_10:HA       1:ASN_14:HD22    1.800     4.500    10.000    10.000     2.000   100.000  0.00
1:ARG_10:HA       1:ASN_14:HD2*    1.800     4.240    10.000    10.000     2.000   100.000  0.00
1:ARG_10:HB*       1:ARG_10:HE    1.800     5.340    10.000    10.000     2.000   100.000  0.00
1:ARG_10:HB*       1:ASN_11:HN    1.800     4.540    10.000    10.000     2.000   100.000  0.00
1:ARG_10:HG1       1:ARG_10:HE    1.800     3.060    10.000    10.000     2.000   100.000  0.00
1:ARG_10:HG2       1:ARG_10:HE    1.800     3.060    10.000    10.000     2.000   100.000  0.00
1:ARG_10:HG*       1:ASN_11:HN    1.800     4.830    10.000    10.000     2.000   100.000  0.00
1:ARG_10:HD1       1:ASN_14:HD21    1.800     4.180    10.000    10.000     2.000   100.000  0.00
1:ARG_10:HD1       1:ASN_14:HD22    1.800     4.180    10.000    10.000     2.000   100.000  0.00
1:ARG_10:HD2       1:ASN_14:HD21    1.800     4.180    10.000    10.000     2.000   100.000  0.00
1:ARG_10:HD2       1:ASN_14:HD22    1.800     4.180    10.000    10.000     2.000   100.000  0.00
1:ARG_10:HD*       1:ASN_14:HN    1.800     5.380    10.000    10.000     2.000   100.000  0.00
1:ARG_10:HD*       1:ASN_14:HD2*    1.800     3.430    10.000    10.000     2.000   100.000  0.00
1:ASN_11:HN       1:ASN_11:HB1    1.800     3.060    10.000    10.000     2.000   100.000  0.00
1:ASN_11:HN       1:ASN_11:HB2    1.800     3.060    10.000    10.000     2.000   100.000  0.00
1:ASN_11:HN       1:ASN_11:HB*    1.800     2.810    10.000    10.000     2.000   100.000  0.00
1:ASN_11:HN       1:ASN_14:HN    1.800     4.850    10.000    10.000     2.000   100.000  0.00
1:ASN_11:HA       1:ASN_14:HN    1.800     4.170    10.000    10.000     2.000   100.000  0.00
1:ASN_11:HA       1:ASN_14:HB1    1.800     4.180    10.000    10.000     2.000   100.000  0.00
1:ASN_11:HA       1:ASN_14:HB2    1.800     4.180    10.000    10.000     2.000   100.000  0.00
1:ASN_11:HA       1:ASN_14:HB*    1.800     3.630    10.000    10.000     2.000   100.000  0.00
1:ASN_11:HA       1:THR_15:HN    1.800     4.140    10.000    10.000     2.000   100.000  0.00
1:ASN_11:HB1       1:ASN_11:HD21    1.800     3.860    10.000    10.000     2.000   100.000  0.00
1:ASN_11:HB1       1:ASN_11:HD22    1.800     3.860    10.000    10.000     2.000   100.000  0.00
1:ASN_11:HB2       1:ASN_11:HD21    1.800     3.860    10.000    10.000     2.000   100.000  0.00
1:ASN_11:HB2       1:ASN_11:HD22    1.800     3.860    10.000    10.000     2.000   100.000  0.00
1:ASN_11:HB*       1:ASN_11:HD2*    1.800     3.280    10.000    10.000     2.000   100.000  0.00
1:ILE_12:HN       1:ILE_12:HB    1.800     2.900    10.000    10.000     2.000   100.000  0.00
1:ILE_12:HN       1:ILE_12:HG11    1.800     3.420    10.000    10.000     2.000   100.000  0.00
1:ILE_12:HN       1:ILE_12:HG12    1.800     3.420    10.000    10.000     2.000   100.000  0.00
1:ILE_12:HN       1:ILE_12:HG1*    1.800     3.050    10.000    10.000     2.000   100.000  0.00
1:ILE_12:HN       1:ILE_12:HD1*    1.800     5.290    10.000    10.000     2.000   100.000  0.00
1:ILE_12:HN       1:TYR_13:HN    1.800     3.060    10.000    10.000     2.000   100.000  0.00
1:ILE_12:HN       1:THR_15:HN    1.800     4.750    10.000    10.000     2.000   100.000  0.00
1:ILE_12:HA       1:ILE_12:HG11    1.800     3.380    10.000    10.000     2.000   100.000  0.00
1:ILE_12:HA       1:ILE_12:HG12    1.800     3.380    10.000    10.000     2.000   100.000  0.00
1:ILE_12:HA       1:TYR_13:HN    1.800     3.630    10.000    10.000     2.000   100.000  0.00
1:ILE_12:HA       1:THR_15:HN    1.800     3.820    10.000    10.000     2.000   100.000  0.00
1:ILE_12:HA       1:THR_15:HB    1.800     4.220    10.000    10.000     2.000   100.000  0.00
1:ILE_12:HB       1:ILE_12:HG1*    1.800     2.710    10.000    10.000     2.000   100.000  0.00
1:ILE_12:HB       1:TYR_13:HN    1.800     3.140    10.000    10.000     2.000   100.000  0.00
1:ILE_12:HB       1:SER_30:HA    1.800     3.660    10.000    10.000     2.000   100.000  0.00
1:ILE_12:HB       1:SER_30:HB1    1.800     3.860    10.000    10.000     2.000   100.000  0.00
1:ILE_12:HB       1:SER_30:HB2    1.800     3.860    10.000    10.000     2.000   100.000  0.00
1:ILE_12:HG2*       1:TYR_13:HN    1.800     5.290    10.000    10.000     2.000   100.000  0.00
1:ILE_12:HG2*       1:CYS_16:HN    1.800     5.730    10.000    10.000     2.000   100.000  0.00
1:ILE_12:HG2*       1:SER_30:HA    1.800     4.410    10.000    10.000     2.000   100.000  0.00
1:ILE_12:HG2*       1:SER_30:HB1    1.800     5.090    10.000    10.000     2.000   100.000  0.00
1:ILE_12:HG2*       1:SER_30:HB2    1.800     5.090    10.000    10.000     2.000   100.000  0.00
1:ILE_12:HG2*       1:SER_30:HB*    1.800     4.930    10.000    10.000     2.000   100.000  0.00
1:ILE_12:HG1*       1:TYR_13:HN    1.800     4.980    10.000    10.000     2.000   100.000  0.00
1:ILE_12:HD1*       1:SER_30:HA    1.800     5.010    10.000    10.000     2.000   100.000  0.00
1:TYR_13:HN       1:TYR_13:HA    1.800     2.700    10.000    10.000     2.000   100.000  0.00
1:TYR_13:HN       1:TYR_13:HE*    1.800     6.830    10.000    10.000     2.000   100.000  0.00
1:TYR_13:HN       1:ASN_14:HN    1.800     3.000    10.000    10.000     2.000   100.000  0.00
1:TYR_13:HN       1:THR_15:HN    1.800     4.220    10.000    10.000     2.000   100.000  0.00
1:TYR_13:HN       1:LEU_29:HD*    1.800     8.020    10.000    10.000     2.000   100.000  0.00
1:TYR_13:HN       1:SER_30:HB1    1.800     3.460    10.000    10.000     2.000   100.000  0.00
1:TYR_13:HN       1:SER_30:HB2    1.800     3.460    10.000    10.000     2.000   100.000  0.00
1:TYR_13:HN       1:SER_30:HB*    1.800     3.270    10.000    10.000     2.000   100.000  0.00
1:TYR_13:HA       1:TYR_13:HE*    1.800     5.910    10.000    10.000     2.000   100.000  0.00
1:TYR_13:HA       1:ASN_14:HN    1.800     3.590    10.000    10.000     2.000   100.000  0.00
1:TYR_13:HA       1:THR_15:HN    1.800     4.600    10.000    10.000     2.000   100.000  0.00
1:TYR_13:HA       1:CYS_16:HN    1.800     3.740    10.000    10.000     2.000   100.000  0.00
1:TYR_13:HA       1:CYS_16:HB1    1.800     4.180    10.000    10.000     2.000   100.000  0.00
1:TYR_13:HA       1:CYS_16:HB2    1.800     4.180    10.000    10.000     2.000   100.000  0.00
1:TYR_13:HA       1:CYS_16:HB*    1.800     3.950    10.000    10.000     2.000   100.000  0.00
1:TYR_13:HA       1:CYS_26:HB*    1.800     4.420    10.000    10.000     2.000   100.000  0.00
1:TYR_13:HA       1:SER_30:HN    1.800     4.720    10.000    10.000     2.000   100.000  0.00
1:TYR_13:HA       1:SER_30:HG    1.800     4.140    10.000    10.000     2.000   100.000  0.00
1:TYR_13:HD*       1:ASN_14:HN    1.800     5.920    10.000    10.000     2.000   100.000  0.00
1:TYR_13:HD*       1:ARG_17:HG1    1.800     6.320    10.000    10.000     2.000   100.000  0.00
1:TYR_13:HD*       1:ARG_17:HG2    1.800     6.320    10.000    10.000     2.000   100.000  0.00
1:TYR_13:HD*       1:ARG_17:HG*    1.800     6.160    10.000    10.000     2.000   100.000  0.00
1:TYR_13:HD*       1:ARG_23:HA    1.800     5.840    10.000    10.000     2.000   100.000  0.00
1:TYR_13:HD*       1:CYS_26:HB*    1.800     6.800    10.000    10.000     2.000   100.000  0.00
1:TYR_13:HD*       1:ALA_27:HN    1.800     5.840    10.000    10.000     2.000   100.000  0.00
1:TYR_13:HD*       1:ALA_27:HA    1.800     5.480    10.000    10.000     2.000   100.000  0.00
1:TYR_13:HD*       1:ALA_27:HB*    1.800     7.550    10.000    10.000     2.000   100.000  0.00
1:TYR_13:HD*       1:SER_30:HB*    1.800     7.240    10.000    10.000     2.000   100.000  0.00
1:TYR_13:HD*       1:SER_30:HG    1.800     5.640    10.000    10.000     2.000   100.000  0.00
1:TYR_13:HD*       1:ILE_34:HD1*    1.800     7.470    10.000    10.000     2.000   100.000  0.00
1:TYR_13:HE*       1:ASN_14:HN    1.800     6.190    10.000    10.000     2.000   100.000  0.00
1:TYR_13:HE*       1:CYS_26:HB*    1.800     7.270    10.000    10.000     2.000   100.000  0.00
1:TYR_13:HE*       1:ALA_27:HN    1.800     6.150    10.000    10.000     2.000   100.000  0.00
1:TYR_13:HE*       1:ALA_27:HA    1.800     6.110    10.000    10.000     2.000   100.000  0.00
1:TYR_13:HE*       1:ALA_27:HB*    1.800     8.300    10.000    10.000     2.000   100.000  0.00
1:TYR_13:HE*       1:SER_30:HG    1.800     6.230    10.000    10.000     2.000   100.000  0.00
1:TYR_13:HE*       1:ILE_34:HD1*    1.800     8.220    10.000    10.000     2.000   100.000  0.00
1:ASN_14:HN       1:ASN_14:HB1    1.800     3.460    10.000    10.000     2.000   100.000  0.00
1:ASN_14:HN       1:ASN_14:HB2    1.800     3.460    10.000    10.000     2.000   100.000  0.00
1:ASN_14:HN       1:ASN_14:HB*    1.800     3.030    10.000    10.000     2.000   100.000  0.00
1:ASN_14:HN       1:ASN_14:HD2*    1.800     5.450    10.000    10.000     2.000   100.000  0.00
1:ASN_14:HN       1:THR_15:HN    1.800     3.140    10.000    10.000     2.000   100.000  0.00
1:ASN_14:HN       1:CYS_16:HN    1.800     4.420    10.000    10.000     2.000   100.000  0.00
1:ASN_14:HA       1:ASN_14:HD21    1.800     4.500    10.000    10.000     2.000   100.000  0.00
1:ASN_14:HA       1:ASN_14:HD22    1.800     4.500    10.000    10.000     2.000   100.000  0.00
1:ASN_14:HA       1:ASN_14:HD2*    1.800     4.260    10.000    10.000     2.000   100.000  0.00
1:ASN_14:HA       1:THR_15:HN    1.800     3.620    10.000    10.000     2.000   100.000  0.00
1:ASN_14:HA       1:ARG_17:HB1    1.800     3.660    10.000    10.000     2.000   100.000  0.00
1:ASN_14:HA       1:ARG_17:HB2    1.800     4.050    10.000    10.000     2.000   100.000  0.00
1:ASN_14:HA       1:ARG_17:HB*    1.800     3.410    10.000    10.000     2.000   100.000  0.00
1:ASN_14:HB1       1:ASN_14:HD21    1.800     3.780    10.000    10.000     2.000   100.000  0.00
1:ASN_14:HB1       1:ASN_14:HD22    1.800     3.780    10.000    10.000     2.000   100.000  0.00
1:ASN_14:HB1       1:THR_15:HN    1.800     3.700    10.000    10.000     2.000   100.000  0.00
1:ASN_14:HB2       1:ASN_14:HD21    1.800     3.780    10.000    10.000     2.000   100.000  0.00
1:ASN_14:HB2       1:ASN_14:HD22    1.800     4.100    10.000    10.000     2.000   100.000  0.00
1:ASN_14:HB2       1:THR_15:HN    1.800     3.700    10.000    10.000     2.000   100.000  0.00
1:ASN_14:HB*       1:ASN_14:HD2*    1.800     3.260    10.000    10.000     2.000   100.000  0.00
1:ASN_14:HB*       1:THR_15:HN    1.800     3.410    10.000    10.000     2.000   100.000  0.00
1:THR_15:HN       1:THR_15:HB    1.800     2.780    10.000    10.000     2.000   100.000  0.00
1:THR_15:HN       1:CYS_16:HN    1.800     3.060    10.000    10.000     2.000   100.000  0.00
1:THR_15:HN       1:ARG_17:HN    1.800     4.200    10.000    10.000     2.000   100.000  0.00
1:THR_15:HA       1:CYS_16:HN    1.800     3.500    10.000    10.000     2.000   100.000  0.00
1:THR_15:HA       1:PHE_18:HN    1.800     3.460    10.000    10.000     2.000   100.000  0.00
1:THR_15:HA       1:PHE_18:HB*    1.800     4.540    10.000    10.000     2.000   100.000  0.00
1:THR_15:HA       1:PHE_18:HD*    1.800     6.500    10.000    10.000     2.000   100.000  0.00
1:THR_15:HB       1:CYS_16:HN    1.800     2.980    10.000    10.000     2.000   100.000  0.00
1:THR_15:HG2*       1:CYS_16:HN    1.800     5.650    10.000    10.000     2.000   100.000  0.00
1:CYS_16:HN       1:CYS_16:HB1    1.800     2.860    10.000    10.000     2.000   100.000  0.00
1:CYS_16:HN       1:CYS_16:HB2    1.800     2.860    10.000    10.000     2.000   100.000  0.00
1:CYS_16:HN       1:ARG_17:HN    1.800     3.140    10.000    10.000     2.000   100.000  0.00
1:CYS_16:HA       1:ARG_17:HN    1.800     3.620    10.000    10.000     2.000   100.000  0.00
1:CYS_16:HA       1:PHE_18:HN    1.800     4.400    10.000    10.000     2.000   100.000  0.00
1:CYS_16:HA       1:ALA_19:HN    1.800     3.900    10.000    10.000     2.000   100.000  0.00
1:CYS_16:HA       1:ALA_19:HB*    1.800     4.770    10.000    10.000     2.000   100.000  0.00
1:CYS_16:CB       1:CYS_26:SG    1.800     3.100    10.000    10.000     2.000   100.000  0.00
1:CYS_16:HB1       1:ARG_17:HN    1.800     3.870    10.000    10.000     2.000   100.000  0.00
1:CYS_16:HB1       1:CYS_26:HB1    1.800     5.490    10.000    10.000     2.000   100.000  0.00
1:CYS_16:HB1       1:CYS_26:HB2    1.800     5.490    10.000    10.000     2.000   100.000  0.00
1:CYS_16:HB2       1:ARG_17:HN    1.800     3.700    10.000    10.000     2.000   100.000  0.00
1:CYS_16:HB2       1:CYS_26:HB1    1.800     5.490    10.000    10.000     2.000   100.000  0.00
1:CYS_16:HB2       1:CYS_26:HB2    1.800     5.490    10.000    10.000     2.000   100.000  0.00
1:CYS_16:HB*       1:ARG_17:HN    1.800     3.390    10.000    10.000     2.000   100.000  0.00
1:CYS_16:HB*       1:CYS_26:HB*    1.800     4.290    10.000    10.000     2.000   100.000  0.00
1:CYS_16:SG       1:CYS_26:CB    1.800     3.100    10.000    10.000     2.000   100.000  0.00
1:CYS_16:SG       1:CYS_26:SG    1.800     2.100    10.000    10.000     2.000   100.000  0.00
1:ARG_17:HN       1:ARG_17:HB1    1.800     3.500    10.000    10.000     2.000   100.000  0.00
1:ARG_17:HN       1:ARG_17:HB2    1.800     3.500    10.000    10.000     2.000   100.000  0.00
1:ARG_17:HN       1:ARG_17:HB*    1.800     3.150    10.000    10.000     2.000   100.000  0.00
1:ARG_17:HN       1:ARG_17:HG1    1.800     3.620    10.000    10.000     2.000   100.000  0.00
1:ARG_17:HN       1:ARG_17:HG2    1.800     3.620    10.000    10.000     2.000   100.000  0.00
1:ARG_17:HN       1:ARG_17:HG*    1.800     3.220    10.000    10.000     2.000   100.000  0.00
1:ARG_17:HN       1:ARG_17:HD*    1.800     5.420    10.000    10.000     2.000   100.000  0.00
1:ARG_17:HN       1:PHE_18:HN    1.800     2.940    10.000    10.000     2.000   100.000  0.00
1:ARG_17:HN       1:ALA_19:HN    1.800     4.340    10.000    10.000     2.000   100.000  0.00
1:ARG_17:HN       1:CYS_26:HB*    1.800     5.140    10.000    10.000     2.000   100.000  0.00
1:ARG_17:HA       1:ARG_17:HG1    1.800     4.060    10.000    10.000     2.000   100.000  0.00
1:ARG_17:HA       1:ARG_17:HG2    1.800     4.060    10.000    10.000     2.000   100.000  0.00
1:ARG_17:HA       1:ARG_17:HG*    1.800     3.800    10.000    10.000     2.000   100.000  0.00
1:ARG_17:HA       1:ARG_17:HE    1.800     4.860    10.000    10.000     2.000   100.000  0.00
1:ARG_17:HA       1:ALA_19:HN    1.800     4.580    10.000    10.000     2.000   100.000  0.00
1:ARG_17:HA       1:GLY_20:HN    1.800     3.820    10.000    10.000     2.000   100.000  0.00
1:ARG_17:HB1       1:ARG_17:HE    1.800     4.140    10.000    10.000     2.000   100.000  0.00
1:ARG_17:HB1       1:PHE_18:HN    1.800     3.540    10.000    10.000     2.000   100.000  0.00
1:ARG_17:HB2       1:ARG_17:HE    1.800     4.140    10.000    10.000     2.000   100.000  0.00
1:ARG_17:HB2       1:PHE_18:HN    1.800     3.740    10.000    10.000     2.000   100.000  0.00
1:ARG_17:HB*       1:ARG_17:HE    1.800     3.770    10.000    10.000     2.000   100.000  0.00
1:ARG_17:HB*       1:PHE_18:HN    1.800     3.270    10.000    10.000     2.000   100.000  0.00
1:ARG_17:HG1       1:ARG_17:HE    1.800     4.140    10.000    10.000     2.000   100.000  0.00
1:ARG_17:HG2       1:ARG_17:HE    1.800     4.140    10.000    10.000     2.000   100.000  0.00
1:ARG_17:HG*       1:ARG_17:HE    1.800     3.680    10.000    10.000     2.000   100.000  0.00
1:ARG_17:HD1       1:ARG_23:HA    1.800     4.180    10.000    10.000     2.000   100.000  0.00
1:ARG_17:HD2       1:ARG_23:HA    1.800     4.180    10.000    10.000     2.000   100.000  0.00
1:ARG_17:HD*       1:ARG_17:HH1*    1.800     4.620    10.000    10.000     2.000   100.000  0.00
1:ARG_17:HD*       1:ARG_23:HA    1.800     3.560    10.000    10.000     2.000   100.000  0.00
1:ARG_17:HH11       1:ARG_23:HN    1.800     4.340    10.000    10.000     2.000   100.000  0.00
1:ARG_17:HH12       1:ARG_23:HN    1.800     4.340    10.000    10.000     2.000   100.000  0.00
1:ARG_17:HH1*       1:SER_22:HA    1.800     4.930    10.000    10.000     2.000   100.000  0.00
1:ARG_17:HH1*       1:ARG_23:HN    1.800     4.190    10.000    10.000     2.000   100.000  0.00
1:PHE_18:HN       1:PHE_18:HB*    1.800     3.700    10.000    10.000     2.000   100.000  0.00
1:PHE_18:HN       1:ALA_19:HN    1.800     2.900    10.000    10.000     2.000   100.000  0.00
1:PHE_18:HN       1:ALA_19:HB*    1.800     5.730    10.000    10.000     2.000   100.000  0.00
1:PHE_18:HN       1:GLY_20:HN    1.800     4.450    10.000    10.000     2.000   100.000  0.00
1:PHE_18:HB*       1:ALA_19:HN    1.800     4.340    10.000    10.000     2.000   100.000  0.00
1:ALA_19:HN       1:ALA_19:HA    1.800     2.940    10.000    10.000     2.000   100.000  0.00
1:ALA_19:HN       1:GLY_20:HN    1.800     3.060    10.000    10.000     2.000   100.000  0.00
1:ALA_19:HN       1:GLY_21:HN    1.800     4.300    10.000    10.000     2.000   100.000  0.00
1:ALA_19:HB*       1:GLY_21:HN    1.800     5.650    10.000    10.000     2.000   100.000  0.00
1:GLY_20:HN       1:GLY_20:HA1    1.800     2.940    10.000    10.000     2.000   100.000  0.00
1:GLY_20:HN       1:GLY_20:HA2    1.800     2.940    10.000    10.000     2.000   100.000  0.00
1:GLY_20:HN       1:GLY_21:HN    1.800     2.860    10.000    10.000     2.000   100.000  0.00
1:GLY_21:HN       1:GLY_21:HA1    1.800     2.740    10.000    10.000     2.000   100.000  0.00
1:GLY_21:HN       1:GLY_21:HA2    1.800     2.740    10.000    10.000     2.000   100.000  0.00
1:GLY_21:HA1       1:SER_22:HN    1.800     3.470    10.000    10.000     2.000   100.000  0.00
1:GLY_21:HA2       1:SER_22:HN    1.800     3.100    10.000    10.000     2.000   100.000  0.00
1:GLY_21:HA*       1:SER_22:HN    1.800     2.680    10.000    10.000     2.000   100.000  0.00
1:SER_22:HN       1:SER_22:HB1    1.800     3.460    10.000    10.000     2.000   100.000  0.00
1:SER_22:HN       1:SER_22:HB2    1.800     3.460    10.000    10.000     2.000   100.000  0.00
1:SER_22:HN       1:SER_22:HB*    1.800     3.160    10.000    10.000     2.000   100.000  0.00
1:SER_22:HN       1:ARG_25:HB1    1.800     3.740    10.000    10.000     2.000   100.000  0.00
1:SER_22:HN       1:ARG_25:HB2    1.800     3.740    10.000    10.000     2.000   100.000  0.00
1:SER_22:HN       1:ARG_25:HB*    1.800     3.470    10.000    10.000     2.000   100.000  0.00
1:SER_22:HA       1:SER_22:HB*    1.800     2.710    10.000    10.000     2.000   100.000  0.00
1:SER_22:HA       1:ARG_23:HN    1.800     2.580    10.000    10.000     2.000   100.000  0.00
1:SER_22:HA       1:GLU_24:HN    1.800     4.580    10.000    10.000     2.000   100.000  0.00
1:SER_22:HB1       1:ARG_23:HN    1.800     3.500    10.000    10.000     2.000   100.000  0.00
1:SER_22:HB1       1:GLU_24:HN    1.800     4.220    10.000    10.000     2.000   100.000  0.00
1:SER_22:HB2       1:ARG_23:HN    1.800     3.500    10.000    10.000     2.000   100.000  0.00
1:SER_22:HB2       1:GLU_24:HN    1.800     4.220    10.000    10.000     2.000   100.000  0.00
1:SER_22:HB*       1:ARG_23:HN    1.800     3.130    10.000    10.000     2.000   100.000  0.00
1:SER_22:HB*       1:GLU_24:HN    1.800     3.780    10.000    10.000     2.000   100.000  0.00
1:SER_22:HB*       1:ARG_25:HN    1.800     4.980    10.000    10.000     2.000   100.000  0.00
1:ARG_23:HN       1:ARG_23:HB1    1.800     2.980    10.000    10.000     2.000   100.000  0.00
1:ARG_23:HN       1:ARG_23:HB2    1.800     3.580    10.000    10.000     2.000   100.000  0.00
1:ARG_23:HN       1:ARG_23:HG1    1.800     3.420    10.000    10.000     2.000   100.000  0.00
1:ARG_23:HN       1:ARG_23:HG2    1.800     3.420    10.000    10.000     2.000   100.000  0.00
1:ARG_23:HN       1:ARG_23:HG*    1.800     3.090    10.000    10.000     2.000   100.000  0.00
1:ARG_23:HN       1:ARG_23:HD1    1.800     4.500    10.000    10.000     2.000   100.000  0.00
1:ARG_23:HN       1:ARG_23:HD2    1.800     4.500    10.000    10.000     2.000   100.000  0.00
1:ARG_23:HN       1:ARG_23:HD*    1.800     4.600    10.000    10.000     2.000   100.000  0.00
1:ARG_23:HN       1:GLU_24:HN    1.800     3.300    10.000    10.000     2.000   100.000  0.00
1:ARG_23:HA       1:ARG_23:HG1    1.800     3.700    10.000    10.000     2.000   100.000  0.00
1:ARG_23:HA       1:ARG_23:HG2    1.800     3.700    10.000    10.000     2.000   100.000  0.00
1:ARG_23:HA       1:ARG_23:HG*    1.800     3.470    10.000    10.000     2.000   100.000  0.00
1:ARG_23:HA       1:ARG_23:HE    1.800     4.940    10.000    10.000     2.000   100.000  0.00
1:ARG_23:HA       1:GLU_24:HN    1.800     3.650    10.000    10.000     2.000   100.000  0.00
1:ARG_23:HA       1:CYS_26:HN    1.800     3.870    10.000    10.000     2.000   100.000  0.00
1:ARG_23:HA       1:ALA_27:HN    1.800     4.420    10.000    10.000     2.000   100.000  0.00
1:ARG_23:HB1       1:ARG_23:HG1    1.800     3.050    10.000    10.000     2.000   100.000  0.00
1:ARG_23:HB1       1:ARG_23:HG2    1.800     3.050    10.000    10.000     2.000   100.000  0.00
1:ARG_23:HB1       1:ARG_23:HE    1.800     4.140    10.000    10.000     2.000   100.000  0.00
1:ARG_23:HB1       1:GLU_24:HN    1.800     3.180    10.000    10.000     2.000   100.000  0.00
1:ARG_23:HB2       1:ARG_23:HG1    1.800     2.620    10.000    10.000     2.000   100.000  0.00
1:ARG_23:HB2       1:ARG_23:HG2    1.800     3.060    10.000    10.000     2.000   100.000  0.00
1:ARG_23:HB2       1:ARG_23:HE    1.800     4.140    10.000    10.000     2.000   100.000  0.00
1:ARG_23:HB2       1:GLU_24:HN    1.800     3.180    10.000    10.000     2.000   100.000  0.00
1:ARG_23:HB*       1:ARG_23:HG*    1.800     2.500    10.000    10.000     2.000   100.000  0.00
1:ARG_23:HB*       1:ARG_23:HD*    1.800     3.670    10.000    10.000     2.000   100.000  0.00
1:ARG_23:HB*       1:ARG_23:HE    1.800     3.990    10.000    10.000     2.000   100.000  0.00
1:ARG_23:HB*       1:ILE_34:HD1*    1.800     6.040    10.000    10.000     2.000   100.000  0.00
1:ARG_23:HG1       1:ARG_23:HH1*    1.800     5.890    10.000    10.000     2.000   100.000  0.00
1:ARG_23:HG2       1:ARG_23:HH1*    1.800     5.890    10.000    10.000     2.000   100.000  0.00
1:ARG_23:HG*       1:ARG_23:HH1*    1.800     5.740    10.000    10.000     2.000   100.000  0.00
1:ARG_23:HD1       1:ILE_34:HG2*    1.800     6.090    10.000    10.000     2.000   100.000  0.00
1:ARG_23:HD2       1:ILE_34:HG2*    1.800     6.090    10.000    10.000     2.000   100.000  0.00
1:ARG_23:HD*       1:ILE_34:HG2*    1.800     5.900    10.000    10.000     2.000   100.000  0.00
1:ARG_23:HD*       1:ILE_34:HD1*    1.800     6.520    10.000    10.000     2.000   100.000  0.00
1:GLU_24:HN       1:GLU_24:HB1    1.800     3.060    10.000    10.000     2.000   100.000  0.00
1:GLU_24:HN       1:GLU_24:HB2    1.800     3.550    10.000    10.000     2.000   100.000  0.00
1:GLU_24:HN       1:GLU_24:HG1    1.800     4.020    10.000    10.000     2.000   100.000  0.00
1:GLU_24:HN       1:GLU_24:HG2    1.800     4.020    10.000    10.000     2.000   100.000  0.00
1:GLU_24:HN       1:GLU_24:HG*    1.800     4.200    10.000    10.000     2.000   100.000  0.00
1:GLU_24:HN       1:ARG_25:HN    1.800     3.020    10.000    10.000     2.000   100.000  0.00
1:GLU_24:HA       1:GLU_24:HG1    1.800     3.540    10.000    10.000     2.000   100.000  0.00
1:GLU_24:HA       1:GLU_24:HG2    1.800     3.540    10.000    10.000     2.000   100.000  0.00
1:GLU_24:HA       1:GLU_24:HG*    1.800     3.370    10.000    10.000     2.000   100.000  0.00
1:GLU_24:HA       1:ALA_27:HN    1.800     3.530    10.000    10.000     2.000   100.000  0.00
1:GLU_24:HA       1:ALA_27:HB*    1.800     4.130    10.000    10.000     2.000   100.000  0.00
1:GLU_24:HA       1:ILE_34:HD1*    1.800     6.010    10.000    10.000     2.000   100.000  0.00
1:GLU_24:HB1       1:ARG_25:HN    1.800     3.500    10.000    10.000     2.000   100.000  0.00
1:GLU_24:HB2       1:ARG_25:HN    1.800     3.500    10.000    10.000     2.000   100.000  0.00
1:GLU_24:HG*       1:ARG_25:HN    1.800     5.060    10.000    10.000     2.000   100.000  0.00
1:ARG_25:HN       1:ARG_25:HB1    1.800     2.900    10.000    10.000     2.000   100.000  0.00
1:ARG_25:HN       1:ARG_25:HB2    1.800     2.900    10.000    10.000     2.000   100.000  0.00
1:ARG_25:HN       1:ARG_25:HG1    1.800     4.580    10.000    10.000     2.000   100.000  0.00
1:ARG_25:HN       1:ARG_25:HG2    1.800     4.580    10.000    10.000     2.000   100.000  0.00
1:ARG_25:HN       1:ARG_25:HG*    1.800     4.260    10.000    10.000     2.000   100.000  0.00
1:ARG_25:HN       1:ARG_25:HD1    1.800     5.500    10.000    10.000     2.000   100.000  0.00
1:ARG_25:HN       1:ARG_25:HD2    1.800     5.500    10.000    10.000     2.000   100.000  0.00
1:ARG_25:HN       1:CYS_26:HN    1.800     2.900    10.000    10.000     2.000   100.000  0.00
1:ARG_25:HN       1:ALA_27:HN    1.800     4.380    10.000    10.000     2.000   100.000  0.00
1:ARG_25:HA       1:ARG_25:HG1    1.800     3.820    10.000    10.000     2.000   100.000  0.00
1:ARG_25:HA       1:ARG_25:HG2    1.800     3.820    10.000    10.000     2.000   100.000  0.00
1:ARG_25:HA       1:ARG_25:HG*    1.800     3.500    10.000    10.000     2.000   100.000  0.00
1:ARG_25:HA       1:ARG_25:HE    1.800     5.060    10.000    10.000     2.000   100.000  0.00
1:ARG_25:HA       1:ALA_27:HN    1.800     4.420    10.000    10.000     2.000   100.000  0.00
1:ARG_25:HA       1:LYS_28:HN    1.800     3.660    10.000    10.000     2.000   100.000  0.00
1:ARG_25:HA       1:LYS_28:HB1    1.800     3.980    10.000    10.000     2.000   100.000  0.00
1:ARG_25:HA       1:LYS_28:HB2    1.800     3.980    10.000    10.000     2.000   100.000  0.00
1:ARG_25:HA       1:LYS_28:HB*    1.800     3.800    10.000    10.000     2.000   100.000  0.00
1:ARG_25:HB1       1:ARG_25:HD1    1.800     4.220    10.000    10.000     2.000   100.000  0.00
1:ARG_25:HB1       1:ARG_25:HD2    1.800     4.220    10.000    10.000     2.000   100.000  0.00
1:ARG_25:HB1       1:ARG_25:HE    1.800     4.420    10.000    10.000     2.000   100.000  0.00
1:ARG_25:HB1       1:CYS_26:HN    1.800     3.180    10.000    10.000     2.000   100.000  0.00
1:ARG_25:HB2       1:ARG_25:HD1    1.800     4.220    10.000    10.000     2.000   100.000  0.00
1:ARG_25:HB2       1:ARG_25:HD2    1.800     4.220    10.000    10.000     2.000   100.000  0.00
1:ARG_25:HB2       1:ARG_25:HE    1.800     4.420    10.000    10.000     2.000   100.000  0.00
1:ARG_25:HB2       1:CYS_26:HN    1.800     3.180    10.000    10.000     2.000   100.000  0.00
1:ARG_25:HB*       1:ARG_25:HD*    1.800     3.680    10.000    10.000     2.000   100.000  0.00
1:ARG_25:HB*       1:ARG_25:HE    1.800     4.190    10.000    10.000     2.000   100.000  0.00
1:ARG_25:HB*       1:CYS_26:HN    1.800     2.990    10.000    10.000     2.000   100.000  0.00
1:CYS_26:HN       1:CYS_26:HB1    1.800     3.420    10.000    10.000     2.000   100.000  0.00
1:CYS_26:HN       1:CYS_26:HB2    1.800     3.420    10.000    10.000     2.000   100.000  0.00
1:CYS_26:HN       1:CYS_26:HB*    1.800     3.100    10.000    10.000     2.000   100.000  0.00
1:CYS_26:HN       1:ALA_27:HN    1.800     3.020    10.000    10.000     2.000   100.000  0.00
1:CYS_26:HN       1:LYS_28:HN    1.800     4.460    10.000    10.000     2.000   100.000  0.00
1:CYS_26:HA       1:LEU_29:HN    1.800     3.500    10.000    10.000     2.000   100.000  0.00
1:CYS_26:HA       1:LEU_29:HB1    1.800     4.280    10.000    10.000     2.000   100.000  0.00
1:CYS_26:HA       1:LEU_29:HB2    1.800     3.740    10.000    10.000     2.000   100.000  0.00
1:CYS_26:HA       1:LEU_29:HB*    1.800     3.380    10.000    10.000     2.000   100.000  0.00
1:CYS_26:HA       1:SER_30:HN    1.800     4.100    10.000    10.000     2.000   100.000  0.00
1:CYS_26:HB1       1:ALA_27:HN    1.800     3.660    10.000    10.000     2.000   100.000  0.00
1:CYS_26:HB2       1:ALA_27:HN    1.800     3.660    10.000    10.000     2.000   100.000  0.00
1:CYS_26:HB*       1:ALA_27:HN    1.800     3.490    10.000    10.000     2.000   100.000  0.00
1:ALA_27:HN       1:LYS_28:HN    1.800     3.100    10.000    10.000     2.000   100.000  0.00
1:ALA_27:HN       1:SER_30:HG    1.800     4.460    10.000    10.000     2.000   100.000  0.00
1:ALA_27:HA       1:SER_30:HN    1.800     3.660    10.000    10.000     2.000   100.000  0.00
1:ALA_27:HA       1:SER_30:HB*    1.800     4.420    10.000    10.000     2.000   100.000  0.00
1:ALA_27:HA       1:SER_30:HG    1.800     3.180    10.000    10.000     2.000   100.000  0.00
1:ALA_27:HA       1:GLY_31:HN    1.800     3.840    10.000    10.000     2.000   100.000  0.00
1:ALA_27:HA       1:CYS_32:HB1    1.800     4.020    10.000    10.000     2.000   100.000  0.00
1:ALA_27:HA       1:CYS_32:HB2    1.800     4.020    10.000    10.000     2.000   100.000  0.00
1:ALA_27:HA       1:CYS_32:HB*    1.800     3.760    10.000    10.000     2.000   100.000  0.00
1:ALA_27:HB*       1:ILE_34:HD1*    1.800     6.560    10.000    10.000     2.000   100.000  0.00
1:LYS_28:HN       1:LYS_28:HB1    1.800     2.900    10.000    10.000     2.000   100.000  0.00
1:LYS_28:HN       1:LYS_28:HB2    1.800     3.480    10.000    10.000     2.000   100.000  0.00
1:LYS_28:HN       1:LYS_28:HG1    1.800     3.960    10.000    10.000     2.000   100.000  0.00
1:LYS_28:HN       1:LYS_28:HG2    1.800     3.700    10.000    10.000     2.000   100.000  0.00
1:LYS_28:HN       1:LYS_28:HG*    1.800     4.100    10.000    10.000     2.000   100.000  0.00
1:LYS_28:HN       1:LYS_28:HD*    1.800     5.900    10.000    10.000     2.000   100.000  0.00
1:LYS_28:HN       1:LYS_28:HE*    1.800     6.380    10.000    10.000     2.000   100.000  0.00
1:LYS_28:HN       1:LEU_29:HN    1.800     3.020    10.000    10.000     2.000   100.000  0.00
1:LYS_28:HA       1:LYS_28:HG1    1.800     3.660    10.000    10.000     2.000   100.000  0.00
1:LYS_28:HA       1:LYS_28:HG2    1.800     3.660    10.000    10.000     2.000   100.000  0.00
1:LYS_28:HA       1:LYS_28:HG*    1.800     3.490    10.000    10.000     2.000   100.000  0.00
1:LYS_28:HA       1:LYS_28:HD*    1.800     5.100    10.000    10.000     2.000   100.000  0.00
1:LYS_28:HA       1:LEU_29:HN    1.800     3.640    10.000    10.000     2.000   100.000  0.00
1:LYS_28:HA       1:GLY_31:HN    1.800     4.020    10.000    10.000     2.000   100.000  0.00
1:LYS_28:HB1       1:LYS_28:HE*    1.800     6.380    10.000    10.000     2.000   100.000  0.00
1:LYS_28:HB1       1:LEU_29:HN    1.800     3.260    10.000    10.000     2.000   100.000  0.00
1:LYS_28:HB1       1:SER_30:HN    1.800     5.060    10.000    10.000     2.000   100.000  0.00
1:LYS_28:HB2       1:LYS_28:HE*    1.800     6.380    10.000    10.000     2.000   100.000  0.00
1:LYS_28:HB2       1:LEU_29:HN    1.800     3.260    10.000    10.000     2.000   100.000  0.00
1:LYS_28:HB2       1:SER_30:HN    1.800     4.770    10.000    10.000     2.000   100.000  0.00
1:LYS_28:HB*       1:SER_30:HN    1.800     5.300    10.000    10.000     2.000   100.000  0.00
1:LYS_28:HG*       1:LEU_29:HN    1.800     5.060    10.000    10.000     2.000   100.000  0.00
1:LYS_28:HD*       1:LEU_29:HN    1.800     4.800    10.000    10.000     2.000   100.000  0.00
1:LEU_29:HN       1:LEU_29:HB1    1.800     3.310    10.000    10.000     2.000   100.000  0.00
1:LEU_29:HN       1:LEU_29:HB2    1.800     2.860    10.000    10.000     2.000   100.000  0.00
1:LEU_29:HN       1:LEU_29:HB*    1.800     2.580    10.000    10.000     2.000   100.000  0.00
1:LEU_29:HN       1:LEU_29:HG    1.800     4.500    10.000    10.000     2.000   100.000  0.00
1:LEU_29:HN       1:LEU_29:HD1*    1.800     6.050    10.000    10.000     2.000   100.000  0.00
1:LEU_29:HN       1:LEU_29:HD2*    1.800     6.050    10.000    10.000     2.000   100.000  0.00
1:LEU_29:HN       1:LEU_29:HD*    1.800     5.640    10.000    10.000     2.000   100.000  0.00
1:LEU_29:HN       1:SER_30:HN    1.800     3.020    10.000    10.000     2.000   100.000  0.00
1:LEU_29:HA       1:LEU_29:HD1*    1.800     5.610    10.000    10.000     2.000   100.000  0.00
1:LEU_29:HA       1:LEU_29:HD2*    1.800     5.610    10.000    10.000     2.000   100.000  0.00
1:LEU_29:HB1       1:SER_30:HN    1.800     4.580    10.000    10.000     2.000   100.000  0.00
1:LEU_29:HB2       1:SER_30:HN    1.800     3.820    10.000    10.000     2.000   100.000  0.00
1:LEU_29:HB*       1:SER_30:HN    1.800     4.100    10.000    10.000     2.000   100.000  0.00
1:LEU_29:HG       1:SER_30:HN    1.800     3.940    10.000    10.000     2.000   100.000  0.00
1:LEU_29:HD1*       1:SER_30:HN    1.800     6.490    10.000    10.000     2.000   100.000  0.00
1:LEU_29:HD2*       1:SER_30:HN    1.800     6.490    10.000    10.000     2.000   100.000  0.00
1:LEU_29:HD*       1:SER_30:HN    1.800     6.030    10.000    10.000     2.000   100.000  0.00
1:LEU_29:HD*       1:SER_30:HB*    1.800     7.530    10.000    10.000     2.000   100.000  0.00
1:SER_30:HN       1:SER_30:HB1    1.800     3.780    10.000    10.000     2.000   100.000  0.00
1:SER_30:HN       1:SER_30:HB2    1.800     3.780    10.000    10.000     2.000   100.000  0.00
1:SER_30:HN       1:SER_30:HB*    1.800     3.480    10.000    10.000     2.000   100.000  0.00
1:SER_30:HN       1:SER_30:HG    1.800     2.820    10.000    10.000     2.000   100.000  0.00
1:SER_30:HN       1:GLY_31:HN    1.800     2.900    10.000    10.000     2.000   100.000  0.00
1:SER_30:HN       1:CYS_32:HN    1.800     3.680    10.000    10.000     2.000   100.000  0.00
1:SER_30:HA       1:GLY_31:HN    1.800     3.640    10.000    10.000     2.000   100.000  0.00
1:SER_30:HB1       1:GLY_31:HN    1.800     3.980    10.000    10.000     2.000   100.000  0.00
1:SER_30:HB2       1:GLY_31:HN    1.800     3.980    10.000    10.000     2.000   100.000  0.00
1:SER_30:HG       1:GLY_31:HN    1.800     3.180    10.000    10.000     2.000   100.000  0.00
1:CYS_32:HN       1:CYS_32:HB1    1.800     3.580    10.000    10.000     2.000   100.000  0.00
1:CYS_32:HN       1:CYS_32:HB2    1.800     3.580    10.000    10.000     2.000   100.000  0.00
1:CYS_32:HN       1:CYS_32:HB*    1.800     3.160    10.000    10.000     2.000   100.000  0.00
1:CYS_32:HA       1:LYS_33:HN    1.800     2.940    10.000    10.000     2.000   100.000  0.00
1:CYS_32:HA       1:TYR_44:HD*    1.800     5.240    10.000    10.000     2.000   100.000  0.00
1:CYS_32:HA       1:TYR_44:HE*    1.800     5.190    10.000    10.000     2.000   100.000  0.00
1:CYS_32:HB1       1:LYS_33:HN    1.800     3.540    10.000    10.000     2.000   100.000  0.00
1:CYS_32:HB2       1:LYS_33:HN    1.800     3.540    10.000    10.000     2.000   100.000  0.00
1:CYS_32:HB*       1:LYS_33:HN    1.800     3.170    10.000    10.000     2.000   100.000  0.00
1:LYS_33:HN       1:LYS_33:HG1    1.800     3.780    10.000    10.000     2.000   100.000  0.00
1:LYS_33:HN       1:LYS_33:HG2    1.800     4.220    10.000    10.000     2.000   100.000  0.00
1:LYS_33:HN       1:LYS_33:HD*    1.800     4.620    10.000    10.000     2.000   100.000  0.00
1:LYS_33:HN       1:LYS_33:HE1    1.800     4.020    10.000    10.000     2.000   100.000  0.00
1:LYS_33:HN       1:LYS_33:HE2    1.800     4.020    10.000    10.000     2.000   100.000  0.00
1:LYS_33:HN       1:LYS_33:HE*    1.800     3.800    10.000    10.000     2.000   100.000  0.00
1:LYS_33:HN       1:ILE_34:HN    1.800     4.380    10.000    10.000     2.000   100.000  0.00
1:LYS_33:HN       1:TYR_44:HD*    1.800     6.680    10.000    10.000     2.000   100.000  0.00
1:LYS_33:HA       1:ILE_34:HN    1.800     2.540    10.000    10.000     2.000   100.000  0.00
1:LYS_33:HB*       1:ILE_34:HN    1.800     5.100    10.000    10.000     2.000   100.000  0.00
1:LYS_33:HG*       1:ILE_34:HN    1.800     5.490    10.000    10.000     2.000   100.000  0.00
1:LYS_33:HG*       1:TYR_44:HD*    1.800     7.280    10.000    10.000     2.000   100.000  0.00
1:LYS_33:HG*       1:TYR_44:HE*    1.800     7.270    10.000    10.000     2.000   100.000  0.00
1:LYS_33:HD*       1:ILE_34:HN    1.800     5.030    10.000    10.000     2.000   100.000  0.00
1:ILE_34:HN       1:ILE_34:HA    1.800     3.000    10.000    10.000     2.000   100.000  0.00
1:ILE_34:HN       1:ILE_34:HB    1.800     2.940    10.000    10.000     2.000   100.000  0.00
1:ILE_34:HN       1:ILE_34:HG11    1.800     3.580    10.000    10.000     2.000   100.000  0.00
1:ILE_34:HN       1:ILE_34:HG12    1.800     3.580    10.000    10.000     2.000   100.000  0.00
1:ILE_34:HN       1:ILE_34:HG1*    1.800     3.250    10.000    10.000     2.000   100.000  0.00
1:ILE_34:HN       1:ILE_34:HD1*    1.800     5.610    10.000    10.000     2.000   100.000  0.00
1:ILE_34:HA       1:ILE_34:HD1*    1.800     4.450    10.000    10.000     2.000   100.000  0.00
