*HEADER   FUNGICIDE                               05-NOV-97   1AYJ    
*TITLE    DETERMINATION OF THE THREE-DIMENSIONAL SOLUTION STRUCTURE   
*TITLE   2 OF RAPHANUS SATIVUS ANTIFUNGAL PROTEIN 1 (RS-AFP1) BY 1H   
*TITLE   3 NMR, 20 STRUCTURES                                         
*COMPND   MOL_ID: 1;                                                  
*COMPND  2 MOLECULE: ANTIFUNGAL PROTEIN 1;                            
*COMPND  3 CHAIN: NULL;                                               
*COMPND  4 SYNONYM: RS-AFP1                                           
*SOURCE   MOL_ID: 1;                                                  
*SOURCE  2 ORGANISM_SCIENTIFIC: RAPHANUS SATIVUS L.;                  
*SOURCE  3 ORGANISM_COMMON: RADISH;                                   
*SOURCE  4 ORGAN: SEED                                                
*KEYWDS   FUNGICIDE, PLANT DEFENSIN, CYSTEINE-STABILIZED ALFA/BETA    
*KEYWDS  2 MOTIF                                                      
*EXPDTA   NMR, 20 STRUCTURES                                          
*AUTHOR   F.FANT,F.A.M.BORREMANS                                      
*REVDAT  1   28-JAN-98 1AYJ    0                                      
 
!BIOSYM restraint 1
!
#chiral
1:PYR_1:CA        S
1:LYS_2:CA         S
1:LEU_3:CA         S
1:CYS_4:CA         R
1:GLU_5:CA         S
1:ARG_6:CA         S
1:PRO_7:CA         S
1:SER_8:CA         S
1:THR_10:CA        S
1:TRP_11:CA        S
1:SER_12:CA        S
1:VAL_14:CA        S
1:CYS_15:CA        R
1:ASN_17:CA        S
1:ASN_18:CA        S
1:ASN_19:CA        S
1:ALA_20:CA        S
1:CYS_21:CA        R
1:LYS_22:CA        S
1:ASN_23:CA        S
1:GLN_24:CA        S
1:CYS_25:CA        R
1:ILE_26:CA        S
1:ASN_27:CA        S
1:LEU_28:CA        S
1:GLU_29:CA        S
1:LYS_30:CA        S
1:ALA_31:CA        S
1:ARG_32:CA        S
1:HISD_33:CA       S
1:SER_35:CA        S
1:CYS_36:CA        R
1:ASN_37:CA        S
1:TYR_38:CA        S
1:VAL_39:CA        S
1:PHE_40:CA        S
1:PRO_41:CA        S
1:ALA_42:CA        S
1:HISD_43:CA       S
1:LYS_44:CA        S
1:CYS_45:CA        R
1:ILE_46:CA        S
1:CYS_47:CA        R
1:TYR_48:CA        S
1:PHE_49:CA        S
1:PRO_50:CA        S
1:CYS_51:CA        R
1:THR_10:CB        R
1:ILE_26:CB        S
1:ILE_46:CB        S
!
#distance
1:PYR_1:HA        1:PYR_1:HG*        1.800  3.850 32.00 32.00 320.000
1:LYS_2:HN         1:LYS_2:HB*         1.800  3.530 32.00 32.00 320.000
1:LYS_2:HN         1:LYS_2:HG*         1.800  6.600 32.00 32.00 320.000
1:LYS_2:HA         1:LEU_3:HN          1.800  2.640 32.00 32.00 320.000
1:LYS_2:HA         1:LEU_3:HD*         1.800  8.170 32.00 32.00 320.000
1:LYS_2:HG*        1:LEU_3:HN          1.800  5.280 32.00 32.00 320.000
1:LYS_2:HG*        1:LEU_3:HA          1.800  5.940 32.00 32.00 320.000
1:LYS_2:HE*        1:LEU_3:HN          1.800  6.600 32.00 32.00 320.000
1:LEU_3:HN         1:LEU_3:HB1         1.800  2.750 32.00 32.00 320.000
1:LEU_3:HN         1:LEU_3:HG          1.800  3.300 32.00 32.00 320.000
1:LEU_3:HN         1:LEU_3:HD1*        1.800  6.600 32.00 32.00 320.000
1:LEU_3:HN         1:LEU_3:HD2*        1.800  6.600 32.00 32.00 320.000