1:ILE_34:HA       1:ILE_35:HN    1.800     2.580    10.000    10.000     2.000   100.000  0.00
1:ILE_34:HB       1:ILE_34:HG11    1.800     2.940    10.000    10.000     2.000   100.000  0.00
1:ILE_34:HB       1:ILE_34:HG12    1.800     2.940    10.000    10.000     2.000   100.000  0.00
1:ILE_34:HB       1:ILE_34:HG1*    1.800     2.580    10.000    10.000     2.000   100.000  0.00
1:ILE_34:HD1*       1:ILE_35:HN    1.800     5.650    10.000    10.000     2.000   100.000  0.00
1:ILE_35:HN       1:ILE_35:HA    1.800     2.780    10.000    10.000     2.000   100.000  0.00
1:ILE_35:HN       1:ILE_35:HB    1.800     3.870    10.000    10.000     2.000   100.000  0.00
1:ILE_35:HN       1:ILE_35:HG11    1.800     3.580    10.000    10.000     2.000   100.000  0.00
1:ILE_35:HN       1:ILE_35:HG12    1.800     3.580    10.000    10.000     2.000   100.000  0.00
1:ILE_35:HN       1:ILE_35:HG1*    1.800     3.290    10.000    10.000     2.000   100.000  0.00
1:ILE_35:HN       1:ILE_35:HD1*    1.800     4.730    10.000    10.000     2.000   100.000  0.00
1:ILE_35:HA       1:ILE_35:HB    1.800     2.980    10.000    10.000     2.000   100.000  0.00
1:ILE_35:HA       1:SER_36:HN    1.800     2.580    10.000    10.000     2.000   100.000  0.00
1:ILE_35:HA       1:ALA_37:HN    1.800     4.220    10.000    10.000     2.000   100.000  0.00
1:ILE_35:HB       1:SER_36:HN    1.800     2.940    10.000    10.000     2.000   100.000  0.00
1:ILE_35:HB       1:ALA_37:HN    1.800     3.300    10.000    10.000     2.000   100.000  0.00
1:ILE_35:HG2*       1:SER_36:HN    1.800     5.290    10.000    10.000     2.000   100.000  0.00
1:ILE_35:HG2*       1:ALA_37:HN    1.800     5.330    10.000    10.000     2.000   100.000  0.00
1:ILE_35:HG2*       1:ALA_37:HB*    1.800     6.640    10.000    10.000     2.000   100.000  0.00
1:ILE_35:HG2*       1:CYS_40:HA    1.800     6.000    10.000    10.000     2.000   100.000  0.00
1:ILE_35:HG2*       1:PRO_41:HD1    1.800     6.090    10.000    10.000     2.000   100.000  0.00
1:ILE_35:HG2*       1:PRO_41:HD2    1.800     6.090    10.000    10.000     2.000   100.000  0.00
1:ILE_35:HG2*       1:PRO_41:HD*    1.800     6.000    10.000    10.000     2.000   100.000  0.00
1:ILE_35:HG11       1:ALA_37:HN    1.800     4.620    10.000    10.000     2.000   100.000  0.00
1:ILE_35:HG12       1:ALA_37:HN    1.800     4.620    10.000    10.000     2.000   100.000  0.00
1:ILE_35:HG1*       1:SER_36:HN    1.800     5.300    10.000    10.000     2.000   100.000  0.00
1:ILE_35:HG1*       1:ALA_37:HN    1.800     4.020    10.000    10.000     2.000   100.000  0.00
1:ILE_35:HD1*       1:SER_36:HN    1.800     5.810    10.000    10.000     2.000   100.000  0.00
1:ILE_35:HD1*       1:ALA_37:HN    1.800     5.210    10.000    10.000     2.000   100.000  0.00
1:ILE_35:HD1*       1:ALA_37:HB*    1.800     6.200    10.000    10.000     2.000   100.000  0.00
1:ILE_35:HD1*       1:CYS_40:HA    1.800     4.730    10.000    10.000     2.000   100.000  0.00
1:ILE_35:HD1*       1:PRO_41:HD1    1.800     5.650    10.000    10.000     2.000   100.000  0.00
1:ILE_35:HD1*       1:PRO_41:HD2    1.800     5.650    10.000    10.000     2.000   100.000  0.00
1:ILE_35:HD1*       1:PRO_41:HD*    1.800     5.320    10.000    10.000     2.000   100.000  0.00
1:SER_36:HN       1:ALA_37:HN    1.800     3.020    10.000    10.000     2.000   100.000  0.00
1:SER_36:HA       1:ALA_37:HN    1.800     3.060    10.000    10.000     2.000   100.000  0.00
1:ALA_37:HN       1:SER_38:HN    1.800     2.900    10.000    10.000     2.000   100.000  0.00
1:ALA_37:HA       1:SER_38:HN    1.800     3.530    10.000    10.000     2.000   100.000  0.00
1:ALA_37:HA       1:THR_39:HN    1.800     4.400    10.000    10.000     2.000   100.000  0.00
1:ALA_37:HB*       1:SER_38:HN    1.800     4.370    10.000    10.000     2.000   100.000  0.00
1:ALA_37:HB*       1:THR_39:HN    1.800     4.410    10.000    10.000     2.000   100.000  0.00
1:SER_38:HN       1:SER_38:HB1    1.800     3.100    10.000    10.000     2.000   100.000  0.00
1:SER_38:HN       1:SER_38:HB2    1.800     3.100    10.000    10.000     2.000   100.000  0.00
1:SER_38:HN       1:THR_39:HN    1.800     2.820    10.000    10.000     2.000   100.000  0.00
1:SER_38:HA       1:SER_38:HB1    1.800     2.940    10.000    10.000     2.000   100.000  0.00
1:SER_38:HA       1:SER_38:HB2    1.800     2.940    10.000    10.000     2.000   100.000  0.00
1:SER_38:HA       1:SER_38:HB*    1.800     2.640    10.000    10.000     2.000   100.000  0.00
1:SER_38:HA       1:THR_39:HN    1.800     3.580    10.000    10.000     2.000   100.000  0.00
1:THR_39:HN       1:THR_39:HB    1.800     3.180    10.000    10.000     2.000   100.000  0.00
1:THR_39:HA       1:THR_39:HB    1.800     3.020    10.000    10.000     2.000   100.000  0.00
1:THR_39:HA       1:CYS_40:HN    1.800     2.460    10.000    10.000     2.000   100.000  0.00
1:THR_39:HB       1:CYS_40:HN    1.800     3.900    10.000    10.000     2.000   100.000  0.00
1:THR_39:HG2*       1:CYS_40:HN    1.800     4.930    10.000    10.000     2.000   100.000  0.00
1:CYS_40:HN       1:CYS_40:HB1    1.800     3.100    10.000    10.000     2.000   100.000  0.00
1:CYS_40:HN       1:CYS_40:HB2    1.800     3.640    10.000    10.000     2.000   100.000  0.00
1:CYS_40:HN       1:CYS_40:HB*    1.800     3.390    10.000    10.000     2.000   100.000  0.00
1:CYS_40:HN       1:PRO_41:HD*    1.800     4.780    10.000    10.000     2.000   100.000  0.00
1:CYS_40:HA       1:PRO_41:HD1    1.800     2.940    10.000    10.000     2.000   100.000  0.00
1:CYS_40:HA       1:PRO_41:HD2    1.800     2.940    10.000    10.000     2.000   100.000  0.00
1:CYS_40:HA       1:PRO_41:HD*    1.800     2.720    10.000    10.000     2.000   100.000  0.00
1:PRO_41:HA       1:SER_42:HN    1.800     2.720    10.000    10.000     2.000   100.000  0.00
1:PRO_41:HB*       1:SER_42:HN    1.800     4.470    10.000    10.000     2.000   100.000  0.00
1:PRO_41:HB*       1:ASP_43:HN    1.800     4.790    10.000    10.000     2.000   100.000  0.00
1:PRO_41:HG*       1:TYR_44:HD*    1.800     7.240    10.000    10.000     2.000   100.000  0.00
1:PRO_41:HD*       1:TYR_44:HD*    1.800     7.520    10.000    10.000     2.000   100.000  0.00
1:PRO_41:HD*       1:TYR_44:HE*    1.800     6.830    10.000    10.000     2.000   100.000  0.00
1:SER_42:HN       1:SER_42:HA    1.800     2.860    10.000    10.000     2.000   100.000  0.00
1:SER_42:HN       1:SER_42:HB*    1.800     3.820    10.000    10.000     2.000   100.000  0.00
1:SER_42:HA       1:ASP_43:HN    1.800     3.620    10.000    10.000     2.000   100.000  0.00
1:ASP_43:HN       1:TYR_44:HN    1.800     3.330    10.000    10.000     2.000   100.000  0.00
1:ASP_43:HA       1:TYR_44:HN    1.800     3.620    10.000    10.000     2.000   100.000  0.00
1:ASP_43:HB*       1:TYR_44:HD*    1.800     7.760    10.000    10.000     2.000   100.000  0.00
1:ASP_43:HB*       1:TYR_44:HE*    1.800     8.030    10.000    10.000     2.000   100.000  0.00
1:TYR_44:HN       1:TYR_44:HB1    1.800     4.060    10.000    10.000     2.000   100.000  0.00
1:TYR_44:HN       1:TYR_44:HB2    1.800     4.060    10.000    10.000     2.000   100.000  0.00
1:TYR_44:HN       1:TYR_44:HB*    1.800     3.610    10.000    10.000     2.000   100.000  0.00
1:TYR_44:HN       1:TYR_44:HE*    1.800     6.830    10.000    10.000     2.000   100.000  0.00
1:TYR_44:HN       1:PRO_45:HD*    1.800     4.620    10.000    10.000     2.000   100.000  0.00
1:PRO_45:HD*       1:LYSC_46:HN    1.800     4.580    10.000    10.000     2.000   100.000  0.00
1:PRO_45:HD*       1:LYSC_46:HB*    1.800     6.850    10.000    10.000     2.000   100.000  0.00
1:LYSC_46:HN       1:LYSC_46:HG*    1.800     5.140    10.000    10.000     2.000   100.000  0.00
1:LYSC_46:HN       1:LYSC_46:HD1    1.800     5.500    10.000    10.000     2.000   100.000  0.00
1:LYSC_46:HN       1:LYSC_46:HD2    1.800     5.500    10.000    10.000     2.000   100.000  0.00
1:LYSC_46:HN       1:LYSC_46:HD*    1.800     5.100    10.000    10.000     2.000   100.000  0.00
1:LYSC_46:HN       1:LYSC_46:HE1    1.800     5.500    10.000    10.000     2.000   100.000  0.00
1:LYSC_46:HN       1:LYSC_46:HE2    1.800     5.500    10.000    10.000     2.000   100.000  0.00
1:LYSC_46:HA       1:LYSC_46:HD1    1.800     3.660    10.000    10.000     2.000   100.000  0.00
1:LYSC_46:HA       1:LYSC_46:HD2    1.800     3.660    10.000    10.000     2.000   100.000  0.00
1:LYSC_46:HA       1:LYSC_46:HD*    1.800     3.280    10.000    10.000     2.000   100.000  0.00
1:LYSC_46:HA       1:LYSC_46:HE*    1.800     5.900    10.000    10.000     2.000   100.000  0.00
1:LYSC_46:HB*       1:LYSC_46:HE1    1.800     5.180    10.000    10.000     2.000   100.000  0.00
1:LYSC_46:HB*       1:LYSC_46:HE2    1.800     5.180    10.000    10.000     2.000   100.000  0.00
1:LYSC_46:HB*       1:LYSC_46:HE*    1.800     4.940    10.000    10.000     2.000   100.000  0.00
1:LYSC_46:HB*       1:LYSC_46:HZ*    1.800     7.320    10.000    10.000     2.000   100.000  0.00
1:LYSC_46:HG*       1:LYSC_46:HZ*    1.800     7.320    10.000    10.000     2.000   100.000  0.00
1:ILE_12:HN       1:THR_8:O    1.800     2.000    10.000    10.000     2.000   100.000  0.00
1:ILE_12:N       1:THR_8:O    1.800     3.000    10.000    10.000     2.000   100.000  0.00
1:TYR_13:HN       1:GLY_9:O    1.800     2.000    10.000    10.000     2.000   100.000  0.00
1:TYR_13:N       1:GLY_9:O    1.800     3.000    10.000    10.000     2.000   100.000  0.00
1:ASN_14:HN       1:ARG_10:O    1.800     2.000    10.000    10.000     2.000   100.000  0.00
1:ASN_14:N       1:ARG_10:O    1.800     3.000    10.000    10.000     2.000   100.000  0.00
1:THR_15:HN       1:ASN_11:O    1.800     2.000    10.000    10.000     2.000   100.000  0.00
1:THR_15:N       1:ASN_11:O    1.800     3.000    10.000    10.000     2.000   100.000  0.00
1:CYS_16:HN       1:ILE_12:O    1.800     2.000    10.000    10.000     2.000   100.000  0.00
1:CYS_16:N       1:ILE_12:O    1.800     3.000    10.000    10.000     2.000   100.000  0.00
1:ARG_17:HN       1:TYR_13:O    1.800     2.000    10.000    10.000     2.000   100.000  0.00
1:ARG_17:N       1:TYR_13:O    1.800     3.000    10.000    10.000     2.000   100.000  0.00
1:CYS_26:HN       1:SER_22:O    1.800     2.000    10.000    10.000     2.000   100.000  0.00
1:CYS_26:N       1:SER_22:O    1.800     3.000    10.000    10.000     2.000   100.000  0.00
1:ALA_27:HN       1:ARG_23:O    1.800     2.000    10.000    10.000     2.000   100.000  0.00
1:ALA_27:N       1:ARG_23:O    1.800     3.000    10.000    10.000     2.000   100.000  0.00
1:LYS_28:HN       1:GLU_24:O    1.800     2.000    10.000    10.000     2.000   100.000  0.00
1:LYS_28:N       1:GLU_24:O    1.800     3.000    10.000    10.000     2.000   100.000  0.00
1:LEU_29:HN       1:ARG_25:O    1.800     2.000    10.000    10.000     2.000   100.000  0.00
1:LEU_29:N       1:ARG_25:O    1.800     3.000    10.000    10.000     2.000   100.000  0.00
1:GLY_31:HN       1:ALA_27:O    1.800     2.000    10.000    10.000     2.000   100.000  0.00
1:GLY_31:N       1:ALA_27:O    1.800     3.000    10.000    10.000     2.000   100.000  0.00
1:LYS_33:HN       1:CYS_3:O    1.800     2.000    10.000    10.000     2.000   100.000  0.00
1:LYS_33:N       1:CYS_3:O    1.800     3.000    10.000    10.000     2.000   100.000  0.00
#NMR_dihedral
1:CYS_3:C       1:CYS_4:N       1:CYS_4:CA       1:CYS_4:C -163.000  -103.000    30.000    30.000   100.000
1:ASN_6:C       1:THR_7:N       1:THR_7:CA       1:THR_7:C  -85.000   -25.000    30.000    30.000   100.000
1:ARG_10:C       1:ASN_11:N       1:ASN_11:CA       1:ASN_11:C  -85.000   -25.000    30.000    30.000   100.000
1:ASN_11:C       1:ILE_12:N       1:ILE_12:CA       1:ILE_12:C  -85.000   -25.000    30.000    30.000   100.000
1:TYR_13:C       1:ASN_14:N       1:ASN_14:CA       1:ASN_14:C  -85.000   -25.000    30.000    30.000   100.000
1:ASN_14:C       1:THR_15:N       1:THR_15:CA       1:THR_15:C  -85.000   -25.000    30.000    30.000   100.000
1:CYS_16:C       1:ARG_17:N       1:ARG_17:CA       1:ARG_17:C  -85.000   -25.000    30.000    30.000   100.000
1:ARG_23:C       1:GLU_24:N       1:GLU_24:CA       1:GLU_24:C  -85.000   -25.000    30.000    30.000   100.000
1:GLU_24:C       1:ARG_25:N       1:ARG_25:CA       1:ARG_25:C  -85.000   -25.000    30.000    30.000   100.000
1:ARG_25:C       1:CYS_26:N       1:CYS_26:CA       1:CYS_26:C  -85.000   -25.000    30.000    30.000   100.000
1:CYS_26:C       1:ALA_27:N       1:ALA_27:CA       1:ALA_27:C  -85.000   -25.000    30.000    30.000   100.000
1:ALA_27:C       1:LYS_28:N       1:LYS_28:CA       1:LYS_28:C  -85.000   -25.000    30.000    30.000   100.000
1:CYS_32:C       1:LYS_33:N       1:LYS_33:CA       1:LYS_33:C -163.000  -103.000    30.000    30.000   100.000
1:LYS_33:C       1:ILE_34:N       1:ILE_34:CA       1:ILE_34:C -168.000  -108.000    30.000    30.000   100.000
1:ILE_34:C       1:ILE_35:N       1:ILE_35:CA       1:ILE_35:C -168.000  -108.000    30.000    30.000   100.000
1:SER_38:C       1:THR_39:N       1:THR_39:CA       1:THR_39:C -163.000  -103.000    30.000    30.000   100.000
1:PRO_41:C       1:SER_42:N       1:SER_42:CA       1:SER_42:C  -73.000   -23.000    30.000    30.000   100.000
1:PRO_45:C       1:LYSC_46:N       1:LYSC_46:CA       1:LYSC_46:C -163.000  -103.000    30.000    30.000   100.000

  Entry H atom name         Submitted Coord H atom name
  Start of MODEL    1
    1   1H    LYS   1          1H        LYS   1  -2.655   4.246  -9.525
    2   2H    LYS   1          2H        LYS   1  -3.487   3.559  -8.274
    3   3H    LYS   1          3H        LYS   1  -2.838   5.041  -8.084
    4    HA   LYS   1           HA       LYS   1  -1.361   2.564  -8.502
    5   1HB   LYS   1          1HB       LYS   1   0.672   3.785  -8.281
    6   2HB   LYS   1          2HB       LYS   1  -0.319   4.645  -9.468
    7   1HG   LYS   1          1HG       LYS   1  -1.055   6.173  -7.507
    8   2HG   LYS   1          2HG       LYS   1   0.233   5.392  -6.572
    9   1HD   LYS   1          1HD       LYS   1   1.858   6.086  -8.406
   10   2HD   LYS   1          2HD       LYS   1   0.524   7.015  -9.121
   11   1HE   LYS   1          1HE       LYS   1   0.296   8.111  -6.761
   12   2HE   LYS   1          2HE       LYS   1   1.885   7.397  -6.420
   13   1HZ   LYS   1          1HZ       LYS   1   2.688   8.620  -8.372
   14   2HZ   LYS   1          2HZ       LYS   1   1.194   9.319  -8.524
   15   3HZ   LYS   1          3HZ       LYS   1   2.111   9.605  -7.182
   16    H    SER   2           H        SER   2   0.051   2.024  -6.610
   17    HA   SER   2           HA       SER   2  -1.394   2.242  -4.070
   18   1HB   SER   2          1HB       SER   2   1.251   0.900  -4.764
   19   2HB   SER   2          2HB       SER   2   0.359   0.747  -3.237
   20    HG   SER   2           HG       SER   2  -0.205  -0.970  -4.496
   21    H    CYS   3           H        CYS   3  -0.631   3.342  -2.240
   22    HA   CYS   3           HA       CYS   3   1.757   5.091  -2.471
   23   1HB   CYS   3          1HB       CYS   3  -1.107   6.022  -2.078
   24   2HB   CYS   3          2HB       CYS   3   0.303   7.001  -1.641
   25    H    CYS   4           H        CYS   4   2.876   4.928  -0.670
   26    HA   CYS   4           HA       CYS   4   1.622   3.847   1.796
   27   1HB   CYS   4          1HB       CYS   4   4.341   3.437   0.520
   28   2HB   CYS   4          2HB       CYS   4   3.989   2.940   2.159
   29    HA   PRO   5           HA       PRO   5   3.293   7.358   4.038
   30   1HB   PRO   5          1HB       PRO   5   3.909   6.232   6.458
   31   2HB   PRO   5          2HB       PRO   5   2.246   6.555   5.908
   32   1HG   PRO   5          1HG       PRO   5   3.746   3.931   5.740
   33   2HG   PRO   5          2HG       PRO   5   2.094   4.220   6.359
   34   1HD   PRO   5          1HD       PRO   5   2.481   3.352   3.847
   35   2HD   PRO   5          2HD       PRO   5   1.253   4.605   4.171
   36    H    ASN   6           H        ASN   6   5.168   4.290   3.974
   37    HA   ASN   6           HA       ASN   6   7.701   5.706   3.639
   38   1HB   ASN   6          1HB       ASN   6   8.647   4.770   5.769
   39   2HB   ASN   6          2HB       ASN   6   7.435   6.024   5.999
   40   1HD2  ASN   6          2HD2      ASN   6   5.975   5.592   7.580
   41   2HD2  ASN   6          1HD2      ASN   6   5.411   4.000   8.034
   42    H    THR   7           H        THR   7   9.534   4.086   3.889
   43    HA   THR   7           HA       THR   7   9.287   2.172   1.871
   44    HB   THR   7           HB       THR   7  11.425   2.354   4.030
   45    HG1  THR   7           1HG      THR   7  12.374   3.835   2.573
   46   1HG2  THR   7          1HG2      THR   7  12.928   1.560   2.237
   47   2HG2  THR   7          2HG2      THR   7  11.646   0.375   2.529
   48   3HG2  THR   7          3HG2      THR   7  11.556   1.448   1.113
   49    H    THR   8           H        THR   8   9.036   1.814   5.443
   50    HA   THR   8           HA       THR   8   9.121  -1.038   5.445
   51    HB   THR   8           HB       THR   8   7.675   0.705   7.469
   52    HG1  THR   8           1HG      THR   8   9.722   0.756   8.484
   53   1HG2  THR   8          1HG2      THR   8   9.098  -1.995   7.640
   54   2HG2  THR   8          2HG2      THR   8   8.379  -1.118   9.006
   55   3HG2  THR   8          3HG2      THR   8   7.342  -1.737   7.709
   56    H    GLY   9           H        GLY   9   6.479   1.354   5.085
   57   1HA   GLY   9          1HA       GLY   9   4.253  -0.380   5.023
   58   2HA   GLY   9          2HA       GLY   9   4.400   1.161   4.161
   59    H    ARG  10           H        ARG  10   6.352   0.799   2.326
   60    HA   ARG  10           HA       ARG  10   5.204  -0.785   0.282
   61   1HB   ARG  10          1HB       ARG  10   8.010   0.332   0.654
   62   2HB   ARG  10          2HB       ARG  10   7.541  -0.557  -0.793
   63   1HG   ARG  10          1HG       ARG  10   6.055   1.912   0.174
   64   2HG   ARG  10          2HG       ARG  10   7.417   1.963  -0.953
   65   1HD   ARG  10          1HD       ARG  10   6.249   0.517  -2.540
   66   2HD   ARG  10          2HD       ARG  10   4.839   0.409  -1.471
   67    HE   ARG  10           HE       ARG  10   5.242   3.133  -1.840
   68   1HH1  ARG  10          1HH2      ARG  10   4.419   0.306  -3.833
   69   2HH1  ARG  10          2HH2      ARG  10   3.562   1.256  -5.023
   70   1HH2  ARG  10          1HH1      ARG  10   4.158   4.344  -3.417
   71   2HH2  ARG  10          2HH1      ARG  10   3.296   3.554  -4.711
   72    H    ASN  11           H        ASN  11   7.924  -1.574   2.493
   73    HA   ASN  11           HA       ASN  11   8.579  -4.068   1.382
   74   1HB   ASN  11          1HB       ASN  11  10.019  -3.000   2.973
   75   2HB   ASN  11          2HB       ASN  11   8.776  -3.003   4.221
   76   1HD2  ASN  11          2HD2      ASN  11   8.254  -4.939   5.340
   77   2HD2  ASN  11          1HD2      ASN  11   9.349  -6.303   5.314
   78    H    ILE  12           H        ILE  12   6.204  -3.360   4.039
   79    HA   ILE  12           HA       ILE  12   5.506  -6.111   4.395
   80    HB   ILE  12           HB       ILE  12   4.030  -3.567   5.128
   81   1HG1  ILE  12          1HG1      ILE  12   5.670  -5.467   6.866
   82   2HG1  ILE  12          2HG1      ILE  12   6.334  -3.997   6.164
   83   1HG2  ILE  12          1HG2      ILE  12   3.572  -6.441   6.072
   84   2HG2  ILE  12          2HG2      ILE  12   2.720  -5.012   6.684
   85   3HG2  ILE  12          3HG2      ILE  12   2.464  -5.535   5.028
   86   1HD1  ILE  12          1HD1      ILE  12   4.078  -4.126   8.195
   87   2HD1  ILE  12          2HD1      ILE  12   5.713  -3.497   8.413
   88   3HD1  ILE  12          3HD1      ILE  12   4.582  -2.649   7.340
   89    H    TYR  13           H        TYR  13   3.959  -3.457   2.530
   90    HA   TYR  13           HA       TYR  13   1.756  -4.802   1.490
   91   1HB   TYR  13          1HB       TYR  13   2.035  -2.427   1.221
   92   2HB   TYR  13          2HB       TYR  13   3.546  -2.637   0.349
   93    HD1  TYR  13           1HD      TYR  13   3.449  -2.205  -1.942
   94    HD2  TYR  13           2HD      TYR  13  -0.029  -3.805   0.033
   95    HE1  TYR  13           1HE      TYR  13   2.218  -2.170  -4.083
   96    HE2  TYR  13           2HE      TYR  13  -1.251  -3.809  -2.121
   97    HH   TYR  13           HH       TYR  13   0.290  -2.764  -5.186
   98    H    ASN  14           H        ASN  14   5.034  -4.534   0.039
   99    HA   ASN  14           HA       ASN  14   4.540  -6.174  -2.219
  100   1HB   ASN  14          1HB       ASN  14   7.027  -5.211  -0.789
  101   2HB   ASN  14          2HB       ASN  14   7.150  -6.436  -2.043
  102   1HD2  ASN  14          2HD2      ASN  14   6.021  -3.085  -1.472
  103   2HD2  ASN  14          1HD2      ASN  14   6.123  -2.618  -3.161
  104    H    THR  15           H        THR  15   5.835  -7.036   1.046
  105    HA   THR  15           HA       THR  15   6.416  -9.741   0.400
  106    HB   THR  15           HB       THR  15   5.654  -8.508   3.082
  107    HG1  THR  15           1HG      THR  15   7.466  -7.556   2.117
  108   1HG2  THR  15          1HG2      THR  15   6.961 -10.389   4.033
  109   2HG2  THR  15          2HG2      THR  15   5.531 -10.982   3.175
  110   3HG2  THR  15          3HG2      THR  15   7.134 -11.094   2.414
  111    H    CYS  16           H        CYS  16   3.476  -8.219   1.757
  112    HA   CYS  16           HA       CYS  16   1.916 -10.574   2.052
  113   1HB   CYS  16          1HB       CYS  16   1.418  -8.554   3.207
  114   2HB   CYS  16          2HB       CYS  16   1.242  -7.637   1.717
  115    H    ARG  17           H        ARG  17   2.237  -8.257  -0.677
  116    HA   ARG  17           HA       ARG  17   0.343  -9.489  -2.410
  117   1HB   ARG  17          1HB       ARG  17   2.831  -7.817  -2.897
  118   2HB   ARG  17          2HB       ARG  17   1.775  -8.327  -4.208
  119   1HG   ARG  17          1HG       ARG  17   0.462  -6.938  -1.874
  120   2HG   ARG  17          2HG       ARG  17   1.512  -5.973  -2.919
  121   1HD   ARG  17          1HD       ARG  17  -0.798  -5.871  -3.661
  122   2HD   ARG  17          2HD       ARG  17   0.269  -6.551  -4.883
  123    HE   ARG  17           HE       ARG  17  -1.450  -8.223  -3.055
  124   1HH1  ARG  17          1HH2      ARG  17  -0.326  -7.589  -6.398
  125   2HH1  ARG  17          2HH2      ARG  17  -1.256  -8.908  -7.052
  126   1HH2  ARG  17          1HH1      ARG  17  -2.624  -9.908  -3.968
  127   2HH2  ARG  17          2HH1      ARG  17  -2.569 -10.218  -5.686
  128    H    PHE  18           H        PHE  18   3.840 -10.059  -1.895
  129    HA   PHE  18           HA       PHE  18   4.203 -11.915  -4.001
  130   1HB   PHE  18          1HB       PHE  18   5.918 -10.629  -2.525
  131   2HB   PHE  18          2HB       PHE  18   5.783 -11.984  -1.416
  132    HD1  PHE  18           1HD      PHE  18   7.321 -10.669  -4.396
  133    HD2  PHE  18           2HD      PHE  18   6.316 -14.363  -2.400
  134    HE1  PHE  18           1HE      PHE  18   9.002 -11.867  -5.760
  135    HE2  PHE  18           2HE      PHE  18   7.976 -15.559  -3.800
  136    HZ   PHE  18           HZ       PHE  18   9.340 -14.311  -5.461
  137    H    ALA  19           H        ALA  19   3.324 -12.352  -0.547
  138    HA   ALA  19           HA       ALA  19   3.167 -15.192  -0.533
  139   1HB   ALA  19          1HB       ALA  19   3.216 -13.899   1.523
  140   2HB   ALA  19          2HB       ALA  19   1.675 -13.113   1.120
  141   3HB   ALA  19          3HB       ALA  19   1.721 -14.855   1.456
  142    H    GLY  20           H        GLY  20   0.707 -12.676  -1.235
  143   1HA   GLY  20          1HA       GLY  20  -0.569 -13.153  -3.293
  144   2HA   GLY  20          2HA       GLY  20  -0.977 -14.736  -2.630
  145    H    GLY  21           H        GLY  21  -0.914 -11.764  -0.633
  146   1HA   GLY  21          1HA       GLY  21  -3.768 -12.048  -0.053
  147   2HA   GLY  21          2HA       GLY  21  -2.648 -10.867   0.632
  148    H    SER  22           H        SER  22  -5.350 -10.393  -0.533
  149    HA   SER  22           HA       SER  22  -5.244  -9.336  -3.141
  150   1HB   SER  22          1HB       SER  22  -7.022  -8.361  -0.880
  151   2HB   SER  22          2HB       SER  22  -7.375  -8.364  -2.615
  152    HG   SER  22           HG       SER  22  -7.353 -10.646  -2.533
  153    H    ARG  23           H        ARG  23  -5.164  -7.130  -3.880
  154    HA   ARG  23           HA       ARG  23  -2.965  -5.719  -2.935
  155   1HB   ARG  23          1HB       ARG  23  -5.305  -4.743  -4.626
  156   2HB   ARG  23          2HB       ARG  23  -3.834  -3.824  -4.293
  157   1HG   ARG  23          1HG       ARG  23  -2.481  -5.720  -5.287
  158   2HG   ARG  23          2HG       ARG  23  -4.014  -6.437  -5.812
  159   1HD   ARG  23          1HD       ARG  23  -3.085  -5.146  -7.629
  160   2HD   ARG  23          2HD       ARG  23  -4.530  -4.308  -7.031
  161    HE   ARG  23           HE       ARG  23  -2.208  -3.310  -5.684
  162   1HH1  ARG  23          1HH2      ARG  23  -3.699  -3.264  -8.902
  163   2HH1  ARG  23          2HH2      ARG  23  -3.042  -1.707  -9.329
  164   1HH2  ARG  23          1HH1      ARG  23  -1.416  -1.208  -6.222
  165   2HH2  ARG  23          2HH1      ARG  23  -1.713  -0.560  -7.812
  166    H    GLU  24           H        GLU  24  -6.411  -4.721  -2.464
  167    HA   GLU  24           HA       GLU  24  -5.701  -2.525  -0.794
  168   1HB   GLU  24          1HB       GLU  24  -8.227  -3.873  -1.607
  169   2HB   GLU  24          2HB       GLU  24  -8.289  -3.080  -0.031
  170   1HG   GLU  24          1HG       GLU  24  -7.300  -1.699  -2.554
  171   2HG   GLU  24          2HG       GLU  24  -8.958  -1.606  -1.940
  172    HE2  GLU  24           HE       GLU  24  -8.107   0.386   0.869
  173    H    ARG  25           H        ARG  25  -6.422  -5.938   0.014
  174    HA   ARG  25           HA       ARG  25  -6.623  -5.557   2.806
  175   1HB   ARG  25          1HB       ARG  25  -7.252  -7.592   1.466
  176   2HB   ARG  25          2HB       ARG  25  -5.541  -8.022   1.362
  177   1HG   ARG  25          1HG       ARG  25  -5.375  -8.320   3.746
  178   2HG   ARG  25          2HG       ARG  25  -6.909  -7.479   4.028
  179   1HD   ARG  25          1HD       ARG  25  -7.250  -9.845   4.311
  180   2HD   ARG  25          2HD       ARG  25  -8.162  -9.244   2.927
  181    HE   ARG  25           HE       ARG  25  -5.478 -10.550   2.631
  182   1HH1  ARG  25          1HH2      ARG  25  -8.961 -10.631   1.805
  183   2HH1  ARG  25          2HH2      ARG  25  -8.755 -11.934   0.670
  184   1HH2  ARG  25          1HH1      ARG  25  -5.302 -12.320   1.236
  185   2HH2  ARG  25          2HH1      ARG  25  -6.682 -12.880   0.327
  186    H    CYS  26           H        CYS  26  -3.832  -6.431   0.748
  187    HA   CYS  26           HA       CYS  26  -1.838  -6.414   2.770
  188   1HB   CYS  26          1HB       CYS  26  -1.688  -5.890  -0.231
  189   2HB   CYS  26          2HB       CYS  26  -0.285  -6.084   0.819
  190    H    ALA  27           H        ALA  27  -3.121  -3.786   0.700
  191    HA   ALA  27           HA       ALA  27  -1.215  -1.826   1.469
  192   1HB   ALA  27          1HB       ALA  27  -4.106  -1.398   0.611
  193   2HB   ALA  27          2HB       ALA  27  -2.787  -0.214   0.560
  194   3HB   ALA  27          3HB       ALA  27  -2.727  -1.641  -0.484
  195    H    LYS  28           H        LYS  28  -4.567  -2.424   2.732
  196    HA   LYS  28           HA       LYS  28  -4.573  -0.589   4.794
  197   1HB   LYS  28          1HB       LYS  28  -6.427  -1.989   3.843
  198   2HB   LYS  28          2HB       LYS  28  -5.823  -3.377   4.755
  199   1HG   LYS  28          1HG       LYS  28  -6.150  -2.175   6.862
  200   2HG   LYS  28          2HG       LYS  28  -6.636  -0.711   5.974
  201   1HD   LYS  28          1HD       LYS  28  -8.595  -1.871   5.058
  202   2HD   LYS  28          2HD       LYS  28  -8.101  -3.385   5.849
  203   1HE   LYS  28          1HE       LYS  28  -8.335  -2.299   8.073
  204   2HE   LYS  28          2HE       LYS  28  -8.827  -0.786   7.285
  205   1HZ   LYS  28          1HZ       LYS  28 -10.263  -3.344   7.122
  206   2HZ   LYS  28          2HZ       LYS  28 -10.695  -2.049   8.046
  207   3HZ   LYS  28          3HZ       LYS  28 -10.724  -1.933   6.403
  208    H    LEU  29           H        LEU  29  -3.629  -4.027   4.882
  209    HA   LEU  29           HA       LEU  29  -2.916  -4.351   7.543
  210   1HB   LEU  29          1HB       LEU  29  -3.093  -6.157   5.881
  211   2HB   LEU  29          2HB       LEU  29  -1.692  -5.520   5.015
  212    HG   LEU  29           HG       LEU  29  -0.254  -6.030   7.011
  213   1HD1  LEU  29          1HD1      LEU  29  -1.971  -6.040   8.787
  214   2HD1  LEU  29          2HD1      LEU  29  -2.793  -7.410   8.005
  215   3HD1  LEU  29          3HD1      LEU  29  -1.170  -7.613   8.698
  216   1HD2  LEU  29          1HD2      LEU  29  -0.354  -7.538   5.107
  217   2HD2  LEU  29          2HD2      LEU  29  -0.275  -8.484   6.603
  218   3HD2  LEU  29          3HD2      LEU  29  -1.822  -8.311   5.744
  219    H    SER  30           H        SER  30  -0.906  -3.165   4.827
  220    HA   SER  30           HA       SER  30   1.480  -2.873   6.479
  221   1HB   SER  30          1HB       SER  30   2.467  -1.938   4.452
  222   2HB   SER  30          2HB       SER  30   1.659  -3.487   4.132
  223    HG   SER  30           HG       SER  30  -0.078  -2.347   3.273
  224    H    GLY  31           H        GLY  31  -1.196  -0.821   5.530
  225   1HA   GLY  31          1HA       GLY  31  -1.788   1.146   6.701
  226   2HA   GLY  31          2HA       GLY  31  -0.098   1.461   7.105
  227    H    CYS  32           H        CYS  32  -0.817   0.414   3.846
  228    HA   CYS  32           HA       CYS  32  -0.365   3.118   2.715
  229   1HB   CYS  32          1HB       CYS  32  -0.455   0.404   1.355
  230   2HB   CYS  32          2HB       CYS  32   0.127   1.905   0.666
  231    H    LYS  33           H        LYS  33  -1.761   3.678   0.816
  232    HA   LYS  33           HA       LYS  33  -4.426   2.323   0.759
  233   1HB   LYS  33          1HB       LYS  33  -5.397   4.367   0.026
  234   2HB   LYS  33          2HB       LYS  33  -4.465   4.687   1.495
  235   1HG   LYS  33          1HG       LYS  33  -2.597   5.595   0.052
  236   2HG   LYS  33          2HG       LYS  33  -3.569   5.264  -1.390
  237   1HD   LYS  33          1HD       LYS  33  -3.767   7.581  -0.883
  238   2HD   LYS  33          2HD       LYS  33  -5.335   6.812  -0.557
  239   1HE   LYS  33          1HE       LYS  33  -4.823   6.774   1.868
  240   2HE   LYS  33          2HE       LYS  33  -3.199   7.384   1.523
  241   1HZ   LYS  33          1HZ       LYS  33  -5.708   8.822   1.006
  242   2HZ   LYS  33          2HZ       LYS  33  -4.685   9.102   2.267
  243   3HZ   LYS  33          3HZ       LYS  33  -4.189   9.400   0.724
  244    H    ILE  34           H        ILE  34  -5.413   2.474  -1.441
  245    HA   ILE  34           HA       ILE  34  -3.558   2.825  -3.694
  246    HB   ILE  34           HB       ILE  34  -5.516   0.495  -3.569
  247   1HG1  ILE  34          1HG1      ILE  34  -2.512   0.524  -3.089
  248   2HG1  ILE  34          2HG1      ILE  34  -3.781   0.005  -1.971
  249   1HG2  ILE  34          1HG2      ILE  34  -4.960   1.500  -5.835
  250   2HG2  ILE  34          2HG2      ILE  34  -3.261   1.087  -5.538
  251   3HG2  ILE  34          3HG2      ILE  34  -4.496  -0.182  -5.673
  252   1HD1  ILE  34          1HD1      ILE  34  -4.395  -1.812  -3.505
  253   2HD1  ILE  34          2HD1      ILE  34  -3.004  -1.388  -4.544
  254   3HD1  ILE  34          3HD1      ILE  34  -2.726  -1.936  -2.891
  255    H    ILE  35           H        ILE  35  -4.518   4.023  -5.270
  256    HA   ILE  35           HA       ILE  35  -7.444   4.439  -5.269
  257    HB   ILE  35           HB       ILE  35  -7.210   6.862  -5.232
  258   1HG1  ILE  35          1HG1      ILE  35  -4.242   6.390  -4.671
  259   2HG1  ILE  35          2HG1      ILE  35  -4.951   7.141  -6.109
  260   1HG2  ILE  35          1HG2      ILE  35  -7.604   5.596  -3.100
  261   2HG2  ILE  35          2HG2      ILE  35  -5.865   5.737  -2.747
  262   3HG2  ILE  35          3HG2      ILE  35  -6.879   7.184  -2.871
  263   1HD1  ILE  35          1HD1      ILE  35  -4.890   8.259  -3.293
  264   2HD1  ILE  35          2HD1      ILE  35  -4.199   8.929  -4.779
  265   3HD1  ILE  35          3HD1      ILE  35  -5.958   8.905  -4.561
  266    H    SER  36           H        SER  36  -8.238   5.296  -7.248
  267    HA   SER  36           HA       SER  36  -6.463   4.878  -9.582
  268   1HB   SER  36          1HB       SER  36  -8.613   4.968 -10.829
  269   2HB   SER  36          2HB       SER  36  -8.605   3.733  -9.561
  270    HG   SER  36           HG       SER  36  -9.754   6.324  -9.384
  271    H    ALA  37           H        ALA  37  -6.539   7.368  -7.639
  272    HA   ALA  37           HA       ALA  37  -7.367   9.534  -9.403
  273   1HB   ALA  37          1HB       ALA  37  -7.608   9.608  -6.929
  274   2HB   ALA  37          2HB       ALA  37  -5.836   9.599  -6.786
  275   3HB   ALA  37          3HB       ALA  37  -6.655  10.959  -7.576
  276    H    SER  38           H        SER  38  -4.455   7.702  -8.838
  277    HA   SER  38           HA       SER  38  -2.454   7.642  -9.767
  278   1HB   SER  38          1HB       SER  38  -3.585   8.312 -11.883
  279   2HB   SER  38          2HB       SER  38  -3.199  10.005 -11.510
  280    HG   SER  38           HG       SER  38  -1.347   7.881 -11.831
  281    H    THR  39           H        THR  39  -3.554  10.841  -8.746
  282    HA   THR  39           HA       THR  39  -0.852  11.536  -7.720
  283    HB   THR  39           HB       THR  39  -3.388  13.193  -7.991
  284    HG1  THR  39           1HG      THR  39  -1.054  13.023  -9.594
  285   1HG2  THR  39          1HG2      THR  39  -1.869  15.113  -7.669
  286   2HG2  THR  39          2HG2      THR  39  -1.855  14.061  -6.244
  287   3HG2  THR  39          3HG2      THR  39  -0.504  14.010  -7.400
  288    H    CYS  40           H        CYS  40  -0.500  11.402  -5.588
  289    HA   CYS  40           HA       CYS  40  -2.718  10.677  -3.734
  290   1HB   CYS  40          1HB       CYS  40   0.203   9.881  -3.898
  291   2HB   CYS  40          2HB       CYS  40  -0.758   9.616  -2.441
  292    HA   PRO  41           HA       PRO  41  -1.822  14.433  -1.639
  293   1HB   PRO  41          1HB       PRO  41  -2.525  13.910   0.958
  294   2HB   PRO  41          2HB       PRO  41  -3.709  13.977  -0.378
  295   1HG   PRO  41          1HG       PRO  41  -2.378  11.509   0.776
  296   2HG   PRO  41          2HG       PRO  41  -4.126  11.786   0.509
  297   1HD   PRO  41          1HD       PRO  41  -2.616  10.430  -1.292
  298   2HD   PRO  41          2HD       PRO  41  -3.877  11.566  -1.847
  299    H    SER  42           H        SER  42  -0.409  15.483  -0.102
  300    HA   SER  42           HA       SER  42   2.210  14.288   0.125
  301   1HB   SER  42          1HB       SER  42   1.114  16.919   1.199
  302   2HB   SER  42          2HB       SER  42   2.826  16.457   1.082
  303    HG   SER  42           HG       SER  42   2.472  16.232  -1.200
  304    H    ASP  43           H        ASP  43   1.211  12.486   1.330
  305    HA   ASP  43           HA       ASP  43   1.618  12.630   4.239
  306   1HB   ASP  43          1HB       ASP  43  -1.046  11.911   2.931
  307   2HB   ASP  43          2HB       ASP  43  -0.625  11.489   4.598
  308    HD2  ASP  43           HD       ASP  43   0.067  13.321   5.924
  309    H    TYR  44           H        TYR  44   0.860  10.792   1.269
  310    HA   TYR  44           HA       TYR  44   2.304   8.416   2.357
  311   1HB   TYR  44          1HB       TYR  44   0.097   8.588   0.292
  312   2HB   TYR  44          2HB       TYR  44   1.033   7.157   0.689
  313    HD1  TYR  44           1HD      TYR  44  -1.195   9.725   2.339
  314    HD2  TYR  44           2HD      TYR  44   0.162   5.642   2.243
  315    HE1  TYR  44           1HE      TYR  44  -2.710   9.175   4.214
  316    HE2  TYR  44           2HE      TYR  44  -1.566   5.041   3.901
  317    HH   TYR  44           HH       TYR  44  -3.635   7.483   5.495
  318    HA   PRO  45           HA       PRO  45   4.594  10.641  -1.020
  319   1HB   PRO  45          1HB       PRO  45   7.065  10.898   0.097
  320   2HB   PRO  45          2HB       PRO  45   5.679  11.931   0.550
  321   1HG   PRO  45          1HG       PRO  45   6.639   9.429   1.975
  322   2HG   PRO  45          2HG       PRO  45   6.328  11.041   2.683
  323   1HD   PRO  45          1HD       PRO  45   4.444   9.101   2.762
  324   2HD   PRO  45          2HD       PRO  45   4.017  10.810   2.439
  325    H    LYS  46           H        LYS  46   5.006   7.440   0.273
  326    HA   LYS  46           HA       LYS  46   7.047   6.749  -1.816
  327   1HB   LYS  46          1HB       LYS  46   6.119   5.382   0.730
  328   2HB   LYS  46          2HB       LYS  46   6.891   4.496  -0.586
  329   1HG   LYS  46          1HG       LYS  46   8.540   5.043   1.035
  330   2HG   LYS  46          2HG       LYS  46   8.881   5.890  -0.481
  331   1HD   LYS  46          1HD       LYS  46   8.108   8.001   0.444
  332   2HD   LYS  46          2HD       LYS  46   7.413   7.181   1.854
  333   1HE   LYS  46          1HE       LYS  46   9.476   8.259   2.515
  334   2HE   LYS  46          2HE       LYS  46   9.723   6.506   2.562
  335   1HZ   LYS  46          1HZ       LYS  46  10.800   6.671   0.432
  336   2HZ   LYS  46          2HZ       LYS  46  10.566   8.303   0.396
  337   3HZ   LYS  46          3HZ       LYS  46  11.546   7.635   1.541
  Start of MODEL    2
    1   1H    LYS   1          1H        LYS   1  -2.795   6.997  -8.008
    2   2H    LYS   1          2H        LYS   1  -2.825   5.663  -7.061
    3   3H    LYS   1          3H        LYS   1  -2.176   7.072  -6.490
    4    HA   LYS   1           HA       LYS   1  -1.193   5.417  -8.688
    5   1HB   LYS   1          1HB       LYS   1   0.694   6.945  -8.936
    6   2HB   LYS   1          2HB       LYS   1  -0.842   7.752  -9.214
    7   1HG   LYS   1          1HG       LYS   1  -0.745   8.678  -6.882
    8   2HG   LYS   1          2HG       LYS   1   0.863   7.940  -6.702
    9   1HD   LYS   1          1HD       LYS   1   1.689   9.292  -8.613
   10   2HD   LYS   1          2HD       LYS   1   0.061   9.943  -8.858
   11   1HE   LYS   1          1HE       LYS   1   1.357  11.600  -7.691
   12   2HE   LYS   1          2HE       LYS   1   0.123  10.971  -6.587
   13   1HZ   LYS   1          1HZ       LYS   1   1.838   9.565  -5.632
   14   2HZ   LYS   1          2HZ       LYS   1   2.965  10.211  -6.646
   15   3HZ   LYS   1          3HZ       LYS   1   2.228  11.159  -5.518
   16    H    SER   2           H        SER   2  -1.708   4.738  -5.782
   17    HA   SER   2           HA       SER   2  -0.835   3.401  -4.248
   18   1HB   SER   2          1HB       SER   2   1.219   2.695  -6.367
   19   2HB   SER   2          2HB       SER   2   0.777   1.732  -4.948
   20    HG   SER   2           HG       SER   2  -1.422   1.823  -5.810
   21    H    CYS   3           H        CYS   3  -0.128   4.578  -2.527
   22    HA   CYS   3           HA       CYS   3   2.699   5.580  -2.534
   23   1HB   CYS   3          1HB       CYS   3   0.270   7.087  -1.527
   24   2HB   CYS   3          2HB       CYS   3   1.965   7.582  -1.452
   25    H    CYS   4           H        CYS   4   3.816   5.169  -0.707
   26    HA   CYS   4           HA       CYS   4   2.395   3.885   1.582
   27   1HB   CYS   4          1HB       CYS   4   5.095   3.372   0.329
   28   2HB   CYS   4          2HB       CYS   4   4.673   2.747   1.911
   29    HA   PRO   5           HA       PRO   5   4.144   7.007   4.174
   30   1HB   PRO   5          1HB       PRO   5   4.638   5.677   6.522
   31   2HB   PRO   5          2HB       PRO   5   3.007   6.080   5.941
   32   1HG   PRO   5          1HG       PRO   5   4.449   3.437   5.620
   33   2HG   PRO   5          2HG       PRO   5   2.781   3.723   6.195
   34   1HD   PRO   5          1HD       PRO   5   3.260   3.047   3.631
   35   2HD   PRO   5          2HD       PRO   5   2.026   4.252   4.022
   36    H    ASN   6           H        ASN   6   5.935   3.875   4.092
   37    HA   ASN   6           HA       ASN   6   8.509   5.192   3.806
   38   1HB   ASN   6          1HB       ASN   6   9.401   4.434   5.982
   39   2HB   ASN   6          2HB       ASN   6   8.106   5.604   6.184
   40   1HD2  ASN   6          2HD2      ASN   6   6.467   5.064   7.585
   41   2HD2  ASN   6          1HD2      ASN   6   6.117   3.442   8.137
   42    H    THR   7           H        THR   7  10.282   3.473   4.267
   43    HA   THR   7           HA       THR   7  10.082   1.544   2.279
   44    HB   THR   7           HB       THR   7  12.020   1.586   4.626
   45    HG1  THR   7           1HG      THR   7  13.197   2.988   3.254
   46   1HG2  THR   7          1HG2      THR   7  13.621   0.696   2.958
   47   2HG2  THR   7          2HG2      THR   7  12.254  -0.409   3.159
   48   3HG2  THR   7          3HG2      THR   7  12.337   0.651   1.733
   49    H    THR   8           H        THR   8   9.483   1.246   5.802
   50    HA   THR   8           HA       THR   8   9.377  -1.639   5.779
   51    HB   THR   8           HB       THR   8   8.132   0.211   7.841
   52    HG1  THR   8           1HG      THR   8  10.324   0.710   7.541
   53   1HG2  THR   8          1HG2      THR   8   9.214  -2.638   7.994
   54   2HG2  THR   8          2HG2      THR   8   8.555  -1.690   9.342
   55   3HG2  THR   8          3HG2      THR   8   7.497  -2.183   8.011
   56    H    GLY   9           H        GLY   9   7.022   1.031   5.418
   57   1HA   GLY   9          1HA       GLY   9   4.617  -0.457   5.247
   58   2HA   GLY   9          2HA       GLY   9   4.960   1.078   4.435
   59    H    ARG  10           H        ARG  10   6.895   0.579   2.631
   60    HA   ARG  10           HA       ARG  10   5.661  -0.811   0.505
   61   1HB   ARG  10          1HB       ARG  10   8.545   0.000   1.021
   62   2HB   ARG  10          2HB       ARG  10   8.064  -0.811  -0.471
   63   1HG   ARG  10          1HG       ARG  10   6.736   1.743   0.478
   64   2HG   ARG  10          2HG       ARG  10   8.194   1.744  -0.521
   65   1HD   ARG  10          1HD       ARG  10   7.084   0.542  -2.316
   66   2HD   ARG  10          2HD       ARG  10   5.618   0.349  -1.347
   67    HE   ARG  10           HE       ARG  10   6.498   3.124  -1.740
   68   1HH1  ARG  10          1HH2      ARG  10   4.502   0.519  -3.120
   69   2HH1  ARG  10          2HH2      ARG  10   3.417   1.632  -3.915
   70   1HH2  ARG  10          1HH1      ARG  10   5.055   4.530  -2.733
   71   2HH2  ARG  10          2HH1      ARG  10   3.759   3.924  -3.737
   72    H    ASN  11           H        ASN  11   8.238  -1.938   2.750
   73    HA   ASN  11           HA       ASN  11   8.631  -4.472   1.604
   74   1HB   ASN  11          1HB       ASN  11  10.161  -3.644   3.239
   75   2HB   ASN  11          2HB       ASN  11   8.893  -3.456   4.450
   76   1HD2  ASN  11          2HD2      ASN  11   8.390  -5.139   5.799
   77   2HD2  ASN  11          1HD2      ASN  11   9.115  -6.726   5.682
   78    H    ILE  12           H        ILE  12   6.335  -3.568   4.266
   79    HA   ILE  12           HA       ILE  12   5.222  -6.150   4.582
   80    HB   ILE  12           HB       ILE  12   4.089  -3.379   5.103
   81   1HG1  ILE  12          1HG1      ILE  12   5.069  -5.477   7.084
   82   2HG1  ILE  12          2HG1      ILE  12   6.170  -4.302   6.382
   83   1HG2  ILE  12          1HG2      ILE  12   2.182  -4.914   4.866
   84   2HG2  ILE  12          2HG2      ILE  12   2.985  -6.116   5.896
   85   3HG2  ILE  12          3HG2      ILE  12   2.421  -4.581   6.574
   86   1HD1  ILE  12          1HD1      ILE  12   4.799  -2.435   7.262
   87   2HD1  ILE  12          2HD1      ILE  12   3.735  -3.607   8.070
   88   3HD1  ILE  12          3HD1      ILE  12   5.438  -3.497   8.531
   89    H    TYR  13           H        TYR  13   4.230  -3.413   2.482
   90    HA   TYR  13           HA       TYR  13   1.901  -4.558   1.428
   91   1HB   TYR  13          1HB       TYR  13   2.577  -2.180   1.237
   92   2HB   TYR  13          2HB       TYR  13   3.841  -2.621   0.097
   93    HD1  TYR  13           1HD      TYR  13   3.315  -2.975  -2.246
   94    HD2  TYR  13           2HD      TYR  13   0.162  -2.620   0.666
   95    HE1  TYR  13           1HE      TYR  13   1.638  -2.913  -4.070
   96    HE2  TYR  13           2HE      TYR  13  -1.510  -2.590  -1.146
   97    HH   TYR  13           HH       TYR  13  -1.877  -2.692  -3.400
   98    H    ASN  14           H        ASN  14   5.228  -4.600   0.079
   99    HA   ASN  14           HA       ASN  14   4.664  -6.165  -2.217
  100   1HB   ASN  14          1HB       ASN  14   7.172  -5.484  -0.652
  101   2HB   ASN  14          2HB       ASN  14   7.227  -6.663  -1.958
  102   1HD2  ASN  14          2HD2      ASN  14   6.361  -3.253  -1.264
  103   2HD2  ASN  14          1HD2      ASN  14   6.613  -2.708  -2.913
  104    H    THR  15           H        THR  15   5.784  -7.149   1.075
  105    HA   THR  15           HA       THR  15   6.087  -9.905   0.478
  106    HB   THR  15           HB       THR  15   5.391  -8.520   3.105
  107    HG1  THR  15           1HG      THR  15   7.844  -9.330   1.933
  108   1HG2  THR  15          1HG2      THR  15   6.520 -11.303   2.559
  109   2HG2  THR  15          2HG2      THR  15   6.438 -10.521   4.152
  110   3HG2  THR  15          3HG2      THR  15   4.945 -10.937   3.300
  111    H    CYS  16           H        CYS  16   3.286  -8.072   1.754
  112    HA   CYS  16           HA       CYS  16   1.500 -10.248   2.034
  113   1HB   CYS  16          1HB       CYS  16   1.152  -8.149   3.107
  114   2HB   CYS  16          2HB       CYS  16   1.088  -7.272   1.582
  115    H    ARG  17           H        ARG  17   2.020  -7.998  -0.714
  116    HA   ARG  17           HA       ARG  17   0.056  -9.077  -2.443
  117   1HB   ARG  17          1HB       ARG  17   2.674  -7.607  -2.917
  118   2HB   ARG  17          2HB       ARG  17   1.595  -8.024  -4.243
  119   1HG   ARG  17          1HG       ARG  17   0.377  -6.558  -1.903
  120   2HG   ARG  17          2HG       ARG  17   1.493  -5.672  -2.946
  121   1HD   ARG  17          1HD       ARG  17  -0.834  -5.416  -3.670
  122   2HD   ARG  17          2HD       ARG  17   0.206  -6.125  -4.903
  123    HE   ARG  17           HE       ARG  17  -1.566  -7.776  -3.112
  124   1HH1  ARG  17          1HH2      ARG  17  -0.604  -6.951  -6.463
  125   2HH1  ARG  17          2HH2      ARG  17  -1.515  -8.271  -7.140
  126   1HH2  ARG  17          1HH1      ARG  17  -2.699  -9.471  -4.051
  127   2HH2  ARG  17          2HH1      ARG  17  -2.719  -9.695  -5.783
  128    H    PHE  18           H        PHE  18   3.519  -9.898  -2.040
  129    HA   PHE  18           HA       PHE  18   3.645 -11.791  -4.159
  130   1HB   PHE  18          1HB       PHE  18   5.637 -10.782  -3.238
  131   2HB   PHE  18          2HB       PHE  18   5.290 -11.424  -1.634
  132    HD1  PHE  18           1HD      PHE  18   5.819 -12.621  -5.175
  133    HD2  PHE  18           2HD      PHE  18   6.331 -13.438  -0.969
  134    HE1  PHE  18           1HE      PHE  18   7.002 -14.729  -5.724
  135    HE2  PHE  18           2HE      PHE  18   7.531 -15.532  -1.527
  136    HZ   PHE  18           HZ       PHE  18   7.862 -16.186  -3.902
  137    H    ALA  19           H        ALA  19   3.002 -12.161  -0.644
  138    HA   ALA  19           HA       ALA  19   2.739 -14.967  -0.551
  139   1HB   ALA  19          1HB       ALA  19   2.875 -13.539   1.444
  140   2HB   ALA  19          2HB       ALA  19   1.278 -12.849   1.083
  141   3HB   ALA  19          3HB       ALA  19   1.432 -14.570   1.490
  142    H    GLY  20           H        GLY  20   0.325 -12.418  -1.311
  143   1HA   GLY  20          1HA       GLY  20  -0.902 -13.264  -3.405
  144   2HA   GLY  20          2HA       GLY  20  -1.583 -14.486  -2.324
  145    H    GLY  21           H        GLY  21  -1.232 -11.691  -0.454
  146   1HA   GLY  21          1HA       GLY  21  -4.039 -11.414  -0.162
  147   2HA   GLY  21          2HA       GLY  21  -2.799 -10.328   0.480
  148    H    SER  22           H        SER  22  -5.497  -9.905  -0.974
  149    HA   SER  22           HA       SER  22  -5.060  -8.766  -3.514
  150   1HB   SER  22          1HB       SER  22  -7.168  -8.032  -1.446
  151   2HB   SER  22          2HB       SER  22  -7.256  -7.747  -3.194
  152    HG   SER  22           HG       SER  22  -8.354  -9.656  -2.576
  153    H    ARG  23           H        ARG  23  -5.091  -6.530  -4.161
  154    HA   ARG  23           HA       ARG  23  -3.012  -5.071  -3.068
  155   1HB   ARG  23          1HB       ARG  23  -5.333  -4.076  -4.782
  156   2HB   ARG  23          2HB       ARG  23  -3.868  -3.171  -4.401
  157   1HG   ARG  23          1HG       ARG  23  -2.609  -5.292  -5.365
  158   2HG   ARG  23          2HG       ARG  23  -4.175  -5.649  -6.110
  159   1HD   ARG  23          1HD       ARG  23  -2.872  -4.381  -7.688
  160   2HD   ARG  23          2HD       ARG  23  -4.141  -3.301  -7.062
  161    HE   ARG  23           HE       ARG  23  -1.633  -3.198  -5.563
  162   1HH1  ARG  23          1HH2      ARG  23  -3.331  -1.823  -8.374
  163   2HH1  ARG  23          2HH2      ARG  23  -2.416  -0.338  -8.335
  164   1HH2  ARG  23          1HH1      ARG  23  -0.448  -1.307  -5.555
  165   2HH2  ARG  23          2HH1      ARG  23  -0.767  -0.026  -6.703
  166    H    GLU  24           H        GLU  24  -6.507  -4.284  -2.648
  167    HA   GLU  24           HA       GLU  24  -5.986  -2.064  -0.933
  168   1HB   GLU  24          1HB       GLU  24  -8.499  -3.724  -1.367
  169   2HB   GLU  24          2HB       GLU  24  -8.420  -2.227  -0.423
  170   1HG   GLU  24          1HG       GLU  24  -7.518  -1.029  -2.434
  171   2HG   GLU  24          2HG       GLU  24  -7.750  -2.502  -3.391
  172    HE2  GLU  24           HE       GLU  24 -11.321  -2.274  -3.202
  173    H    ARG  25           H        ARG  25  -6.530  -5.513  -0.242
  174    HA   ARG  25           HA       ARG  25  -6.887  -5.273   2.571
  175   1HB   ARG  25          1HB       ARG  25  -7.233  -7.263   0.935
  176   2HB   ARG  25          2HB       ARG  25  -5.536  -7.644   1.217
  177   1HG   ARG  25          1HG       ARG  25  -7.696  -7.375   3.371
  178   2HG   ARG  25          2HG       ARG  25  -7.189  -8.889   2.609
  179   1HD   ARG  25          1HD       ARG  25  -4.848  -8.465   3.453
  180   2HD   ARG  25          2HD       ARG  25  -5.504  -7.100   4.393
  181    HE   ARG  25           HE       ARG  25  -7.091  -9.367   4.917
  182   1HH1  ARG  25          1HH2      ARG  25  -3.787  -8.229   5.533
  183   2HH1  ARG  25          2HH2      ARG  25  -3.600  -9.165   6.994
  184   1HH2  ARG  25          1HH1      ARG  25  -6.839 -10.583   6.842
  185   2HH2  ARG  25          2HH1      ARG  25  -5.348 -10.508   7.744
  186    H    CYS  26           H        CYS  26  -3.985  -5.945   0.573
  187    HA   CYS  26           HA       CYS  26  -2.053  -5.818   2.645
  188   1HB   CYS  26          1HB       CYS  26  -1.782  -5.244  -0.327
  189   2HB   CYS  26          2HB       CYS  26  -0.448  -5.477   0.799
  190    H    ALA  27           H        ALA  27  -3.502  -3.262   0.619
  191    HA   ALA  27           HA       ALA  27  -1.828  -1.099   1.265
  192   1HB   ALA  27          1HB       ALA  27  -4.859  -0.937   0.964
  193   2HB   ALA  27          2HB       ALA  27  -3.671   0.299   0.607
  194   3HB   ALA  27          3HB       ALA  27  -3.759  -1.157  -0.402
  195    H    LYS  28           H        LYS  28  -4.836  -2.214   2.906
  196    HA   LYS  28           HA       LYS  28  -4.777  -0.413   5.046
  197   1HB   LYS  28          1HB       LYS  28  -6.448  -2.370   4.110
  198   2HB   LYS  28          2HB       LYS  28  -5.837  -3.178   5.546
  199   1HG   LYS  28          1HG       LYS  28  -7.124  -0.403   5.430
  200   2HG   LYS  28          2HG       LYS  28  -7.935  -1.913   5.863
  201   1HD   LYS  28          1HD       LYS  28  -6.382  -2.186   7.803
  202   2HD   LYS  28          2HD       LYS  28  -5.636  -0.623   7.405
  203   1HE   LYS  28          1HE       LYS  28  -7.808   0.517   7.707
  204   2HE   LYS  28          2HE       LYS  28  -8.583  -1.034   8.079
  205   1HZ   LYS  28          1HZ       LYS  28  -6.426   0.205   9.641
  206   2HZ   LYS  28          2HZ       LYS  28  -8.024   0.192  10.041
  207   3HZ   LYS  28          3HZ       LYS  28  -7.178  -1.221   9.988
  208    H    LEU  29           H        LEU  29  -3.560  -3.785   4.860
  209    HA   LEU  29           HA       LEU  29  -2.563  -4.072   7.440
  210   1HB   LEU  29          1HB       LEU  29  -2.843  -5.889   5.786
  211   2HB   LEU  29          2HB       LEU  29  -1.529  -5.213   4.822
  212    HG   LEU  29           HG       LEU  29   0.076  -5.665   6.673
  213   1HD1  LEU  29          1HD1      LEU  29  -1.384  -5.646   8.631
  214   2HD1  LEU  29          2HD1      LEU  29  -2.347  -6.991   7.974
  215   3HD1  LEU  29          3HD1      LEU  29  -0.664  -7.253   8.476
  216   1HD2  LEU  29          1HD2      LEU  29  -1.507  -8.101   5.775
  217   2HD2  LEU  29          2HD2      LEU  29  -0.276  -7.251   4.816
  218   3HD2  LEU  29          3HD2      LEU  29   0.183  -8.066   6.321
  219    H    SER  30           H        SER  30  -0.957  -2.691   4.573
  220    HA   SER  30           HA       SER  30   1.637  -2.401   5.872
  221   1HB   SER  30          1HB       SER  30   2.257  -1.289   3.776
  222   2HB   SER  30          2HB       SER  30   1.472  -2.852   3.472
  223    HG   SER  30           HG       SER  30  -0.452  -1.703   3.040
  224    H    GLY  31           H        GLY  31  -1.108  -0.307   5.069
  225   1HA   GLY  31          1HA       GLY  31  -1.627   1.711   6.254
  226   2HA   GLY  31          2HA       GLY  31   0.092   1.995   6.554
  227    H    CYS  32           H        CYS  32  -0.082   0.782   3.397
  228    HA   CYS  32           HA       CYS  32   0.326   3.408   2.237
  229   1HB   CYS  32          1HB       CYS  32  -0.066   0.770   0.784
  230   2HB   CYS  32          2HB       CYS  32   0.716   2.201   0.174
  231    H    LYS  33           H        LYS  33  -0.930   4.316   0.523
  232    HA   LYS  33           HA       LYS  33  -3.850   3.701   0.572
  233   1HB   LYS  33          1HB       LYS  33  -2.431   6.139  -0.554
  234   2HB   LYS  33          2HB       LYS  33  -4.167   5.905  -0.340
  235   1HG   LYS  33          1HG       LYS  33  -2.052   6.260   1.813
  236   2HG   LYS  33          2HG       LYS  33  -3.227   7.439   1.245
  237   1HD   LYS  33          1HD       LYS  33  -4.188   6.807   3.200
  238   2HD   LYS  33          2HD       LYS  33  -5.063   5.778   2.059
  239   1HE   LYS  33          1HE       LYS  33  -4.081   3.840   2.896
  240   2HE   LYS  33          2HE       LYS  33  -2.551   4.666   3.274
  241   1HZ   LYS  33          1HZ       LYS  33  -3.548   5.635   5.153
  242   2HZ   LYS  33          2HZ       LYS  33  -4.999   4.898   4.839
  243   3HZ   LYS  33          3HZ       LYS  33  -3.670   3.994   5.213
  244    H    ILE  34           H        ILE  34  -4.405   2.377  -1.061
  245    HA   ILE  34           HA       ILE  34  -3.039   2.623  -3.714
  246    HB   ILE  34           HB       ILE  34  -4.598   0.288  -2.571
  247   1HG1  ILE  34          1HG1      ILE  34  -2.513   0.532  -1.320
  248   2HG1  ILE  34          2HG1      ILE  34  -2.524  -0.885  -2.361
  249   1HG2  ILE  34          1HG2      ILE  34  -2.999   0.647  -5.139
  250   2HG2  ILE  34          2HG2      ILE  34  -3.613  -0.904  -4.535
  251   3HG2  ILE  34          3HG2      ILE  34  -4.739   0.375  -4.997
  252   1HD1  ILE  34          1HD1      ILE  34  -1.027   1.719  -2.798
  253   2HD1  ILE  34          2HD1      ILE  34  -0.345   0.154  -2.361
  254   3HD1  ILE  34          3HD1      ILE  34  -1.052   0.373  -3.968
  255    H    ILE  35           H        ILE  35  -4.203   4.100  -4.796
  256    HA   ILE  35           HA       ILE  35  -7.011   3.420  -5.381
  257    HB   ILE  35           HB       ILE  35  -7.627   5.797  -5.426
  258   1HG1  ILE  35          1HG1      ILE  35  -4.948   6.325  -4.047
  259   2HG1  ILE  35          2HG1      ILE  35  -5.405   6.821  -5.686
  260   1HG2  ILE  35          1HG2      ILE  35  -8.062   4.289  -3.453
  261   2HG2  ILE  35          2HG2      ILE  35  -6.648   5.007  -2.653
  262   3HG2  ILE  35          3HG2      ILE  35  -8.054   6.007  -3.069
  263   1HD1  ILE  35          1HD1      ILE  35  -6.656   7.798  -3.095
  264   2HD1  ILE  35          2HD1      ILE  35  -5.668   8.715  -4.234
  265   3HD1  ILE  35          3HD1      ILE  35  -7.281   8.166  -4.723
  266    H    SER  36           H        SER  36  -7.564   3.719  -7.501
  267    HA   SER  36           HA       SER  36  -5.316   4.018  -9.392
  268   1HB   SER  36          1HB       SER  36  -6.925   2.992 -10.968
  269   2HB   SER  36          2HB       SER  36  -6.716   2.026  -9.499
  270    HG   SER  36           HG       SER  36  -8.845   3.820 -10.049
  271    H    ALA  37           H        ALA  37  -6.441   6.419  -8.006
  272    HA   ALA  37           HA       ALA  37  -7.869   7.906 -10.108
  273   1HB   ALA  37          1HB       ALA  37  -6.841   8.729  -7.365
  274   2HB   ALA  37          2HB       ALA  37  -7.928   9.670  -8.408
  275   3HB   ALA  37          3HB       ALA  37  -8.476   8.132  -7.725
  276    H    SER  38           H        SER  38  -4.792   6.933 -10.064
  277    HA   SER  38           HA       SER  38  -2.737   7.674 -10.469
  278   1HB   SER  38          1HB       SER  38  -3.861   8.062 -12.638
  279   2HB   SER  38          2HB       SER  38  -4.155   9.747 -12.168
  280    HG   SER  38           HG       SER  38  -1.856   9.932 -11.928
  281    H    THR  39           H        THR  39  -3.968   8.720  -8.069
  282    HA   THR  39           HA       THR  39  -2.325  11.092  -7.498
  283    HB   THR  39           HB       THR  39  -5.358  11.004  -7.092
  284    HG1  THR  39           1HG      THR  39  -4.951  11.320  -9.244
  285   1HG2  THR  39          1HG2      THR  39  -5.024  13.490  -6.686
  286   2HG2  THR  39          2HG2      THR  39  -4.415  12.445  -5.402
  287   3HG2  THR  39          3HG2      THR  39  -3.283  13.175  -6.570
  288    H    CYS  40           H        CYS  40  -2.419  11.502  -5.078
  289    HA   CYS  40           HA       CYS  40  -3.478   9.346  -3.397
  290   1HB   CYS  40          1HB       CYS  40  -0.567  10.241  -3.427
  291   2HB   CYS  40          2HB       CYS  40  -1.292   9.312  -2.118
  292    HA   PRO  41           HA       PRO  41  -3.930  13.082  -0.762
  293   1HB   PRO  41          1HB       PRO  41  -4.015  11.949   1.726
  294   2HB   PRO  41          2HB       PRO  41  -5.391  11.886   0.586
  295   1HG   PRO  41          1HG       PRO  41  -3.294   9.772   1.076
  296   2HG   PRO  41          2HG       PRO  41  -5.067   9.553   1.012
  297   1HD   PRO  41          1HD       PRO  41  -3.464   9.025  -1.123
  298   2HD   PRO  41          2HD       PRO  41  -5.081   9.751  -1.355
  299    H    SER  42           H        SER  42  -2.291  14.382   0.002
  300    HA   SER  42           HA       SER  42   0.401  13.411  -0.276
  301   1HB   SER  42          1HB       SER  42  -0.418  15.620  -1.074
  302   2HB   SER  42          2HB       SER  42  -0.546  16.160   0.612
  303    HG   SER  42           HG       SER  42   1.457  16.705  -0.384
  304    H    ASP  43           H        ASP  43   0.031  11.780   1.555
  305    HA   ASP  43           HA       ASP  43   1.348  12.811   4.006
  306   1HB   ASP  43          1HB       ASP  43  -1.195  11.121   4.004
  307   2HB   ASP  43          2HB       ASP  43  -0.271  11.595   5.438
  308    HD2  ASP  43           HD       ASP  43  -1.459  14.906   5.431
  309    H    TYR  44           H        TYR  44   1.933  11.025   1.529
  310    HA   TYR  44           HA       TYR  44   2.956   8.631   2.963
  311   1HB   TYR  44          1HB       TYR  44   1.076   8.601   0.582
  312   2HB   TYR  44          2HB       TYR  44   1.979   7.213   1.174
  313    HD1  TYR  44           1HD      TYR  44  -0.939   9.351   1.744
  314    HD2  TYR  44           2HD      TYR  44   1.603   6.388   3.521
  315    HE1  TYR  44           1HE      TYR  44  -2.606   8.997   3.544
  316    HE2  TYR  44           2HE      TYR  44  -0.078   5.974   5.287
  317    HH   TYR  44           HH       TYR  44  -3.098   7.882   5.504
  318    HA   PRO  45           HA       PRO  45   5.704  10.574  -0.157
  319   1HB   PRO  45          1HB       PRO  45   7.800  11.354   1.368
  320   2HB   PRO  45          2HB       PRO  45   6.201  12.120   1.529
  321   1HG   PRO  45          1HG       PRO  45   7.291   9.844   3.224
  322   2HG   PRO  45          2HG       PRO  45   6.668  11.420   3.795
  323   1HD   PRO  45          1HD       PRO  45   5.086   9.199   3.655
  324   2HD   PRO  45          2HD       PRO  45   4.455  10.828   3.283
  325    H    LYS  46           H        LYS  46   5.469   7.640   0.155
  326    HA   LYS  46           HA       LYS  46   8.096   6.962  -0.929
  327   1HB   LYS  46          1HB       LYS  46   7.445   6.261   1.748
  328   2HB   LYS  46          2HB       LYS  46   7.009   4.844   0.833
  329   1HG   LYS  46          1HG       LYS  46   9.282   4.534   1.489
  330   2HG   LYS  46          2HG       LYS  46   9.245   4.830  -0.243
  331   1HD   LYS  46          1HD       LYS  46  11.087   5.985   0.603
  332   2HD   LYS  46          2HD       LYS  46   9.940   7.241   0.202
  333   1HE   LYS  46          1HE       LYS  46  10.470   6.162   3.017
  334   2HE   LYS  46          2HE       LYS  46  11.199   7.605   2.292
  335   1HZ   LYS  46          1HZ       LYS  46   8.954   8.483   2.039
  336   2HZ   LYS  46          2HZ       LYS  46   8.395   7.281   3.026
  337   3HZ   LYS  46          3HZ       LYS  46   9.501   8.351   3.588
  Start of MODEL    3
    1   1H    LYS   1          1H        LYS   1  -3.297   3.294  -9.107
    2   2H    LYS   1          2H        LYS   1  -3.362   2.199  -7.870
    3   3H    LYS   1          3H        LYS   1  -3.763   3.773  -7.597
    4    HA   LYS   1           HA       LYS   1  -1.131   2.767  -8.318
    5   1HB   LYS   1          1HB       LYS   1  -1.604   4.962  -9.274
    6   2HB   LYS   1          2HB       LYS   1  -2.017   5.609  -7.676
    7   1HG   LYS   1          1HG       LYS   1   0.258   5.451  -6.923
    8   2HG   LYS   1          2HG       LYS   1   0.690   4.334  -8.224
    9   1HD   LYS   1          1HD       LYS   1   1.655   6.446  -8.775
   10   2HD   LYS   1          2HD       LYS   1   0.329   6.139  -9.901
   11   1HE   LYS   1          1HE       LYS   1  -1.136   7.639  -8.455
   12   2HE   LYS   1          2HE       LYS   1   0.301   7.990  -7.474
   13   1HZ   LYS   1          1HZ       LYS   1  -0.061   8.579 -10.329
   14   2HZ   LYS   1          2HZ       LYS   1  -0.022   9.665  -9.101
   15   3HZ   LYS   1          3HZ       LYS   1   1.340   8.826  -9.496
   16    H    SER   2           H        SER   2   0.157   2.195  -6.647
   17    HA   SER   2           HA       SER   2  -1.019   2.138  -3.954
   18   1HB   SER   2          1HB       SER   2   1.511   0.858  -5.074
   19   2HB   SER   2          2HB       SER   2   0.784   0.539  -3.486
   20    HG   SER   2           HG       SER   2  -0.419   0.065  -6.020
   21    H    CYS   3           H        CYS   3  -0.331   3.523  -2.360
   22    HA   CYS   3           HA       CYS   3   2.281   4.962  -2.626
   23   1HB   CYS   3          1HB       CYS   3  -0.468   6.168  -2.279
   24   2HB   CYS   3          2HB       CYS   3   1.039   7.040  -1.962
   25    H    CYS   4           H        CYS   4   3.376   5.019  -0.755
   26    HA   CYS   4           HA       CYS   4   2.040   3.751   1.582
   27   1HB   CYS   4          1HB       CYS   4   4.750   3.396   0.312
   28   2HB   CYS   4          2HB       CYS   4   4.383   2.751   1.901
   29    HA   PRO   5           HA       PRO   5   3.439   7.008   4.177
   30   1HB   PRO   5          1HB       PRO   5   3.821   5.784   6.576
   31   2HB   PRO   5          2HB       PRO   5   2.215   5.964   5.829
   32   1HG   PRO   5          1HG       PRO   5   4.015   3.526   5.674
   33   2HG   PRO   5          2HG       PRO   5   2.296   3.589   6.159
   34   1HD   PRO   5          1HD       PRO   5   2.983   2.973   3.634
   35   2HD   PRO   5          2HD       PRO   5   1.603   4.043   3.947
   36    H    ASN   6           H        ASN   6   5.494   4.066   4.029
   37    HA   ASN   6           HA       ASN   6   7.970   5.553   4.036
   38   1HB   ASN   6          1HB       ASN   6   8.786   4.685   6.224
   39   2HB   ASN   6          2HB       ASN   6   7.467   5.832   6.400
   40   1HD2  ASN   6          2HD2      ASN   6   5.640   5.202   7.517
   41   2HD2  ASN   6          1HD2      ASN   6   5.317   3.566   8.045
   42    H    THR   7           H        THR   7   9.825   3.894   4.518
   43    HA   THR   7           HA       THR   7   9.760   2.026   2.425
   44    HB   THR   7           HB       THR   7  11.709   2.190   4.755
   45    HG1  THR   7           1HG      THR   7  12.777   3.661   3.398
   46   1HG2  THR   7          1HG2      THR   7  12.029   1.229   1.872
   47   2HG2  THR   7          2HG2      THR   7  13.344   1.394   3.054
   48   3HG2  THR   7          3HG2      THR   7  12.066   0.201   3.321
   49    H    THR   8           H        THR   8   9.251   1.580   5.967
   50    HA   THR   8           HA       THR   8   9.295  -1.295   5.829
   51    HB   THR   8           HB       THR   8   7.906   0.390   7.936
   52    HG1  THR   8           1HG      THR   8  10.623  -0.403   7.729
   53   1HG2  THR   8          1HG2      THR   8   8.514  -1.530   9.378
   54   2HG2  THR   8          2HG2      THR   8   7.487  -2.056   8.033
   55   3HG2  THR   8          3HG2      THR   8   9.233  -2.365   7.986
   56    H    GLY   9           H        GLY   9   6.770   1.221   5.555
   57   1HA   GLY   9          1HA       GLY   9   4.462  -0.391   5.311
   58   2HA   GLY   9          2HA       GLY   9   4.730   1.180   4.537
   59    H    ARG  10           H        ARG  10   6.683   0.852   2.736
   60    HA   ARG  10           HA       ARG  10   5.592  -0.570   0.575
   61   1HB   ARG  10          1HB       ARG  10   8.404   0.394   1.204
   62   2HB   ARG  10          2HB       ARG  10   8.074  -0.487  -0.286
   63   1HG   ARG  10          1HG       ARG  10   6.544   2.007   0.507
   64   2HG   ARG  10          2HG       ARG  10   8.051   2.034  -0.425
   65   1HD   ARG  10          1HD       ARG  10   7.110   0.709  -2.210
   66   2HD   ARG  10          2HD       ARG  10   5.608   0.458  -1.309
   67    HE   ARG  10           HE       ARG  10   6.304   3.265  -1.817
   68   1HH1  ARG  10          1HH2      ARG  10   4.599   0.423  -3.121
   69   2HH1  ARG  10          2HH2      ARG  10   3.505   1.394  -4.074
   70   1HH2  ARG  10          1HH1      ARG  10   4.854   4.477  -3.027
   71   2HH2  ARG  10          2HH1      ARG  10   3.656   3.704  -4.045
   72    H    ASN  11           H        ASN  11   8.181  -1.634   2.832
   73    HA   ASN  11           HA       ASN  11   8.702  -4.107   1.606
   74   1HB   ASN  11          1HB       ASN  11  10.179  -3.201   3.273
   75   2HB   ASN  11          2HB       ASN  11   8.915  -3.210   4.504
   76   1HD2  ASN  11          2HD2      ASN  11   8.559  -5.048   5.716
   77   2HD2  ASN  11          1HD2      ASN  11   9.464  -6.530   5.499
   78    H    ILE  12           H        ILE  12   6.359  -3.402   4.287
   79    HA   ILE  12           HA       ILE  12   5.441  -6.080   4.534
   80    HB   ILE  12           HB       ILE  12   4.128  -3.430   5.231
   81   1HG1  ILE  12          1HG1      ILE  12   5.414  -5.498   7.064
   82   2HG1  ILE  12          2HG1      ILE  12   6.346  -4.178   6.371
   83   1HG2  ILE  12          1HG2      ILE  12   2.360  -5.136   5.028
   84   2HG2  ILE  12          2HG2      ILE  12   3.323  -6.285   5.974
   85   3HG2  ILE  12          3HG2      ILE  12   2.653  -4.832   6.732
   86   1HD1  ILE  12          1HD1      ILE  12   3.946  -3.836   8.212
   87   2HD1  ILE  12          2HD1      ILE  12   5.649  -3.549   8.586
   88   3HD1  ILE  12          3HD1      ILE  12   4.822  -2.516   7.403
   89    H    TYR  13           H        TYR  13   4.229  -3.320   2.582
   90    HA   TYR  13           HA       TYR  13   1.930  -4.540   1.535
   91   1HB   TYR  13          1HB       TYR  13   2.412  -2.152   1.370
   92   2HB   TYR  13          2HB       TYR  13   3.792  -2.455   0.324
   93    HD1  TYR  13           1HD      TYR  13   3.461  -2.292  -2.024
   94    HD2  TYR  13           2HD      TYR  13   0.111  -3.175   0.540
   95    HE1  TYR  13           1HE      TYR  13   1.942  -2.208  -3.976
   96    HE2  TYR  13           2HE      TYR  13  -1.394  -3.171  -1.427
   97    HH   TYR  13           HH       TYR  13  -0.281  -2.196  -4.661
   98    H    ASN  14           H        ASN  14   5.238  -4.376   0.144
   99    HA   ASN  14           HA       ASN  14   4.681  -5.939  -2.163
  100   1HB   ASN  14          1HB       ASN  14   7.209  -5.079  -0.737
  101   2HB   ASN  14          2HB       ASN  14   7.271  -6.216  -2.076
  102   1HD2  ASN  14          2HD2      ASN  14   6.181  -2.906  -1.228
  103   2HD2  ASN  14          1HD2      ASN  14   6.244  -2.312  -2.878
  104    H    THR  15           H        THR  15   5.823  -6.881   1.113
  105    HA   THR  15           HA       THR  15   6.353  -9.610   0.539
  106    HB   THR  15           HB       THR  15   5.366  -8.281   3.106
  107    HG1  THR  15           1HG      THR  15   7.370  -7.537   2.363
  108   1HG2  THR  15          1HG2      THR  15   6.593 -11.033   2.648
  109   2HG2  THR  15          2HG2      THR  15   6.369 -10.261   4.231
  110   3HG2  THR  15          3HG2      THR  15   4.957 -10.689   3.257
  111    H    CYS  16           H        CYS  16   3.366  -7.989   1.677
  112    HA   CYS  16           HA       CYS  16   1.744 -10.323   1.756
  113   1HB   CYS  16          1HB       CYS  16   1.323  -8.319   3.012
  114   2HB   CYS  16          2HB       CYS  16   1.088  -7.363   1.554
  115    H    ARG  17           H        ARG  17   2.341  -7.924  -0.832
  116    HA   ARG  17           HA       ARG  17   0.453  -8.966  -2.698
  117   1HB   ARG  17          1HB       ARG  17   3.017  -7.377  -3.006
  118   2HB   ARG  17          2HB       ARG  17   1.988  -7.764  -4.378
  119   1HG   ARG  17          1HG       ARG  17   0.554  -6.552  -2.047
  120   2HG   ARG  17          2HG       ARG  17   1.767  -5.516  -2.782
  121   1HD   ARG  17          1HD       ARG  17  -0.592  -5.269  -3.691
  122   2HD   ARG  17          2HD       ARG  17   0.715  -5.445  -4.862
  123    HE   ARG  17           HE       ARG  17  -0.249  -7.321  -5.661
  124   1HH1  ARG  17          1HH2      ARG  17  -1.466  -6.866  -2.356
  125   2HH1  ARG  17          2HH2      ARG  17  -2.596  -8.195  -2.475
  126   1HH2  ARG  17          1HH1      ARG  17  -1.864  -8.962  -5.825
  127   2HH2  ARG  17          2HH1      ARG  17  -2.806  -9.378  -4.412
  128    H    PHE  18           H        PHE  18   3.914  -9.748  -2.119
  129    HA   PHE  18           HA       PHE  18   4.176 -11.620  -4.263
  130   1HB   PHE  18          1HB       PHE  18   6.131 -10.696  -3.232
  131   2HB   PHE  18          2HB       PHE  18   5.647 -11.256  -1.636
  132    HD1  PHE  18           1HD      PHE  18   6.064 -13.515  -0.890
  133    HD2  PHE  18           2HD      PHE  18   6.826 -12.410  -4.988
  134    HE1  PHE  18           1HE      PHE  18   7.172 -15.697  -1.274
  135    HE2  PHE  18           2HE      PHE  18   7.966 -14.582  -5.357
  136    HZ   PHE  18           HZ       PHE  18   8.123 -16.235  -3.508
  137    H    ALA  19           H        ALA  19   3.344 -12.038  -0.785
  138    HA   ALA  19           HA       ALA  19   3.144 -14.869  -0.819
  139   1HB   ALA  19          1HB       ALA  19   3.325 -13.504   1.235
  140   2HB   ALA  19          2HB       ALA  19   1.693 -12.859   0.954
  141   3HB   ALA  19          3HB       ALA  19   1.922 -14.590   1.282
  142    H    GLY  20           H        GLY  20   0.804 -12.273  -1.502
  143   1HA   GLY  20          1HA       GLY  20  -0.693 -12.497  -3.314
  144   2HA   GLY  20          2HA       GLY  20  -0.902 -14.218  -2.983
  145    H    GLY  21           H        GLY  21  -1.201 -11.112  -1.174
  146   1HA   GLY  21          1HA       GLY  21  -3.913 -11.897  -0.192
  147   2HA   GLY  21          2HA       GLY  21  -2.939 -10.537   0.369
  148    H    SER  22           H        SER  22  -5.466  -9.850  -0.265
  149    HA   SER  22           HA       SER  22  -5.735  -8.996  -3.029
  150   1HB   SER  22          1HB       SER  22  -7.230  -7.893  -0.637
  151   2HB   SER  22          2HB       SER  22  -7.755  -7.985  -2.325
  152    HG   SER  22           HG       SER  22  -8.670  -9.628  -0.989
  153    H    ARG  23           H        ARG  23  -5.475  -6.818  -3.791
  154    HA   ARG  23           HA       ARG  23  -3.256  -5.328  -2.938
  155   1HB   ARG  23          1HB       ARG  23  -5.744  -4.480  -4.460
  156   2HB   ARG  23          2HB       ARG  23  -4.293  -3.483  -4.276
  157   1HG   ARG  23          1HG       ARG  23  -2.909  -5.202  -5.354