1:LEU_3:HA         1:LEU_3:HB1         1.800  2.970 32.00 32.00 320.000
1:LEU_3:HA         1:LEU_3:HB2         1.800  2.640 32.00 32.00 320.000
1:LEU_3:HA         1:LEU_3:HG          1.800  3.300 32.00 32.00 320.000
1:LEU_3:HA         1:TYR_48:CG         1.800  7.700 32.00 32.00 320.000
1:LEU_3:HA         1:PHE_49:HN         1.800  4.510 32.00 32.00 320.000
1:LEU_3:HA         1:PRO_50:HA         1.800  2.970 32.00 32.00 320.000
1:LEU_3:HB1        1:CYS_4:HN          1.800  3.740 32.00 32.00 320.000
1:LEU_3:HB1        1:TYR_48:HA         1.800  5.500 32.00 32.00 320.000
1:LEU_3:HB1        1:TYR_48:HB*        1.800  6.600 32.00 32.00 320.000
1:LEU_3:HB1        1:TYR_48:CG         1.800  5.720 32.00 32.00 320.000
1:LEU_3:HB1        1:TYR_48:CZ         1.800  7.700 32.00 32.00 320.000
1:LEU_3:HB2        1:CYS_4:HN          1.800  3.190 32.00 32.00 320.000
1:LEU_3:HB2        1:TYR_48:HA         1.800  4.400 32.00 32.00 320.000
1:LEU_3:HB2        1:TYR_48:HB*        1.800  4.730 32.00 32.00 320.000
1:LEU_3:HB2        1:TYR_48:CG         1.800  5.720 32.00 32.00 320.000
1:LEU_3:HB2        1:TYR_48:CZ         1.800  7.700 32.00 32.00 320.000
1:LEU_3:HB2        1:PHE_49:HN         1.800  5.390 32.00 32.00 320.000
1:LEU_3:HB2        1:PRO_50:HA         1.800  5.500 32.00 32.00 320.000
1:LEU_3:HG         1:PRO_50:HA         1.800  5.500 32.00 32.00 320.000
1:LEU_3:HG         1:PRO_50:HD2        1.800  5.500 32.00 32.00 320.000
1:LEU_3:HD*        1:CYS_4:HN          1.800  8.170 32.00 32.00 320.000
1:LEU_3:HD*        1:ARG_32:HD*        1.800  9.270 32.00 32.00 320.000
1:LEU_3:HD*        1:HISD_33:HB*       1.800  9.240 32.00 32.00 320.000
1:LEU_3:HD*        1:HISD_33:HD2       1.800  8.140 32.00 32.00 320.000
1:LEU_3:HD*        1:ILE_46:HG2*       1.800  9.270 32.00 32.00 320.000
1:LEU_3:HD*        1:TYR_48:HA         1.800  8.140 32.00 32.00 320.000
1:LEU_3:HD*        1:TYR_48:HB*        1.800  9.240 32.00 32.00 320.000
1:LEU_3:HD*        1:TYR_48:CG         1.800 10.340 32.00 32.00 320.000
1:LEU_3:HD*        1:TYR_48:CZ         1.800 10.340 32.00 32.00 320.000
1:LEU_3:HD*        1:PHE_49:HA         1.800  8.170 32.00 32.00 320.000
1:LEU_3:HD*        1:PRO_50:HA         1.800  8.030 32.00 32.00 320.000
1:LEU_3:HD*        1:PRO_50:HB*        1.800  9.050 32.00 32.00 320.000
1:LEU_3:HD*        1:PRO_50:HG*        1.800  9.050 32.00 32.00 320.000
1:LEU_3:HD*        1:PRO_50:HD1        1.800  8.170 32.00 32.00 320.000
1:LEU_3:HD*        1:PRO_50:HD2        1.800  8.170 32.00 32.00 320.000
1:CYS_4:HN         1:CYS_4:HB1         1.800  2.750 32.00 32.00 320.000
1:CYS_4:HN         1:TYR_48:HA         1.800  5.500 32.00 32.00 320.000
1:CYS_4:HN         1:PHE_49:HN         1.800  3.520 32.00 32.00 320.000
1:CYS_4:HN         1:PHE_49:HB1        1.800  5.500 32.00 32.00 320.000
1:CYS_4:HN         1:CYS_51:HN         1.800  3.960 32.00 32.00 320.000
1:CYS_4:HA         1:GLU_5:HN          1.800  2.640 32.00 32.00 320.000
1:CYS_4:HB1        1:PHE_49:HN         1.800  4.510 32.00 32.00 320.000
1:CYS_4:HB1        1:CYS_51:HB1        1.800  3.300 32.00 32.00 320.000
1:GLU_5:HN         1:GLU_5:HG1         1.800  4.070 32.00 32.00 320.000