  158   2HG   ARG  23          2HG       ARG  23  -4.312  -6.271  -5.541
  159   1HD   ARG  23          1HD       ARG  23  -4.078  -3.486  -6.736
  160   2HD   ARG  23          2HD       ARG  23  -3.709  -4.966  -7.611
  161    HE   ARG  23           HE       ARG  23  -6.353  -3.941  -6.763
  162   1HH1  ARG  23          1HH2      ARG  23  -4.606  -6.694  -8.193
  163   2HH1  ARG  23          2HH2      ARG  23  -6.032  -7.351  -8.954
  164   1HH2  ARG  23          1HH1      ARG  23  -8.195  -4.816  -7.772
  165   2HH2  ARG  23          2HH1      ARG  23  -8.080  -6.288  -8.703
  166    H    GLU  24           H        GLU  24  -6.711  -4.585  -2.309
  167    HA   GLU  24           HA       GLU  24  -6.235  -2.325  -0.673
  168   1HB   GLU  24          1HB       GLU  24  -8.629  -4.188  -0.889
  169   2HB   GLU  24          2HB       GLU  24  -8.616  -2.642  -0.027
  170   1HG   GLU  24          1HG       GLU  24  -7.978  -1.463  -2.125
  171   2HG   GLU  24          2HG       GLU  24  -8.030  -2.998  -3.006
  172    HE2  GLU  24           HE       GLU  24 -11.510  -1.303  -1.766
  173    H    ARG  25           H        ARG  25  -6.667  -5.777   0.197
  174    HA   ARG  25           HA       ARG  25  -6.764  -5.394   3.015
  175   1HB   ARG  25          1HB       ARG  25  -7.492  -7.388   1.679
  176   2HB   ARG  25          2HB       ARG  25  -5.791  -7.816   1.440
  177   1HG   ARG  25          1HG       ARG  25  -5.493  -7.972   3.901
  178   2HG   ARG  25          2HG       ARG  25  -7.200  -7.556   4.142
  179   1HD   ARG  25          1HD       ARG  25  -6.206  -9.978   2.568
  180   2HD   ARG  25          2HD       ARG  25  -6.690  -9.994   4.274
  181    HE   ARG  25           HE       ARG  25  -8.787  -8.867   2.695
  182   1HH1  ARG  25          1HH2      ARG  25  -7.270 -11.989   3.435
  183   2HH1  ARG  25          2HH2      ARG  25  -8.729 -12.906   3.163
  184   1HH2  ARG  25          1HH1      ARG  25 -10.699 -10.088   2.329
  185   2HH2  ARG  25          2HH1      ARG  25 -10.681 -11.822   2.527
  186    H    CYS  26           H        CYS  26  -4.072  -6.202   0.787
  187    HA   CYS  26           HA       CYS  26  -1.983  -6.221   2.729
  188   1HB   CYS  26          1HB       CYS  26  -1.967  -5.657  -0.264
  189   2HB   CYS  26          2HB       CYS  26  -0.522  -5.827   0.724
  190    H    ALA  27           H        ALA  27  -3.410  -3.592   0.776
  191    HA   ALA  27           HA       ALA  27  -1.535  -1.575   1.458
  192   1HB   ALA  27          1HB       ALA  27  -4.474  -1.296   0.733
  193   2HB   ALA  27          2HB       ALA  27  -3.219  -0.047   0.632
  194   3HB   ALA  27          3HB       ALA  27  -3.114  -1.482  -0.397
  195    H    LYS  28           H        LYS  28  -4.685  -2.510   2.931
  196    HA   LYS  28           HA       LYS  28  -4.682  -0.649   5.073
  197   1HB   LYS  28          1HB       LYS  28  -5.905  -3.392   4.640
  198   2HB   LYS  28          2HB       LYS  28  -6.116  -2.509   6.153
  199   1HG   LYS  28          1HG       LYS  28  -7.147  -0.632   5.012
  200   2HG   LYS  28          2HG       LYS  28  -6.737  -1.301   3.425
  201   1HD   LYS  28          1HD       LYS  28  -8.231  -3.251   3.863
  202   2HD   LYS  28          2HD       LYS  28  -8.620  -2.574   5.454
  203   1HE   LYS  28          1HE       LYS  28 -10.418  -2.004   3.926
  204   2HE   LYS  28          2HE       LYS  28  -9.532  -0.523   4.328
  205   1HZ   LYS  28          1HZ       LYS  28  -9.221  -2.120   1.883
  206   2HZ   LYS  28          2HZ       LYS  28  -9.993  -0.669   1.998
  207   3HZ   LYS  28          3HZ       LYS  28  -8.366  -0.757   2.236
  208    H    LEU  29           H        LEU  29  -3.505  -4.050   4.962
  209    HA   LEU  29           HA       LEU  29  -2.579  -4.301   7.572
  210   1HB   LEU  29          1HB       LEU  29  -2.650  -6.175   5.963
  211   2HB   LEU  29          2HB       LEU  29  -1.387  -5.413   4.995
  212    HG   LEU  29           HG       LEU  29   0.201  -5.626   6.957
  213   1HD1  LEU  29          1HD1      LEU  29  -2.106  -7.252   8.107
  214   2HD1  LEU  29          2HD1      LEU  29  -0.433  -7.310   8.703
  215   3HD1  LEU  29          3HD1      LEU  29  -1.354  -5.806   8.820
  216   1HD2  LEU  29          1HD2      LEU  29   0.286  -7.194   5.117
  217   2HD2  LEU  29          2HD2      LEU  29   0.594  -8.018   6.653
  218   3HD2  LEU  29          3HD2      LEU  29  -0.989  -8.191   5.861
  219    H    SER  30           H        SER  30  -0.857  -3.047   4.716
  220    HA   SER  30           HA       SER  30   1.645  -2.676   6.105
  221   1HB   SER  30          1HB       SER  30   2.367  -1.700   3.994
  222   2HB   SER  30          2HB       SER  30   1.502  -3.223   3.712
  223    HG   SER  30           HG       SER  30  -0.336  -1.997   3.185
  224    H    GLY  31           H        GLY  31  -1.091  -0.599   5.285
  225   1HA   GLY  31          1HA       GLY  31  -1.447   1.450   6.607
  226   2HA   GLY  31          2HA       GLY  31   0.278   1.805   6.439
  227    H    CYS  32           H        CYS  32   0.012   0.569   3.545
  228    HA   CYS  32           HA       CYS  32   0.017   3.108   2.285
  229   1HB   CYS  32          1HB       CYS  32  -0.238   0.387   0.970
  230   2HB   CYS  32          2HB       CYS  32   0.382   1.852   0.225
  231    H    LYS  33           H        LYS  33  -1.235   3.668   0.319
  232    HA   LYS  33           HA       LYS  33  -4.169   3.215   0.626
  233   1HB   LYS  33          1HB       LYS  33  -2.745   5.441  -0.861
  234   2HB   LYS  33          2HB       LYS  33  -4.457   5.349  -0.458
  235   1HG   LYS  33          1HG       LYS  33  -2.155   5.806   1.489
  236   2HG   LYS  33          2HG       LYS  33  -3.204   7.027   0.790
  237   1HD   LYS  33          1HD       LYS  33  -4.045   6.769   2.906
  238   2HD   LYS  33          2HD       LYS  33  -5.191   5.867   1.908
  239   1HE   LYS  33          1HE       LYS  33  -4.427   3.783   2.741
  240   2HE   LYS  33          2HE       LYS  33  -2.848   4.460   3.200
  241   1HZ   LYS  33          1HZ       LYS  33  -5.355   5.081   4.561
  242   2HZ   LYS  33          2HZ       LYS  33  -4.254   3.956   5.051
  243   3HZ   LYS  33          3HZ       LYS  33  -3.826   5.544   5.000
  244    H    ILE  34           H        ILE  34  -5.361   2.755  -1.201
  245    HA   ILE  34           HA       ILE  34  -3.975   2.310  -3.808
  246    HB   ILE  34           HB       ILE  34  -6.253   0.713  -2.547
  247   1HG1  ILE  34          1HG1      ILE  34  -4.070   0.237  -1.520
  248   2HG1  ILE  34          2HG1      ILE  34  -4.844  -1.133  -2.296
  249   1HG2  ILE  34          1HG2      ILE  34  -4.871   0.390  -5.240
  250   2HG2  ILE  34          2HG2      ILE  34  -5.953  -0.815  -4.506
  251   3HG2  ILE  34          3HG2      ILE  34  -6.576   0.778  -4.945
  252   1HD1  ILE  34          1HD1      ILE  34  -2.580   0.482  -3.538
  253   2HD1  ILE  34          2HD1      ILE  34  -2.396  -1.048  -2.674
  254   3HD1  ILE  34          3HD1      ILE  34  -3.298  -1.009  -4.193
  255    H    ILE  35           H        ILE  35  -4.661   4.223  -4.849
  256    HA   ILE  35           HA       ILE  35  -7.576   4.367  -5.303
  257    HB   ILE  35           HB       ILE  35  -7.547   6.820  -5.313
  258   1HG1  ILE  35          1HG1      ILE  35  -4.865   6.623  -3.872
  259   2HG1  ILE  35          2HG1      ILE  35  -5.113   7.200  -5.530
  260   1HG2  ILE  35          1HG2      ILE  35  -6.879   5.727  -2.560
  261   2HG2  ILE  35          2HG2      ILE  35  -7.936   7.098  -2.969
  262   3HG2  ILE  35          3HG2      ILE  35  -8.423   5.464  -3.408
  263   1HD1  ILE  35          1HD1      ILE  35  -6.651   8.978  -4.643
  264   2HD1  ILE  35          2HD1      ILE  35  -6.180   8.494  -2.992
  265   3HD1  ILE  35          3HD1      ILE  35  -4.971   9.129  -4.108
  266    H    SER  36           H        SER  36  -8.213   5.140  -7.267
  267    HA   SER  36           HA       SER  36  -6.189   4.865  -9.418
  268   1HB   SER  36          1HB       SER  36  -8.183   4.345 -10.790
  269   2HB   SER  36          2HB       SER  36  -8.082   3.295  -9.368
  270    HG   SER  36           HG       SER  36  -9.675   5.631  -9.626
  271    H    ALA  37           H        ALA  37  -6.271   7.374  -7.972
  272    HA   ALA  37           HA       ALA  37  -7.740   9.278  -9.676
  273   1HB   ALA  37          1HB       ALA  37  -7.601   9.520  -7.197
  274   2HB   ALA  37          2HB       ALA  37  -5.848   9.767  -7.350
  275   3HB   ALA  37          3HB       ALA  37  -6.979  10.926  -8.081
  276    H    SER  38           H        SER  38  -4.858   7.600 -10.044
  277    HA   SER  38           HA       SER  38  -2.817   7.906 -10.859
  278   1HB   SER  38          1HB       SER  38  -4.163   8.519 -12.884
  279   2HB   SER  38          2HB       SER  38  -3.973  10.224 -12.436
  280    HG   SER  38           HG       SER  38  -2.363   9.578 -13.894
  281    H    THR  39           H        THR  39  -3.601   9.247  -8.375
  282    HA   THR  39           HA       THR  39  -1.377  11.064  -7.950
  283    HB   THR  39           HB       THR  39  -4.269  12.033  -7.658
  284    HG1  THR  39           1HG      THR  39  -2.339  12.445  -9.644
  285   1HG2  THR  39          1HG2      THR  39  -3.178  14.256  -7.262
  286   2HG2  THR  39          2HG2      THR  39  -2.841  13.093  -5.979
  287   3HG2  THR  39          3HG2      THR  39  -1.600  13.446  -7.208
  288    H    CYS  40           H        CYS  40  -1.226  11.512  -5.568
  289    HA   CYS  40           HA       CYS  40  -2.855   9.743  -3.855
  290   1HB   CYS  40          1HB       CYS  40   0.164   9.691  -4.156
  291   2HB   CYS  40          2HB       CYS  40  -0.675   9.025  -2.756
  292    HA   PRO  41           HA       PRO  41  -2.520  13.205  -1.078
  293   1HB   PRO  41          1HB       PRO  41  -2.713  11.940   1.388
  294   2HB   PRO  41          2HB       PRO  41  -4.085  12.255   0.288
  295   1HG   PRO  41          1HG       PRO  41  -2.476   9.704   0.543
  296   2HG   PRO  41          2HG       PRO  41  -4.253   9.880   0.503
  297   1HD   PRO  41          1HD       PRO  41  -2.807   9.183  -1.663
  298   2HD   PRO  41          2HD       PRO  41  -4.191  10.302  -1.835
  299    H    SER  42           H        SER  42  -0.959  14.312  -0.001
  300    HA   SER  42           HA       SER  42   1.707  13.716  -0.403
  301   1HB   SER  42          1HB       SER  42   0.494  15.601   1.663
  302   2HB   SER  42          2HB       SER  42   2.135  15.693   0.985
  303    HG   SER  42           HG       SER  42   0.684  17.083  -0.094
  304    H    ASP  43           H        ASP  43  -0.293  13.011   2.428
  305    HA   ASP  43           HA       ASP  43   1.678  12.473   4.358
  306   1HB   ASP  43          1HB       ASP  43  -1.081  11.246   3.980
  307   2HB   ASP  43          2HB       ASP  43  -0.121  11.170   5.464
  308    HD2  ASP  43           HD       ASP  43  -1.038  14.337   6.518
  309    H    TYR  44           H        TYR  44   1.056  10.690   1.465
  310    HA   TYR  44           HA       TYR  44   2.527   8.309   2.517
  311   1HB   TYR  44          1HB       TYR  44   0.401   8.455   0.367
  312   2HB   TYR  44          2HB       TYR  44   1.357   7.046   0.807
  313    HD1  TYR  44           1HD      TYR  44  -1.113   9.511   2.195
  314    HD2  TYR  44           2HD      TYR  44   0.819   5.711   2.696
  315    HE1  TYR  44           1HE      TYR  44  -2.594   9.021   4.109
  316    HE2  TYR  44           2HE      TYR  44  -0.457   5.345   4.787
  317    HH   TYR  44           HH       TYR  44  -3.018   7.596   5.874
  318    HA   PRO  45           HA       PRO  45   4.914  10.799  -0.570
  319   1HB   PRO  45          1HB       PRO  45   7.342  10.890   0.664
  320   2HB   PRO  45          2HB       PRO  45   5.961  11.901   1.175
  321   1HG   PRO  45          1HG       PRO  45   6.844   9.252   2.367
  322   2HG   PRO  45          2HG       PRO  45   6.501  10.785   3.227
  323   1HD   PRO  45          1HD       PRO  45   4.635   8.829   3.003
  324   2HD   PRO  45          2HD       PRO  45   4.190  10.561   2.902
  325    H    LYS  46           H        LYS  46   5.478   7.551   0.697
  326    HA   LYS  46           HA       LYS  46   7.712   7.070  -1.143
  327   1HB   LYS  46          1HB       LYS  46   7.654   6.520   1.391
  328   2HB   LYS  46          2HB       LYS  46   6.508   5.255   0.974
  329   1HG   LYS  46          1HG       LYS  46   8.673   4.246   1.113
  330   2HG   LYS  46          2HG       LYS  46   8.192   4.255  -0.577
  331   1HD   LYS  46          1HD       LYS  46  10.556   4.815  -0.289
  332   2HD   LYS  46          2HD       LYS  46   9.679   6.104  -1.097
  333   1HE   LYS  46          1HE       LYS  46  11.305   6.932   0.582
  334   2HE   LYS  46          2HE       LYS  46   9.662   7.454   0.941
  335   1HZ   LYS  46          1HZ       LYS  46  11.013   5.157   2.211
  336   2HZ   LYS  46          2HZ       LYS  46  10.832   6.654   2.878
  337   3HZ   LYS  46          3HZ       LYS  46   9.508   5.730   2.559
  Start of MODEL    4
    1   1H    LYS   1          1H        LYS   1  -2.361   6.661  -7.841
    2   2H    LYS   1          2H        LYS   1  -2.839   5.415  -6.890
    3   3H    LYS   1          3H        LYS   1  -1.688   6.476  -6.355
    4    HA   LYS   1           HA       LYS   1  -1.467   4.612  -8.603
    5   1HB   LYS   1          1HB       LYS   1   0.847   5.365  -8.860
    6   2HB   LYS   1          2HB       LYS   1  -0.265   6.716  -9.053
    7   1HG   LYS   1          1HG       LYS   1   0.210   7.546  -6.832
    8   2HG   LYS   1          2HG       LYS   1   1.200   6.122  -6.455
    9   1HD   LYS   1          1HD       LYS   1   2.783   6.767  -8.270
   10   2HD   LYS   1          2HD       LYS   1   1.795   8.203  -8.588
   11   1HE   LYS   1          1HE       LYS   1   3.687   8.846  -7.216
   12   2HE   LYS   1          2HE       LYS   1   2.214   8.992  -6.249
   13   1HZ   LYS   1          1HZ       LYS   1   2.779   6.859  -5.245
   14   2HZ   LYS   1          2HZ       LYS   1   4.140   6.763  -6.157
   15   3HZ   LYS   1          3HZ       LYS   1   3.979   7.942  -5.025
   16    H    SER   2           H        SER   2  -2.111   4.113  -5.666
   17    HA   SER   2           HA       SER   2  -1.541   2.805  -3.943
   18   1HB   SER   2          1HB       SER   2  -0.605   1.126  -5.526
   19   2HB   SER   2          2HB       SER   2   0.993   1.890  -5.372
   20    HG   SER   2           HG       SER   2   0.785   1.523  -3.086
   21    H    CYS   3           H        CYS   3  -0.749   3.600  -2.051
   22    HA   CYS   3           HA       CYS   3   1.425   5.664  -2.157
   23   1HB   CYS   3          1HB       CYS   3  -1.396   6.033  -1.091
   24   2HB   CYS   3          2HB       CYS   3  -0.105   7.240  -1.133
   25    H    CYS   4           H        CYS   4   2.862   4.863  -0.706
   26    HA   CYS   4           HA       CYS   4   1.873   3.758   1.877
   27   1HB   CYS   4          1HB       CYS   4   4.426   3.322   0.314
   28   2HB   CYS   4          2HB       CYS   4   4.217   2.770   1.960
   29    HA   PRO   5           HA       PRO   5   3.749   7.205   3.886
   30   1HB   PRO   5          1HB       PRO   5   4.243   6.282   6.379
   31   2HB   PRO   5          2HB       PRO   5   2.590   6.440   5.738
   32   1HG   PRO   5          1HG       PRO   5   4.289   3.926   5.794
   33   2HG   PRO   5          2HG       PRO   5   2.610   4.122   6.374
   34   1HD   PRO   5          1HD       PRO   5   3.130   3.150   3.892
   35   2HD   PRO   5          2HD       PRO   5   1.765   4.236   4.177
   36    H    ASN   6           H        ASN   6   5.547   4.106   3.931
   37    HA   ASN   6           HA       ASN   6   8.134   5.495   3.745
   38   1HB   ASN   6          1HB       ASN   6   7.478   3.556   6.008
   39   2HB   ASN   6          2HB       ASN   6   9.054   4.279   5.675
   40   1HD2  ASN   6          2HD2      ASN   6   6.147   4.641   7.433
   41   2HD2  ASN   6          1HD2      ASN   6   6.396   6.290   7.965
   42    H    THR   7           H        THR   7   9.893   3.987   3.444
   43    HA   THR   7           HA       THR   7   9.618   1.969   1.570
   44    HB   THR   7           HB       THR   7  11.768   2.129   3.721
   45    HG1  THR   7           1HG      THR   7  12.740   3.624   2.294
   46   1HG2  THR   7          1HG2      THR   7  13.242   1.365   1.886
   47   2HG2  THR   7          2HG2      THR   7  11.946   0.191   2.168
   48   3HG2  THR   7          3HG2      THR   7  11.855   1.299   0.780
   49    H    THR   8           H        THR   8   9.526   1.733   5.171
   50    HA   THR   8           HA       THR   8   9.495  -1.108   5.296
   51    HB   THR   8           HB       THR   8   8.253   0.835   7.278
   52    HG1  THR   8           1HG      THR   8  10.338   0.844   8.181
   53   1HG2  THR   8          1HG2      THR   8   9.503  -1.944   7.569
   54   2HG2  THR   8          2HG2      THR   8   8.932  -0.931   8.910
   55   3HG2  THR   8          3HG2      THR   8   7.776  -1.564   7.729
   56    H    GLY   9           H        GLY   9   6.925   1.350   4.918
   57   1HA   GLY   9          1HA       GLY   9   4.649  -0.368   5.133
   58   2HA   GLY   9          2HA       GLY   9   4.742   1.181   4.278
   59    H    ARG  10           H        ARG  10   6.606   0.785   2.333
   60    HA   ARG  10           HA       ARG  10   5.299  -0.732   0.342
   61   1HB   ARG  10          1HB       ARG  10   8.128   0.352   0.574
   62   2HB   ARG  10          2HB       ARG  10   7.617  -0.568  -0.840
   63   1HG   ARG  10          1HG       ARG  10   6.138   1.894   0.125
   64   2HG   ARG  10          2HG       ARG  10   7.478   1.969  -1.024
   65   1HD   ARG  10          1HD       ARG  10   6.333   0.594  -2.637
   66   2HD   ARG  10          2HD       ARG  10   5.002   0.260  -1.518
   67    HE   ARG  10           HE       ARG  10   5.256   3.084  -1.899
   68   1HH1  ARG  10          1HH2      ARG  10   4.034   0.130  -3.456
   69   2HH1  ARG  10          2HH2      ARG  10   2.829   0.979  -4.386
   70   1HH2  ARG  10          1HH1      ARG  10   3.734   4.167  -3.129
   71   2HH2  ARG  10          2HH1      ARG  10   2.691   3.332  -4.251
   72    H    ASN  11           H        ASN  11   8.058  -1.641   2.454
   73    HA   ASN  11           HA       ASN  11   8.579  -4.150   1.281
   74   1HB   ASN  11          1HB       ASN  11  10.141  -3.197   2.803
   75   2HB   ASN  11          2HB       ASN  11   8.949  -3.082   4.096
   76   1HD2  ASN  11          2HD2      ASN  11   8.688  -4.767   5.505
   77   2HD2  ASN  11          1HD2      ASN  11   9.531  -6.292   5.360
   78    H    ILE  12           H        ILE  12   6.383  -3.398   4.084
   79    HA   ILE  12           HA       ILE  12   5.524  -6.088   4.431
   80    HB   ILE  12           HB       ILE  12   4.135  -3.468   5.097
   81   1HG1  ILE  12          1HG1      ILE  12   5.624  -5.376   6.953
   82   2HG1  ILE  12          2HG1      ILE  12   6.430  -4.024   6.170
   83   1HG2  ILE  12          1HG2      ILE  12   3.529  -6.328   5.995
   84   2HG2  ILE  12          2HG2      ILE  12   2.795  -4.882   6.707
   85   3HG2  ILE  12          3HG2      ILE  12   2.465  -5.288   5.030
   86   1HD1  ILE  12          1HD1      ILE  12   4.119  -3.794   8.126
   87   2HD1  ILE  12          2HD1      ILE  12   5.803  -3.311   8.361
   88   3HD1  ILE  12          3HD1      ILE  12   4.794  -2.440   7.190
   89    H    TYR  13           H        TYR  13   4.100  -3.385   2.567
   90    HA   TYR  13           HA       TYR  13   1.824  -4.639   1.569
   91   1HB   TYR  13          1HB       TYR  13   2.180  -2.268   1.395
   92   2HB   TYR  13          2HB       TYR  13   3.641  -2.489   0.445
   93    HD1  TYR  13           1HD      TYR  13   3.466  -1.999  -1.829
   94    HD2  TYR  13           2HD      TYR  13   0.006  -3.471   0.274
   95    HE1  TYR  13           1HE      TYR  13   2.115  -1.768  -3.889
   96    HE2  TYR  13           2HE      TYR  13  -1.337  -3.270  -1.799
   97    HH   TYR  13           HH       TYR  13   0.044  -2.014  -4.851
   98    H    ASN  14           H        ASN  14   5.079  -4.467   0.040
   99    HA   ASN  14           HA       ASN  14   4.425  -5.989  -2.270
  100   1HB   ASN  14          1HB       ASN  14   7.011  -5.144  -0.939
  101   2HB   ASN  14          2HB       ASN  14   7.028  -6.314  -2.249
  102   1HD2  ASN  14          2HD2      ASN  14   6.204  -2.936  -1.487
  103   2HD2  ASN  14          1HD2      ASN  14   6.183  -2.414  -3.160
  104    H    THR  15           H        THR  15   5.810  -6.990   0.916
  105    HA   THR  15           HA       THR  15   6.283  -9.694   0.166
  106    HB   THR  15           HB       THR  15   5.657  -8.501   2.901
  107    HG1  THR  15           1HG      THR  15   8.091  -9.043   1.546
  108   1HG2  THR  15          1HG2      THR  15   6.906 -10.480   3.758
  109   2HG2  THR  15          2HG2      THR  15   5.403 -10.956   2.955
  110   3HG2  THR  15          3HG2      THR  15   6.958 -11.151   2.115
  111    H    CYS  16           H        CYS  16   3.431  -8.107   1.652
  112    HA   CYS  16           HA       CYS  16   1.823 -10.444   1.895
  113   1HB   CYS  16          1HB       CYS  16   1.389  -8.485   3.164
  114   2HB   CYS  16          2HB       CYS  16   1.213  -7.481   1.730
  115    H    ARG  17           H        ARG  17   2.038  -7.974  -0.704
  116    HA   ARG  17           HA       ARG  17   0.078  -9.006  -2.448
  117   1HB   ARG  17          1HB       ARG  17   2.681  -7.510  -2.904
  118   2HB   ARG  17          2HB       ARG  17   1.587  -7.887  -4.227
  119   1HG   ARG  17          1HG       ARG  17   0.363  -6.511  -1.843
  120   2HG   ARG  17          2HG       ARG  17   1.502  -5.577  -2.822
  121   1HD   ARG  17          1HD       ARG  17  -0.769  -5.254  -3.622
  122   2HD   ARG  17          2HD       ARG  17   0.262  -6.007  -4.835
  123    HE   ARG  17           HE       ARG  17  -1.533  -7.649  -3.073
  124   1HH1  ARG  17          1HH2      ARG  17  -0.681  -6.665  -6.406
  125   2HH1  ARG  17          2HH2      ARG  17  -1.709  -7.875  -7.121
  126   1HH2  ARG  17          1HH1      ARG  17  -2.808  -9.221  -4.063
  127   2HH2  ARG  17          2HH1      ARG  17  -2.931  -9.314  -5.804
  128    H    PHE  18           H        PHE  18   3.573  -9.753  -2.196
  129    HA   PHE  18           HA       PHE  18   3.678 -11.624  -4.332
  130   1HB   PHE  18          1HB       PHE  18   5.650 -10.529  -3.456
  131   2HB   PHE  18          2HB       PHE  18   5.404 -11.235  -1.864
  132    HD1  PHE  18           1HD      PHE  18   6.440 -13.294  -1.311
  133    HD2  PHE  18           2HD      PHE  18   5.976 -12.197  -5.458
  134    HE1  PHE  18           1HE      PHE  18   7.766 -15.275  -1.987
  135    HE2  PHE  18           2HE      PHE  18   7.295 -14.188  -6.127
  136    HZ   PHE  18           HZ       PHE  18   8.187 -15.733  -4.394
  137    H    ALA  19           H        ALA  19   3.093 -12.041  -0.806
  138    HA   ALA  19           HA       ALA  19   2.977 -14.858  -0.751
  139   1HB   ALA  19          1HB       ALA  19   3.049 -13.422   1.262
  140   2HB   ALA  19          2HB       ALA  19   1.386 -12.886   0.940
  141   3HB   ALA  19          3HB       ALA  19   1.711 -14.586   1.313
  142    H    GLY  20           H        GLY  20   0.421 -12.433  -1.417
  143   1HA   GLY  20          1HA       GLY  20  -0.845 -13.219  -3.479
  144   2HA   GLY  20          2HA       GLY  20  -1.377 -14.580  -2.485
  145    H    GLY  21           H        GLY  21  -1.097 -11.678  -0.608
  146   1HA   GLY  21          1HA       GLY  21  -3.957 -11.583  -0.211
  147   2HA   GLY  21          2HA       GLY  21  -2.741 -10.509   0.483
  148    H    SER  22           H        SER  22  -5.383  -9.889  -0.807
  149    HA   SER  22           HA       SER  22  -5.034  -8.780  -3.399
  150   1HB   SER  22          1HB       SER  22  -7.015  -7.995  -1.223
  151   2HB   SER  22          2HB       SER  22  -7.156  -7.640  -2.953
  152    HG   SER  22           HG       SER  22  -7.067 -10.232  -1.795
  153    H    ARG  23           H        ARG  23  -5.055  -6.492  -3.998
  154    HA   ARG  23           HA       ARG  23  -2.926  -5.019  -2.922
  155   1HB   ARG  23          1HB       ARG  23  -5.327  -4.082  -4.550
  156   2HB   ARG  23          2HB       ARG  23  -3.898  -3.098  -4.197
  157   1HG   ARG  23          1HG       ARG  23  -2.454  -4.749  -5.359
  158   2HG   ARG  23          2HG       ARG  23  -3.879  -5.748  -5.710
  159   1HD   ARG  23          1HD       ARG  23  -3.382  -4.447  -7.686
  160   2HD   ARG  23          2HD       ARG  23  -4.879  -3.855  -6.977
  161    HE   ARG  23           HE       ARG  23  -3.899  -1.847  -6.412
  162   1HH1  ARG  23          1HH2      ARG  23  -1.365  -4.043  -7.611
  163   2HH1  ARG  23          2HH2      ARG  23  -0.171  -2.777  -7.740
  164   1HH2  ARG  23          1HH1      ARG  23  -2.314  -0.227  -6.568
  165   2HH2  ARG  23          2HH1      ARG  23  -0.714  -0.605  -7.158
  166    H    GLU  24           H        GLU  24  -6.436  -4.421  -2.482
  167    HA   GLU  24           HA       GLU  24  -6.226  -2.275  -0.673
  168   1HB   GLU  24          1HB       GLU  24  -8.383  -4.409  -0.978
  169   2HB   GLU  24          2HB       GLU  24  -8.553  -2.921  -0.027
  170   1HG   GLU  24          1HG       GLU  24  -8.112  -1.565  -2.064
  171   2HG   GLU  24          2HG       GLU  24  -8.011  -3.045  -3.032
  172    HE2  GLU  24           HE       GLU  24 -11.532  -1.439  -2.480
  173    H    ARG  25           H        ARG  25  -6.494  -5.800   0.012
  174    HA   ARG  25           HA       ARG  25  -6.669  -5.590   2.802
  175   1HB   ARG  25          1HB       ARG  25  -7.180  -7.543   1.309
  176   2HB   ARG  25          2HB       ARG  25  -5.451  -7.877   1.183
  177   1HG   ARG  25          1HG       ARG  25  -5.293  -8.224   3.603
  178   2HG   ARG  25          2HG       ARG  25  -6.979  -7.734   3.823
  179   1HD   ARG  25          1HD       ARG  25  -6.031 -10.146   2.212
  180   2HD   ARG  25          2HD       ARG  25  -6.670 -10.218   3.852
  181    HE   ARG  25           HE       ARG  25  -8.147  -9.941   1.363
  182   1HH1  ARG  25          1HH2      ARG  25  -8.324  -9.313   4.858
  183   2HH1  ARG  25          2HH2      ARG  25 -10.068  -9.251   4.879
  184   1HH2  ARG  25          1HH1      ARG  25 -10.429  -9.837   1.411
  185   2HH2  ARG  25          2HH1      ARG  25 -11.266  -9.546   2.915
  186    H    CYS  26           H        CYS  26  -3.821  -6.223   0.734
  187    HA   CYS  26           HA       CYS  26  -1.867  -6.273   2.799
  188   1HB   CYS  26          1HB       CYS  26  -1.685  -5.628  -0.174
  189   2HB   CYS  26          2HB       CYS  26  -0.291  -5.868   0.881
  190    H    ALA  27           H        ALA  27  -3.173  -3.587   0.831
  191    HA   ALA  27           HA       ALA  27  -1.362  -1.601   1.740
  192   1HB   ALA  27          1HB       ALA  27  -2.768  -1.347  -0.212
  193   2HB   ALA  27          2HB       ALA  27  -4.237  -1.323   0.794
  194   3HB   ALA  27          3HB       ALA  27  -3.040  -0.021   0.921
  195    H    LYS  28           H        LYS  28  -4.568  -2.689   3.005
  196    HA   LYS  28           HA       LYS  28  -4.730  -0.878   5.146
  197   1HB   LYS  28          1HB       LYS  28  -6.297  -2.879   4.072
  198   2HB   LYS  28          2HB       LYS  28  -5.826  -3.626   5.588
  199   1HG   LYS  28          1HG       LYS  28  -7.101  -0.863   5.248
  200   2HG   LYS  28          2HG       LYS  28  -7.951  -2.358   5.660
  201   1HD   LYS  28          1HD       LYS  28  -6.558  -2.555   7.736
  202   2HD   LYS  28          2HD       LYS  28  -5.797  -0.996   7.347
  203   1HE   LYS  28          1HE       LYS  28  -7.982   0.132   7.447
  204   2HE   LYS  28          2HE       LYS  28  -8.783  -1.413   7.798
  205   1HZ   LYS  28          1HZ       LYS  28  -7.512  -1.549   9.809
  206   2HZ   LYS  28          2HZ       LYS  28  -6.756  -0.120   9.486
  207   3HZ   LYS  28          3HZ       LYS  28  -8.379  -0.149   9.771
  208    H    LEU  29           H        LEU  29  -3.410  -4.196   4.998
  209    HA   LEU  29           HA       LEU  29  -2.651  -4.563   7.656
  210   1HB   LEU  29          1HB       LEU  29  -2.736  -6.292   5.862
  211   2HB   LEU  29          2HB       LEU  29  -1.331  -5.551   5.097
  212    HG   LEU  29           HG       LEU  29   0.026  -6.074   7.158
  213   1HD1  LEU  29          1HD1      LEU  29  -1.778  -6.322   8.829
  214   2HD1  LEU  29          2HD1      LEU  29  -2.468  -7.674   7.901
  215   3HD1  LEU  29          3HD1      LEU  29  -0.877  -7.836   8.672
  216   1HD2  LEU  29          1HD2      LEU  29   0.129  -7.468   5.162
  217   2HD2  LEU  29          2HD2      LEU  29   0.207  -8.486   6.612
  218   3HD2  LEU  29          3HD2      LEU  29  -1.305  -8.379   5.683
  219    H    SER  30           H        SER  30  -0.812  -3.142   4.941
  220    HA   SER  30           HA       SER  30   1.622  -2.756   6.473
  221   1HB   SER  30          1HB       SER  30   2.361  -1.539   4.442
  222   2HB   SER  30          2HB       SER  30   1.721  -3.156   4.080
  223    HG   SER  30           HG       SER  30  -0.202  -2.210   3.434
  224    H    GLY  31           H        GLY  31  -1.127  -0.734   5.542
  225   1HA   GLY  31          1HA       GLY  31  -1.738   1.180   6.943
  226   2HA   GLY  31          2HA       GLY  31  -0.027   1.613   7.050
  227    H    CYS  32           H        CYS  32  -0.250   0.491   3.948
  228    HA   CYS  32           HA       CYS  32  -0.189   3.135   2.804
  229   1HB   CYS  32          1HB       CYS  32  -0.424   0.481   1.354
  230   2HB   CYS  32          2HB       CYS  32   0.186   1.995   0.716
  231    H    LYS  33           H        LYS  33  -1.573   3.694   0.879
  232    HA   LYS  33           HA       LYS  33  -4.428   2.840   1.104
  233   1HB   LYS  33          1HB       LYS  33  -3.355   5.373  -0.152
  234   2HB   LYS  33          2HB       LYS  33  -5.026   5.007   0.246
  235   1HG   LYS  33          1HG       LYS  33  -2.792   5.524   2.276
  236   2HG   LYS  33          2HG       LYS  33  -3.894   6.731   1.627
  237   1HD   LYS  33          1HD       LYS  33  -4.823   6.256   3.664
  238   2HD   LYS  33          2HD       LYS  33  -5.839   5.347   2.539
  239   1HE   LYS  33          1HE       LYS  33  -4.883   3.269   3.237
  240   2HE   LYS  33          2HE       LYS  33  -3.482   4.073   3.988
  241   1HZ   LYS  33          1HZ       LYS  33  -6.237   4.243   4.952
  242   2HZ   LYS  33          2HZ       LYS  33  -5.047   3.284   5.575
  243   3HZ   LYS  33          3HZ       LYS  33  -4.901   4.924   5.647
  244    H    ILE  34           H        ILE  34  -5.534   2.520  -0.860
  245    HA   ILE  34           HA       ILE  34  -3.930   2.367  -3.379
  246    HB   ILE  34           HB       ILE  34  -6.289   0.674  -2.464
  247   1HG1  ILE  34          1HG1      ILE  34  -4.196   0.055  -1.356
  248   2HG1  ILE  34          2HG1      ILE  34  -4.829  -1.198  -2.409
  249   1HG2  ILE  34          1HG2      ILE  34  -4.764   0.683  -5.100
  250   2HG2  ILE  34          2HG2      ILE  34  -5.854  -0.620  -4.570
  251   3HG2  ILE  34          3HG2      ILE  34  -6.487   1.006  -4.842
  252   1HD1  ILE  34          1HD1      ILE  34  -2.500   0.655  -3.094
  253   2HD1  ILE  34          2HD1      ILE  34  -2.385  -1.033  -2.589
  254   3HD1  ILE  34          3HD1      ILE  34  -3.137  -0.635  -4.138
  255    H    ILE  35           H        ILE  35  -4.456   4.077  -4.581
  256    HA   ILE  35           HA       ILE  35  -7.312   4.515  -5.146
  257    HB   ILE  35           HB       ILE  35  -7.037   6.902  -5.343
  258   1HG1  ILE  35          1HG1      ILE  35  -4.225   6.547  -4.208
  259   2HG1  ILE  35          2HG1      ILE  35  -4.655   7.113  -5.833
  260   1HG2  ILE  35          1HG2      ILE  35  -7.794   5.832  -3.186
  261   2HG2  ILE  35          2HG2      ILE  35  -6.152   6.089  -2.550
  262   3HG2  ILE  35          3HG2      ILE  35  -7.167   7.471  -3.020
  263   1HD1  ILE  35          1HD1      ILE  35  -5.163   8.549  -3.208
  264   2HD1  ILE  35          2HD1      ILE  35  -4.145   9.062  -4.555
  265   3HD1  ILE  35          3HD1      ILE  35  -5.904   9.033  -4.756
  266    H    SER  36           H        SER  36  -7.725   4.883  -7.293
  267    HA   SER  36           HA       SER  36  -5.513   4.226  -9.165
  268   1HB   SER  36          1HB       SER  36  -8.531   4.182  -9.539
  269   2HB   SER  36          2HB       SER  36  -7.309   3.554 -10.666
  270    HG   SER  36           HG       SER  36  -8.172   1.914  -9.337
  271    H    ALA  37           H        ALA  37  -5.845   6.960  -8.006
  272    HA   ALA  37           HA       ALA  37  -6.922   8.611 -10.177
  273   1HB   ALA  37          1HB       ALA  37  -5.582   9.353  -7.548
  274   2HB   ALA  37          2HB       ALA  37  -6.491  10.441  -8.623
  275   3HB   ALA  37          3HB       ALA  37  -7.329   9.122  -7.787
  276    H    SER  38           H        SER  38  -4.029   6.999  -9.892
  277    HA   SER  38           HA       SER  38  -1.900   7.272 -10.460
  278   1HB   SER  38          1HB       SER  38  -3.022   7.653 -12.657
  279   2HB   SER  38          2HB       SER  38  -2.866   9.397 -12.382
  280    HG   SER  38           HG       SER  38  -1.110   8.583 -13.575
  281    H    THR  39           H        THR  39  -2.774   8.700  -8.160
  282    HA   THR  39           HA       THR  39  -0.721  10.794  -7.889
  283    HB   THR  39           HB       THR  39  -3.699  11.261  -7.368
  284    HG1  THR  39           1HG      THR  39  -1.987  11.994  -9.470
  285   1HG2  THR  39          1HG2      THR  39  -3.002  13.665  -7.149
  286   2HG2  THR  39          2HG2      THR  39  -2.434  12.658  -5.826
  287   3HG2  THR  39          3HG2      THR  39  -1.308  13.140  -7.124
  288    H    CYS  40           H        CYS  40  -0.699  11.491  -5.496
  289    HA   CYS  40           HA       CYS  40  -1.897   9.593  -3.620
  290   1HB   CYS  40          1HB       CYS  40   1.083  10.235  -3.783
  291   2HB   CYS  40          2HB       CYS  40   0.310   9.593  -2.339
  292    HA   PRO  41           HA       PRO  41  -2.520  13.483  -1.568
  293   1HB   PRO  41          1HB       PRO  41  -3.166  12.729   0.958
  294   2HB   PRO  41          2HB       PRO  41  -4.205  12.309  -0.436
  295   1HG   PRO  41          1HG       PRO  41  -2.066  10.589   0.844
  296   2HG   PRO  41          2HG       PRO  41  -3.773  10.137   0.535
  297   1HD   PRO  41          1HD       PRO  41  -1.787   9.464  -1.191
  298   2HD   PRO  41          2HD       PRO  41  -3.384   9.985  -1.801
  299    H    SER  42           H        SER  42  -1.575  14.889   0.035
  300    HA   SER  42           HA       SER  42   1.268  14.525   0.468
  301   1HB   SER  42          1HB       SER  42   0.232  16.693  -0.125
  302   2HB   SER  42          2HB       SER  42  -0.613  16.717   1.435
  303    HG   SER  42           HG       SER  42   1.372  17.871   1.461
  304    H    ASP  43           H        ASP  43   0.897  12.490   1.644
  305    HA   ASP  43           HA       ASP  43   1.127  12.718   4.505
  306   1HB   ASP  43          1HB       ASP  43  -1.375  12.947   4.268
  307   2HB   ASP  43          2HB       ASP  43  -1.402  11.408   3.398
  308    HD2  ASP  43           HD       ASP  43  -0.604  12.942   6.404
  309    H    TYR  44           H        TYR  44   0.358  10.676   1.677
  310    HA   TYR  44           HA       TYR  44   2.184   8.509   2.648
  311   1HB   TYR  44          1HB       TYR  44  -0.214   8.407   0.800
  312   2HB   TYR  44          2HB       TYR  44   0.891   7.082   1.148
  313    HD1  TYR  44           1HD      TYR  44   1.155   6.264   3.482
  314    HD2  TYR  44           2HD      TYR  44  -2.049   8.887   2.376
  315    HE1  TYR  44           1HE      TYR  44  -0.169   5.416   5.391
  316    HE2  TYR  44           2HE      TYR  44  -3.377   8.080   4.299
  317    HH   TYR  44           HH       TYR  44  -2.229   5.386   6.382
  318    HA   PRO  45           HA       PRO  45   3.847  10.947  -0.907
  319   1HB   PRO  45          1HB       PRO  45   6.485  11.152  -0.218
  320   2HB   PRO  45          2HB       PRO  45   5.188  12.124   0.533
  321   1HG   PRO  45          1HG       PRO  45   6.319   9.512   1.577
  322   2HG   PRO  45          2HG       PRO  45   6.200  11.068   2.456
  323   1HD   PRO  45          1HD       PRO  45   4.311   9.190   2.742
  324   2HD   PRO  45          2HD       PRO  45   3.825  10.901   2.519
  325    H    LYS  46           H        LYS  46   4.946   7.708   0.133
  326    HA   LYS  46           HA       LYS  46   6.363   7.348  -2.480
  327   1HB   LYS  46          1HB       LYS  46   6.518   5.823   0.140
  328   2HB   LYS  46          2HB       LYS  46   7.023   5.142  -1.395