1:GLU_5:HN         1:GLU_5:HG2         1.800  4.070 32.00 32.00 320.000
1:GLU_5:HN         1:GLU_5:HG*         1.800  3.650 32.00 32.00 320.000
1:GLU_5:HA         1:GLU_5:HG*         1.800  3.980 32.00 32.00 320.000
1:GLU_5:HA         1:ILE_46:HG2*       1.800  4.950 32.00 32.00 320.000
1:GLU_5:HA         1:TYR_48:HA         1.800  2.860 32.00 32.00 320.000
1:GLU_5:HA         1:TYR_48:CG         1.800  7.040 32.00 32.00 320.000
1:GLU_5:HA         1:TYR_48:CZ         1.800  7.700 32.00 32.00 320.000
1:GLU_5:HA         1:PHE_49:HN         1.800  5.500 32.00 32.00 320.000
1:GLU_5:HB*        1:TYR_48:CG         1.800  7.920 32.00 32.00 320.000
1:GLU_5:HB*        1:TYR_48:CZ         1.800  7.920 32.00 32.00 320.000
1:GLU_5:HG*        1:ARG_6:HN          1.800  5.170 32.00 32.00 320.000
1:ARG_6:N          1:CYS_47:O          1.800  3.000 32.00 32.00 320.000
1:ARG_6:HN         1:ARG_6:HA          1.800  5.500 32.00 32.00 320.000
1:ARG_6:HN         1:ARG_6:HB1         1.800  3.960 32.00 32.00 320.000
1:ARG_6:HN         1:ARG_6:HB2         1.800  3.960 32.00 32.00 320.000
1:ARG_6:HN         1:ARG_6:HB*         1.800  3.590 32.00 32.00 320.000
1:ARG_6:HN         1:ARG_6:HG1         1.800  5.500 32.00 32.00 320.000
1:ARG_6:HN         1:ARG_6:HG2         1.800  5.500 32.00 32.00 320.000
1:ARG_6:HN         1:ARG_6:HG*         1.800  4.850 32.00 32.00 320.000
1:ARG_6:HN         1:ILE_46:HG2*       1.800  6.600 32.00 32.00 320.000
1:ARG_6:HN         1:ILE_46:HD1*       1.800  6.600 32.00 32.00 320.000
1:ARG_6:HN         1:CYS_47:HN         1.800  3.630 32.00 32.00 320.000
1:ARG_6:HN         1:CYS_47:O          1.800  2.700 32.00 32.00 320.000
1:ARG_6:HN         1:TYR_48:HA         1.800  3.960 32.00 32.00 320.000
1:ARG_6:HN         1:PHE_49:CG         1.800  7.700 32.00 32.00 320.000
1:ARG_6:HN         1:PHE_49:HZ         1.800  5.500 32.00 32.00 320.000
1:ARG_6:HA         1:ARG_6:HB*         1.800  2.720 32.00 32.00 320.000
1:ARG_6:HA         1:ARG_6:HG1         1.800  3.850 32.00 32.00 320.000
1:ARG_6:HA         1:ARG_6:HG2         1.800  3.850 32.00 32.00 320.000
1:ARG_6:HA         1:ARG_6:HG*         1.800  3.640 32.00 32.00 320.000
1:ARG_6:HA         1:ARG_6:HD1         1.800  5.500 32.00 32.00 320.000
1:ARG_6:HA         1:ARG_6:HD2         1.800  5.500 32.00 32.00 320.000
1:ARG_6:HA         1:PRO_7:HG*         1.800  5.360 32.00 32.00 320.000
1:ARG_6:HA         1:PRO_7:HD1         1.800  2.640 32.00 32.00 320.000
1:ARG_6:HA         1:PRO_7:HD2         1.800  2.640 32.00 32.00 320.000
1:ARG_6:HB1        1:ARG_6:HE          1.800  5.500 32.00 32.00 320.000
1:ARG_6:HB1        1:PRO_7:HD1         1.800  7.250 32.00 32.00 320.000
1:ARG_6:HB1        1:PRO_7:HD2         1.800  7.250 32.00 32.00 320.000
1:ARG_6:HB1        1:PHE_49:CG         1.800  7.370 32.00 32.00 320.000
1:ARG_6:HB1        1:PHE_49:HZ         1.800  3.740 32.00 32.00 320.000
1:ARG_6:HB2        1:ARG_6:HE          1.800  5.500 32.00 32.00 320.000
1:ARG_6:HB2        1:PRO_7:HD1         1.800  7.250 32.00 32.00 320.000
1:ARG_6:HB2        1:PRO_7:HD2         1.800  7.250 32.00 32.00 320.000
1:ARG_6:HB2        1:PHE_49:CG         1.800  7.370 32.00 32.00 320.000
1:ARG_6:HB2        1:PHE_49:HZ         1.800  3.740 32.00 32.00 320.000
1:ARG_6:HB*        1:ARG_6:HE          1.800  5.320 32.00 32.00 320.000
1:ARG_6:HB*        1:PRO_7:HD*         1.800  5.690 32.00 32.00 320.000
1:ARG_6:HB*        1:ILE_46:HG2*       1.800  7.480 32.00 32.00 320.000
1:ARG_6:HB*        1:CYS_47:HB2        1.800  6.380 32.00 32.00 320.000
1:ARG_6:HB*        1:PHE_49:CG         1.800  6.590 32.00 32.00 320.000
1:ARG_6:HB*        1:PHE_49:HZ         1.800  3.210 32.00 32.00 320.000
1:ARG_6:HG1        1:PRO_7:HD1         1.800  5.930 32.00 32.00 320.000
1:ARG_6:HG1        1:PRO_7:HD2         1.800  5.930 32.00 32.00 320.000
1:ARG_6:HG1        1:PHE_49:CG         1.800  7.700 32.00 32.00 320.000
1:ARG_6:HG2        1:PRO_7:HD1         1.800  5.930 32.00 32.00 320.000
1:ARG_6:HG2        1:PRO_7:HD2         1.800  5.930 32.00 32.00 320.000
1:ARG_6:HG2        1:PHE_49:CG         1.800  7.700 32.00 32.00 320.000
1:ARG_6:HG*        1:PRO_7:HD*         1.800  4.810 32.00 32.00 320.000
1:ARG_6:HG*        1:PHE_49:HZ         1.800  4.730 32.00 32.00 320.000
1:ARG_6:HD*        1:PHE_49:CG         1.800  7.700 32.00 32.00 320.000
1:PRO_7:HA         1:ILE_46:HD1*       1.800  4.070 32.00 32.00 320.000
1:PRO_7:HA         1:CYS_47:HN         1.800  3.960 32.00 32.00 320.000
1:PRO_7:HB*        1:ILE_46:HD1*       1.800  7.480 32.00 32.00 320.000
1:SER_8:HN         1:SER_8:HB*         1.800  3.530 32.00 32.00 320.000
1:SER_8:HN         1:SER_8:HG          1.800  5.500 32.00 32.00 320.000
1:GLY_9:HN         1:THR_10:HN         1.800  3.300 32.00 32.00 320.000
1:GLY_9:HA2        1:THR_10:HG2*       1.800  6.600 32.00 32.00 320.000
1:THR_10:HA        1:THR_10:HG2*       1.800  3.740 32.00 32.00 320.000
1:THR_10:HA        1:LEU_28:HD2*       1.800  6.600 32.00 32.00 320.000
1:THR_10:HB        1:LEU_28:HD2*       1.800  6.160 32.00 32.00 320.000
1:THR_10:HG2*      1:TRP_11:HN         1.800  6.600 32.00 32.00 320.000
1:THR_10:HG2*      1:GLN_24:HE21       1.800  6.600 32.00 32.00 320.000
1:THR_10:HG2*      1:LEU_28:HB*        1.800  7.480 32.00 32.00 320.000
1:THR_10:HG2*      1:LEU_28:HG         1.800  6.600 32.00 32.00 320.000
1:THR_10:HG2*      1:GLU_29:HG1        1.800  6.600 32.00 32.00 320.000
1:THR_10:HG2*      1:GLU_29:HG2        1.800  5.390 32.00 32.00 320.000
1:TRP_11:HN        1:TRP_11:HB1        1.800  2.970 32.00 32.00 320.000
1:TRP_11:HN        1:TRP_11:HB2        1.800  2.970 32.00 32.00 320.000
1:TRP_11:HB1       1:TRP_11:HE3        1.800  3.960 32.00 32.00 320.000
1:TRP_11:HB1       1:CYS_45:HB*        1.800  5.280 32.00 32.00 320.000
1:TRP_11:HB2       1:TRP_11:HE3        1.800  4.070 32.00 32.00 320.000
1:TRP_11:HB2       1:CYS_45:HB*        1.800  4.840 32.00 32.00 320.000
1:TRP_11:NE1       1:VAL_14:O          1.800  3.000 32.00 32.00 320.000
1:TRP_11:HD1       1:SER_12:HA         1.800  5.500 32.00 32.00 320.000
1:TRP_11:HD1       1:CYS_45:HN         1.800  5.500 32.00 32.00 320.000
1:TRP_11:HD1       1:CYS_45:HB*        1.800  6.600 32.00 32.00 320.000
1:TRP_11:HE3       1:ALA_20:HB*        1.800  6.600 32.00 32.00 320.000
1:TRP_11:HE3       1:GLN_24:HB*        1.800  4.180 32.00 32.00 320.000