  329   1HG   LYS  46          1HG       LYS  46   8.993   5.960  -0.544
  330   2HG   LYS  46          2HG       LYS  46   8.528   7.087  -1.811
  331   1HD   LYS  46          1HD       LYS  46   9.426   8.273   0.074
  332   2HD   LYS  46          2HD       LYS  46   7.717   8.683  -0.070
  333   1HE   LYS  46          1HE       LYS  46   7.143   7.178   1.767
  334   2HE   LYS  46          2HE       LYS  46   8.776   6.481   1.769
  335   1HZ   LYS  46          1HZ       LYS  46   8.135   9.251   2.492
  336   2HZ   LYS  46          2HZ       LYS  46   8.391   8.019   3.550
  337   3HZ   LYS  46          3HZ       LYS  46   9.617   8.532   2.568
  Start of MODEL    5
    1   1H    LYS   1          1H        LYS   1  -2.636   6.888  -7.870
    2   2H    LYS   1          2H        LYS   1  -2.787   5.563  -6.923
    3   3H    LYS   1          3H        LYS   1  -1.850   6.833  -6.429
    4    HA   LYS   1           HA       LYS   1  -1.386   5.015  -8.669
    5   1HB   LYS   1          1HB       LYS   1   0.645   6.291  -9.204
    6   2HB   LYS   1          2HB       LYS   1  -0.822   7.248  -9.376
    7   1HG   LYS   1          1HG       LYS   1  -0.406   8.343  -7.201
    8   2HG   LYS   1          2HG       LYS   1   1.077   7.385  -6.989
    9   1HD   LYS   1          1HD       LYS   1   2.038   8.396  -9.013
   10   2HD   LYS   1          2HD       LYS   1   0.530   9.287  -9.310
   11   1HE   LYS   1          1HE       LYS   1   0.825  10.486  -7.141
   12   2HE   LYS   1          2HE       LYS   1   2.357   9.626  -6.890
   13   1HZ   LYS   1          1HZ       LYS   1   1.752  11.430  -9.129
   14   2HZ   LYS   1          2HZ       LYS   1   2.686  11.794  -7.822
   15   3HZ   LYS   1          3HZ       LYS   1   3.179  10.641  -8.889
   16    H    SER   2           H        SER   2  -1.649   4.477  -5.752
   17    HA   SER   2           HA       SER   2  -0.784   3.309  -4.133
   18   1HB   SER   2          1HB       SER   2   0.750   1.609  -4.417
   19   2HB   SER   2          2HB       SER   2  -0.014   1.778  -6.004
   20    HG   SER   2           HG       SER   2   1.899   3.103  -6.512
   21    H    CYS   3           H        CYS   3   0.010   4.228  -2.313
   22    HA   CYS   3           HA       CYS   3   2.718   5.375  -2.332
   23   1HB   CYS   3          1HB       CYS   3   0.318   7.083  -1.619
   24   2HB   CYS   3          2HB       CYS   3   1.995   7.419  -1.179
   25    H    CYS   4           H        CYS   4   3.753   5.000  -0.519
   26    HA   CYS   4           HA       CYS   4   2.305   3.807   1.788
   27   1HB   CYS   4          1HB       CYS   4   5.049   3.391   0.575
   28   2HB   CYS   4          2HB       CYS   4   4.633   2.755   2.155
   29    HA   PRO   5           HA       PRO   5   3.880   7.004   4.430
   30   1HB   PRO   5          1HB       PRO   5   4.492   5.681   6.750
   31   2HB   PRO   5          2HB       PRO   5   2.829   5.984   6.193
   32   1HG   PRO   5          1HG       PRO   5   4.446   3.453   5.794
   33   2HG   PRO   5          2HG       PRO   5   2.782   3.606   6.426
   34   1HD   PRO   5          1HD       PRO   5   3.202   3.012   3.841
   35   2HD   PRO   5          2HD       PRO   5   1.932   4.165   4.276
   36    H    ASN   6           H        ASN   6   5.852   4.040   4.036
   37    HA   ASN   6           HA       ASN   6   8.348   5.486   3.767
   38   1HB   ASN   6          1HB       ASN   6   9.380   4.464   5.816
   39   2HB   ASN   6          2HB       ASN   6   8.184   5.711   6.148
   40   1HD2  ASN   6          2HD2      ASN   6   6.648   5.223   7.653
   41   2HD2  ASN   6          1HD2      ASN   6   6.167   3.605   8.118
   42    H    THR   7           H        THR   7  10.192   3.819   3.859
   43    HA   THR   7           HA       THR   7   9.898   1.947   1.838
   44    HB   THR   7           HB       THR   7  11.973   1.929   4.068
   45    HG1  THR   7           1HG      THR   7  13.052   3.416   2.764
   46   1HG2  THR   7          1HG2      THR   7  13.479   1.116   2.270
   47   2HG2  THR   7          2HG2      THR   7  12.137  -0.010   2.529
   48   3HG2  THR   7          3HG2      THR   7  12.115   1.088   1.132
   49    H    THR   8           H        THR   8   9.666   1.465   5.404
   50    HA   THR   8           HA       THR   8   9.564  -1.381   5.284
   51    HB   THR   8           HB       THR   8   8.312   0.330   7.454
   52    HG1  THR   8           1HG      THR   8  10.402   0.328   8.344
   53   1HG2  THR   8          1HG2      THR   8   9.681  -2.399   7.431
   54   2HG2  THR   8          2HG2      THR   8   9.070  -1.564   8.872
   55   3HG2  THR   8          3HG2      THR   8   7.939  -2.108   7.620
   56    H    GLY   9           H        GLY   9   7.090   1.179   5.043
   57   1HA   GLY   9          1HA       GLY   9   4.727  -0.370   4.988
   58   2HA   GLY   9          2HA       GLY   9   5.006   1.148   4.119
   59    H    ARG  10           H        ARG  10   6.896   0.627   2.259
   60    HA   ARG  10           HA       ARG  10   5.555  -0.870   0.253
   61   1HB   ARG  10          1HB       ARG  10   8.435   0.078   0.491
   62   2HB   ARG  10          2HB       ARG  10   7.847  -0.791  -0.927
   63   1HG   ARG  10          1HG       ARG  10   6.539   1.748   0.088
   64   2HG   ARG  10          2HG       ARG  10   7.870   1.747  -1.073
   65   1HD   ARG  10          1HD       ARG  10   6.604   0.463  -2.690
   66   2HD   ARG  10          2HD       ARG  10   5.247   0.268  -1.573
   67    HE   ARG  10           HE       ARG  10   5.768   3.044  -1.860
   68   1HH1  ARG  10          1HH2      ARG  10   4.382   0.338  -3.732
   69   2HH1  ARG  10          2HH2      ARG  10   3.394   1.405  -4.709
   70   1HH2  ARG  10          1HH1      ARG  10   4.526   4.354  -3.139
   71   2HH2  ARG  10          2HH1      ARG  10   3.466   3.710  -4.376
   72    H    ASN  11           H        ASN  11   8.276  -1.821   2.399
   73    HA   ASN  11           HA       ASN  11   8.721  -4.369   1.284
   74   1HB   ASN  11          1HB       ASN  11  10.269  -3.390   2.848
   75   2HB   ASN  11          2HB       ASN  11   9.049  -3.335   4.122
   76   1HD2  ASN  11          2HD2      ASN  11   8.683  -5.139   5.400
   77   2HD2  ASN  11          1HD2      ASN  11   9.583  -6.630   5.220
   78    H    ILE  12           H        ILE  12   6.508  -3.481   4.023
   79    HA   ILE  12           HA       ILE  12   5.516  -6.109   4.440
   80    HB   ILE  12           HB       ILE  12   4.314  -3.376   5.009
   81   1HG1  ILE  12          1HG1      ILE  12   5.525  -5.391   6.948
   82   2HG1  ILE  12          2HG1      ILE  12   6.522  -4.182   6.150
   83   1HG2  ILE  12          1HG2      ILE  12   3.401  -6.159   5.879
   84   2HG2  ILE  12          2HG2      ILE  12   2.826  -4.661   6.625
   85   3HG2  ILE  12          3HG2      ILE  12   2.466  -4.984   4.935
   86   1HD1  ILE  12          1HD1      ILE  12   4.185  -3.567   8.001
   87   2HD1  ILE  12          2HD1      ILE  12   5.911  -3.357   8.325
   88   3HD1  ILE  12          3HD1      ILE  12   5.122  -2.361   7.087
   89    H    TYR  13           H        TYR  13   4.322  -3.418   2.392
   90    HA   TYR  13           HA       TYR  13   1.968  -4.598   1.453
   91   1HB   TYR  13          1HB       TYR  13   2.615  -2.232   1.156
   92   2HB   TYR  13          2HB       TYR  13   3.858  -2.697   0.003
   93    HD1  TYR  13           1HD      TYR  13   0.245  -2.363   0.601
   94    HD2  TYR  13           2HD      TYR  13   3.253  -3.454  -2.281
   95    HE1  TYR  13           1HE      TYR  13  -1.482  -2.449  -1.169
   96    HE2  TYR  13           2HE      TYR  13   1.519  -3.570  -4.048
   97    HH   TYR  13           HH       TYR  13  -1.949  -3.028  -3.315
   98    H    ASN  14           H        ASN  14   5.221  -4.618  -0.091
   99    HA   ASN  14           HA       ASN  14   4.579  -6.313  -2.267
  100   1HB   ASN  14          1HB       ASN  14   7.151  -5.561  -0.838
  101   2HB   ASN  14          2HB       ASN  14   7.148  -6.797  -2.090
  102   1HD2  ASN  14          2HD2      ASN  14   6.163  -3.373  -1.540
  103   2HD2  ASN  14          1HD2      ASN  14   6.398  -2.901  -3.213
  104    H    THR  15           H        THR  15   5.939  -7.159   0.989
  105    HA   THR  15           HA       THR  15   6.162  -9.920   0.531
  106    HB   THR  15           HB       THR  15   5.503  -8.462   3.121
  107    HG1  THR  15           1HG      THR  15   7.747  -8.509   3.344
  108   1HG2  THR  15          1HG2      THR  15   6.688 -11.229   2.602
  109   2HG2  THR  15          2HG2      THR  15   6.621 -10.427   4.185
  110   3HG2  THR  15          3HG2      THR  15   5.120 -10.890   3.369
  111    H    CYS  16           H        CYS  16   3.321  -7.994   1.547
  112    HA   CYS  16           HA       CYS  16   1.558 -10.216   1.887
  113   1HB   CYS  16          1HB       CYS  16   1.184  -8.125   2.942
  114   2HB   CYS  16          2HB       CYS  16   1.058  -7.267   1.418
  115    H    ARG  17           H        ARG  17   2.398  -8.228  -0.997
  116    HA   ARG  17           HA       ARG  17   0.456  -9.417  -2.735
  117   1HB   ARG  17          1HB       ARG  17   3.230  -8.378  -3.463
  118   2HB   ARG  17          2HB       ARG  17   1.934  -8.758  -4.574
  119   1HG   ARG  17          1HG       ARG  17   2.042  -6.479  -2.586
  120   2HG   ARG  17          2HG       ARG  17   2.016  -6.398  -4.337
  121   1HD   ARG  17          1HD       ARG  17  -0.237  -7.225  -2.488
  122   2HD   ARG  17          2HD       ARG  17  -0.151  -5.771  -3.464
  123    HE   ARG  17           HE       ARG  17  -0.135  -7.226  -5.500
  124   1HH1  ARG  17          1HH2      ARG  17  -1.754  -8.398  -2.534
  125   2HH1  ARG  17          2HH2      ARG  17  -2.854  -9.407  -3.428
  126   1HH2  ARG  17          1HH1      ARG  17  -1.671  -8.491  -6.606
  127   2HH2  ARG  17          2HH1      ARG  17  -2.828  -9.446  -5.717
  128    H    PHE  18           H        PHE  18   3.866 -10.327  -2.035
  129    HA   PHE  18           HA       PHE  18   3.905 -12.673  -3.643
  130   1HB   PHE  18          1HB       PHE  18   5.512 -11.705  -1.274
  131   2HB   PHE  18          2HB       PHE  18   5.698 -13.352  -1.846
  132    HD1  PHE  18           1HD      PHE  18   6.362  -9.817  -2.682
  133    HD2  PHE  18           2HD      PHE  18   6.663 -13.907  -4.010
  134    HE1  PHE  18           1HE      PHE  18   7.934  -9.121  -4.453
  135    HE2  PHE  18           2HE      PHE  18   8.303 -13.215  -5.735
  136    HZ   PHE  18           HZ       PHE  18   8.935 -10.821  -5.967
  137    H    ALA  19           H        ALA  19   2.839 -12.180  -0.252
  138    HA   ALA  19           HA       ALA  19   2.445 -14.929   0.377
  139   1HB   ALA  19          1HB       ALA  19   2.561 -13.133   2.064
  140   2HB   ALA  19          2HB       ALA  19   1.019 -12.475   1.473
  141   3HB   ALA  19          3HB       ALA  19   1.070 -14.084   2.214
  142    H    GLY  20           H        GLY  20   0.306 -12.443  -1.053
  143   1HA   GLY  20          1HA       GLY  20  -1.090 -13.005  -2.879
  144   2HA   GLY  20          2HA       GLY  20  -1.392 -14.607  -2.210
  145    H    GLY  21           H        GLY  21  -1.577 -11.291  -0.788
  146   1HA   GLY  21          1HA       GLY  21  -4.370 -11.696   0.095
  147   2HA   GLY  21          2HA       GLY  21  -3.362 -10.255   0.297
  148    H    SER  22           H        SER  22  -5.427  -9.162  -0.482
  149    HA   SER  22           HA       SER  22  -5.382  -8.880  -3.457
  150   1HB   SER  22          1HB       SER  22  -7.330  -7.453  -3.166
  151   2HB   SER  22          2HB       SER  22  -7.629  -9.056  -2.487
  152    HG   SER  22           HG       SER  22  -8.316  -7.410  -1.080
  153    H    ARG  23           H        ARG  23  -5.077  -6.681  -4.244
  154    HA   ARG  23           HA       ARG  23  -2.909  -5.276  -3.122
  155   1HB   ARG  23          1HB       ARG  23  -5.131  -4.308  -4.981
  156   2HB   ARG  23          2HB       ARG  23  -3.695  -3.379  -4.557
  157   1HG   ARG  23          1HG       ARG  23  -2.374  -5.534  -5.353
  158   2HG   ARG  23          2HG       ARG  23  -3.896  -5.938  -6.164
  159   1HD   ARG  23          1HD       ARG  23  -2.538  -4.779  -7.739
  160   2HD   ARG  23          2HD       ARG  23  -3.792  -3.623  -7.240
  161    HE   ARG  23           HE       ARG  23  -1.520  -3.350  -5.531
  162   1HH1  ARG  23          1HH2      ARG  23  -2.473  -2.646  -8.881
  163   2HH1  ARG  23          2HH2      ARG  23  -1.281  -1.387  -9.082
  164   1HH2  ARG  23          1HH1      ARG  23   0.038  -1.734  -5.813
  165   2HH2  ARG  23          2HH1      ARG  23   0.165  -0.869  -7.326
  166    H    GLU  24           H        GLU  24  -6.419  -4.713  -2.740
  167    HA   GLU  24           HA       GLU  24  -6.210  -2.339  -1.192
  168   1HB   GLU  24          1HB       GLU  24  -8.409  -4.445  -1.339
  169   2HB   GLU  24          2HB       GLU  24  -8.555  -2.876  -0.527
  170   1HG   GLU  24          1HG       GLU  24  -8.064  -1.716  -2.675
  171   2HG   GLU  24          2HG       GLU  24  -7.964  -3.284  -3.494
  172    HE2  GLU  24           HE       GLU  24 -11.587  -1.914  -2.246
  173    H    ARG  25           H        ARG  25  -6.681  -5.787  -0.126
  174    HA   ARG  25           HA       ARG  25  -6.736  -5.252   2.635
  175   1HB   ARG  25          1HB       ARG  25  -7.393  -7.347   1.491
  176   2HB   ARG  25          2HB       ARG  25  -5.694  -7.729   1.184
  177   1HG   ARG  25          1HG       ARG  25  -5.219  -7.920   3.538
  178   2HG   ARG  25          2HG       ARG  25  -6.791  -7.237   3.991
  179   1HD   ARG  25          1HD       ARG  25  -6.433  -9.867   2.486
  180   2HD   ARG  25          2HD       ARG  25  -6.634  -9.712   4.243
  181    HE   ARG  25           HE       ARG  25  -8.745  -8.318   2.943
  182   1HH1  ARG  25          1HH2      ARG  25  -7.685 -11.649   3.577
  183   2HH1  ARG  25          2HH2      ARG  25  -9.307 -12.288   3.607
  184   1HH2  ARG  25          1HH1      ARG  25 -10.862  -9.172   2.982
  185   2HH2  ARG  25          2HH1      ARG  25 -11.121 -10.875   3.262
  186    H    CYS  26           H        CYS  26  -3.997  -6.031   0.479
  187    HA   CYS  26           HA       CYS  26  -1.957  -5.940   2.460
  188   1HB   CYS  26          1HB       CYS  26  -1.841  -5.396  -0.528
  189   2HB   CYS  26          2HB       CYS  26  -0.441  -5.589   0.523
  190    H    ALA  27           H        ALA  27  -3.432  -3.330   0.494
  191    HA   ALA  27           HA       ALA  27  -1.693  -1.233   1.262
  192   1HB   ALA  27          1HB       ALA  27  -3.581  -1.237  -0.493
  193   2HB   ALA  27          2HB       ALA  27  -4.680  -0.862   0.839
  194   3HB   ALA  27          3HB       ALA  27  -3.353   0.233   0.454
  195    H    LYS  28           H        LYS  28  -4.816  -2.263   2.746
  196    HA   LYS  28           HA       LYS  28  -4.758  -0.545   4.978
  197   1HB   LYS  28          1HB       LYS  28  -6.052  -3.205   4.347
  198   2HB   LYS  28          2HB       LYS  28  -6.035  -2.641   6.010
  199   1HG   LYS  28          1HG       LYS  28  -8.084  -1.918   5.060
  200   2HG   LYS  28          2HG       LYS  28  -7.081  -0.479   5.289
  201   1HD   LYS  28          1HD       LYS  28  -6.514  -0.481   2.872
  202   2HD   LYS  28          2HD       LYS  28  -7.437  -1.995   2.675
  203   1HE   LYS  28          1HE       LYS  28  -9.500  -0.795   3.413
  204   2HE   LYS  28          2HE       LYS  28  -8.569   0.715   3.473
  205   1HZ   LYS  28          1HZ       LYS  28  -8.973  -0.963   1.092
  206   2HZ   LYS  28          2HZ       LYS  28  -9.758   0.449   1.417
  207   3HZ   LYS  28          3HZ       LYS  28  -8.134   0.455   1.136
  208    H    LEU  29           H        LEU  29  -3.584  -3.931   4.758
  209    HA   LEU  29           HA       LEU  29  -2.679  -4.263   7.354
  210   1HB   LEU  29          1HB       LEU  29  -2.901  -6.060   5.695
  211   2HB   LEU  29          2HB       LEU  29  -1.594  -5.360   4.736
  212    HG   LEU  29           HG       LEU  29   0.021  -5.830   6.582
  213   1HD1  LEU  29          1HD1      LEU  29  -1.503  -5.844   8.524
  214   2HD1  LEU  29          2HD1      LEU  29  -2.358  -7.256   7.861
  215   3HD1  LEU  29          3HD1      LEU  29  -0.666  -7.392   8.383
  216   1HD2  LEU  29          1HD2      LEU  29  -1.594  -8.183   5.529
  217   2HD2  LEU  29          2HD2      LEU  29  -0.227  -7.374   4.734
  218   3HD2  LEU  29          3HD2      LEU  29   0.037  -8.287   6.229
  219    H    SER  30           H        SER  30  -0.901  -2.970   4.539
  220    HA   SER  30           HA       SER  30   1.616  -2.676   5.951
  221   1HB   SER  30          1HB       SER  30   2.345  -1.570   3.893
  222   2HB   SER  30          2HB       SER  30   1.505  -3.092   3.529
  223    HG   SER  30           HG       SER  30  -0.360  -1.867   3.074
  224    H    GLY  31           H        GLY  31  -1.134  -0.582   5.209
  225   1HA   GLY  31          1HA       GLY  31  -1.642   1.395   6.464
  226   2HA   GLY  31          2HA       GLY  31   0.081   1.702   6.714
  227    H    CYS  32           H        CYS  32  -0.015   0.585   3.577
  228    HA   CYS  32           HA       CYS  32   0.259   3.240   2.465
  229   1HB   CYS  32          1HB       CYS  32   0.007   0.607   0.969
  230   2HB   CYS  32          2HB       CYS  32   0.733   2.090   0.392
  231    H    LYS  33           H        LYS  33  -0.981   4.008   0.613
  232    HA   LYS  33           HA       LYS  33  -3.870   3.248   0.626
  233   1HB   LYS  33          1HB       LYS  33  -2.520   5.673  -0.598
  234   2HB   LYS  33          2HB       LYS  33  -4.254   5.381  -0.452
  235   1HG   LYS  33          1HG       LYS  33  -2.294   5.882   1.826
  236   2HG   LYS  33          2HG       LYS  33  -3.400   7.045   1.102
  237   1HD   LYS  33          1HD       LYS  33  -4.567   6.523   2.960
  238   2HD   LYS  33          2HD       LYS  33  -5.308   5.402   1.817
  239   1HE   LYS  33          1HE       LYS  33  -4.337   3.538   2.859
  240   2HE   LYS  33          2HE       LYS  33  -2.937   4.456   3.449
  241   1HZ   LYS  33          1HZ       LYS  33  -5.643   4.700   4.521
  242   2HZ   LYS  33          2HZ       LYS  33  -4.413   3.823   5.186
  243   3HZ   LYS  33          3HZ       LYS  33  -4.278   5.459   5.069
  244    H    ILE  34           H        ILE  34  -4.667   2.262  -1.151
  245    HA   ILE  34           HA       ILE  34  -3.215   2.448  -3.754
  246    HB   ILE  34           HB       ILE  34  -4.930   0.229  -2.570
  247   1HG1  ILE  34          1HG1      ILE  34  -2.472   0.303  -1.953
  248   2HG1  ILE  34          2HG1      ILE  34  -3.064  -1.171  -2.720
  249   1HG2  ILE  34          1HG2      ILE  34  -3.995   0.601  -5.442
  250   2HG2  ILE  34          2HG2      ILE  34  -4.539  -0.953  -4.766
  251   3HG2  ILE  34          3HG2      ILE  34  -5.655   0.410  -4.852
  252   1HD1  ILE  34          1HD1      ILE  34  -1.591   1.029  -4.215
  253   2HD1  ILE  34          2HD1      ILE  34  -0.825  -0.418  -3.548
  254   3HD1  ILE  34          3HD1      ILE  34  -2.035  -0.576  -4.832
  255    H    ILE  35           H        ILE  35  -4.198   4.049  -4.800
  256    HA   ILE  35           HA       ILE  35  -7.106   3.860  -5.212
  257    HB   ILE  35           HB       ILE  35  -7.368   6.276  -5.147
  258   1HG1  ILE  35          1HG1      ILE  35  -4.524   6.415  -4.038
  259   2HG1  ILE  35          2HG1      ILE  35  -5.058   6.999  -5.622
  260   1HG2  ILE  35          1HG2      ILE  35  -6.229   5.328  -2.488
  261   2HG2  ILE  35          2HG2      ILE  35  -7.522   6.514  -2.758
  262   3HG2  ILE  35          3HG2      ILE  35  -7.804   4.816  -3.133
  263   1HD1  ILE  35          1HD1      ILE  35  -6.643   8.566  -4.486
  264   2HD1  ILE  35          2HD1      ILE  35  -5.923   8.094  -2.926
  265   3HD1  ILE  35          3HD1      ILE  35  -4.933   8.886  -4.153
  266    H    SER  36           H        SER  36  -7.727   4.337  -7.282
  267    HA   SER  36           HA       SER  36  -5.558   4.343  -9.299
  268   1HB   SER  36          1HB       SER  36  -8.538   3.807  -9.575
  269   2HB   SER  36          2HB       SER  36  -7.289   3.526 -10.803
  270    HG   SER  36           HG       SER  36  -6.330   2.033  -9.356
  271    H    ALA  37           H        ALA  37  -6.192   6.838  -7.857
  272    HA   ALA  37           HA       ALA  37  -7.660   8.519  -9.779
  273   1HB   ALA  37          1HB       ALA  37  -7.991   8.756  -7.342
  274   2HB   ALA  37          2HB       ALA  37  -6.272   9.165  -7.150
  275   3HB   ALA  37          3HB       ALA  37  -7.351  10.242  -8.066
  276    H    SER  38           H        SER  38  -4.690   7.235 -10.044
  277    HA   SER  38           HA       SER  38  -2.623   7.792 -10.682
  278   1HB   SER  38          1HB       SER  38  -3.913   8.380 -12.705
  279   2HB   SER  38          2HB       SER  38  -4.021  10.057 -12.136
  280    HG   SER  38           HG       SER  38  -1.712  10.072 -12.147
  281    H    THR  39           H        THR  39  -3.554   8.894  -8.128
  282    HA   THR  39           HA       THR  39  -1.719  11.152  -7.671
  283    HB   THR  39           HB       THR  39  -4.744  11.237  -7.203
  284    HG1  THR  39           1HG      THR  39  -4.316  11.625  -9.330
  285   1HG2  THR  39          1HG2      THR  39  -4.304  13.667  -6.677
  286   2HG2  THR  39          2HG2      THR  39  -3.723  12.551  -5.446
  287   3HG2  THR  39          3HG2      THR  39  -2.572  13.288  -6.596
  288    H    CYS  40           H        CYS  40  -1.653  11.619  -5.302
  289    HA   CYS  40           HA       CYS  40  -2.758   9.597  -3.484
  290   1HB   CYS  40          1HB       CYS  40   0.166  10.443  -3.553
  291   2HB   CYS  40          2HB       CYS  40  -0.592   9.505  -2.267
  292    HA   PRO  41           HA       PRO  41  -3.293  13.533  -1.335
  293   1HB   PRO  41          1HB       PRO  41  -3.887  12.748   1.195
  294   2HB   PRO  41          2HB       PRO  41  -4.988  12.426  -0.175
  295   1HG   PRO  41          1HG       PRO  41  -2.939  10.540   1.021
  296   2HG   PRO  41          2HG       PRO  41  -4.666  10.209   0.701
  297   1HD   PRO  41          1HD       PRO  41  -2.692   9.490  -1.049
  298   2HD   PRO  41          2HD       PRO  41  -4.288  10.048  -1.632
  299    H    SER  42           H        SER  42  -2.176  14.876   0.227
  300    HA   SER  42           HA       SER  42   0.657  14.303   0.441
  301   1HB   SER  42          1HB       SER  42  -0.270  16.537  -0.101
  302   2HB   SER  42          2HB       SER  42  -0.939  16.647   1.539
  303    HG   SER  42           HG       SER  42   1.139  17.621   1.327
  304    H    ASP  43           H        ASP  43   0.210  12.312   1.674
  305    HA   ASP  43           HA       ASP  43   0.542  12.724   4.584
  306   1HB   ASP  43          1HB       ASP  43  -1.615  10.970   3.328
  307   2HB   ASP  43          2HB       ASP  43  -1.108  10.867   5.019
  308    HD2  ASP  43           HD       ASP  43  -2.576  13.962   5.918
  309    H    TYR  44           H        TYR  44   0.529  10.544   1.749
  310    HA   TYR  44           HA       TYR  44   2.539   8.770   3.054
  311   1HB   TYR  44          1HB       TYR  44   0.578   8.201   0.820
  312   2HB   TYR  44          2HB       TYR  44   1.730   7.077   1.525
  313    HD1  TYR  44           1HD      TYR  44   1.504   6.403   3.937
  314    HD2  TYR  44           2HD      TYR  44  -1.485   8.801   2.004
  315    HE1  TYR  44           1HE      TYR  44  -0.109   5.768   5.695
  316    HE2  TYR  44           2HE      TYR  44  -3.089   8.251   3.806
  317    HH   TYR  44           HH       TYR  44  -2.264   6.015   6.486
  318    HA   PRO  45           HA       PRO  45   4.781  11.065  -0.167
  319   1HB   PRO  45          1HB       PRO  45   7.293  11.005   0.844
  320   2HB   PRO  45          2HB       PRO  45   5.983  11.963   1.594
  321   1HG   PRO  45          1HG       PRO  45   6.924   9.198   2.396
  322   2HG   PRO  45          2HG       PRO  45   6.696  10.618   3.452
  323   1HD   PRO  45          1HD       PRO  45   4.790   8.693   3.152
  324   2HD   PRO  45          2HD       PRO  45   4.346  10.414   3.363
  325    H    LYS  46           H        LYS  46   5.341   7.672   0.712
  326    HA   LYS  46           HA       LYS  46   7.257   7.340  -1.545
  327   1HB   LYS  46          1HB       LYS  46   6.545   5.342   0.621
  328   2HB   LYS  46          2HB       LYS  46   7.867   5.266  -0.544
  329   1HG   LYS  46          1HG       LYS  46   7.532   7.042   1.879
  330   2HG   LYS  46          2HG       LYS  46   8.788   5.848   1.551
  331   1HD   LYS  46          1HD       LYS  46   8.493   8.533   0.129
  332   2HD   LYS  46          2HD       LYS  46   9.632   8.139   1.413
  333   1HE   LYS  46          1HE       LYS  46  10.700   6.428  -0.011
  334   2HE   LYS  46          2HE       LYS  46   9.572   6.801  -1.328
  335   1HZ   LYS  46          1HZ       LYS  46  11.472   8.693  -0.139
  336   2HZ   LYS  46          2HZ       LYS  46  11.646   7.930  -1.590
  337   3HZ   LYS  46          3HZ       LYS  46  10.427   9.017  -1.372
  Start of MODEL    6
    1   1H    LYS   1          1H        LYS   1  -2.901   3.822  -9.569
    2   2H    LYS   1          2H        LYS   1  -2.991   2.677  -8.382
    3   3H    LYS   1          3H        LYS   1  -3.527   4.207  -8.089
    4    HA   LYS   1           HA       LYS   1  -0.784   3.433  -8.644
    5   1HB   LYS   1          1HB       LYS   1  -1.470   5.709  -9.439
    6   2HB   LYS   1          2HB       LYS   1  -1.828   6.152  -7.760
    7   1HG   LYS   1          1HG       LYS   1   0.567   5.751  -7.161
    8   2HG   LYS   1          2HG       LYS   1   0.872   5.172  -8.804
    9   1HD   LYS   1          1HD       LYS   1   1.687   7.379  -8.775
   10   2HD   LYS   1          2HD       LYS   1   0.158   7.459  -9.662
   11   1HE   LYS   1          1HE       LYS   1  -0.956   8.281  -7.548
   12   2HE   LYS   1          2HE       LYS   1   0.619   8.201  -6.736
   13   1HZ   LYS   1          1HZ       LYS   1   1.440   9.802  -8.309
   14   2HZ   LYS   1          2HZ       LYS   1  -0.046   9.912  -9.024
   15   3HZ   LYS   1          3HZ       LYS   1   0.154  10.388  -7.464
   16    H    SER   2           H        SER   2   0.409   2.815  -6.927
   17    HA   SER   2           HA       SER   2  -0.902   2.560  -4.298
   18   1HB   SER   2          1HB       SER   2   0.072   0.573  -5.379
   19   2HB   SER   2          2HB       SER   2   1.658   1.360  -5.421
   20    HG   SER   2           HG       SER   2   1.542   1.437  -3.107
   21    H    CYS   3           H        CYS   3  -0.193   3.625  -2.512
   22    HA   CYS   3           HA       CYS   3   2.190   5.426  -2.633
   23   1HB   CYS   3          1HB       CYS   3  -0.714   6.163  -2.129
   24   2HB   CYS   3          2HB       CYS   3   0.647   7.208  -1.709
   25    H    CYS   4           H        CYS   4   3.365   5.033  -0.844
   26    HA   CYS   4           HA       CYS   4   2.036   3.830   1.539
   27   1HB   CYS   4          1HB       CYS   4   4.731   3.391   0.229
   28   2HB   CYS   4          2HB       CYS   4   4.384   2.821   1.850
   29    HA   PRO   5           HA       PRO   5   3.716   7.104   4.031
   30   1HB   PRO   5          1HB       PRO   5   4.257   5.837   6.403
   31   2HB   PRO   5          2HB       PRO   5   2.613   6.203   5.838
   32   1HG   PRO   5          1HG       PRO   5   4.101   3.584   5.572
   33   2HG   PRO   5          2HG       PRO   5   2.426   3.849   6.135
   34   1HD   PRO   5          1HD       PRO   5   2.939   3.105   3.593
   35   2HD   PRO   5          2HD       PRO   5   1.669   4.295   3.933
   36    H    ASN   6           H        ASN   6   5.592   4.047   3.854
   37    HA   ASN   6           HA       ASN   6   8.108   5.464   3.568
   38   1HB   ASN   6          1HB       ASN   6   9.083   4.544   5.684
   39   2HB   ASN   6          2HB       ASN   6   7.873   5.795   5.933
   40   1HD2  ASN   6          2HD2      ASN   6   6.273   5.352   7.404
   41   2HD2  ASN   6          1HD2      ASN   6   5.803   3.748   7.921
   42    H    THR   7           H        THR   7   9.950   3.812   3.786
   43    HA   THR   7           HA       THR   7   9.641   1.835   1.842
   44    HB   THR   7           HB       THR   7  11.826   2.076   3.945
   45    HG1  THR   7           1HG      THR   7  12.746   3.496   2.447
   46   1HG2  THR   7          1HG2      THR   7  11.830   0.972   1.095
   47   2HG2  THR   7          2HG2      THR   7  13.272   1.216   2.100
   48   3HG2  THR   7          3HG2      THR   7  12.053   0.029   2.586
   49    H    THR   8           H        THR   8   9.305   1.594   5.399
   50    HA   THR   8           HA       THR   8   9.360  -1.297   5.434
   51    HB   THR   8           HB       THR   8   8.139   0.550   7.514
   52    HG1  THR   8           1HG      THR   8  10.320   1.058   7.103
   53   1HG2  THR   8          1HG2      THR   8   9.215  -2.303   7.623
   54   2HG2  THR   8          2HG2      THR   8   8.708  -1.338   9.024
   55   3HG2  THR   8          3HG2      THR   8   7.516  -1.811   7.802
   56    H    GLY   9           H        GLY   9   6.839   1.223   5.101
   57   1HA   GLY   9          1HA       GLY   9   4.525  -0.412   5.083
   58   2HA   GLY   9          2HA       GLY   9   4.734   1.123   4.222
   59    H    ARG  10           H        ARG  10   6.675   0.663   2.387
   60    HA   ARG  10           HA       ARG  10   5.478  -0.836   0.312
   61   1HB   ARG  10          1HB       ARG  10   8.358   0.038   0.762
   62   2HB   ARG  10          2HB       ARG  10   7.829  -0.761  -0.715
   63   1HG   ARG  10          1HG       ARG  10   6.514   1.784   0.296
   64   2HG   ARG  10          2HG       ARG  10   7.947   1.795  -0.739
   65   1HD   ARG  10          1HD       ARG  10   6.801   0.578  -2.501
   66   2HD   ARG  10          2HD       ARG  10   5.354   0.386  -1.498
   67    HE   ARG  10           HE       ARG  10   6.119   3.162  -1.797
   68   1HH1  ARG  10          1HH2      ARG  10   4.514   0.513  -3.532
   69   2HH1  ARG  10          2HH2      ARG  10   3.509   1.587  -4.470
   70   1HH2  ARG  10          1HH1      ARG  10   4.692   4.526  -2.895
   71   2HH2  ARG  10          2HH1      ARG  10   3.610   3.896  -4.115
   72    H    ASN  11           H        ASN  11   8.092  -1.801   2.596
   73    HA   ASN  11           HA       ASN  11   8.553  -4.358   1.501
   74   1HB   ASN  11          1HB       ASN  11  10.099  -3.450   3.067
   75   2HB   ASN  11          2HB       ASN  11   8.866  -3.261   4.311
   76   1HD2  ASN  11          2HD2      ASN  11   8.353  -4.959   5.667
   77   2HD2  ASN  11          1HD2      ASN  11   9.163  -6.510   5.597
   78    H    ILE  12           H        ILE  12   6.281  -3.460   4.191
   79    HA   ILE  12           HA       ILE  12   5.306  -6.084   4.617
   80    HB   ILE  12           HB       ILE  12   4.010  -3.375   5.082
   81   1HG1  ILE  12          1HG1      ILE  12   5.278  -5.284   7.092
   82   2HG1  ILE  12          2HG1      ILE  12   6.204  -4.017   6.303
   83   1HG2  ILE  12          1HG2      ILE  12   2.246  -5.125   4.990
   84   2HG2  ILE  12          2HG2      ILE  12   3.188  -6.144   6.094
   85   3HG2  ILE  12          3HG2      ILE  12   2.486  -4.615   6.651
   86   1HD1  ILE  12          1HD1      ILE  12   4.650  -2.292   7.184
   87   2HD1  ILE  12          2HD1      ILE  12   3.797  -3.555   8.101
   88   3HD1  ILE  12          3HD1      ILE  12   5.495  -3.208   8.446
   89    H    TYR  13           H        TYR  13   4.062  -3.442   2.536
   90    HA   TYR  13           HA       TYR  13   1.803  -4.703   1.500
   91   1HB   TYR  13          1HB       TYR  13   2.230  -2.347   1.192
   92   2HB   TYR  13          2HB       TYR  13   3.719  -2.667   0.316
   93    HD1  TYR  13           1HD      TYR  13   3.644  -2.392  -2.008
   94    HD2  TYR  13           2HD      TYR  13   0.072  -3.572   0.089
   95    HE1  TYR  13           1HE      TYR  13   2.385  -2.350  -4.135
   96    HE2  TYR  13           2HE      TYR  13  -1.192  -3.536  -2.045
   97    HH   TYR  13           HH       TYR  13   0.352  -2.687  -5.165
   98    H    ASN  14           H        ASN  14   5.101  -4.602   0.052
   99    HA   ASN  14           HA       ASN  14   4.545  -6.291  -2.144
  100   1HB   ASN  14          1HB       ASN  14   7.082  -5.421  -0.737
  101   2HB   ASN  14          2HB       ASN  14   7.133  -6.649  -1.991
  102   1HD2  ASN  14          2HD2      ASN  14   6.243  -3.238  -1.407
  103   2HD2  ASN  14          1HD2      ASN  14   6.333  -2.779  -3.097
  104    H    THR  15           H        THR  15   5.773  -7.132   1.146
  105    HA   THR  15           HA       THR  15   6.255  -9.875   0.568
  106    HB   THR  15           HB       THR  15   5.560  -8.508   3.204
  107    HG1  THR  15           1HG      THR  15   8.021  -9.169   1.955
  108   1HG2  THR  15          1HG2      THR  15   6.782 -10.442   4.215
  109   2HG2  THR  15          2HG2      THR  15   5.264 -10.931   3.449
  110   3HG2  THR  15          3HG2      THR  15   6.811 -11.233   2.626
  111    H    CYS  16           H        CYS  16   3.362  -8.183   1.843
  112    HA   CYS  16           HA       CYS  16   1.746 -10.507   2.186
  113   1HB   CYS  16          1HB       CYS  16   1.269  -8.491   3.334
  114   2HB   CYS  16          2HB       CYS  16   1.155  -7.556   1.851
  115    H    ARG  17           H        ARG  17   2.077  -8.206  -0.557
  116    HA   ARG  17           HA       ARG  17   0.177  -9.378  -2.293
  117   1HB   ARG  17          1HB       ARG  17   2.774  -7.879  -2.783
  118   2HB   ARG  17          2HB       ARG  17   1.704  -8.344  -4.098
  119   1HG   ARG  17          1HG       ARG  17   0.449  -6.828  -1.816
  120   2HG   ARG  17          2HG       ARG  17   1.581  -5.951  -2.852
  121   1HD   ARG  17          1HD       ARG  17  -0.719  -5.718  -3.648
  122   2HD   ARG  17          2HD       ARG  17   0.339  -6.475  -4.832
  123    HE   ARG  17           HE       ARG  17  -1.492  -8.030  -3.014
  124   1HH1  ARG  17          1HH2      ARG  17  -0.338  -7.459  -6.358
  125   2HH1  ARG  17          2HH2      ARG  17  -1.185  -8.848  -6.977
  126   1HH2  ARG  17          1HH1      ARG  17  -2.575  -9.791  -3.884
  127   2HH2  ARG  17          2HH1      ARG  17  -2.489 -10.151  -5.592
  128    H    PHE  18           H        PHE  18   3.663 -10.086  -1.839
  129    HA   PHE  18           HA       PHE  18   3.897 -12.086  -3.836
  130   1HB   PHE  18          1HB       PHE  18   5.831 -11.010  -2.886
  131   2HB   PHE  18          2HB       PHE  18   5.432 -11.570  -1.268
  132    HD1  PHE  18           1HD      PHE  18   6.104 -13.741  -0.487
  133    HD2  PHE  18           2HD      PHE  18   6.486 -12.728  -4.662
  134    HE1  PHE  18           1HE      PHE  18   7.424 -15.804  -0.869
  135    HE2  PHE  18           2HE      PHE  18   7.799 -14.801  -5.040
  136    HZ   PHE  18           HZ       PHE  18   8.273 -16.338  -3.145
  137    H    ALA  19           H        ALA  19   3.117 -12.325  -0.329
  138    HA   ALA  19           HA       ALA  19   2.902 -15.140  -0.172
  139   1HB   ALA  19          1HB       ALA  19   2.987 -13.663   1.791
  140   2HB   ALA  19          2HB       ALA  19   1.386 -13.007   1.392
  141   3HB   ALA  19          3HB       ALA  19   1.559 -14.715   1.839
  142    H    GLY  20           H        GLY  20   0.525 -12.649  -1.115
  143   1HA   GLY  20          1HA       GLY  20  -0.798 -13.245  -3.080
  144   2HA   GLY  20          2HA       GLY  20  -1.218 -14.778  -2.316
  145    H    GLY  21           H        GLY  21  -1.069 -11.666  -0.565
  146   1HA   GLY  21          1HA       GLY  21  -3.931 -11.833   0.083
  147   2HA   GLY  21          2HA       GLY  21  -2.745 -10.694   0.730
  148    H    SER  22           H        SER  22  -5.441 -10.184  -0.499
  149    HA   SER  22           HA       SER  22  -5.249  -9.206  -3.118
  150   1HB   SER  22          1HB       SER  22  -7.044  -8.149  -0.905
  151   2HB   SER  22          2HB       SER  22  -7.347  -8.099  -2.649
  152    HG   SER  22           HG       SER  22  -8.439  -9.839  -1.677
  153    H    ARG  23           H        ARG  23  -5.115  -7.041  -3.932
  154    HA   ARG  23           HA       ARG  23  -2.922  -5.558  -3.059
  155   1HB   ARG  23          1HB       ARG  23  -5.325  -4.737  -4.726
  156   2HB   ARG  23          2HB       ARG  23  -3.871  -3.746  -4.531
  157   1HG   ARG  23          1HG       ARG  23  -2.468  -5.484  -5.510
  158   2HG   ARG  23          2HG       ARG  23  -3.850  -6.584  -5.669
  159   1HD   ARG  23          1HD       ARG  23  -3.635  -3.847  -6.982
  160   2HD   ARG  23          2HD       ARG  23  -3.259  -5.361  -7.799
  161    HE   ARG  23           HE       ARG  23  -5.890  -4.264  -7.111
  162   1HH1  ARG  23          1HH2      ARG  23  -4.159  -7.235  -8.002
  163   2HH1  ARG  23          2HH2      ARG  23  -5.587  -8.034  -8.606
  164   1HH2  ARG  23          1HH1      ARG  23  -7.750  -5.316  -7.941
  165   2HH2  ARG  23          2HH1      ARG  23  -7.632  -6.942  -8.565
  166    H    GLU  24           H        GLU  24  -6.379  -4.723  -2.656
  167    HA   GLU  24           HA       GLU  24  -6.055  -2.411  -1.089
  168   1HB   GLU  24          1HB       GLU  24  -8.311  -4.466  -1.160
  169   2HB   GLU  24          2HB       GLU  24  -8.402  -2.887  -0.360
  170   1HG   GLU  24          1HG       GLU  24  -7.962  -1.756  -2.531
  171   2HG   GLU  24          2HG       GLU  24  -7.880  -3.328  -3.339
  172    HE2  GLU  24           HE       GLU  24  -9.972  -1.455  -1.259
  173    H    ARG  25           H        ARG  25  -6.473  -5.836  -0.048
  174    HA   ARG  25           HA       ARG  25  -6.632  -5.319   2.698
  175   1HB   ARG  25          1HB       ARG  25  -7.246  -7.393   1.408
  176   2HB   ARG  25          2HB       ARG  25  -5.540  -7.847   1.375
  177   1HG   ARG  25          1HG       ARG  25  -5.471  -8.059   3.786
  178   2HG   ARG  25          2HG       ARG  25  -7.014  -7.207   3.962
  179   1HD   ARG  25          1HD       ARG  25  -7.432  -9.536   4.304
  180   2HD   ARG  25          2HD       ARG  25  -8.196  -9.015   2.794
  181    HE   ARG  25           HE       ARG  25  -5.506 -10.155   2.503
  182   1HH1  ARG  25          1HH2      ARG  25  -8.982 -10.914   2.586
  183   2HH1  ARG  25          2HH2      ARG  25  -8.789 -12.450   1.784
  184   1HH2  ARG  25          1HH1      ARG  25  -5.275 -12.222   1.539
  185   2HH2  ARG  25          2HH1      ARG  25  -6.680 -13.182   1.164
  186    H    CYS  26           H        CYS  26  -3.806  -6.268   0.717
  187    HA   CYS  26           HA       CYS  26  -1.858  -6.227   2.790
  188   1HB   CYS  26          1HB       CYS  26  -1.621  -5.742  -0.211
  189   2HB   CYS  26          2HB       CYS  26  -0.259  -5.979   0.881
  190    H    ALA  27           H        ALA  27  -3.043  -3.661   0.588
  191    HA   ALA  27           HA       ALA  27  -1.188  -1.664   1.371
  192   1HB   ALA  27          1HB       ALA  27  -4.034  -1.346   0.361
  193   2HB   ALA  27          2HB       ALA  27  -2.743  -0.127   0.329
  194   3HB   ALA  27          3HB       ALA  27  -2.582  -1.600  -0.633
  195    H    LYS  28           H        LYS  28  -4.460  -2.521   2.635
  196    HA   LYS  28           HA       LYS  28  -4.624  -0.551   4.628
  197   1HB   LYS  28          1HB       LYS  28  -6.206  -2.584   3.670
  198   2HB   LYS  28          2HB       LYS  28  -5.788  -3.241   5.242
  199   1HG   LYS  28          1HG       LYS  28  -6.978  -0.475   4.699
  200   2HG   LYS  28          2HG       LYS  28  -7.896  -1.923   5.123
  201   1HD   LYS  28          1HD       LYS  28  -6.725  -2.061   7.302
  202   2HD   LYS  28          2HD       LYS  28  -5.788  -0.606   6.898
  203   1HE   LYS  28          1HE       LYS  28  -7.835   0.734   6.750
  204   2HE   LYS  28          2HE       LYS  28  -8.834  -0.702   7.050
  205   1HZ   LYS  28          1HZ       LYS  28  -6.888   0.434   8.933
  206   2HZ   LYS  28          2HZ       LYS  28  -8.525   0.611   9.009
  207   3HZ   LYS  28          3HZ       LYS  28  -7.849  -0.879   9.204
  208    H    LEU  29           H        LEU  29  -3.387  -3.913   4.803
  209    HA   LEU  29           HA       LEU  29  -2.713  -4.035   7.502
  210   1HB   LEU  29          1HB       LEU  29  -2.782  -5.940   5.895
  211   2HB   LEU  29          2HB       LEU  29  -1.326  -5.320   5.116
  212    HG   LEU  29           HG       LEU  29  -0.055  -5.668   7.256
  213   1HD1  LEU  29          1HD1      LEU  29  -2.661  -7.000   8.132
  214   2HD1  LEU  29          2HD1      LEU  29  -1.096  -7.204   8.945
  215   3HD1  LEU  29          3HD1      LEU  29  -1.865  -5.613   8.911
  216   1HD2  LEU  29          1HD2      LEU  29   0.006  -7.310   5.444
  217   2HD2  LEU  29          2HD2      LEU  29   0.035  -8.130   7.015
  218   3HD2  LEU  29          3HD2      LEU  29  -1.467  -8.089   6.066
  219    H    SER  30           H        SER  30  -0.785  -2.882   4.736
  220    HA   SER  30           HA       SER  30   1.614  -2.357   6.301
  221   1HB   SER  30          1HB       SER  30   2.405  -1.333   4.196
  222   2HB   SER  30          2HB       SER  30   1.798  -2.987   3.968
  223    HG   SER  30           HG       SER  30  -0.105  -2.144   3.156
  224    H    GLY  31           H        GLY  31  -1.158  -0.482   5.181
  225   1HA   GLY  31          1HA       GLY  31  -1.906   1.524   6.191
  226   2HA   GLY  31          2HA       GLY  31  -0.257   1.945   6.666
  227    H    CYS  32           H        CYS  32  -0.511   0.615   3.463
  228    HA   CYS  32           HA       CYS  32  -0.043   3.232   2.208
  229   1HB   CYS  32          1HB       CYS  32  -0.231   0.478   0.944
  230   2HB   CYS  32          2HB       CYS  32   0.425   1.930   0.215
  231    H    LYS  33           H        LYS  33  -1.327   3.870   0.351
  232    HA   LYS  33           HA       LYS  33  -4.168   2.952   0.369
  233   1HB   LYS  33          1HB       LYS  33  -3.073   5.622  -0.589
  234   2HB   LYS  33          2HB       LYS  33  -4.766   5.158  -0.400
  235   1HG   LYS  33          1HG       LYS  33  -2.721   5.629   1.800
  236   2HG   LYS  33          2HG       LYS  33  -4.055   6.676   1.344
  237   1HD   LYS  33          1HD       LYS  33  -5.365   5.684   2.847
  238   2HD   LYS  33          2HD       LYS  33  -5.332   4.229   1.869
  239   1HE   LYS  33          1HE       LYS  33  -4.344   3.165   3.587
  240   2HE   LYS  33          2HE       LYS  33  -2.899   4.140   3.341
  241   1HZ   LYS  33          1HZ       LYS  33  -5.133   4.870   5.077
  242   2HZ   LYS  33          2HZ       LYS  33  -3.673   4.273   5.555
  243   3HZ   LYS  33          3HZ       LYS  33  -3.757   5.753   4.847
  244    H    ILE  34           H        ILE  34  -4.964   2.168  -1.496
  245    HA   ILE  34           HA       ILE  34  -3.412   2.413  -4.037
  246    HB   ILE  34           HB       ILE  34  -5.622   0.443  -3.330
  247   1HG1  ILE  34          1HG1      ILE  34  -3.832  -0.077  -1.864
  248   2HG1  ILE  34          2HG1      ILE  34  -3.951  -1.295  -3.121
  249   1HG2  ILE  34          1HG2      ILE  34  -3.666   0.588  -5.663
  250   2HG2  ILE  34          2HG2      ILE  34  -4.771  -0.766  -5.333
  251   3HG2  ILE  34          3HG2      ILE  34  -5.421   0.835  -5.714
  252   1HD1  ILE  34          1HD1      ILE  34  -1.869   0.927  -2.968
  253   2HD1  ILE  34          2HD1      ILE  34  -1.604  -0.790  -2.669
  254   3HD1  ILE  34          3HD1      ILE  34  -2.003  -0.245  -4.303
  255    H    ILE  35           H        ILE  35  -4.248   4.115  -5.196
  256    HA   ILE  35           HA       ILE  35  -7.180   4.339  -5.444
  257    HB   ILE  35           HB       ILE  35  -7.045   6.809  -5.185
  258   1HG1  ILE  35          1HG1      ILE  35  -4.297   6.210  -3.980
  259   2HG1  ILE  35          2HG1      ILE  35  -4.640   7.186  -5.417
  260   1HG2  ILE  35          1HG2      ILE  35  -6.302   5.363  -2.616
  261   2HG2  ILE  35          2HG2      ILE  35  -7.342   6.789  -2.808
  262   3HG2  ILE  35          3HG2      ILE  35  -7.895   5.231  -3.404
  263   1HD1  ILE  35          1HD1      ILE  35  -5.919   8.786  -3.975
  264   2HD1  ILE  35          2HD1      ILE  35  -5.419   7.844  -2.540
  265   3HD1  ILE  35          3HD1      ILE  35  -4.205   8.616  -3.535
  266    H    SER  36           H        SER  36  -7.854   4.871  -7.395
  267    HA   SER  36           HA       SER  36  -5.843   4.680  -9.512
  268   1HB   SER  36          1HB       SER  36  -7.928   3.236  -9.296
  269   2HB   SER  36          2HB       SER  36  -8.871   4.665  -9.763
  270    HG   SER  36           HG       SER  36  -6.784   3.423 -11.247
  271    H    ALA  37           H        ALA  37  -6.771   7.325  -7.919
  272    HA   ALA  37           HA       ALA  37  -7.628   9.101 -10.043
  273   1HB   ALA  37          1HB       ALA  37  -8.197   9.449  -7.669
  274   2HB   ALA  37          2HB       ALA  37  -6.474   9.651  -7.281
  275   3HB   ALA  37          3HB       ALA  37  -7.297  10.831  -8.325
  276    H    SER  38           H        SER  38  -4.676   7.581  -9.532
  277    HA   SER  38           HA       SER  38  -2.522   7.946  -9.921
  278   1HB   SER  38          1HB       SER  38  -3.399   8.068 -12.224
  279   2HB   SER  38          2HB       SER  38  -3.552   9.827 -12.075
  280    HG   SER  38           HG       SER  38  -1.295   9.889 -11.710
  281    H    THR  39           H        THR  39  -3.764   9.542  -7.865
  282    HA   THR  39           HA       THR  39  -1.802  11.702  -7.496
  283    HB   THR  39           HB       THR  39  -4.830  12.096  -7.310
  284    HG1  THR  39           1HG      THR  39  -4.283  12.068  -9.450
  285   1HG2  THR  39          1HG2      THR  39  -4.211  14.499  -7.056
  286   2HG2  THR  39          2HG2      THR  39  -3.615  13.509  -5.715
  287   3HG2  THR  39          3HG2      THR  39  -2.499  14.039  -6.996
  288    H    CYS  40           H        CYS  40  -1.484  12.038  -5.212
  289    HA   CYS  40           HA       CYS  40  -3.066  10.432  -3.324
  290   1HB   CYS  40          1HB       CYS  40  -0.072  10.163  -3.789
  291   2HB   CYS  40          2HB       CYS  40  -0.880   9.589  -2.329
  292    HA   PRO  41           HA       PRO  41  -2.506  14.153  -1.071
  293   1HB   PRO  41          1HB       PRO  41  -3.235  13.450   1.458
  294   2HB   PRO  41          2HB       PRO  41  -4.382  13.403   0.091
  295   1HG   PRO  41          1HG       PRO  41  -2.748  11.086   1.183
  296   2HG   PRO  41          2HG       PRO  41  -4.521  11.146   0.937
  297   1HD   PRO  41          1HD       PRO  41  -2.891  10.063  -0.944
  298   2HD   PRO  41          2HD       PRO  41  -4.276  11.080  -1.425
  299    H    SER  42           H        SER  42  -1.371  15.138   0.784
  300    HA   SER  42           HA       SER  42   1.390  14.332   0.972
  301   1HB   SER  42          1HB       SER  42  -0.203  16.531   2.347
  302   2HB   SER  42          2HB       SER  42   1.568  16.374   2.362
  303    HG   SER  42           HG       SER  42   0.816  17.779   0.712
  304    H    ASP  43           H        ASP  43   0.540  12.178   1.830
  305    HA   ASP  43           HA       ASP  43   1.008  12.029   4.756
  306   1HB   ASP  43          1HB       ASP  43  -1.357  10.795   3.270
  307   2HB   ASP  43          2HB       ASP  43  -0.785  10.243   4.850
  308    HD2  ASP  43           HD       ASP  43  -2.836  13.701   4.571
  309    H    TYR  44           H        TYR  44   0.754  10.451   1.553
  310    HA   TYR  44           HA       TYR  44   2.627   8.304   2.448
  311   1HB   TYR  44          1HB       TYR  44   0.319   8.108   0.494
  312   2HB   TYR  44          2HB       TYR  44   1.348   6.806   1.087
  313    HD1  TYR  44           1HD      TYR  44   1.429   6.640   3.769
  314    HD2  TYR  44           2HD      TYR  44  -1.768   8.446   1.538
  315    HE1  TYR  44           1HE      TYR  44  -0.055   6.356   5.714
  316    HE2  TYR  44           2HE      TYR  44  -3.270   8.172   3.485
  317    HH   TYR  44           HH       TYR  44  -2.160   6.782   6.588
  318    HA   PRO  45           HA       PRO  45   4.305  10.586  -1.239
  319   1HB   PRO  45          1HB       PRO  45   6.710  11.409  -0.324
  320   2HB   PRO  45          2HB       PRO  45   5.197  12.210   0.188
  321   1HG   PRO  45          1HG       PRO  45   6.695  10.014   1.664
  322   2HG   PRO  45          2HG       PRO  45   6.195  11.607   2.306
  323   1HD   PRO  45          1HD       PRO  45   4.663   9.384   2.667
  324   2HD   PRO  45          2HD       PRO  45   3.921  10.982   2.338
  325    H    LYS  46           H        LYS  46   5.286   7.746   0.526
  326    HA   LYS  46           HA       LYS  46   7.607   7.257  -1.205
  327   1HB   LYS  46          1HB       LYS  46   7.561   7.188   1.407
  328   2HB   LYS  46          2HB       LYS  46   6.743   5.638   1.203
  329   1HG   LYS  46          1HG       LYS  46   9.127   5.332   1.557
  330   2HG   LYS  46          2HG       LYS  46   8.716   4.774  -0.057
  331   1HD   LYS  46          1HD       LYS  46   9.505   7.654   0.112
  332   2HD   LYS  46          2HD       LYS  46  10.760   6.553   0.658
  333   1HE   LYS  46          1HE       LYS  46   9.363   6.225  -2.040
  334   2HE   LYS  46          2HE       LYS  46  10.827   7.180  -1.793
  335   1HZ   LYS  46          1HZ       LYS  46  10.531   4.317  -1.198
  336   2HZ   LYS  46          2HZ       LYS  46  11.305   4.958  -2.504
  337   3HZ   LYS  46          3HZ       LYS  46  11.906   5.204  -0.990
  Start of MODEL    7
    1   1H    LYS   1          1H        LYS   1  -2.760   4.194  -9.714
    2   2H    LYS   1          2H        LYS   1  -3.265   2.994  -8.700
    3   3H    LYS   1          3H        LYS   1  -3.362   4.559  -8.215
    4    HA   LYS   1           HA       LYS   1  -0.969   2.984  -8.676
    5   1HB   LYS   1          1HB       LYS   1   0.379   4.907  -8.076
    6   2HB   LYS   1          2HB       LYS   1  -0.591   5.217  -9.519
    7   1HG   LYS   1          1HG       LYS   1  -2.254   6.419  -8.072
    8   2HG   LYS   1          2HG       LYS   1  -1.159   6.287  -6.700
    9   1HD   LYS   1          1HD       LYS   1  -0.211   7.505  -9.328
   10   2HD   LYS   1          2HD       LYS   1  -1.249   8.428  -8.248
   11   1HE   LYS   1          1HE       LYS   1   1.129   8.962  -7.955
   12   2HE   LYS   1          2HE       LYS   1   0.329   8.439  -6.477
   13   1HZ   LYS   1          1HZ       LYS   1   2.043   6.749  -8.161
   14   2HZ   LYS   1          2HZ       LYS   1   2.503   7.482  -6.762
   15   3HZ   LYS   1          3HZ       LYS   1   1.355   6.306  -6.726
   16    H    SER   2           H        SER   2   0.316   2.645  -6.820
   17    HA   SER   2           HA       SER   2  -1.176   2.525  -4.260
   18   1HB   SER   2          1HB       SER   2  -0.166   0.431  -5.058
   19   2HB   SER   2          2HB       SER   2   1.421   1.214  -5.142
   20    HG   SER   2           HG       SER   2   1.030   0.015  -3.182
   21    H    CYS   3           H        CYS   3  -0.342   3.522  -2.410
   22    HA   CYS   3           HA       CYS   3   2.039   5.303  -2.602
   23   1HB   CYS   3          1HB       CYS   3  -0.817   6.173  -2.021
   24   2HB   CYS   3          2HB       CYS   3   0.613   7.159  -1.679
   25    H    CYS   4           H        CYS   4   3.218   4.678  -0.882
   26    HA   CYS   4           HA       CYS   4   1.862   3.672   1.564
   27   1HB   CYS   4          1HB       CYS   4   4.571   3.113   0.319
   28   2HB   CYS   4          2HB       CYS   4   4.138   2.556   1.911
   29    HA   PRO   5           HA       PRO   5   3.606   6.926   3.997
   30   1HB   PRO   5          1HB       PRO   5   4.362   5.669   6.317
   31   2HB   PRO   5          2HB       PRO   5   2.675   5.998   5.859
   32   1HG   PRO   5          1HG       PRO   5   4.202   3.418   5.444
   33   2HG   PRO   5          2HG       PRO   5   2.579   3.633   6.168
   34   1HD   PRO   5          1HD       PRO   5   2.787   2.944   3.592
   35   2HD   PRO   5          2HD       PRO   5   1.620   4.187   4.059
   36    H    ASN   6           H        ASN   6   5.622   3.956   3.650
   37    HA   ASN   6           HA       ASN   6   8.014   5.465   3.058
   38   1HB   ASN   6          1HB       ASN   6   9.258   4.790   5.137
   39   2HB   ASN   6          2HB       ASN   6   7.986   5.956   5.436
   40   1HD2  ASN   6          2HD2      ASN   6   6.533   5.488   7.038
   41   2HD2  ASN   6          1HD2      ASN   6   6.270   3.898   7.724
   42    H    THR   7           H        THR   7   9.970   3.862   3.455
   43    HA   THR   7           HA       THR   7   9.793   1.802   1.585
   44    HB   THR   7           HB       THR   7  11.824   2.174   3.826
   45    HG1  THR   7           1HG      THR   7  11.654   4.033   2.609
   46   1HG2  THR   7          1HG2      THR   7  12.051   0.789   1.116
   47   2HG2  THR   7          2HG2      THR   7  13.396   1.111   2.227
   48   3HG2  THR   7          3HG2      THR   7  12.113  -0.007   2.705
   49    H    THR   8           H        THR   8   9.341   1.680   5.148
   50    HA   THR   8           HA       THR   8   9.425  -1.212   5.253
   51    HB   THR   8           HB       THR   8   8.226   0.643   7.333
   52    HG1  THR   8           1HG      THR   8  10.370   1.242   6.823
   53   1HG2  THR   8          1HG2      THR   8   9.480  -2.131   7.495
   54   2HG2  THR   8          2HG2      THR   8   8.881  -1.172   8.863
   55   3HG2  THR   8          3HG2      THR   8   7.746  -1.769   7.641
   56    H    GLY   9           H        GLY   9   6.899   1.315   5.000
   57   1HA   GLY   9          1HA       GLY   9   4.568  -0.282   5.057
   58   2HA   GLY   9          2HA       GLY   9   4.785   1.215   4.136
   59    H    ARG  10           H        ARG  10   6.670   0.659   2.272
   60    HA   ARG  10           HA       ARG  10   5.391  -0.936   0.312
   61   1HB   ARG  10          1HB       ARG  10   8.256   0.039   0.586
   62   2HB   ARG  10          2HB       ARG  10   7.708  -0.882  -0.815
   63   1HG   ARG  10          1HG       ARG  10   6.363   1.688   0.079
   64   2HG   ARG  10          2HG       ARG  10   7.725   1.649  -1.048
   65   1HD   ARG  10          1HD       ARG  10   6.522   0.362  -2.667
   66   2HD   ARG  10          2HD       ARG  10   5.153   0.104  -1.573
   67    HE   ARG  10           HE       ARG  10   5.484   2.888  -1.811
   68   1HH1  ARG  10          1HH2      ARG  10   4.506   0.133  -3.832
   69   2HH1  ARG  10          2HH2      ARG  10   3.496   1.112  -4.866
   70   1HH2  ARG  10          1HH1      ARG  10   4.170   4.118  -3.122
   71   2HH2  ARG  10          2HH1      ARG  10   3.233   3.408  -4.417
   72    H    ASN  11           H        ASN  11   8.122  -1.789   2.522
   73    HA   ASN  11           HA       ASN  11   8.585  -4.362   1.495
   74   1HB   ASN  11          1HB       ASN  11  10.114  -3.342   3.053
   75   2HB   ASN  11          2HB       ASN  11   8.886  -3.269   4.316
   76   1HD2  ASN  11          2HD2      ASN  11   8.433  -5.072   5.581
   77   2HD2  ASN  11          1HD2      ASN  11   9.368  -6.545   5.475
   78    H    ILE  12           H        ILE  12   6.278  -3.411   4.124
   79    HA   ILE  12           HA       ILE  12   5.348  -6.057   4.628
   80    HB   ILE  12           HB       ILE  12   4.057  -3.343   5.074
   81   1HG1  ILE  12          1HG1      ILE  12   5.358  -5.188   7.114
   82   2HG1  ILE  12          2HG1      ILE  12   6.288  -3.967   6.257
   83   1HG2  ILE  12          1HG2      ILE  12   3.282  -6.108   6.129
   84   2HG2  ILE  12          2HG2      ILE  12   2.601  -4.587   6.729
   85   3HG2  ILE  12          3HG2      ILE  12   2.294  -5.085   5.072
   86   1HD1  ILE  12          1HD1      ILE  12   3.921  -3.393   8.077
   87   2HD1  ILE  12          2HD1      ILE  12   5.631  -3.059   8.376
   88   3HD1  ILE  12          3HD1      ILE  12   4.778  -2.184   7.094
   89    H    TYR  13           H        TYR  13   4.082  -3.441   2.528
   90    HA   TYR  13           HA       TYR  13   1.783  -4.713   1.567
   91   1HB   TYR  13          1HB       TYR  13   2.169  -2.365   1.245
   92   2HB   TYR  13          2HB       TYR  13   3.668  -2.656   0.376
   93    HD1  TYR  13           1HD      TYR  13   3.611  -2.389  -1.953
   94    HD2  TYR  13           2HD      TYR  13   0.037  -3.609   0.113
   95    HE1  TYR  13           1HE      TYR  13   2.382  -2.401  -4.097
   96    HE2  TYR  13           2HE      TYR  13  -1.198  -3.629  -2.040
   97    HH   TYR  13           HH       TYR  13   0.372  -2.833  -5.158
   98    H    ASN  14           H        ASN  14   5.055  -4.642   0.101
   99    HA   ASN  14           HA       ASN  14   4.464  -6.308  -2.122
  100   1HB   ASN  14          1HB       ASN  14   7.024  -5.443  -0.742
  101   2HB   ASN  14          2HB       ASN  14   7.046  -6.633  -2.035
  102   1HD2  ASN  14          2HD2      ASN  14   6.195  -3.247  -1.314
  103   2HD2  ASN  14          1HD2      ASN  14   6.246  -2.721  -2.986
  104    H    THR  15           H        THR  15   5.867  -7.089   1.116
  105    HA   THR  15           HA       THR  15   6.337  -9.831   0.612
  106    HB   THR  15           HB       THR  15   5.671  -8.383   3.210
  107    HG1  THR  15           1HG      THR  15   7.552  -7.692   2.167
  108   1HG2  THR  15          1HG2      THR  15   6.869 -11.153   2.759
  109   2HG2  THR  15          2HG2      THR  15   6.803 -10.299   4.313
  110   3HG2  THR  15          3HG2      THR  15   5.304 -10.803   3.526
  111    H    CYS  16           H        CYS  16   3.433  -8.177   1.917
  112    HA   CYS  16           HA       CYS  16   1.848 -10.509   2.271
  113   1HB   CYS  16          1HB       CYS  16   1.343  -8.482   3.393
  114   2HB   CYS  16          2HB       CYS  16   1.209  -7.572   1.893
  115    H    ARG  17           H        ARG  17   2.211  -8.284  -0.529
  116    HA   ARG  17           HA       ARG  17   0.242  -9.486  -2.180
  117   1HB   ARG  17          1HB       ARG  17   2.763  -7.902  -2.752
  118   2HB   ARG  17          2HB       ARG  17   1.735  -8.483  -4.052
  119   1HG   ARG  17          1HG       ARG  17   0.358  -6.973  -1.838
  120   2HG   ARG  17          2HG       ARG  17   1.443  -6.059  -2.890
  121   1HD   ARG  17          1HD       ARG  17  -0.794  -5.966  -3.791
  122   2HD   ARG  17          2HD       ARG  17   0.288  -6.838  -4.878
  123    HE   ARG  17           HE       ARG  17  -1.361  -8.404  -2.946
  124   1HH1  ARG  17          1HH2      ARG  17  -0.997  -7.366  -6.339
  125   2HH1  ARG  17          2HH2      ARG  17  -1.945  -8.695  -6.952
  126   1HH2  ARG  17          1HH1      ARG  17  -2.529 -10.137  -3.784
  127   2HH2  ARG  17          2HH1      ARG  17  -2.822 -10.278  -5.501
  128    H    PHE  18           H        PHE  18   3.749 -10.210  -1.830
  129    HA   PHE  18           HA       PHE  18   3.775 -12.328  -3.765
  130   1HB   PHE  18          1HB       PHE  18   5.590 -11.489  -1.494
  131   2HB   PHE  18          2HB       PHE  18   5.815 -13.049  -2.269
  132    HD1  PHE  18           1HD      PHE  18   6.757  -9.624  -2.489
  133    HD2  PHE  18           2HD      PHE  18   5.991 -13.157  -4.842
  134    HE1  PHE  18           1HE      PHE  18   8.037  -8.652  -4.367
  135    HE2  PHE  18           2HE      PHE  18   7.325 -12.200  -6.700
  136    HZ   PHE  18           HZ       PHE  18   8.357  -9.951  -6.464
  137    H    ALA  19           H        ALA  19   3.147 -12.274  -0.228
  138    HA   ALA  19           HA       ALA  19   3.017 -15.062   0.173
  139   1HB   ALA  19          1HB       ALA  19   3.085 -13.394   1.992
  140   2HB   ALA  19          2HB       ALA  19   1.432 -12.886   1.594
  141   3HB   ALA  19          3HB       ALA  19   1.736 -14.530   2.177
  142    H    GLY  20           H        GLY  20   0.473 -12.727  -0.841
  143   1HA   GLY  20          1HA       GLY  20  -0.713 -14.065  -2.794
  144   2HA   GLY  20          2HA       GLY  20  -1.432 -14.923  -1.421
  145    H    GLY  21           H        GLY  21  -1.309 -12.277   0.179
  146   1HA   GLY  21          1HA       GLY  21  -4.046 -11.850   0.040
  147   2HA   GLY  21          2HA       GLY  21  -2.891 -10.764   0.823
  148    H    SER  22           H        SER  22  -5.381 -10.178  -0.699
  149    HA   SER  22           HA       SER  22  -4.880  -9.182  -3.281
  150   1HB   SER  22          1HB       SER  22  -6.953  -8.179  -1.295
  151   2HB   SER  22          2HB       SER  22  -7.045  -8.140  -3.065
  152    HG   SER  22           HG       SER  22  -6.971 -10.458  -2.989
  153    H    ARG  23           H        ARG  23  -4.933  -6.936  -4.007
  154    HA   ARG  23           HA       ARG  23  -2.829  -5.405  -3.011
  155   1HB   ARG  23          1HB       ARG  23  -5.228  -4.560  -4.688
  156   2HB   ARG  23          2HB       ARG  23  -3.780  -3.573  -4.431
  157   1HG   ARG  23          1HG       ARG  23  -2.361  -5.236  -5.484
  158   2HG   ARG  23          2HG       ARG  23  -3.714  -6.367  -5.675
  159   1HD   ARG  23          1HD       ARG  23  -3.571  -3.599  -6.926
  160   2HD   ARG  23          2HD       ARG  23  -3.119  -5.108  -7.750
  161    HE   ARG  23           HE       ARG  23  -5.715  -5.489  -6.754
  162   1HH1  ARG  23          1HH2      ARG  23  -4.103  -3.383  -9.113
  163   2HH1  ARG  23          2HH2      ARG  23  -5.508  -3.242 -10.138
  164   1HH2  ARG  23          1HH1      ARG  23  -7.549  -5.308  -8.119
  165   2HH2  ARG  23          2HH1      ARG  23  -7.472  -4.342  -9.570
  166    H    GLU  24           H        GLU  24  -6.341  -4.664  -2.650
  167    HA   GLU  24           HA       GLU  24  -6.022  -2.424  -1.014
  168   1HB   GLU  24          1HB       GLU  24  -8.070  -3.396  -2.289
  169   2HB   GLU  24          2HB       GLU  24  -8.393  -4.315  -0.817
  170   1HG   GLU  24          1HG       GLU  24  -8.158  -1.279  -1.094
  171   2HG   GLU  24          2HG       GLU  24  -9.652  -2.206  -0.951
  172    HE2  GLU  24           HE       GLU  24  -7.744  -1.069   2.334
  173    H    ARG  25           H        ARG  25  -6.465  -5.861  -0.123
  174    HA   ARG  25           HA       ARG  25  -6.685  -5.566   2.658
  175   1HB   ARG  25          1HB       ARG  25  -7.106  -7.562   1.106
  176   2HB   ARG  25          2HB       ARG  25  -5.394  -7.942   1.236
  177   1HG   ARG  25          1HG       ARG  25  -7.394  -7.756   3.543
  178   2HG   ARG  25          2HG       ARG  25  -6.892  -9.234   2.715
  179   1HD   ARG  25          1HD       ARG  25  -4.510  -8.752   3.442
  180   2HD   ARG  25          2HD       ARG  25  -5.173  -7.469   4.485
  181    HE   ARG  25           HE       ARG  25  -6.655  -9.810   4.955
  182   1HH1  ARG  25          1HH2      ARG  25  -3.346  -8.638   5.491
  183   2HH1  ARG  25          2HH2      ARG  25  -3.082  -9.653   6.887
  184   1HH2  ARG  25          1HH1      ARG  25  -6.305 -11.112   6.789
  185   2HH2  ARG  25          2HH1      ARG  25  -4.780 -11.064   7.635
  186    H    CYS  26           H        CYS  26  -3.779  -6.355   0.699
  187    HA   CYS  26           HA       CYS  26  -1.889  -6.290   2.820
  188   1HB   CYS  26          1HB       CYS  26  -1.605  -5.807  -0.177
  189   2HB   CYS  26          2HB       CYS  26  -0.252  -6.002   0.935
  190    H    ALA  27           H        ALA  27  -3.074  -3.737   0.617
  191    HA   ALA  27           HA       ALA  27  -1.284  -1.689   1.409
  192   1HB   ALA  27          1HB       ALA  27  -4.150  -1.470   0.413
  193   2HB   ALA  27          2HB       ALA  27  -2.943  -0.174   0.439
  194   3HB   ALA  27          3HB       ALA  27  -2.687  -1.592  -0.588
  195    H    LYS  28           H        LYS  28  -4.469  -2.751   2.733
  196    HA   LYS  28           HA       LYS  28  -4.706  -0.782   4.726
  197   1HB   LYS  28          1HB       LYS  28  -6.261  -2.751   3.771
  198   2HB   LYS  28          2HB       LYS  28  -5.688  -3.596   5.202
  199   1HG   LYS  28          1HG       LYS  28  -7.047  -0.855   5.148
  200   2HG   LYS  28          2HG       LYS  28  -7.835  -2.407   5.465
  201   1HD   LYS  28          1HD       LYS  28  -6.288  -2.738   7.431
  202   2HD   LYS  28          2HD       LYS  28  -5.667  -1.094   7.166
  203   1HE   LYS  28          1HE       LYS  28  -7.915  -0.157   7.508
  204   2HE   LYS  28          2HE       LYS  28  -8.575  -1.787   7.743
  205   1HZ   LYS  28          1HZ       LYS  28  -6.528  -0.530   9.432
  206   2HZ   LYS  28          2HZ       LYS  28  -8.126  -0.689   9.812
  207   3HZ   LYS  28          3HZ       LYS  28  -7.181  -2.028   9.649
  208    H    LEU  29           H        LEU  29  -3.326  -4.099   4.850
  209    HA   LEU  29           HA       LEU  29  -2.612  -4.232   7.525
  210   1HB   LEU  29          1HB       LEU  29  -2.552  -6.095   5.827
  211   2HB   LEU  29          2HB       LEU  29  -1.090  -5.377   5.145
  212    HG   LEU  29           HG       LEU  29   0.072  -5.719   7.356
  213   1HD1  LEU  29          1HD1      LEU  29  -2.482  -7.270   7.991
  214   2HD1  LEU  29          2HD1      LEU  29  -0.967  -7.395   8.906
  215   3HD1  LEU  29          3HD1      LEU  29  -1.855  -5.867   8.882
  216   1HD2  LEU  29          1HD2      LEU  29   0.335  -7.289   5.475
  217   2HD2  LEU  29          2HD2      LEU  29   0.376  -8.136   7.030
  218   3HD2  LEU  29          3HD2      LEU  29  -1.087  -8.199   6.027
  219    H    SER  30           H        SER  30  -0.746  -2.928   4.794
  220    HA   SER  30           HA       SER  30   1.627  -2.302   6.375
  221   1HB   SER  30          1HB       SER  30   2.328  -1.204   4.230
  222   2HB   SER  30          2HB       SER  30   1.911  -2.924   4.074
  223    HG   SER  30           HG       SER  30  -0.038  -2.372   3.197
  224    H    GLY  31           H        GLY  31  -1.192  -0.559   5.139
  225   1HA   GLY  31          1HA       GLY  31  -2.101   1.382   6.114
  226   2HA   GLY  31          2HA       GLY  31  -0.509   1.891   6.694
  227    H    CYS  32           H        CYS  32  -0.755   0.584   3.439
  228    HA   CYS  32           HA       CYS  32  -0.212   3.205   2.217
  229   1HB   CYS  32          1HB       CYS  32  -0.533   0.488   0.900
  230   2HB   CYS  32          2HB       CYS  32   0.208   1.920   0.204
  231    H    LYS  33           H        LYS  33  -1.477   3.841   0.305
  232    HA   LYS  33           HA       LYS  33  -4.367   3.089   0.390
  233   1HB   LYS  33          1HB       LYS  33  -3.102   5.451  -1.022
  234   2HB   LYS  33          2HB       LYS  33  -4.811   5.180  -0.689
  235   1HG   LYS  33          1HG       LYS  33  -2.656   5.824   1.378
  236   2HG   LYS  33          2HG       LYS  33  -3.769   6.959   0.627
  237   1HD   LYS  33          1HD       LYS  33  -4.770   6.623   2.639
  238   2HD   LYS  33          2HD       LYS  33  -5.698   5.544   1.599
  239   1HE   LYS  33          1HE       LYS  33  -4.737   3.616   2.589
  240   2HE   LYS  33          2HE       LYS  33  -3.298   4.501   3.158
  241   1HZ   LYS  33          1HZ       LYS  33  -4.647   5.596   4.744
  242   2HZ   LYS  33          2HZ       LYS  33  -6.001   4.792   4.236
  243   3HZ   LYS  33          3HZ       LYS  33  -4.751   3.963   4.926
  244    H    ILE  34           H        ILE  34  -5.338   2.491  -1.542
  245    HA   ILE  34           HA       ILE  34  -3.682   2.234  -4.018
  246    HB   ILE  34           HB       ILE  34  -5.952   0.446  -3.040
  247   1HG1  ILE  34          1HG1      ILE  34  -3.765   0.093  -1.845
  248   2HG1  ILE  34          2HG1      ILE  34  -4.459  -1.293  -2.666
  249   1HG2  ILE  34          1HG2      ILE  34  -4.302   0.404  -5.600
  250   2HG2  ILE  34          2HG2      ILE  34  -5.310  -0.952  -5.043
  251   3HG2  ILE  34          3HG2      ILE  34  -6.057   0.600  -5.442
  252   1HD1  ILE  34          1HD1      ILE  34  -2.845  -1.110  -4.489
  253   2HD1  ILE  34          2HD1      ILE  34  -2.235   0.427  -3.828
  254   3HD1  ILE  34          3HD1      ILE  34  -1.981  -1.086  -2.945
  255    H    ILE  35           H        ILE  35  -4.330   4.126  -5.026
  256    HA   ILE  35           HA       ILE  35  -7.218   4.410  -5.599
  257    HB   ILE  35           HB       ILE  35  -7.145   6.813  -5.222
  258   1HG1  ILE  35          1HG1      ILE  35  -4.383   6.323  -4.006
  259   2HG1  ILE  35          2HG1      ILE  35  -4.769   7.316  -5.422
  260   1HG2  ILE  35          1HG2      ILE  35  -7.943   5.175  -3.470
  261   2HG2  ILE  35          2HG2      ILE  35  -6.368   5.369  -2.663
  262   3HG2  ILE  35          3HG2      ILE  35  -7.468   6.750  -2.845
  263   1HD1  ILE  35          1HD1      ILE  35  -6.137   8.815  -3.975
  264   2HD1  ILE  35          2HD1      ILE  35  -5.586   7.889  -2.548
  265   3HD1  ILE  35          3HD1      ILE  35  -4.418   8.748  -3.542
  266    H    SER  36           H        SER  36  -7.635   4.954  -7.640
  267    HA   SER  36           HA       SER  36  -5.309   5.228  -9.486
  268   1HB   SER  36          1HB       SER  36  -6.846   3.287  -9.741
  269   2HB   SER  36          2HB       SER  36  -8.176   4.415 -10.080
  270    HG   SER  36           HG       SER  36  -6.912   5.189 -11.836
  271    H    ALA  37           H        ALA  37  -6.135   7.516  -7.956
  272    HA   ALA  37           HA       ALA  37  -7.610   9.281  -9.788
  273   1HB   ALA  37          1HB       ALA  37  -6.180   9.834  -7.163
  274   2HB   ALA  37          2HB       ALA  37  -7.285  10.933  -8.018
  275   3HB   ALA  37          3HB       ALA  37  -7.898   9.415  -7.334
  276    H    SER  38           H        SER  38  -4.487   8.074  -9.820
  277    HA   SER  38           HA       SER  38  -2.459   8.712 -10.486
  278   1HB   SER  38          1HB       SER  38  -3.694   9.167 -12.576
  279   2HB   SER  38          2HB       SER  38  -3.926  10.847 -12.065
  280    HG   SER  38           HG       SER  38  -1.613  10.985 -11.974
  281    H    THR  39           H        THR  39  -3.630   9.897  -8.028
  282    HA   THR  39           HA       THR  39  -1.650  11.960  -7.434
  283    HB   THR  39           HB       THR  39  -4.667  12.454  -7.314
  284    HG1  THR  39           1HG      THR  39  -4.181  14.112  -8.765
  285   1HG2  THR  39          1HG2      THR  39  -4.036  14.739  -6.528
  286   2HG2  THR  39          2HG2      THR  39  -3.621  13.488  -5.352
  287   3HG2  THR  39          3HG2      THR  39  -2.351  14.202  -6.377
  288    H    CYS  40           H        CYS  40  -1.348  12.062  -5.151
  289    HA   CYS  40           HA       CYS  40  -3.099  10.468  -3.409
  290   1HB   CYS  40          1HB       CYS  40  -0.104  10.076  -3.740
  291   2HB   CYS  40          2HB       CYS  40  -0.961   9.587  -2.277
  292    HA   PRO  41           HA       PRO  41  -2.615  14.125  -1.048
  293   1HB   PRO  41          1HB       PRO  41  -3.363  13.356   1.464
  294   2HB   PRO  41          2HB       PRO  41  -4.496  13.374   0.084
  295   1HG   PRO  41          1HG       PRO  41  -2.924  11.002   1.134
  296   2HG   PRO  41          2HG       PRO  41  -4.685  11.093   0.834
  297   1HD   PRO  41          1HD       PRO  41  -3.010  10.042  -1.023
  298   2HD   PRO  41          2HD       PRO  41  -4.372  11.081  -1.521
  299    H    SER  42           H        SER  42  -1.425  15.129   0.740
  300    HA   SER  42           HA       SER  42   1.326  14.283   0.805
  301   1HB   SER  42          1HB       SER  42  -0.084  16.572   2.237
  302   2HB   SER  42          2HB       SER  42   1.669  16.381   2.008
  303    HG   SER  42           HG       SER  42   1.225  16.378  -0.275
  304    H    ASP  43           H        ASP  43   0.579  12.195   1.793
  305    HA   ASP  43           HA       ASP  43   1.085  12.143   4.715
  306   1HB   ASP  43          1HB       ASP  43  -1.307  10.890   3.291
  307   2HB   ASP  43          2HB       ASP  43  -0.761  10.418   4.904
  308    HD2  ASP  43           HD       ASP  43  -2.746  13.893   4.388
  309    H    TYR  44           H        TYR  44   0.782  10.469   1.571
  310    HA   TYR  44           HA       TYR  44   2.561   8.272   2.515
  311   1HB   TYR  44          1HB       TYR  44   0.416   8.221   0.390
  312   2HB   TYR  44          2HB       TYR  44   1.370   6.873   0.995
  313    HD1  TYR  44           1HD      TYR  44  -1.632   8.817   1.421
  314    HD2  TYR  44           2HD      TYR  44   1.188   6.398   3.582
  315    HE1  TYR  44           1HE      TYR  44  -3.311   8.439   3.198
  316    HE2  TYR  44           2HE      TYR  44  -0.495   5.974   5.339
  317    HH   TYR  44           HH       TYR  44  -2.676   6.316   6.013
  318    HA   PRO  45           HA       PRO  45   4.693  10.749  -0.786
  319   1HB   PRO  45          1HB       PRO  45   7.225  10.778   0.218
  320   2HB   PRO  45          2HB       PRO  45   5.926  11.821   0.863
  321   1HG   PRO  45          1HG       PRO  45   6.802   9.118   1.933
  322   2HG   PRO  45          2HG       PRO  45   6.653  10.650   2.845
  323   1HD   PRO  45          1HD       PRO  45   4.653   8.846   2.838
  324   2HD   PRO  45          2HD       PRO  45   4.277  10.589   2.711
  325    H    LYS  46           H        LYS  46   5.216   7.460   0.376
  326    HA   LYS  46           HA       LYS  46   7.180   6.878  -1.755
  327   1HB   LYS  46          1HB       LYS  46   7.578   6.353   0.703
  328   2HB   LYS  46          2HB       LYS  46   6.254   5.198   0.598
  329   1HG   LYS  46          1HG       LYS  46   7.987   3.795   0.174
  330   2HG   LYS  46          2HG       LYS  46   7.674   4.278  -1.493
  331   1HD   LYS  46          1HD       LYS  46   9.790   5.369   0.418
  332   2HD   LYS  46          2HD       LYS  46  10.037   4.300  -0.976