1:TRP_11:HE3       1:GLN_24:HG*        1.800  4.290 32.00 32.00 320.000
1:TRP_11:HE3       1:GLN_24:HE21       1.800  4.290 32.00 32.00 320.000
1:TRP_11:HE3       1:GLN_24:HE22       1.800  5.500 32.00 32.00 320.000
1:TRP_11:HE1       1:GLY_13:HA1        1.800  5.500 32.00 32.00 320.000
1:TRP_11:HE1       1:VAL_14:O          1.800  2.700 32.00 32.00 320.000
1:TRP_11:HZ3       1:ALA_20:HA         1.800  4.730 32.00 32.00 320.000
1:TRP_11:HZ3       1:ALA_20:HB*        1.800  5.280 32.00 32.00 320.000
1:TRP_11:HZ3       1:CYS_21:HA         1.800  2.860 32.00 32.00 320.000
1:TRP_11:HZ3       1:GLN_24:HB*        1.800  4.510 32.00 32.00 320.000
1:TRP_11:HZ3       1:GLN_24:HG*        1.800  6.600 32.00 32.00 320.000
1:TRP_11:HZ2       1:GLY_16:HN         1.800  5.500 32.00 32.00 320.000
1:TRP_11:HZ2       1:ALA_20:HB*        1.800  6.600 32.00 32.00 320.000
1:TRP_11:HH2       1:CYS_15:HA         1.800  5.500 32.00 32.00 320.000
1:TRP_11:HH2       1:ASN_17:HB*        1.800  6.380 32.00 32.00 320.000
1:TRP_11:HH2       1:ALA_20:HB*        1.800  6.600 32.00 32.00 320.000
1:TRP_11:HH2       1:CYS_21:HA         1.800  4.180 32.00 32.00 320.000
1:TRP_11:HH2       1:GLN_24:HG*        1.800  6.600 32.00 32.00 320.000
1:SER_12:HN        1:SER_12:HA         1.800  5.500 32.00 32.00 320.000
1:SER_12:HA        1:CYS_45:HB*        1.800  6.600 32.00 32.00 320.000
1:GLY_13:HA2       1:VAL_14:HN         1.800  3.190 32.00 32.00 320.000
1:VAL_14:HN        1:VAL_14:HB         1.800  2.860 32.00 32.00 320.000
1:VAL_14:HA        1:CYS_15:HN         1.800  2.970 32.00 32.00 320.000
1:VAL_14:HA        1:GLY_16:HN         1.800  4.620 32.00 32.00 320.000
1:VAL_14:HB        1:CYS_15:HN         1.800  4.070 32.00 32.00 320.000
1:VAL_14:HB        1:GLY_16:HN         1.800  5.500 32.00 32.00 320.000
1:VAL_14:HG1*      1:CYS_15:HN         1.800  6.600 32.00 32.00 320.000
1:VAL_14:HG1*      1:CYS_15:HA         1.800  6.600 32.00 32.00 320.000
1:VAL_14:HG1*      1:GLY_16:HN         1.800  6.600 32.00 32.00 320.000
1:VAL_14:HG1*      1:GLY_16:HA1        1.800  6.600 32.00 32.00 320.000
1:VAL_14:HG1*      1:HISD_43:HB1       1.800  6.600 32.00 32.00 320.000
1:VAL_14:HG2*      1:CYS_15:HN         1.800  6.600 32.00 32.00 320.000
1:VAL_14:HG2*      1:GLY_16:HN         1.800  6.600 32.00 32.00 320.000
1:CYS_15:HN        1:CYS_15:HB2        1.800  3.190 32.00 32.00 320.000
1:CYS_15:HA        1:CYS_15:HB1        1.800  2.860 32.00 32.00 320.000
1:CYS_15:HB1       1:CYS_36:HA         1.800  5.500 32.00 32.00 320.000
1:CYS_15:HB1       1:LYS_44:HA         1.800  5.500 32.00 32.00 320.000
1:CYS_15:HB1       1:CYS_45:HN         1.800  5.500 32.00 32.00 320.000
1:CYS_15:HB2       1:GLY_16:HN         1.800  4.510 32.00 32.00 320.000
1:CYS_15:HB2       1:CYS_36:HB1        1.800  5.500 32.00 32.00 320.000
1:ASN_17:HN        1:ASN_17:HB*        1.800  3.680 32.00 32.00 320.000
1:ASN_17:HN        1:HISD_43:HB2       1.800  5.500 32.00 32.00 320.000
1:ASN_17:HN        1:HISD_43:HB1       1.800  5.170 32.00 32.00 320.000
1:ASN_17:HA        1:ASN_17:HB*        1.800  2.720 32.00 32.00 320.000
1:ASN_17:HA        1:ASN_18:HN         1.800  3.410 32.00 32.00 320.000