  333   1HE   LYS  46          1HE       LYS  46   9.251   6.162  -2.480
  334   2HE   LYS  46          2HE       LYS  46   9.225   7.228  -1.048
  335   1HZ   LYS  46          1HZ       LYS  46  11.541   6.799  -0.762
  336   2HZ   LYS  46          2HZ       LYS  46  11.573   5.845  -2.108
  337   3HZ   LYS  46          3HZ       LYS  46  11.233   7.451  -2.243
  Start of MODEL    8
    1   1H    LYS   1          1H        LYS   1  -2.769   7.074  -7.656
    2   2H    LYS   1          2H        LYS   1  -3.029   5.760  -6.714
    3   3H    LYS   1          3H        LYS   1  -1.923   6.901  -6.262
    4    HA   LYS   1           HA       LYS   1  -1.793   5.069  -8.522
    5   1HB   LYS   1          1HB       LYS   1   0.333   6.088  -9.165
    6   2HB   LYS   1          2HB       LYS   1  -1.006   7.234  -9.223
    7   1HG   LYS   1          1HG       LYS   1  -0.297   8.289  -7.142
    8   2HG   LYS   1          2HG       LYS   1   0.938   7.044  -6.884
    9   1HD   LYS   1          1HD       LYS   1   1.992   9.049  -7.679
   10   2HD   LYS   1          2HD       LYS   1   2.138   7.783  -8.911
   11   1HE   LYS   1          1HE       LYS   1   0.272   8.823 -10.194
   12   2HE   LYS   1          2HE       LYS   1   0.075  10.036  -8.910
   13   1HZ   LYS   1          1HZ       LYS   1   2.285  10.797  -9.403
   14   2HZ   LYS   1          2HZ       LYS   1   2.441   9.677 -10.603
   15   3HZ   LYS   1          3HZ       LYS   1   1.317  10.874 -10.734
   16    H    SER   2           H        SER   2  -1.996   4.523  -5.593
   17    HA   SER   2           HA       SER   2  -1.245   3.033  -4.140
   18   1HB   SER   2          1HB       SER   2   0.786   2.099  -6.186
   19   2HB   SER   2          2HB       SER   2   0.193   1.231  -4.765
   20    HG   SER   2           HG       SER   2  -1.385   2.081  -6.969
   21    H    CYS   3           H        CYS   3  -0.394   4.057  -2.400
   22    HA   CYS   3           HA       CYS   3   2.403   5.111  -2.497
   23   1HB   CYS   3          1HB       CYS   3  -0.101   6.691  -1.888
   24   2HB   CYS   3          2HB       CYS   3   1.540   7.214  -1.512
   25    H    CYS   4           H        CYS   4   3.466   5.089  -0.598
   26    HA   CYS   4           HA       CYS   4   2.093   3.837   1.733
   27   1HB   CYS   4          1HB       CYS   4   4.830   3.412   0.504
   28   2HB   CYS   4          2HB       CYS   4   4.420   2.824   2.104
   29    HA   PRO   5           HA       PRO   5   3.840   7.154   4.140
   30   1HB   PRO   5          1HB       PRO   5   4.012   6.059   6.627
   31   2HB   PRO   5          2HB       PRO   5   2.457   6.413   5.837
   32   1HG   PRO   5          1HG       PRO   5   3.898   3.748   5.949
   33   2HG   PRO   5          2HG       PRO   5   2.182   4.087   6.313
   34   1HD   PRO   5          1HD       PRO   5   2.972   3.152   3.879
   35   2HD   PRO   5          2HD       PRO   5   1.649   4.316   4.038
   36    H    ASN   6           H        ASN   6   5.445   3.947   4.189
   37    HA   ASN   6           HA       ASN   6   8.101   5.210   4.386
   38   1HB   ASN   6          1HB       ASN   6   7.017   3.220   6.426
   39   2HB   ASN   6          2HB       ASN   6   8.711   3.709   6.290
   40   1HD2  ASN   6          2HD2      ASN   6   5.716   4.468   7.759
   41   2HD2  ASN   6          1HD2      ASN   6   6.152   6.046   8.376
   42    H    THR   7           H        THR   7   9.838   3.649   4.172
   43    HA   THR   7           HA       THR   7   9.534   1.800   2.054
   44    HB   THR   7           HB       THR   7  11.744   1.899   4.145
   45    HG1  THR   7           1HG      THR   7  12.654   3.452   2.753
   46   1HG2  THR   7          1HG2      THR   7  11.731   1.128   1.186
   47   2HG2  THR   7          2HG2      THR   7  13.164   1.198   2.231
   48   3HG2  THR   7          3HG2      THR   7  11.899   0.001   2.549
   49    H    THR   8           H        THR   8   9.336   1.481   5.604
   50    HA   THR   8           HA       THR   8   9.271  -1.373   5.728
   51    HB   THR   8           HB       THR   8   7.939   0.652   7.575
   52    HG1  THR   8           1HG      THR   8  10.178   1.012   7.327
   53   1HG2  THR   8          1HG2      THR   8   8.265  -1.155   9.264
   54   2HG2  THR   8          2HG2      THR   8   7.179  -1.677   7.966
   55   3HG2  THR   8          3HG2      THR   8   8.867  -2.235   7.990
   56    H    GLY   9           H        GLY   9   6.790   1.143   5.110
   57   1HA   GLY   9          1HA       GLY   9   4.479  -0.518   5.063
   58   2HA   GLY   9          2HA       GLY   9   4.703   1.010   4.197
   59    H    ARG  10           H        ARG  10   6.735   0.557   2.448
   60    HA   ARG  10           HA       ARG  10   5.572  -0.963   0.360
   61   1HB   ARG  10          1HB       ARG  10   8.429  -0.016   0.807
   62   2HB   ARG  10          2HB       ARG  10   7.912  -0.820  -0.674
   63   1HG   ARG  10          1HG       ARG  10   6.593   1.713   0.375
   64   2HG   ARG  10          2HG       ARG  10   7.964   1.707  -0.742
   65   1HD   ARG  10          1HD       ARG  10   6.694   0.441  -2.408
   66   2HD   ARG  10          2HD       ARG  10   5.296   0.352  -1.327
   67    HE   ARG  10           HE       ARG  10   6.195   3.074  -1.764
   68   1HH1  ARG  10          1HH2      ARG  10   4.163   0.505  -3.160
   69   2HH1  ARG  10          2HH2      ARG  10   3.200   1.634  -4.083
   70   1HH2  ARG  10          1HH1      ARG  10   4.944   4.487  -2.927
   71   2HH2  ARG  10          2HH1      ARG  10   3.636   3.922  -3.952
   72    H    ASN  11           H        ASN  11   8.112  -1.892   2.711
   73    HA   ASN  11           HA       ASN  11   8.705  -4.432   1.633
   74   1HB   ASN  11          1HB       ASN  11  10.140  -3.484   3.279
   75   2HB   ASN  11          2HB       ASN  11   8.830  -3.288   4.440
   76   1HD2  ASN  11          2HD2      ASN  11   8.448  -4.876   5.916
   77   2HD2  ASN  11          1HD2      ASN  11   9.223  -6.442   5.894
   78    H    ILE  12           H        ILE  12   6.304  -3.584   4.226
   79    HA   ILE  12           HA       ILE  12   5.372  -6.252   4.555
   80    HB   ILE  12           HB       ILE  12   4.049  -3.580   5.134
   81   1HG1  ILE  12          1HG1      ILE  12   5.356  -5.557   7.056
   82   2HG1  ILE  12          2HG1      ILE  12   6.252  -4.233   6.325
   83   1HG2  ILE  12          1HG2      ILE  12   3.265  -6.410   5.993
   84   2HG2  ILE  12          2HG2      ILE  12   2.559  -4.932   6.669
   85   3HG2  ILE  12          3HG2      ILE  12   2.301  -5.324   4.976
   86   1HD1  ILE  12          1HD1      ILE  12   4.649  -2.590   7.282
   87   2HD1  ILE  12          2HD1      ILE  12   3.851  -3.918   8.159
   88   3HD1  ILE  12          3HD1      ILE  12   5.542  -3.528   8.496
   89    H    TYR  13           H        TYR  13   4.183  -3.553   2.523
   90    HA   TYR  13           HA       TYR  13   1.924  -4.782   1.429
   91   1HB   TYR  13          1HB       TYR  13   2.426  -2.405   1.219
   92   2HB   TYR  13          2HB       TYR  13   3.850  -2.750   0.244
   93    HD1  TYR  13           1HD      TYR  13   3.629  -2.538  -2.097
   94    HD2  TYR  13           2HD      TYR  13   0.157  -3.478   0.273
   95    HE1  TYR  13           1HE      TYR  13   2.204  -2.366  -4.117
   96    HE2  TYR  13           2HE      TYR  13  -1.262  -3.323  -1.749
   97    HH   TYR  13           HH       TYR  13  -1.358  -2.765  -3.941
   98    H    ASN  14           H        ASN  14   5.284  -4.716   0.130
   99    HA   ASN  14           HA       ASN  14   4.776  -6.315  -2.158
  100   1HB   ASN  14          1HB       ASN  14   7.262  -5.481  -0.651
  101   2HB   ASN  14          2HB       ASN  14   7.363  -6.718  -1.895
  102   1HD2  ASN  14          2HD2      ASN  14   6.153  -3.361  -1.409
  103   2HD2  ASN  14          1HD2      ASN  14   6.419  -2.881  -3.076
  104    H    THR  15           H        THR  15   5.881  -7.250   1.153
  105    HA   THR  15           HA       THR  15   6.291  -9.996   0.564
  106    HB   THR  15           HB       THR  15   5.460  -8.648   3.168
  107    HG1  THR  15           1HG      THR  15   7.697  -8.692   3.515
  108   1HG2  THR  15          1HG2      THR  15   6.523 -10.634   4.237
  109   2HG2  THR  15          2HG2      THR  15   5.089 -11.091   3.306
  110   3HG2  THR  15          3HG2      THR  15   6.712 -11.386   2.639
  111    H    CYS  16           H        CYS  16   3.386  -8.238   1.714
  112    HA   CYS  16           HA       CYS  16   1.676 -10.513   1.883
  113   1HB   CYS  16          1HB       CYS  16   1.313  -8.468   3.085
  114   2HB   CYS  16          2HB       CYS  16   1.129  -7.545   1.599
  115    H    ARG  17           H        ARG  17   2.390  -8.230  -0.777
  116    HA   ARG  17           HA       ARG  17   0.452  -9.223  -2.626
  117   1HB   ARG  17          1HB       ARG  17   3.116  -7.807  -2.980
  118   2HB   ARG  17          2HB       ARG  17   2.075  -8.190  -4.338
  119   1HG   ARG  17          1HG       ARG  17   0.705  -6.771  -2.093
  120   2HG   ARG  17          2HG       ARG  17   2.000  -5.856  -2.855
  121   1HD   ARG  17          1HD       ARG  17  -0.324  -5.490  -3.821
  122   2HD   ARG  17          2HD       ARG  17   0.989  -5.812  -4.951
  123    HE   ARG  17           HE       ARG  17  -0.096  -7.638  -5.697
  124   1HH1  ARG  17          1HH2      ARG  17  -1.287  -7.027  -2.402
  125   2HH1  ARG  17          2HH2      ARG  17  -2.445  -8.333  -2.470
  126   1HH2  ARG  17          1HH1      ARG  17  -1.739  -9.245  -5.791
  127   2HH2  ARG  17          2HH1      ARG  17  -2.691  -9.582  -4.363
  128    H    PHE  18           H        PHE  18   3.855 -10.127  -1.981
  129    HA   PHE  18           HA       PHE  18   4.042 -12.082  -4.046
  130   1HB   PHE  18          1HB       PHE  18   5.974 -11.041  -2.946
  131   2HB   PHE  18          2HB       PHE  18   5.560 -11.824  -1.424
  132    HD1  PHE  18           1HD      PHE  18   6.682 -12.428  -4.932
  133    HD2  PHE  18           2HD      PHE  18   6.131 -14.149  -1.016
  134    HE1  PHE  18           1HE      PHE  18   7.967 -14.431  -5.629
  135    HE2  PHE  18           2HE      PHE  18   7.405 -16.154  -1.722
  136    HZ   PHE  18           HZ       PHE  18   8.329 -16.298  -4.026
  137    H    ALA  19           H        ALA  19   3.117 -12.309  -0.578
  138    HA   ALA  19           HA       ALA  19   2.755 -15.119  -0.447
  139   1HB   ALA  19          1HB       ALA  19   1.322 -12.897   1.070
  140   2HB   ALA  19          2HB       ALA  19   1.361 -14.615   1.516
  141   3HB   ALA  19          3HB       ALA  19   2.859 -13.662   1.531
  142    H    GLY  20           H        GLY  20   0.517 -12.463  -1.314
  143   1HA   GLY  20          1HA       GLY  20  -0.812 -12.733  -3.280
  144   2HA   GLY  20          2HA       GLY  20  -1.161 -14.407  -2.850
  145    H    GLY  21           H        GLY  21  -1.271 -11.465  -0.762
  146   1HA   GLY  21          1HA       GLY  21  -4.121 -11.883  -0.130
  147   2HA   GLY  21          2HA       GLY  21  -3.065 -10.581   0.436
  148    H    SER  22           H        SER  22  -5.529  -9.749  -0.409
  149    HA   SER  22           HA       SER  22  -5.457  -8.936  -3.217
  150   1HB   SER  22          1HB       SER  22  -7.202  -7.947  -0.938
  151   2HB   SER  22          2HB       SER  22  -7.466  -7.688  -2.670
  152    HG   SER  22           HG       SER  22  -8.682  -9.454  -1.859
  153    H    ARG  23           H        ARG  23  -5.143  -6.763  -3.948
  154    HA   ARG  23           HA       ARG  23  -2.916  -5.409  -2.921
  155   1HB   ARG  23          1HB       ARG  23  -5.174  -4.308  -4.648
  156   2HB   ARG  23          2HB       ARG  23  -3.629  -3.513  -4.319
  157   1HG   ARG  23          1HG       ARG  23  -2.514  -5.671  -5.248
  158   2HG   ARG  23          2HG       ARG  23  -4.125  -6.088  -5.857
  159   1HD   ARG  23          1HD       ARG  23  -2.936  -4.971  -7.624
  160   2HD   ARG  23          2HD       ARG  23  -4.169  -3.845  -7.020
  161    HE   ARG  23           HE       ARG  23  -1.565  -3.602  -5.709
  162   1HH1  ARG  23          1HH2      ARG  23  -3.379  -2.525  -8.574
  163   2HH1  ARG  23          2HH2      ARG  23  -2.509  -1.018  -8.690
  164   1HH2  ARG  23          1HH1      ARG  23  -0.482  -1.668  -5.855
  165   2HH2  ARG  23          2HH1      ARG  23  -0.898  -0.473  -7.063
  166    H    GLU  24           H        GLU  24  -6.358  -4.429  -2.582
  167    HA   GLU  24           HA       GLU  24  -5.916  -2.184  -0.944
  168   1HB   GLU  24          1HB       GLU  24  -8.317  -4.055  -1.090
  169   2HB   GLU  24          2HB       GLU  24  -8.293  -2.478  -0.283
  170   1HG   GLU  24          1HG       GLU  24  -7.678  -1.394  -2.458
  171   2HG   GLU  24          2HG       GLU  24  -7.794  -2.969  -3.258
  172    HE2  GLU  24           HE       GLU  24  -9.556  -0.554  -1.524
  173    H    ARG  25           H        ARG  25  -6.560  -5.593   0.007
  174    HA   ARG  25           HA       ARG  25  -6.680  -5.152   2.788
  175   1HB   ARG  25          1HB       ARG  25  -7.334  -7.172   1.323
  176   2HB   ARG  25          2HB       ARG  25  -5.670  -7.723   1.493
  177   1HG   ARG  25          1HG       ARG  25  -7.595  -7.115   3.797
  178   2HG   ARG  25          2HG       ARG  25  -7.363  -8.704   3.060
  179   1HD   ARG  25          1HD       ARG  25  -4.917  -8.571   3.674
  180   2HD   ARG  25          2HD       ARG  25  -5.305  -7.120   4.634
  181    HE   ARG  25           HE       ARG  25  -7.129  -9.103   5.384
  182   1HH1  ARG  25          1HH2      ARG  25  -3.630  -8.560   5.554
  183   2HH1  ARG  25          2HH2      ARG  25  -3.412  -9.533   6.987
  184   1HH2  ARG  25          1HH1      ARG  25  -6.841 -10.374   7.273
  185   2HH2  ARG  25          2HH1      ARG  25  -5.254 -10.571   7.971
  186    H    CYS  26           H        CYS  26  -3.917  -6.240   0.765
  187    HA   CYS  26           HA       CYS  26  -1.916  -6.261   2.764
  188   1HB   CYS  26          1HB       CYS  26  -1.776  -5.700  -0.228
  189   2HB   CYS  26          2HB       CYS  26  -0.371  -5.955   0.802
  190    H    ALA  27           H        ALA  27  -3.112  -3.583   0.707
  191    HA   ALA  27           HA       ALA  27  -1.161  -1.679   1.495
  192   1HB   ALA  27          1HB       ALA  27  -3.994  -1.192   0.537
  193   2HB   ALA  27          2HB       ALA  27  -2.641  -0.043   0.544
  194   3HB   ALA  27          3HB       ALA  27  -2.562  -1.482  -0.480
  195    H    LYS  28           H        LYS  28  -4.492  -2.324   2.789
  196    HA   LYS  28           HA       LYS  28  -4.432  -0.434   4.888
  197   1HB   LYS  28          1HB       LYS  28  -5.931  -2.989   4.313
  198   2HB   LYS  28          2HB       LYS  28  -5.893  -2.419   5.974
  199   1HG   LYS  28          1HG       LYS  28  -7.847  -1.511   5.028
  200   2HG   LYS  28          2HG       LYS  28  -6.701  -0.176   5.222
  201   1HD   LYS  28          1HD       LYS  28  -6.144  -0.399   2.752
  202   2HD   LYS  28          2HD       LYS  28  -7.345  -1.707   2.667
  203   1HE   LYS  28          1HE       LYS  28  -8.375   0.290   1.834
  204   2HE   LYS  28          2HE       LYS  28  -9.121  -0.120   3.387
  205   1HZ   LYS  28          1HZ       LYS  28  -7.037   1.905   2.948
  206   2HZ   LYS  28          2HZ       LYS  28  -8.638   2.202   3.205
  207   3HZ   LYS  28          3HZ       LYS  28  -7.723   1.541   4.405
  208    H    LEU  29           H        LEU  29  -3.464  -3.893   4.917
  209    HA   LEU  29           HA       LEU  29  -2.686  -4.136   7.574
  210   1HB   LEU  29          1HB       LEU  29  -2.885  -6.017   6.002
  211   2HB   LEU  29          2HB       LEU  29  -1.526  -5.396   5.063
  212    HG   LEU  29           HG       LEU  29  -0.017  -5.764   7.044
  213   1HD1  LEU  29          1HD1      LEU  29  -1.668  -5.753   8.872
  214   2HD1  LEU  29          2HD1      LEU  29  -2.483  -7.171   8.173
  215   3HD1  LEU  29          3HD1      LEU  29  -0.836  -7.312   8.821
  216   1HD2  LEU  29          1HD2      LEU  29  -1.475  -8.225   6.030
  217   2HD2  LEU  29          2HD2      LEU  29  -0.182  -7.361   5.176
  218   3HD2  LEU  29          3HD2      LEU  29   0.159  -8.162   6.718
  219    H    SER  30           H        SER  30  -0.786  -2.975   4.787
  220    HA   SER  30           HA       SER  30   1.673  -2.655   6.302
  221   1HB   SER  30          1HB       SER  30   2.522  -1.699   4.217
  222   2HB   SER  30          2HB       SER  30   1.718  -3.257   3.942
  223    HG   SER  30           HG       SER  30  -0.102  -2.131   3.236
  224    H    GLY  31           H        GLY  31  -0.990  -0.545   5.329
  225   1HA   GLY  31          1HA       GLY  31  -1.477   1.461   6.587
  226   2HA   GLY  31          2HA       GLY  31   0.251   1.797   6.727
  227    H    CYS  32           H        CYS  32  -0.259   0.562   3.618
  228    HA   CYS  32           HA       CYS  32   0.061   3.203   2.421
  229   1HB   CYS  32          1HB       CYS  32  -0.175   0.508   1.054
  230   2HB   CYS  32          2HB       CYS  32   0.502   1.970   0.383
  231    H    LYS  33           H        LYS  33  -1.222   3.839   0.539
  232    HA   LYS  33           HA       LYS  33  -4.128   3.190   0.749
  233   1HB   LYS  33          1HB       LYS  33  -2.805   5.557  -0.608
  234   2HB   LYS  33          2HB       LYS  33  -4.518   5.344  -0.257
  235   1HG   LYS  33          1HG       LYS  33  -2.274   5.861   1.748
  236   2HG   LYS  33          2HG       LYS  33  -3.449   7.007   1.118
  237   1HD   LYS  33          1HD       LYS  33  -4.386   6.596   3.125
  238   2HD   LYS  33          2HD       LYS  33  -5.277   5.437   2.141
  239   1HE   LYS  33          1HE       LYS  33  -4.240   3.614   3.165
  240   2HE   LYS  33          2HE       LYS  33  -2.730   4.501   3.479
  241   1HZ   LYS  33          1HZ       LYS  33  -5.224   4.908   4.945
  242   2HZ   LYS  33          2HZ       LYS  33  -3.922   4.033   5.461
  243   3HZ   LYS  33          3HZ       LYS  33  -3.775   5.654   5.220
  244    H    ILE  34           H        ILE  34  -5.199   2.600  -1.151
  245    HA   ILE  34           HA       ILE  34  -3.692   2.488  -3.730
  246    HB   ILE  34           HB       ILE  34  -5.808   0.549  -2.712
  247   1HG1  ILE  34          1HG1      ILE  34  -3.642   0.255  -1.577
  248   2HG1  ILE  34          2HG1      ILE  34  -4.180  -1.129  -2.513
  249   1HG2  ILE  34          1HG2      ILE  34  -4.235   0.620  -5.322
  250   2HG2  ILE  34          2HG2      ILE  34  -5.214  -0.755  -4.764
  251   3HG2  ILE  34          3HG2      ILE  34  -5.987   0.794  -5.119
  252   1HD1  ILE  34          1HD1      ILE  34  -2.069   0.872  -3.440
  253   2HD1  ILE  34          2HD1      ILE  34  -1.744  -0.708  -2.718
  254   3HD1  ILE  34          3HD1      ILE  34  -2.556  -0.615  -4.288
  255    H    ILE  35           H        ILE  35  -4.492   4.244  -4.771
  256    HA   ILE  35           HA       ILE  35  -7.398   4.253  -5.281
  257    HB   ILE  35           HB       ILE  35  -7.515   6.658  -5.281
  258   1HG1  ILE  35          1HG1      ILE  35  -4.658   6.683  -4.201
  259   2HG1  ILE  35          2HG1      ILE  35  -5.205   7.282  -5.778
  260   1HG2  ILE  35          1HG2      ILE  35  -8.048   5.309  -3.226
  261   2HG2  ILE  35          2HG2      ILE  35  -6.444   5.738  -2.585
  262   3HG2  ILE  35          3HG2      ILE  35  -7.656   6.996  -2.901
  263   1HD1  ILE  35          1HD1      ILE  35  -6.712   8.908  -4.590
  264   2HD1  ILE  35          2HD1      ILE  35  -5.920   8.437  -3.064
  265   3HD1  ILE  35          3HD1      ILE  35  -4.980   9.185  -4.355
  266    H    SER  36           H        SER  36  -7.912   4.601  -7.384
  267    HA   SER  36           HA       SER  36  -5.674   4.497  -9.329
  268   1HB   SER  36          1HB       SER  36  -8.648   3.946  -9.656
  269   2HB   SER  36          2HB       SER  36  -7.371   3.623 -10.849
  270    HG   SER  36           HG       SER  36  -6.440   2.186  -9.325
  271    H    ALA  37           H        ALA  37  -6.275   7.041  -8.035
  272    HA   ALA  37           HA       ALA  37  -7.718   8.659 -10.032
  273   1HB   ALA  37          1HB       ALA  37  -6.366   9.397  -7.410
  274   2HB   ALA  37          2HB       ALA  37  -7.418  10.446  -8.384
  275   3HB   ALA  37          3HB       ALA  37  -8.085   8.994  -7.614
  276    H    SER  38           H        SER  38  -4.684   7.388 -10.075
  277    HA   SER  38           HA       SER  38  -2.621   7.957 -10.711
  278   1HB   SER  38          1HB       SER  38  -3.823   8.329 -12.821
  279   2HB   SER  38          2HB       SER  38  -4.059  10.032 -12.394
  280    HG   SER  38           HG       SER  38  -1.794  10.247 -12.359
  281    H    THR  39           H        THR  39  -3.573   9.129  -8.258
  282    HA   THR  39           HA       THR  39  -1.685  11.343  -7.864
  283    HB   THR  39           HB       THR  39  -4.688  11.613  -7.350
  284    HG1  THR  39           1HG      THR  39  -2.999  12.750  -9.311
  285   1HG2  THR  39          1HG2      THR  39  -4.098  14.023  -6.933
  286   2HG2  THR  39          2HG2      THR  39  -3.492  12.930  -5.691
  287   3HG2  THR  39          3HG2      THR  39  -2.383  13.569  -6.934
  288    H    CYS  40           H        CYS  40  -1.501  11.806  -5.501
  289    HA   CYS  40           HA       CYS  40  -2.810   9.981  -3.634
  290   1HB   CYS  40          1HB       CYS  40   0.213  10.249  -3.883
  291   2HB   CYS  40          2HB       CYS  40  -0.599   9.605  -2.457
  292    HA   PRO  41           HA       PRO  41  -2.799  13.939  -1.538
  293   1HB   PRO  41          1HB       PRO  41  -3.508  13.256   1.000
  294   2HB   PRO  41          2HB       PRO  41  -4.622  13.057  -0.383
  295   1HG   PRO  41          1HG       PRO  41  -2.815  10.951   0.833
  296   2HG   PRO  41          2HG       PRO  41  -4.573  10.826   0.524
  297   1HD   PRO  41          1HD       PRO  41  -2.757   9.847  -1.249
  298   2HD   PRO  41          2HD       PRO  41  -4.237  10.674  -1.821
  299    H    SER  42           H        SER  42  -1.714  15.118   0.218
  300    HA   SER  42           HA       SER  42   1.105  14.499   0.379
  301   1HB   SER  42          1HB       SER  42   0.257  16.773   0.029
  302   2HB   SER  42          2HB       SER  42  -0.547  16.740   1.612
  303    HG   SER  42           HG       SER  42   1.511  16.459   2.550
  304    H    ASP  43           H        ASP  43   0.462  12.389   1.468
  305    HA   ASP  43           HA       ASP  43   0.883  12.557   4.397
  306   1HB   ASP  43          1HB       ASP  43  -1.458  11.161   3.041
  307   2HB   ASP  43          2HB       ASP  43  -0.977  10.885   4.724
  308    HD2  ASP  43           HD       ASP  43  -2.073  14.084   5.802
  309    H    TYR  44           H        TYR  44   0.929  10.717   1.349
  310    HA   TYR  44           HA       TYR  44   2.596   8.592   2.638
  311   1HB   TYR  44          1HB       TYR  44   0.560   8.346   0.405
  312   2HB   TYR  44          2HB       TYR  44   1.536   7.053   1.094
  313    HD1  TYR  44           1HD      TYR  44   1.208   6.427   3.522
  314    HD2  TYR  44           2HD      TYR  44  -1.447   9.123   1.504
  315    HE1  TYR  44           1HE      TYR  44  -0.464   6.076   5.309
  316    HE2  TYR  44           2HE      TYR  44  -3.076   8.900   3.355
  317    HH   TYR  44           HH       TYR  44  -3.513   7.962   5.422
  318    HA   PRO  45           HA       PRO  45   4.825  10.741  -0.802
  319   1HB   PRO  45          1HB       PRO  45   7.176  11.393   0.427
  320   2HB   PRO  45          2HB       PRO  45   5.668  12.332   0.600
  321   1HG   PRO  45          1HG       PRO  45   6.775  10.263   2.501
  322   2HG   PRO  45          2HG       PRO  45   6.139  11.882   2.887
  323   1HD   PRO  45          1HD       PRO  45   4.628   9.602   3.114
  324   2HD   PRO  45          2HD       PRO  45   3.931  11.179   2.629
  325    H    LYS  46           H        LYS  46   5.383   7.749   0.819
  326    HA   LYS  46           HA       LYS  46   7.713   7.063  -0.927
  327   1HB   LYS  46          1HB       LYS  46   6.625   5.822   1.625
  328   2HB   LYS  46          2HB       LYS  46   7.760   5.005   0.557
  329   1HG   LYS  46          1HG       LYS  46   8.960   5.993   2.361
  330   2HG   LYS  46          2HG       LYS  46   9.427   6.773   0.849
  331   1HD   LYS  46          1HD       LYS  46   8.281   8.757   1.349
  332   2HD   LYS  46          2HD       LYS  46   7.258   7.992   2.580
  333   1HE   LYS  46          1HE       LYS  46  10.267   8.426   2.880
  334   2HE   LYS  46          2HE       LYS  46   9.027   9.555   3.453
  335   1HZ   LYS  46          1HZ       LYS  46   9.436   6.813   4.375
  336   2HZ   LYS  46          2HZ       LYS  46   9.615   8.203   5.236
  337   3HZ   LYS  46          3HZ       LYS  46   8.113   7.711   4.760
  Start of MODEL    9
    1   1H    LYS   1          1H        LYS   1  -2.562   6.661  -8.169
    2   2H    LYS   1          2H        LYS   1  -3.373   5.867  -6.976
    3   3H    LYS   1          3H        LYS   1  -2.187   6.936  -6.583
    4    HA   LYS   1           HA       LYS   1  -1.855   4.416  -8.042
    5   1HB   LYS   1          1HB       LYS   1   0.340   6.216  -6.942
    6   2HB   LYS   1          2HB       LYS   1   0.530   4.743  -7.888
    7   1HG   LYS   1          1HG       LYS   1   0.818   6.149  -9.611
    8   2HG   LYS   1          2HG       LYS   1  -0.935   6.087  -9.672
    9   1HD   LYS   1          1HD       LYS   1  -0.391   8.392  -9.824
   10   2HD   LYS   1          2HD       LYS   1  -0.922   8.179  -8.155
   11   1HE   LYS   1          1HE       LYS   1   0.994   9.604  -8.153
   12   2HE   LYS   1          2HE       LYS   1   1.499   8.065  -7.447
   13   1HZ   LYS   1          1HZ       LYS   1   1.974   8.955 -10.210
   14   2HZ   LYS   1          2HZ       LYS   1   3.087   8.897  -8.998
   15   3HZ   LYS   1          3HZ       LYS   1   2.447   7.502  -9.590
   16    H    SER   2           H        SER   2  -0.070   3.080  -6.702
   17    HA   SER   2           HA       SER   2  -1.035   2.682  -3.976
   18   1HB   SER   2          1HB       SER   2   0.685   0.933  -3.888
   19   2HB   SER   2          2HB       SER   2  -0.345   0.759  -5.321
   20    HG   SER   2           HG       SER   2   1.776   0.527  -5.947
   21    H    CYS   3           H        CYS   3  -0.156   3.701  -2.208
   22    HA   CYS   3           HA       CYS   3   2.514   4.991  -2.345
   23   1HB   CYS   3          1HB       CYS   3  -0.134   6.430  -2.171
   24   2HB   CYS   3          2HB       CYS   3   1.335   7.112  -1.472
   25    H    CYS   4           H        CYS   4   3.534   4.864  -0.478
   26    HA   CYS   4           HA       CYS   4   2.087   3.843   1.904
   27   1HB   CYS   4          1HB       CYS   4   4.873   3.325   0.830
   28   2HB   CYS   4          2HB       CYS   4   4.300   2.712   2.362
   29    HA   PRO   5           HA       PRO   5   3.859   7.195   4.252
   30   1HB   PRO   5          1HB       PRO   5   3.991   6.141   6.762
   31   2HB   PRO   5          2HB       PRO   5   2.443   6.506   5.962
   32   1HG   PRO   5          1HG       PRO   5   3.856   3.826   6.096
   33   2HG   PRO   5          2HG       PRO   5   2.148   4.182   6.473
   34   1HD   PRO   5          1HD       PRO   5   2.876   3.213   4.053
   35   2HD   PRO   5          2HD       PRO   5   1.612   4.449   4.182
   36    H    ASN   6           H        ASN   6   5.401   3.979   4.379
   37    HA   ASN   6           HA       ASN   6   8.073   5.195   4.814
   38   1HB   ASN   6          1HB       ASN   6   6.843   2.982   6.502
   39   2HB   ASN   6          2HB       ASN   6   8.520   3.534   6.582
   40   1HD2  ASN   6          2HD2      ASN   6   5.453   3.932   7.960
   41   2HD2  ASN   6          1HD2      ASN   6   5.738   5.460   8.759
   42    H    THR   7           H        THR   7   9.809   3.699   4.390
   43    HA   THR   7           HA       THR   7   9.506   1.964   2.162
   44    HB   THR   7           HB       THR   7  11.724   1.964   4.248
   45    HG1  THR   7           1HG      THR   7  12.645   3.545   2.877
   46   1HG2  THR   7          1HG2      THR   7  13.138   1.312   2.326
   47   2HG2  THR   7          2HG2      THR   7  11.854   0.120   2.581
   48   3HG2  THR   7          3HG2      THR   7  11.715   1.305   1.262
   49    H    THR   8           H        THR   8   9.357   1.463   5.692
   50    HA   THR   8           HA       THR   8   9.268  -1.386   5.689
   51    HB   THR   8           HB       THR   8   7.958   0.542   7.644
   52    HG1  THR   8           1HG      THR   8  10.173   0.972   7.396
   53   1HG2  THR   8          1HG2      THR   8   8.958  -2.332   7.939
   54   2HG2  THR   8          2HG2      THR   8   8.352  -1.311   9.257
   55   3HG2  THR   8          3HG2      THR   8   7.256  -1.818   7.961
   56    H    GLY   9           H        GLY   9   6.795   1.158   5.191
   57   1HA   GLY   9          1HA       GLY   9   4.466  -0.469   5.133
   58   2HA   GLY   9          2HA       GLY   9   4.703   1.071   4.292
   59    H    ARG  10           H        ARG  10   6.680   0.633   2.491
   60    HA   ARG  10           HA       ARG  10   5.465  -0.848   0.400
   61   1HB   ARG  10          1HB       ARG  10   8.322   0.119   0.804
   62   2HB   ARG  10          2HB       ARG  10   7.811  -0.722  -0.660
   63   1HG   ARG  10          1HG       ARG  10   6.477   1.815   0.337
   64   2HG   ARG  10          2HG       ARG  10   7.841   1.800  -0.784
   65   1HD   ARG  10          1HD       ARG  10   6.592   0.513  -2.431
   66   2HD   ARG  10          2HD       ARG  10   5.194   0.399  -1.355
   67    HE   ARG  10           HE       ARG  10   5.853   3.146  -1.685
   68   1HH1  ARG  10          1HH2      ARG  10   4.266   0.451  -3.372
   69   2HH1  ARG  10          2HH2      ARG  10   3.395   1.504  -4.465
   70   1HH2  ARG  10          1HH1      ARG  10   4.814   4.484  -3.218
   71   2HH2  ARG  10          2HH1      ARG  10   3.684   3.791  -4.351
   72    H    ASN  11           H        ASN  11   8.065  -1.806   2.680
   73    HA   ASN  11           HA       ASN  11   8.614  -4.334   1.568
   74   1HB   ASN  11          1HB       ASN  11  10.076  -3.415   3.212
   75   2HB   ASN  11          2HB       ASN  11   8.784  -3.266   4.400
   76   1HD2  ASN  11          2HD2      ASN  11   8.438  -4.904   5.828
   77   2HD2  ASN  11          1HD2      ASN  11   9.205  -6.474   5.727
   78    H    ILE  12           H        ILE  12   6.270  -3.557   4.246
   79    HA   ILE  12           HA       ILE  12   5.363  -6.234   4.517
   80    HB   ILE  12           HB       ILE  12   4.005  -3.603   5.181
   81   1HG1  ILE  12          1HG1      ILE  12   5.405  -5.588   7.025
   82   2HG1  ILE  12          2HG1      ILE  12   6.235  -4.208   6.321
   83   1HG2  ILE  12          1HG2      ILE  12   2.319  -5.454   5.000
   84   2HG2  ILE  12          2HG2      ILE  12   3.310  -6.443   6.084
   85   3HG2  ILE  12          3HG2      ILE  12   2.532  -4.962   6.672
   86   1HD1  ILE  12          1HD1      ILE  12   3.858  -4.044   8.207
   87   2HD1  ILE  12          2HD1      ILE  12   5.540  -3.608   8.532
   88   3HD1  ILE  12          3HD1      ILE  12   4.596  -2.659   7.367
   89    H    TYR  13           H        TYR  13   4.019  -3.494   2.631
   90    HA   TYR  13           HA       TYR  13   1.810  -4.709   1.478
   91   1HB   TYR  13          1HB       TYR  13   2.253  -2.345   1.271
   92   2HB   TYR  13          2HB       TYR  13   3.759  -2.640   0.415
   93    HD1  TYR  13           1HD      TYR  13   0.117  -3.550   0.050
   94    HD2  TYR  13           2HD      TYR  13   3.730  -2.218  -1.882
   95    HE1  TYR  13           1HE      TYR  13  -1.088  -3.417  -2.110
   96    HE2  TYR  13           2HE      TYR  13   2.525  -2.070  -4.035
   97    HH   TYR  13           HH       TYR  13   0.532  -2.407  -5.145
   98    H    ASN  14           H        ASN  14   5.158  -4.625   0.142
   99    HA   ASN  14           HA       ASN  14   4.604  -6.219  -2.145
  100   1HB   ASN  14          1HB       ASN  14   7.120  -5.369  -0.698
  101   2HB   ASN  14          2HB       ASN  14   7.199  -6.609  -1.937
  102   1HD2  ASN  14          2HD2      ASN  14   6.282  -3.196  -1.412
  103   2HD2  ASN  14          1HD2      ASN  14   6.399  -2.760  -3.109
  104    H    THR  15           H        THR  15   5.780  -7.162   1.136
  105    HA   THR  15           HA       THR  15   6.254  -9.887   0.476
  106    HB   THR  15           HB       THR  15   5.512  -8.625   3.150
  107    HG1  THR  15           1HG      THR  15   8.002  -9.175   1.903
  108   1HG2  THR  15          1HG2      THR  15   6.843 -11.291   2.480
  109   2HG2  THR  15          2HG2      THR  15   6.745 -10.575   4.102
  110   3HG2  THR  15          3HG2      THR  15   5.263 -11.069   3.267
  111    H    CYS  16           H        CYS  16   3.352  -8.219   1.745
  112    HA   CYS  16           HA       CYS  16   1.701 -10.536   1.977
  113   1HB   CYS  16          1HB       CYS  16   1.256  -8.542   3.198
  114   2HB   CYS  16          2HB       CYS  16   1.149  -7.567   1.737
  115    H    ARG  17           H        ARG  17   2.106  -8.126  -0.666
  116    HA   ARG  17           HA       ARG  17   0.204  -9.207  -2.473
  117   1HB   ARG  17          1HB       ARG  17   2.796  -7.664  -2.837
  118   2HB   ARG  17          2HB       ARG  17   1.791  -8.114  -4.208
  119   1HG   ARG  17          1HG       ARG  17   0.390  -6.695  -1.951
  120   2HG   ARG  17          2HG       ARG  17   1.561  -5.763  -2.893
  121   1HD   ARG  17          1HD       ARG  17  -0.650  -5.513  -3.855
  122   2HD   ARG  17          2HD       ARG  17   0.461  -6.311  -4.968
  123    HE   ARG  17           HE       ARG  17  -1.363  -7.951  -3.256
  124   1HH1  ARG  17          1HH2      ARG  17  -0.606  -6.810  -6.557
  125   2HH1  ARG  17          2HH2      ARG  17  -1.608  -8.022  -7.309
  126   1HH2  ARG  17          1HH1      ARG  17  -2.630  -9.502  -4.277
  127   2HH2  ARG  17          2HH1      ARG  17  -2.762  -9.558  -6.019
  128    H    PHE  18           H        PHE  18   3.666  -9.951  -1.974
  129    HA   PHE  18           HA       PHE  18   3.935 -11.821  -4.095
  130   1HB   PHE  18          1HB       PHE  18   5.842 -10.746  -3.053
  131   2HB   PHE  18          2HB       PHE  18   5.461 -11.466  -1.493
  132    HD1  PHE  18           1HD      PHE  18   6.279 -13.630  -0.904
  133    HD2  PHE  18           2HD      PHE  18   6.444 -12.318  -5.011
  134    HE1  PHE  18           1HE      PHE  18   7.586 -15.648  -1.501
  135    HE2  PHE  18           2HE      PHE  18   7.738 -14.350  -5.603
  136    HZ   PHE  18           HZ       PHE  18   8.320 -16.012  -3.849
  137    H    ALA  19           H        ALA  19   3.140 -12.249  -0.610
  138    HA   ALA  19           HA       ALA  19   2.920 -15.068  -0.594
  139   1HB   ALA  19          1HB       ALA  19   2.971 -13.687   1.441
  140   2HB   ALA  19          2HB       ALA  19   1.376 -13.012   1.042
  141   3HB   ALA  19          3HB       ALA  19   1.540 -14.740   1.409
  142    H    GLY  20           H        GLY  20   0.500 -12.532  -1.322
  143   1HA   GLY  20          1HA       GLY  20  -0.728 -13.001  -3.409
  144   2HA   GLY  20          2HA       GLY  20  -1.196 -14.565  -2.738
  145    H    GLY  21           H        GLY  21  -1.084 -11.411  -1.014
  146   1HA   GLY  21          1HA       GLY  21  -3.977 -11.616  -0.413
  147   2HA   GLY  21          2HA       GLY  21  -2.802 -10.538   0.341
  148    H    SER  22           H        SER  22  -5.386  -9.808  -0.826
  149    HA   SER  22           HA       SER  22  -5.122  -8.737  -3.449
  150   1HB   SER  22          1HB       SER  22  -7.005  -7.890  -1.209
  151   2HB   SER  22          2HB       SER  22  -7.206  -7.562  -2.937
  152    HG   SER  22           HG       SER  22  -7.135 -10.128  -1.724
  153    H    ARG  23           H        ARG  23  -5.014  -6.506  -4.097
  154    HA   ARG  23           HA       ARG  23  -2.807  -5.129  -3.080
  155   1HB   ARG  23          1HB       ARG  23  -5.149  -4.082  -4.731
  156   2HB   ARG  23          2HB       ARG  23  -3.619  -3.228  -4.474
  157   1HG   ARG  23          1HG       ARG  23  -2.370  -5.060  -5.534
  158   2HG   ARG  23          2HG       ARG  23  -3.870  -5.961  -5.823
  159   1HD   ARG  23          1HD       ARG  23  -3.233  -3.191  -6.910
  160   2HD   ARG  23          2HD       ARG  23  -3.049  -4.711  -7.812
  161    HE   ARG  23           HE       ARG  23  -5.684  -4.677  -6.870
  162   1HH1  ARG  23          1HH2      ARG  23  -3.693  -2.749  -9.094
  163   2HH1  ARG  23          2HH2      ARG  23  -5.043  -2.283 -10.095
  164   1HH2  ARG  23          1HH1      ARG  23  -7.435  -4.078  -8.201
  165   2HH2  ARG  23          2HH1      ARG  23  -7.181  -3.046  -9.586
  166    H    GLU  24           H        GLU  24  -6.265  -4.271  -2.693