1:ASN_17:HA        1:ALA_20:HB*        1.800  6.600 32.00 32.00 320.000
1:ASN_17:HA        1:CYS_36:HB2        1.800  5.500 32.00 32.00 320.000
1:ASN_17:HD21      1:ASN_18:HB*        1.800  6.380 32.00 32.00 320.000
1:ASN_17:HD21      1:ALA_20:HB*        1.800  6.600 32.00 32.00 320.000
1:ASN_17:HD22      1:ALA_20:HB*        1.800  6.600 32.00 32.00 320.000
1:ASN_18:HN        1:ASN_18:HB*        1.800  3.490 32.00 32.00 320.000
1:ASN_18:HN        1:ASN_18:HD21       1.800  5.500 32.00 32.00 320.000
1:ASN_18:HN        1:ASN_18:HD22       1.800  5.500 32.00 32.00 320.000
1:ASN_18:HN        1:ASN_19:HN         1.800  3.630 32.00 32.00 320.000
1:ASN_18:HA        1:ASN_18:HB*        1.800  2.720 32.00 32.00 320.000
1:ASN_18:HA        1:LYS_22:HB*        1.800  6.600 32.00 32.00 320.000
1:ASN_18:HA        1:CYS_36:HN         1.800  4.620 32.00 32.00 320.000
1:ASN_18:HB1       1:ASN_19:HN         1.800  3.410 32.00 32.00 320.000
1:ASN_18:HB2       1:ASN_19:HN         1.800  3.410 32.00 32.00 320.000
1:ASN_18:HB*       1:ALA_20:HN         1.800  6.050 32.00 32.00 320.000
1:ASN_18:HD22      1:ASN_19:HN         1.800  5.500 32.00 32.00 320.000
1:ASN_18:O         1:LYS_22:N          1.800  3.000 32.00 32.00 320.000
1:ASN_18:O         1:LYS_22:HN         1.800  2.700 32.00 32.00 320.000
1:ASN_19:HN        1:ASN_19:HB1        1.800  3.630 32.00 32.00 320.000
1:ASN_19:HN        1:ASN_19:HB2        1.800  3.300 32.00 32.00 320.000
1:ASN_19:HN        1:ALA_20:HN         1.800  2.970 32.00 32.00 320.000
1:ASN_19:HN        1:LYS_22:HB*        1.800  6.600 32.00 32.00 320.000
1:ASN_19:HN        1:SER_35:HA         1.800  5.500 32.00 32.00 320.000
1:ASN_19:HA        1:ALA_20:HB*        1.800  6.600 32.00 32.00 320.000
1:ASN_19:HA        1:LYS_22:HN         1.800  4.290 32.00 32.00 320.000
1:ASN_19:HB*       1:ALA_20:HN         1.800  4.400 32.00 32.00 320.000
1:ASN_19:HD2*      1:ASN_23:HD21       1.800  4.940 32.00 32.00 320.000
1:ALA_20:HN        1:CYS_21:HN         1.800  5.500 32.00 32.00 320.000
1:ALA_20:HA        1:ASN_23:HN         1.800  3.850 32.00 32.00 320.000
1:ALA_20:HA        1:ASN_23:HB1        1.800  5.500 32.00 32.00 320.000
1:ALA_20:HA        1:ASN_23:HB2        1.800  5.500 32.00 32.00 320.000
1:ALA_20:HA        1:ASN_23:HD21       1.800  4.730 32.00 32.00 320.000
1:ALA_20:HA        1:GLN_24:HN         1.800  4.840 32.00 32.00 320.000
1:ALA_20:HB*       1:GLN_24:HE21       1.800  6.600 32.00 32.00 320.000
1:ALA_20:O         1:GLN_24:N          1.800  3.000 32.00 32.00 320.000
1:ALA_20:O         1:GLN_24:HN         1.800  2.700 32.00 32.00 320.000
1:CYS_21:HN        1:CYS_21:HB1        1.800  3.190 32.00 32.00 320.000
1:CYS_21:HN        1:CYS_21:HB2        1.800  2.860 32.00 32.00 320.000
1:CYS_21:HN        1:LYS_22:HN         1.800  3.410 32.00 32.00 320.000
1:CYS_21:HA        1:CYS_21:HB1        1.800  2.640 32.00 32.00 320.000
1:CYS_21:HA        1:GLN_24:HB*        1.800  6.380 32.00 32.00 320.000
1:CYS_21:HB1       1:LYS_22:HN         1.800  5.500 32.00 32.00 320.000
1:CYS_21:HB2       1:LYS_22:HN         1.800  3.630 32.00 32.00 320.000
1:CYS_21:O         1:CYS_25:N          1.800  3.000 32.00 32.00 320.000
1:CYS_21:O         1:CYS_25:HN         1.800  2.700 32.00 32.00 320.000