  167    HA   GLU  24           HA       GLU  24  -5.943  -2.087  -0.949
  168   1HB   GLU  24          1HB       GLU  24  -8.202  -4.116  -1.224
  169   2HB   GLU  24          2HB       GLU  24  -8.309  -2.622  -0.274
  170   1HG   GLU  24          1HG       GLU  24  -7.820  -1.282  -2.300
  171   2HG   GLU  24          2HG       GLU  24  -7.782  -2.763  -3.277
  172    HE2  GLU  24           HE       GLU  24  -9.451  -0.686  -3.783
  173    H    ARG  25           H        ARG  25  -6.390  -5.579  -0.163
  174    HA   ARG  25           HA       ARG  25  -6.622  -5.199   2.609
  175   1HB   ARG  25          1HB       ARG  25  -7.251  -7.210   1.215
  176   2HB   ARG  25          2HB       ARG  25  -5.550  -7.694   1.207
  177   1HG   ARG  25          1HG       ARG  25  -5.553  -7.890   3.655
  178   2HG   ARG  25          2HG       ARG  25  -7.153  -7.133   3.744
  179   1HD   ARG  25          1HD       ARG  25  -7.472  -9.466   4.051
  180   2HD   ARG  25          2HD       ARG  25  -8.126  -9.022   2.466
  181    HE   ARG  25           HE       ARG  25  -5.350  -9.986   2.459
  182   1HH1  ARG  25          1HH2      ARG  25  -8.758 -10.986   2.249
  183   2HH1  ARG  25          2HH2      ARG  25  -8.388 -12.519   1.507
  184   1HH2  ARG  25          1HH1      ARG  25  -4.886 -12.028   1.542
  185   2HH2  ARG  25          2HH1      ARG  25  -6.179 -13.110   1.098
  186    H    CYS  26           H        CYS  26  -3.786  -6.178   0.657
  187    HA   CYS  26           HA       CYS  26  -1.867  -6.235   2.744
  188   1HB   CYS  26          1HB       CYS  26  -1.605  -5.656  -0.241
  189   2HB   CYS  26          2HB       CYS  26  -0.248  -5.948   0.841
  190    H    ALA  27           H        ALA  27  -2.947  -3.574   0.604
  191    HA   ALA  27           HA       ALA  27  -1.000  -1.688   1.428
  192   1HB   ALA  27          1HB       ALA  27  -3.808  -1.249   0.347
  193   2HB   ALA  27          2HB       ALA  27  -2.514  -0.037   0.407
  194   3HB   ALA  27          3HB       ALA  27  -2.316  -1.470  -0.602
  195    H    LYS  28           H        LYS  28  -4.415  -2.183   2.591
  196    HA   LYS  28           HA       LYS  28  -4.425  -0.251   4.596
  197   1HB   LYS  28          1HB       LYS  28  -6.326  -1.513   3.656
  198   2HB   LYS  28          2HB       LYS  28  -5.796  -2.980   4.488
  199   1HG   LYS  28          1HG       LYS  28  -6.082  -1.886   6.664
  200   2HG   LYS  28          2HG       LYS  28  -6.495  -0.357   5.855
  201   1HD   LYS  28          1HD       LYS  28  -8.483  -1.443   4.834
  202   2HD   LYS  28          2HD       LYS  28  -8.072  -2.964   5.660
  203   1HE   LYS  28          1HE       LYS  28  -8.327  -1.829   7.856
  204   2HE   LYS  28          2HE       LYS  28  -8.721  -0.308   7.030
  205   1HZ   LYS  28          1HZ       LYS  28 -10.277  -2.791   6.845
  206   2HZ   LYS  28          2HZ       LYS  28 -10.664  -1.481   7.766
  207   3HZ   LYS  28          3HZ       LYS  28 -10.652  -1.356   6.123
  208    H    LEU  29           H        LEU  29  -3.596  -3.732   4.786
  209    HA   LEU  29           HA       LEU  29  -3.010  -3.939   7.497
  210   1HB   LEU  29          1HB       LEU  29  -3.205  -5.833   5.896
  211   2HB   LEU  29          2HB       LEU  29  -1.686  -5.339   5.144
  212    HG   LEU  29           HG       LEU  29  -0.534  -5.771   7.379
  213   1HD1  LEU  29          1HD1      LEU  29  -3.199  -7.118   8.020
  214   2HD1  LEU  29          2HD1      LEU  29  -1.706  -7.248   8.971
  215   3HD1  LEU  29          3HD1      LEU  29  -2.540  -5.695   8.856
  216   1HD2  LEU  29          1HD2      LEU  29  -0.385  -7.337   5.525
  217   2HD2  LEU  29          2HD2      LEU  29  -0.552  -8.231   7.046
  218   3HD2  LEU  29          3HD2      LEU  29  -1.949  -8.059   5.960
  219    H    SER  30           H        SER  30  -0.905  -2.859   4.825
  220    HA   SER  30           HA       SER  30   1.469  -2.675   6.520
  221   1HB   SER  30          1HB       SER  30   2.526  -1.775   4.498
  222   2HB   SER  30          2HB       SER  30   1.709  -3.322   4.202
  223    HG   SER  30           HG       SER  30   0.021  -2.219   3.254
  224    H    GLY  31           H        GLY  31  -0.979  -0.460   5.257
  225   1HA   GLY  31          1HA       GLY  31  -1.495   1.531   6.583
  226   2HA   GLY  31          2HA       GLY  31   0.235   1.858   6.721
  227    H    CYS  32           H        CYS  32  -0.310   0.613   3.625
  228    HA   CYS  32           HA       CYS  32   0.033   3.238   2.394
  229   1HB   CYS  32          1HB       CYS  32  -0.230   0.517   1.082
  230   2HB   CYS  32          2HB       CYS  32   0.497   1.949   0.382
  231    H    LYS  33           H        LYS  33  -1.292   3.950   0.597
  232    HA   LYS  33           HA       LYS  33  -4.155   3.081   0.699
  233   1HB   LYS  33          1HB       LYS  33  -3.045   5.602  -0.554
  234   2HB   LYS  33          2HB       LYS  33  -4.727   5.216  -0.193
  235   1HG   LYS  33          1HG       LYS  33  -2.522   5.818   1.821
  236   2HG   LYS  33          2HG       LYS  33  -3.759   6.922   1.232
  237   1HD   LYS  33          1HD       LYS  33  -4.678   6.383   3.208
  238   2HD   LYS  33          2HD       LYS  33  -5.493   5.198   2.188
  239   1HE   LYS  33          1HE       LYS  33  -4.332   3.415   3.162
  240   2HE   LYS  33          2HE       LYS  33  -2.890   4.399   3.508
  241   1HZ   LYS  33          1HZ       LYS  33  -4.065   5.458   5.247
  242   2HZ   LYS  33          2HZ       LYS  33  -5.406   4.528   4.979
  243   3HZ   LYS  33          3HZ       LYS  33  -3.995   3.830   5.480
  244    H    ILE  34           H        ILE  34  -5.050   2.277  -1.152
  245    HA   ILE  34           HA       ILE  34  -3.609   2.533  -3.763
  246    HB   ILE  34           HB       ILE  34  -5.846   0.614  -2.994
  247   1HG1  ILE  34          1HG1      ILE  34  -3.909  -0.085  -1.779
  248   2HG1  ILE  34          2HG1      ILE  34  -4.287  -1.205  -3.074
  249   1HG2  ILE  34          1HG2      ILE  34  -4.159   0.860  -5.516
  250   2HG2  ILE  34          2HG2      ILE  34  -5.277  -0.475  -5.159
  251   3HG2  ILE  34          3HG2      ILE  34  -5.894   1.167  -5.353
  252   1HD1  ILE  34          1HD1      ILE  34  -2.033   0.839  -3.052
  253   2HD1  ILE  34          2HD1      ILE  34  -1.883  -0.918  -2.944
  254   3HD1  ILE  34          3HD1      ILE  34  -2.437  -0.183  -4.454
  255    H    ILE  35           H        ILE  35  -4.488   4.251  -4.880
  256    HA   ILE  35           HA       ILE  35  -7.436   4.368  -5.018
  257    HB   ILE  35           HB       ILE  35  -7.450   6.796  -5.063
  258   1HG1  ILE  35          1HG1      ILE  35  -4.519   6.651  -4.210
  259   2HG1  ILE  35          2HG1      ILE  35  -5.160   7.306  -5.728
  260   1HG2  ILE  35          1HG2      ILE  35  -6.237   5.793  -2.459
  261   2HG2  ILE  35          2HG2      ILE  35  -7.399   7.118  -2.675
  262   3HG2  ILE  35          3HG2      ILE  35  -7.903   5.461  -2.983
  263   1HD1  ILE  35          1HD1      ILE  35  -5.601   8.439  -2.942
  264   2HD1  ILE  35          2HD1      ILE  35  -4.692   9.159  -4.269
  265   3HD1  ILE  35          3HD1      ILE  35  -6.451   9.005  -4.404
  266    H    SER  36           H        SER  36  -8.234   4.666  -6.998
  267    HA   SER  36           HA       SER  36  -6.335   4.407  -9.251
  268   1HB   SER  36          1HB       SER  36  -9.353   4.044  -9.086
  269   2HB   SER  36          2HB       SER  36  -8.325   3.665 -10.482
  270    HG   SER  36           HG       SER  36  -8.172   2.490  -7.907
  271    H    ALA  37           H        ALA  37  -6.575   7.005  -7.945
  272    HA   ALA  37           HA       ALA  37  -7.999   8.699  -9.930
  273   1HB   ALA  37          1HB       ALA  37  -8.412   9.058  -7.512
  274   2HB   ALA  37          2HB       ALA  37  -6.680   9.375  -7.274
  275   3HB   ALA  37          3HB       ALA  37  -7.658  10.466  -8.281
  276    H    SER  38           H        SER  38  -5.133   7.196  -9.985
  277    HA   SER  38           HA       SER  38  -2.988   7.587 -10.517
  278   1HB   SER  38          1HB       SER  38  -4.141   7.887 -12.668
  279   2HB   SER  38          2HB       SER  38  -4.263   9.631 -12.367
  280    HG   SER  38           HG       SER  38  -1.968   9.660 -12.275
  281    H    THR  39           H        THR  39  -3.793   8.939  -8.168
  282    HA   THR  39           HA       THR  39  -1.830  11.142  -8.008
  283    HB   THR  39           HB       THR  39  -4.767  11.309  -7.156
  284    HG1  THR  39           1HG      THR  39  -4.584  11.594  -9.350
  285   1HG2  THR  39          1HG2      THR  39  -4.223  13.739  -6.778
  286   2HG2  THR  39          2HG2      THR  39  -3.465  12.660  -5.609
  287   3HG2  THR  39          3HG2      THR  39  -2.500  13.344  -6.947
  288    H    CYS  40           H        CYS  40  -1.403  11.631  -5.673
  289    HA   CYS  40           HA       CYS  40  -2.418   9.736  -3.695
  290   1HB   CYS  40          1HB       CYS  40   0.554  10.190  -4.175
  291   2HB   CYS  40          2HB       CYS  40  -0.137   9.466  -2.720
  292    HA   PRO  41           HA       PRO  41  -2.477  13.742  -1.729
  293   1HB   PRO  41          1HB       PRO  41  -3.296  13.141   0.773
  294   2HB   PRO  41          2HB       PRO  41  -4.324  12.774  -0.640
  295   1HG   PRO  41          1HG       PRO  41  -2.404  10.883   0.755
  296   2HG   PRO  41          2HG       PRO  41  -4.143  10.612   0.438
  297   1HD   PRO  41          1HD       PRO  41  -2.228   9.672  -1.261
  298   2HD   PRO  41          2HD       PRO  41  -3.762  10.345  -1.887
  299    H    SER  42           H        SER  42  -1.497  14.974   0.064
  300    HA   SER  42           HA       SER  42   1.321  14.383   0.387
  301   1HB   SER  42          1HB       SER  42   0.401  16.650  -0.059
  302   2HB   SER  42          2HB       SER  42  -0.350  16.646   1.549
  303    HG   SER  42           HG       SER  42   2.421  16.407   0.944
  304    H    ASP  43           H        ASP  43   0.726  12.311   1.449
  305    HA   ASP  43           HA       ASP  43   0.909  12.476   4.394
  306   1HB   ASP  43          1HB       ASP  43  -1.293  10.977   2.909
  307   2HB   ASP  43          2HB       ASP  43  -0.926  10.784   4.628
  308    HD2  ASP  43           HD       ASP  43  -2.180  14.011   5.481
  309    H    TYR  44           H        TYR  44   0.938  10.567   1.374
  310    HA   TYR  44           HA       TYR  44   2.657   8.490   2.661
  311   1HB   TYR  44          1HB       TYR  44   0.561   8.201   0.492
  312   2HB   TYR  44          2HB       TYR  44   1.542   6.923   1.206
  313    HD1  TYR  44           1HD      TYR  44   1.386   6.700   3.823
  314    HD2  TYR  44           2HD      TYR  44  -1.553   8.746   1.458
  315    HE1  TYR  44           1HE      TYR  44  -0.291   6.274   5.586
  316    HE2  TYR  44           2HE      TYR  44  -3.204   8.472   3.285
  317    HH   TYR  44           HH       TYR  44  -2.438   6.697   6.298
  318    HA   PRO  45           HA       PRO  45   4.777  10.685  -0.768
  319   1HB   PRO  45          1HB       PRO  45   7.199  11.211   0.349
  320   2HB   PRO  45          2HB       PRO  45   5.714  12.102   0.791
  321   1HG   PRO  45          1HG       PRO  45   6.927   9.728   2.217
  322   2HG   PRO  45          2HG       PRO  45   6.451  11.294   2.938
  323   1HD   PRO  45          1HD       PRO  45   4.810   9.129   3.008
  324   2HD   PRO  45          2HD       PRO  45   4.158  10.774   2.734
  325    H    LYS  46           H        LYS  46   5.518   7.556   0.560
  326    HA   LYS  46           HA       LYS  46   7.517   7.044  -1.621
  327   1HB   LYS  46          1HB       LYS  46   6.984   5.614   1.000
  328   2HB   LYS  46          2HB       LYS  46   7.723   4.816  -0.376
  329   1HG   LYS  46          1HG       LYS  46   9.532   5.520   0.894
  330   2HG   LYS  46          2HG       LYS  46   9.483   6.553  -0.529
  331   1HD   LYS  46          1HD       LYS  46  10.050   7.801   1.485
  332   2HD   LYS  46          2HD       LYS  46   8.525   8.401   0.823
  333   1HE   LYS  46          1HE       LYS  46   7.232   7.256   2.502
  334   2HE   LYS  46          2HE       LYS  46   8.615   6.240   2.961
  335   1HZ   LYS  46          1HZ       LYS  46   9.650   8.121   3.922
  336   2HZ   LYS  46          2HZ       LYS  46   8.435   9.125   3.437
  337   3HZ   LYS  46          3HZ       LYS  46   8.127   7.939   4.540
  Start of MODEL   10
    1   1H    LYS   1          1H        LYS   1  -3.100   4.272  -8.946
    2   2H    LYS   1          2H        LYS   1  -3.277   3.301  -7.625
    3   3H    LYS   1          3H        LYS   1  -3.335   4.932  -7.453
    4    HA   LYS   1           HA       LYS   1  -1.042   3.345  -8.297
    5   1HB   LYS   1          1HB       LYS   1  -1.319   5.725  -9.251
    6   2HB   LYS   1          2HB       LYS   1  -0.991   6.301  -7.609
    7   1HG   LYS   1          1HG       LYS   1   1.210   5.040  -7.688
    8   2HG   LYS   1          2HG       LYS   1   0.789   4.488  -9.311
    9   1HD   LYS   1          1HD       LYS   1   2.232   6.311  -9.700
   10   2HD   LYS   1          2HD       LYS   1   0.612   6.916 -10.033
   11   1HE   LYS   1          1HE       LYS   1   1.886   8.572  -8.782
   12   2HE   LYS   1          2HE       LYS   1   0.555   7.997  -7.776
   13   1HZ   LYS   1          1HZ       LYS   1   3.337   7.050  -7.620
   14   2HZ   LYS   1          2HZ       LYS   1   2.647   8.146  -6.601
   15   3HZ   LYS   1          3HZ       LYS   1   2.105   6.594  -6.626
   16    H    SER   2           H        SER   2   0.427   2.771  -6.692
   17    HA   SER   2           HA       SER   2  -0.635   2.778  -3.985
   18   1HB   SER   2          1HB       SER   2   1.250   1.205  -3.581
   19   2HB   SER   2          2HB       SER   2   0.292   0.718  -4.991
   20    HG   SER   2           HG       SER   2   2.478   2.411  -5.406
   21    H    CYS   3           H        CYS   3   0.150   3.881  -2.236
   22    HA   CYS   3           HA       CYS   3   2.769   5.251  -2.337
   23   1HB   CYS   3          1HB       CYS   3   0.087   6.614  -2.228
   24   2HB   CYS   3          2HB       CYS   3   1.510   7.308  -1.467
   25    H    CYS   4           H        CYS   4   3.764   5.119  -0.448
   26    HA   CYS   4           HA       CYS   4   2.265   4.032   1.882
   27   1HB   CYS   4          1HB       CYS   4   5.041   3.506   0.780
   28   2HB   CYS   4          2HB       CYS   4   4.593   3.042   2.409
   29    HA   PRO   5           HA       PRO   5   3.996   7.363   4.326
   30   1HB   PRO   5          1HB       PRO   5   4.187   6.181   6.797
   31   2HB   PRO   5          2HB       PRO   5   2.628   6.610   6.052
   32   1HG   PRO   5          1HG       PRO   5   3.975   3.895   6.030
   33   2HG   PRO   5          2HG       PRO   5   2.285   4.287   6.455
   34   1HD   PRO   5          1HD       PRO   5   2.957   3.411   3.991
   35   2HD   PRO   5          2HD       PRO   5   1.734   4.681   4.194
   36    H    ASN   6           H        ASN   6   5.544   4.109   4.405
   37    HA   ASN   6           HA       ASN   6   8.218   5.266   4.399
   38   1HB   ASN   6          1HB       ASN   6   8.890   4.186   6.533
   39   2HB   ASN   6          2HB       ASN   6   7.737   5.496   6.755
   40   1HD2  ASN   6          2HD2      ASN   6   5.852   5.079   7.852
   41   2HD2  ASN   6          1HD2      ASN   6   5.289   3.487   8.304
   42    H    THR   7           H        THR   7   9.881   3.555   4.603
   43    HA   THR   7           HA       THR   7   9.563   1.718   2.526
   44    HB   THR   7           HB       THR   7  11.721   1.743   4.673
   45    HG1  THR   7           1HG      THR   7  12.708   3.242   3.240
   46   1HG2  THR   7          1HG2      THR   7  13.164   1.001   2.780
   47   2HG2  THR   7          2HG2      THR   7  11.879  -0.172   3.104
   48   3HG2  THR   7          3HG2      THR   7  11.738   0.938   1.723
   49    H    THR   8           H        THR   8   9.244   1.251   6.074
   50    HA   THR   8           HA       THR   8   9.272  -1.625   5.943
   51    HB   THR   8           HB       THR   8   7.961   0.115   8.065
   52    HG1  THR   8           1HG      THR   8  10.135   0.657   7.812
   53   1HG2  THR   8          1HG2      THR   8   8.483  -1.864   9.499
   54   2HG2  THR   8          2HG2      THR   8   7.329  -2.259   8.216
   55   3HG2  THR   8          3HG2      THR   8   9.028  -2.749   8.063
   56    H    GLY   9           H        GLY   9   6.761   0.898   5.666
   57   1HA   GLY   9          1HA       GLY   9   4.449  -0.692   5.408
   58   2HA   GLY   9          2HA       GLY   9   4.740   0.864   4.612
   59    H    ARG  10           H        ARG  10   6.730   0.465   2.828
   60    HA   ARG  10           HA       ARG  10   5.574  -0.983   0.700
   61   1HB   ARG  10          1HB       ARG  10   8.440  -0.094   1.191
   62   2HB   ARG  10          2HB       ARG  10   7.946  -0.894  -0.298
   63   1HG   ARG  10          1HG       ARG  10   6.621   1.644   0.712
   64   2HG   ARG  10          2HG       ARG  10   8.024   1.632  -0.360
   65   1HD   ARG  10          1HD       ARG  10   6.830   0.412  -2.083
   66   2HD   ARG  10          2HD       ARG  10   5.390   0.256  -1.061
   67    HE   ARG  10           HE       ARG  10   6.189   2.999  -1.329
   68   1HH1  ARG  10          1HH2      ARG  10   4.517   0.429  -3.130
   69   2HH1  ARG  10          2HH2      ARG  10   3.636   1.548  -4.139
   70   1HH2  ARG  10          1HH1      ARG  10   5.010   4.425  -2.558
   71   2HH2  ARG  10          2HH1      ARG  10   3.913   3.870  -3.804
   72    H    ASN  11           H        ASN  11   8.118  -2.050   3.006
   73    HA   ASN  11           HA       ASN  11   8.624  -4.553   1.807
   74   1HB   ASN  11          1HB       ASN  11  10.095  -3.713   3.489
   75   2HB   ASN  11          2HB       ASN  11   8.803  -3.598   4.683
   76   1HD2  ASN  11          2HD2      ASN  11   8.294  -5.355   5.950
   77   2HD2  ASN  11          1HD2      ASN  11   9.094  -6.905   5.811
   78    H    ILE  12           H        ILE  12   6.246  -3.758   4.433
   79    HA   ILE  12           HA       ILE  12   5.231  -6.400   4.674
   80    HB   ILE  12           HB       ILE  12   3.973  -3.703   5.284
   81   1HG1  ILE  12          1HG1      ILE  12   5.138  -5.745   7.219
   82   2HG1  ILE  12          2HG1      ILE  12   6.139  -4.489   6.506
   83   1HG2  ILE  12          1HG2      ILE  12   2.185  -5.410   5.049
   84   2HG2  ILE  12          2HG2      ILE  12   3.086  -6.514   6.102
   85   3HG2  ILE  12          3HG2      ILE  12   2.401  -5.014   6.748
   86   1HD1  ILE  12          1HD1      ILE  12   4.674  -2.730   7.425
   87   2HD1  ILE  12          2HD1      ILE  12   3.689  -3.972   8.233
   88   3HD1  ILE  12          3HD1      ILE  12   5.388  -3.761   8.680
   89    H    TYR  13           H        TYR  13   4.123  -3.615   2.720
   90    HA   TYR  13           HA       TYR  13   1.857  -4.726   1.540
   91   1HB   TYR  13          1HB       TYR  13   2.414  -2.364   1.419
   92   2HB   TYR  13          2HB       TYR  13   3.883  -2.707   0.520
   93    HD1  TYR  13           1HD      TYR  13   0.201  -3.431   0.236
   94    HD2  TYR  13           2HD      TYR  13   3.810  -2.198  -1.765
   95    HE1  TYR  13           1HE      TYR  13  -1.073  -3.104  -1.861
   96    HE2  TYR  13           2HE      TYR  13   2.521  -1.797  -3.841
   97    HH   TYR  13           HH       TYR  13  -1.020  -2.342  -4.010
   98    H    ASN  14           H        ASN  14   5.229  -4.723   0.291
   99    HA   ASN  14           HA       ASN  14   4.679  -6.185  -2.086
  100   1HB   ASN  14          1HB       ASN  14   7.189  -5.494  -0.537
  101   2HB   ASN  14          2HB       ASN  14   7.253  -6.658  -1.851
  102   1HD2  ASN  14          2HD2      ASN  14   6.245  -3.283  -1.147
  103   2HD2  ASN  14          1HD2      ASN  14   6.500  -2.723  -2.791
  104    H    THR  15           H        THR  15   5.810  -7.288   1.164
  105    HA   THR  15           HA       THR  15   6.165 -10.007   0.417
  106    HB   THR  15           HB       THR  15   5.478  -8.785   3.124
  107    HG1  THR  15           1HG      THR  15   7.938  -9.463   1.883
  108   1HG2  THR  15          1HG2      THR  15   6.605 -10.836   4.020
  109   2HG2  THR  15          2HG2      THR  15   5.081 -11.202   3.199
  110   3HG2  THR  15          3HG2      THR  15   6.629 -11.515   2.379
  111    H    CYS  16           H        CYS  16   3.333  -8.267   1.756
  112    HA   CYS  16           HA       CYS  16   1.585 -10.500   1.934
  113   1HB   CYS  16          1HB       CYS  16   1.200  -8.495   3.150
  114   2HB   CYS  16          2HB       CYS  16   1.150  -7.510   1.692
  115    H    ARG  17           H        ARG  17   2.073  -8.083  -0.683
  116    HA   ARG  17           HA       ARG  17   0.153  -9.072  -2.503
  117   1HB   ARG  17          1HB       ARG  17   2.807  -7.633  -2.849
  118   2HB   ARG  17          2HB       ARG  17   1.783  -8.017  -4.227
  119   1HG   ARG  17          1HG       ARG  17   0.463  -6.574  -1.934
  120   2HG   ARG  17          2HG       ARG  17   1.651  -5.676  -2.889
  121   1HD   ARG  17          1HD       ARG  17  -0.589  -5.362  -3.784
  122   2HD   ARG  17          2HD       ARG  17   0.489  -6.126  -4.940
  123    HE   ARG  17           HE       ARG  17  -1.459  -7.677  -3.238
  124   1HH1  ARG  17          1HH2      ARG  17  -0.111  -7.085  -6.501
  125   2HH1  ARG  17          2HH2      ARG  17  -1.017  -8.394  -7.206
  126   1HH2  ARG  17          1HH1      ARG  17  -2.583  -9.361  -4.209
  127   2HH2  ARG  17          2HH1      ARG  17  -2.439  -9.672  -5.921
  128    H    PHE  18           H        PHE  18   3.607  -9.916  -2.092
  129    HA   PHE  18           HA       PHE  18   3.780 -11.766  -4.232
  130   1HB   PHE  18          1HB       PHE  18   5.720 -10.736  -3.175
  131   2HB   PHE  18          2HB       PHE  18   5.354 -11.521  -1.643
  132    HD1  PHE  18           1HD      PHE  18   6.254 -13.677  -1.157
  133    HD2  PHE  18           2HD      PHE  18   6.181 -12.262  -5.232
  134    HE1  PHE  18           1HE      PHE  18   7.607 -15.629  -1.864
  135    HE2  PHE  18           2HE      PHE  18   7.524 -14.228  -5.933
  136    HZ   PHE  18           HZ       PHE  18   8.245 -15.908  -4.250
  137    H    ALA  19           H        ALA  19   2.992 -12.220  -0.751
  138    HA   ALA  19           HA       ALA  19   2.752 -15.037  -0.773
  139   1HB   ALA  19          1HB       ALA  19   2.838 -13.682   1.280
  140   2HB   ALA  19          2HB       ALA  19   1.235 -13.006   0.917
  141   3HB   ALA  19          3HB       ALA  19   1.412 -14.739   1.251
  142    H    GLY  20           H        GLY  20   0.356 -12.461  -1.508
  143   1HA   GLY  20          1HA       GLY  20  -0.879 -13.333  -3.623
  144   2HA   GLY  20          2HA       GLY  20  -1.594 -14.491  -2.494
  145    H    GLY  21           H        GLY  21  -1.241 -11.812  -0.575
  146   1HA   GLY  21          1HA       GLY  21  -4.030 -11.418  -0.421
  147   2HA   GLY  21          2HA       GLY  21  -2.790 -10.408   0.327
  148    H    SER  22           H        SER  22  -5.385  -9.720  -1.080
  149    HA   SER  22           HA       SER  22  -4.944  -8.603  -3.620
  150   1HB   SER  22          1HB       SER  22  -6.903  -7.656  -1.493
  151   2HB   SER  22          2HB       SER  22  -7.052  -7.461  -3.250
  152    HG   SER  22           HG       SER  22  -8.261  -9.237  -2.478
  153    H    ARG  23           H        ARG  23  -4.825  -6.341  -4.258
  154    HA   ARG  23           HA       ARG  23  -2.678  -4.977  -3.097
  155   1HB   ARG  23          1HB       ARG  23  -4.881  -3.747  -4.809
  156   2HB   ARG  23          2HB       ARG  23  -3.270  -3.092  -4.497
  157   1HG   ARG  23          1HG       ARG  23  -2.400  -5.347  -5.533
  158   2HG   ARG  23          2HG       ARG  23  -4.060  -5.527  -6.126
  159   1HD   ARG  23          1HD       ARG  23  -2.977  -4.433  -7.910
  160   2HD   ARG  23          2HD       ARG  23  -3.779  -3.122  -7.063
  161    HE   ARG  23           HE       ARG  23  -1.742  -2.311  -6.252
  162   1HH1  ARG  23          1HH2      ARG  23  -1.182  -5.260  -8.177
  163   2HH1  ARG  23          2HH2      ARG  23   0.540  -5.003  -8.263
  164   1HH2  ARG  23          1HH1      ARG  23   0.520  -2.088  -6.277
  165   2HH2  ARG  23          2HH1      ARG  23   1.508  -3.184  -7.212
  166    H    GLU  24           H        GLU  24  -6.170  -4.101  -2.846
  167    HA   GLU  24           HA       GLU  24  -5.885  -1.953  -1.097
  168   1HB   GLU  24          1HB       GLU  24  -7.894  -2.652  -2.399
  169   2HB   GLU  24          2HB       GLU  24  -8.192  -3.955  -1.248
  170   1HG   GLU  24          1HG       GLU  24  -8.014  -0.986  -0.553
  171   2HG   GLU  24          2HG       GLU  24  -9.519  -1.838  -0.923
  172    HE2  GLU  24           HE       GLU  24  -8.063  -0.616   1.540
  173    H    ARG  25           H        ARG  25  -6.481  -5.416  -0.329
  174    HA   ARG  25           HA       ARG  25  -6.701  -5.175   2.435
  175   1HB   ARG  25          1HB       ARG  25  -7.284  -7.119   0.993
  176   2HB   ARG  25          2HB       ARG  25  -5.575  -7.537   0.856
  177   1HG   ARG  25          1HG       ARG  25  -5.402  -7.906   3.258
  178   2HG   ARG  25          2HG       ARG  25  -7.052  -7.312   3.521
  179   1HD   ARG  25          1HD       ARG  25  -6.324  -9.774   1.871
  180   2HD   ARG  25          2HD       ARG  25  -6.879  -9.785   3.559
  181    HE   ARG  25           HE       ARG  25  -8.752  -8.328   2.001
  182   1HH1  ARG  25          1HH2      ARG  25  -7.662 -11.675   2.472
  183   2HH1  ARG  25          2HH2      ARG  25  -9.206 -12.368   2.050
  184   1HH2  ARG  25          1HH1      ARG  25 -10.768  -9.252   1.440
  185   2HH2  ARG  25          2HH1      ARG  25 -10.977 -10.984   1.460
  186    H    CYS  26           H        CYS  26  -3.801  -5.984   0.503
  187    HA   CYS  26           HA       CYS  26  -1.948  -6.102   2.654
  188   1HB   CYS  26          1HB       CYS  26  -1.570  -5.479  -0.302
  189   2HB   CYS  26          2HB       CYS  26  -0.260  -5.790   0.836
  190    H    ALA  27           H        ALA  27  -3.021  -3.366   0.592
  191    HA   ALA  27           HA       ALA  27  -1.113  -1.479   1.521
  192   1HB   ALA  27          1HB       ALA  27  -3.943  -0.971   0.537
  193   2HB   ALA  27          2HB       ALA  27  -2.603   0.190   0.608
  194   3HB   ALA  27          3HB       ALA  27  -2.497  -1.207  -0.472
  195    H    LYS  28           H        LYS  28  -4.460  -2.235   2.677
  196    HA   LYS  28           HA       LYS  28  -4.555  -0.453   4.823
  197   1HB   LYS  28          1HB       LYS  28  -6.270  -2.112   3.691
  198   2HB   LYS  28          2HB       LYS  28  -5.790  -3.227   4.963
  199   1HG   LYS  28          1HG       LYS  28  -6.870  -0.394   5.356
  200   2HG   LYS  28          2HG       LYS  28  -7.820  -1.883   5.426
  201   1HD   LYS  28          1HD       LYS  28  -6.474  -2.674   7.364
  202   2HD   LYS  28          2HD       LYS  28  -5.529  -1.166   7.313
  203   1HE   LYS  28          1HE       LYS  28  -7.580   0.156   7.694
  204   2HE   LYS  28          2HE       LYS  28  -8.520  -1.347   7.811
  205   1HZ   LYS  28          1HZ       LYS  28  -6.311  -0.540   9.574
  206   2HZ   LYS  28          2HZ       LYS  28  -7.915  -0.531   9.953
  207   3HZ   LYS  28          3HZ       LYS  28  -7.140  -1.960   9.680
  208    H    LEU  29           H        LEU  29  -3.602  -3.911   4.814
  209    HA   LEU  29           HA       LEU  29  -2.874  -4.247   7.461
  210   1HB   LEU  29          1HB       LEU  29  -3.112  -6.048   5.810
  211   2HB   LEU  29          2HB       LEU  29  -1.698  -5.458   4.935
  212    HG   LEU  29           HG       LEU  29  -0.254  -5.999   6.899
  213   1HD1  LEU  29          1HD1      LEU  29  -2.846  -7.171   8.015
  214   2HD1  LEU  29          2HD1      LEU  29  -1.224  -7.518   8.649
  215   3HD1  LEU  29          3HD1      LEU  29  -1.867  -5.875   8.739
  216   1HD2  LEU  29          1HD2      LEU  29  -0.566  -7.572   5.018
  217   2HD2  LEU  29          2HD2      LEU  29  -0.290  -8.410   6.554
  218   3HD2  LEU  29          3HD2      LEU  29  -1.930  -8.323   5.876
  219    H    SER  30           H        SER  30  -0.871  -2.991   4.777
  220    HA   SER  30           HA       SER  30   1.546  -2.810   6.406
  221   1HB   SER  30          1HB       SER  30   2.493  -1.759   4.419
  222   2HB   SER  30          2HB       SER  30   1.700  -3.298   4.026
  223    HG   SER  30           HG       SER  30  -0.076  -2.117   3.283
  224    H    GLY  31           H        GLY  31  -1.079  -0.656   5.486
  225   1HA   GLY  31          1HA       GLY  31  -1.657   1.332   6.582
  226   2HA   GLY  31          2HA       GLY  31  -0.005   1.537   7.178
  227    H    CYS  32           H        CYS  32  -0.523   0.605   3.822
  228    HA   CYS  32           HA       CYS  32   0.227   3.305   2.828
  229   1HB   CYS  32          1HB       CYS  32   0.095   0.656   1.351
  230   2HB   CYS  32          2HB       CYS  32   0.766   2.165   0.769
  231    H    LYS  33           H        LYS  33  -0.926   3.986   0.854
  232    HA   LYS  33           HA       LYS  33  -3.814   3.217   0.809
  233   1HB   LYS  33          1HB       LYS  33  -2.743   5.952   0.089
  234   2HB   LYS  33          2HB       LYS  33  -4.399   5.482   0.492
  235   1HG   LYS  33          1HG       LYS  33  -2.015   5.702   2.366
  236   2HG   LYS  33          2HG       LYS  33  -3.365   6.818   2.285
  237   1HD   LYS  33          1HD       LYS  33  -4.779   5.493   3.511
  238   2HD   LYS  33          2HD       LYS  33  -4.203   4.011   2.783
  239   1HE   LYS  33          1HE       LYS  33  -3.383   3.647   4.841
  240   2HE   LYS  33          2HE       LYS  33  -1.991   4.474   4.164
  241   1HZ   LYS  33          1HZ       LYS  33  -2.780   6.508   5.180
  242   2HZ   LYS  33          2HZ       LYS  33  -4.089   5.721   5.804
  243   3HZ   LYS  33          3HZ       LYS  33  -2.569   5.327   6.301
  244    H    ILE  34           H        ILE  34  -4.641   2.602  -1.056
  245    HA   ILE  34           HA       ILE  34  -3.229   3.177  -3.621
  246    HB   ILE  34           HB       ILE  34  -5.373   1.075  -3.192
  247   1HG1  ILE  34          1HG1      ILE  34  -3.700   0.390  -1.647
  248   2HG1  ILE  34          2HG1      ILE  34  -3.762  -0.688  -3.029
  249   1HG2  ILE  34          1HG2      ILE  34  -3.231   1.421  -5.327
  250   2HG2  ILE  34          2HG2      ILE  34  -4.417   0.102  -5.241
  251   3HG2  ILE  34          3HG2      ILE  34  -4.958   1.768  -5.494
  252   1HD1  ILE  34          1HD1      ILE  34  -1.730   0.412  -3.976
  253   2HD1  ILE  34          2HD1      ILE  34  -1.640   1.431  -2.512
  254   3HD1  ILE  34          3HD1      ILE  34  -1.443  -0.317  -2.393
  255    H    ILE  35           H        ILE  35  -4.351   4.715  -4.847
  256    HA   ILE  35           HA       ILE  35  -7.306   4.642  -4.736
  257    HB   ILE  35           HB       ILE  35  -7.488   7.062  -4.882
  258   1HG1  ILE  35          1HG1      ILE  35  -4.546   7.209  -4.082
  259   2HG1  ILE  35          2HG1      ILE  35  -5.187   7.571  -5.693
  260   1HG2  ILE  35          1HG2      ILE  35  -7.734   5.802  -2.724
  261   2HG2  ILE  35          2HG2      ILE  35  -6.062   6.257  -2.318
  262   3HG2  ILE  35          3HG2      ILE  35  -7.312   7.501  -2.522
  263   1HD1  ILE  35          1HD1      ILE  35  -5.829   9.092  -3.145
  264   2HD1  ILE  35          2HD1      ILE  35  -4.904   9.653  -4.547
  265   3HD1  ILE  35          3HD1      ILE  35  -6.643   9.342  -4.705
  266    H    SER  36           H        SER  36  -8.334   5.030  -6.626
  267    HA   SER  36           HA       SER  36  -6.671   4.683  -9.041
  268   1HB   SER  36          1HB       SER  36  -8.576   3.138  -8.457
  269   2HB   SER  36          2HB       SER  36  -9.689   4.496  -8.708
  270    HG   SER  36           HG       SER  36  -7.880   3.381 -10.602
  271    H    ALA  37           H        ALA  37  -6.459   7.235  -7.900
  272    HA   ALA  37           HA       ALA  37  -8.067   9.043  -9.648
  273   1HB   ALA  37          1HB       ALA  37  -6.305   9.595  -7.235
  274   2HB   ALA  37          2HB       ALA  37  -7.285  10.792  -8.111
  275   3HB   ALA  37          3HB       ALA  37  -8.077   9.478  -7.220
  276    H    SER  38           H        SER  38  -5.363   7.280 -10.078
  277    HA   SER  38           HA       SER  38  -3.274   7.477 -10.858
  278   1HB   SER  38          1HB       SER  38  -4.570   8.000 -12.892
  279   2HB   SER  38          2HB       SER  38  -4.489   9.729 -12.500
  280    HG   SER  38           HG       SER  38  -2.207   9.538 -12.622
  281    H    THR  39           H        THR  39  -3.733   8.726  -8.408
  282    HA   THR  39           HA       THR  39  -1.670  10.784  -8.161
  283    HB   THR  39           HB       THR  39  -4.609  11.294  -7.451
  284    HG1  THR  39           1HG      THR  39  -4.294  11.544  -9.638
  285   1HG2  THR  39          1HG2      THR  39  -3.792  13.674  -7.120
  286   2HG2  THR  39          2HG2      THR  39  -3.322  12.550  -5.857
  287   3HG2  THR  39          3HG2      THR  39  -2.138  13.039  -7.103
  288    H    CYS  40           H        CYS  40  -1.687  11.340  -5.628
  289    HA   CYS  40           HA       CYS  40  -2.489   8.985  -4.021
  290   1HB   CYS  40          1HB       CYS  40   0.269  10.235  -4.247
  291   2HB   CYS  40          2HB       CYS  40  -0.230   9.301  -2.843
  292    HA   PRO  41           HA       PRO  41  -3.979  12.042  -1.292
  293   1HB   PRO  41          1HB       PRO  41  -3.909  10.808   1.170
  294   2HB   PRO  41          2HB       PRO  41  -4.993  10.321  -0.161
  295   1HG   PRO  41          1HG       PRO  41  -2.307   9.124   0.560
  296   2HG   PRO  41          2HG       PRO  41  -3.849   8.266   0.275
  297   1HD   PRO  41          1HD       PRO  41  -1.970   8.504  -1.657
  298   2HD   PRO  41          2HD       PRO  41  -3.706   8.636  -2.054
  299    H    SER  42           H        SER  42  -3.581  13.089   0.862
  300    HA   SER  42           HA       SER  42  -2.070  15.080   0.711
  301   1HB   SER  42          1HB       SER  42  -3.533  14.660   2.604
  302   2HB   SER  42          2HB       SER  42  -2.320  13.606   3.356
  303    HG   SER  42           HG       SER  42  -2.058  16.372   2.754
  304    H    ASP  43           H        ASP  43  -0.429  12.401   2.568
  305    HA   ASP  43           HA       ASP  43   2.129  13.240   1.380
  306   1HB   ASP  43          1HB       ASP  43   1.815  14.833   3.237
  307   2HB   ASP  43          2HB       ASP  43   1.597  13.490   4.367
  308    HD2  ASP  43           HD       ASP  43   3.851  14.335   1.793
  309    H    TYR  44           H        TYR  44   1.950  11.176   0.477
  310    HA   TYR  44           HA       TYR  44   3.181   9.103   2.232
  311   1HB   TYR  44          1HB       TYR  44   0.964   8.688   0.190
  312   2HB   TYR  44          2HB       TYR  44   1.936   7.397   0.901
  313    HD1  TYR  44           1HD      TYR  44  -0.485  10.135   1.777
  314    HD2  TYR  44           2HD      TYR  44   1.193   6.324   2.825
  315    HE1  TYR  44           1HE      TYR  44  -1.946  10.041   3.765
  316    HE2  TYR  44           2HE      TYR  44  -0.170   6.274   4.894
  317    HH   TYR  44           HH       TYR  44  -2.360   8.988   5.763
  318    HA   PRO  45           HA       PRO  45   5.326  10.068  -1.791
  319   1HB   PRO  45          1HB       PRO  45   7.539  11.416  -1.054
  320   2HB   PRO  45          2HB       PRO  45   5.923  12.171  -1.021
  321   1HG   PRO  45          1HG       PRO  45   7.407  10.922   1.295
  322   2HG   PRO  45          2HG       PRO  45   6.663  12.539   1.233
  323   1HD   PRO  45          1HD       PRO  45   5.353  10.343   2.289
  324   2HD   PRO  45          2HD       PRO  45   4.518  11.670   1.430
  325    H    LYS  46           H        LYS  46   5.735   7.785   0.528
  326    HA   LYS  46           HA       LYS  46   8.273   6.707  -0.626
  327   1HB   LYS  46          1HB       LYS  46   7.059   6.610   2.105
  328   2HB   LYS  46          2HB       LYS  46   7.711   5.097   1.494
  329   1HG   LYS  46          1HG       LYS  46   9.456   6.212   2.706
  330   2HG   LYS  46          2HG       LYS  46   9.867   6.116   1.004
  331   1HD   LYS  46          1HD       LYS  46  10.513   8.281   1.909
  332   2HD   LYS  46          2HD       LYS  46   9.271   8.487   0.679
  333   1HE   LYS  46          1HE       LYS  46   8.950   9.951   2.652
  334   2HE   LYS  46          2HE       LYS  46   7.561   8.876   2.399
  335   1HZ   LYS  46          1HZ       LYS  46   8.305   7.530   4.152
  336   2HZ   LYS  46          2HZ       LYS  46   9.728   8.366   4.311
  337   3HZ   LYS  46          3HZ       LYS  46   8.287   9.076   4.689