1:LYS_22:HN        1:LYS_22:HG*        1.800  6.160 32.00 32.00 320.000
1:LYS_22:HA        1:LYS_22:HG*        1.800  3.660 32.00 32.00 320.000
1:LYS_22:HA        1:CYS_25:HN         1.800  4.840 32.00 32.00 320.000
1:LYS_22:HA        1:CYS_25:HB1        1.800  4.070 32.00 32.00 320.000
1:LYS_22:HA        1:CYS_25:HB2        1.800  5.500 32.00 32.00 320.000
1:LYS_22:HA        1:ILE_26:HN         1.800  4.950 32.00 32.00 320.000
1:LYS_22:HA        1:ILE_26:HD1*       1.800  6.600 32.00 32.00 320.000
1:LYS_22:HA        1:HISD_33:HA        1.800  5.500 32.00 32.00 320.000
1:LYS_22:HA        1:GLY_34:HN         1.800  5.500 32.00 32.00 320.000
1:LYS_22:HA        1:GLY_34:HA1        1.800  3.850 32.00 32.00 320.000
1:LYS_22:HA        1:GLY_34:HA2        1.800  2.860 32.00 32.00 320.000
1:LYS_22:HB*       1:LYS_22:HE*        1.800  7.700 32.00 32.00 320.000
1:LYS_22:HB*       1:ASN_23:HN         1.800  3.960 32.00 32.00 320.000
1:LYS_22:HG1       1:ASN_23:HN         1.800  5.170 32.00 32.00 320.000
1:LYS_22:HG1       1:ASN_23:HA         1.800  4.730 32.00 32.00 320.000
1:LYS_22:HG2       1:ASN_23:HN         1.800  5.170 32.00 32.00 320.000
1:LYS_22:HG2       1:ASN_23:HA         1.800  4.730 32.00 32.00 320.000
1:LYS_22:HG*       1:ASN_23:HN         1.800  4.520 32.00 32.00 320.000
1:LYS_22:HG*       1:ASN_23:HA         1.800  4.270 32.00 32.00 320.000
1:LYS_22:HG*       1:ILE_26:HD1*       1.800  7.480 32.00 32.00 320.000
1:LYS_22:HG*       1:GLY_34:HN         1.800  6.380 32.00 32.00 320.000
1:LYS_22:HE*       1:ILE_26:HD1*       1.800  7.700 32.00 32.00 320.000
1:LYS_22:O         1:ILE_26:N          1.800  3.000 32.00 32.00 320.000
1:LYS_22:O         1:ILE_26:HN         1.800  2.700 32.00 32.00 320.000
1:ASN_23:HN        1:ASN_23:HB1        1.800  2.860 32.00 32.00 320.000
1:ASN_23:HN        1:ASN_23:HB2        1.800  2.860 32.00 32.00 320.000
1:ASN_23:HN        1:ASN_23:HB*        1.800  2.670 32.00 32.00 320.000
1:ASN_23:HA        1:ASN_23:HD21       1.800  5.060 32.00 32.00 320.000
1:ASN_23:HA        1:ILE_26:HN         1.800  3.850 32.00 32.00 320.000
1:ASN_23:HA        1:ILE_26:HG1*       1.800  6.380 32.00 32.00 320.000
1:ASN_23:HA        1:ILE_26:HD1*       1.800  5.500 32.00 32.00 320.000
1:ASN_23:HB*       1:GLN_24:HN         1.800  4.070 32.00 32.00 320.000
1:GLN_24:HN        1:GLN_24:HG*        1.800  6.600 32.00 32.00 320.000
1:GLN_24:HN        1:CYS_25:HN         1.800  3.080 32.00 32.00 320.000
1:GLN_24:HA        1:GLN_24:HG*        1.800  3.410 32.00 32.00 320.000
1:GLN_24:HA        1:ASN_27:HN         1.800  3.630 32.00 32.00 320.000
1:GLN_24:HA        1:ASN_27:HB1        1.800  3.740 32.00 32.00 320.000
1:GLN_24:HA        1:ASN_27:HB2        1.800  3.740 32.00 32.00 320.000
1:GLN_24:HA        1:LEU_28:HB*        1.800  4.950 32.00 32.00 320.000
1:GLN_24:HA        1:LEU_28:HD1*       1.800  6.600 32.00 32.00 320.000
1:GLN_24:HA        1:LEU_28:HD2*       1.800  6.600 32.00 32.00 320.000
1:GLN_24:HB*       1:GLN_24:HE21       1.800  6.380 32.00 32.00 320.000
1:GLN_24:HB*       1:CYS_25:HN         1.800  4.180 32.00 32.00 320.000
1:GLN_24:HB*       1:ASN_27:HN         1.800  6.380 32.00 32.00 320.000
1:GLN_24:HB*       1:LEU_28:HD2*       1.800  7.480 32.00 32.00 320.000
1:GLN_24:HG*       1:LEU_28:HB*        1.800  7.370 32.00 32.00 320.000
1:GLN_24:HG*       1:LEU_28:HD1*       1.800  7.700 32.00 32.00 320.000
1:GLN_24:HG*       1:LEU_28:HD2*       1.800  7.700 32.00 32.00 320.000
1:GLN_24:HE21      1:LEU_28:HB*        1.800  6.380 32.00 32.00 320.000
1:GLN_24:HE21      1:LEU_28:HD2*       1.800  6.600 32.00 32.00 320.000
1:GLN_24:HE22      1:LEU_28:HD2*       1.800  6.600 32.00 32.00 320.000
1:CYS_25:HN        1:CYS_25:HB1        1.800  3.190 32.00 32.00 320.000
1:CYS_25:HN        1:CYS_25:HB2        1.800  2.860 32.00 32.00 320.000
1:CYS_25:HN        1:ILE_26:HN         1.800  5.500 32.00 32.00 320.000
1:CYS_25:HA        1:CYS_25:HB1        1.800  2.860 32.00 32.00 320.000
1:CYS_25:HA        1:ASN_27:HN         1.800  5.500 32.00 32.00 320.000
1:CYS_25:HA        1:GLU_29:HB2        1.800  5.500 32.00 32.00 320.000
1:CYS_25:HA        1:GLU_29:HG1        1.800  5.500 32.00 32.00 320.000
1:CYS_25:HA        1:GLU_29:HG2        1.800  5.500 32.00 32.00 320.000
1:CYS_25:HA        1:ALA_31:HB*        1.800  6.600 32.00 32.00 320.000
1:CYS_25:HB1       1:ILE_26:HN         1.800  3.850 32.00 32.00 320.000
1:CYS_25:HB1       1:ASN_27:HN         1.800  5.500 32.00 32.00 320.000
1:CYS_25:HB1       1:ALA_31:HB*        1.800  5.390 32.00 32.00 320.000
1:CYS_25:HB1       1:GLY_34:HA2        1.800  4.510 32.00 32.00 320.000
1:CYS_25:HB1       1:CYS_47:HA         1.800  5.500 32.00 32.00 320.000
1:CYS_25:HB2       1:ILE_26:HN         1.800  3.190 32.00 32.00 320.000
1:CYS_25:HB2       1:ALA_31:HB*        1.800  6.160 32.00 32.00 320.000
1:CYS_25:HB2       1:GLY_34:HA2        1.800  3.190 32.00 32.00 320.000
1:CYS_25:O         1:GLU_29:N          1.800  3.000 32.00 32.00 320.000
1:CYS_25:O         1:GLU_29:HN         1.800  2.700 32.00 32.00 320.000
1:ILE_26:HN        1:ILE_26:HG1*       1.800  3.960 32.00 32.00 320.000
1:ILE_26:HN        1:ILE_26:HD1*       1.800  6.600 32.00 32.00 320.000
1:ILE_26:HN        1:ASN_27:HN         1.800  5.500 32.00 32.00 320.000
1:ILE_26:HA        1:ILE_26:HG2*       1.800  3.740 32.00 32.00 320.000
1:ILE_26:HA        1:ASN_27:HN         1.800  3.630 32.00 32.00 320.000
1:ILE_26:HA        1:LYS_30:HN         1.800  5.060 32.00 32.00 320.000
1:ILE_26:HA        1:ALA_31:HN         1.800  3.410 32.00 32.00 320.000
1:ILE_26:HG2*      1:ASN_27:HN         1.800  6.600 32.00 32.00 320.000
1:ILE_26:HG2*      1:ASN_27:HB1        1.800  6.600 32.00 32.00 320.000
1:ILE_26:HG1*      1:ASN_27:HN         1.800  5.830 32.00 32.00 320.000
1:ILE_26:HG1*      1:ASN_27:HA         1.800  4.180 32.00 32.00 320.000
1:ILE_26:HG1*      1:ARG_32:HA         1.800  6.380 32.00 32.00 320.000
1:ILE_26:HD1*      1:ASN_27:HN         1.800  6.600 32.00 32.00 320.000
1:ILE_26:HD1*      1:ARG_32:HA         1.800  6.600 32.00 32.00 320.000
1:ILE_26:HD1*      1:HISD_33:HA        1.800  4.840 32.00 32.00 320.000
1:ASN_27:HN        1:ASN_27:HB2        1.800  3.080 32.00 32.00 320.000
1:ASN_27:HA        1:ASN_27:HB1        1.800  3.190 32.00 32.00 320.000
1:ASN_27:HB1       1:LEU_28:HN         1.800  5.500 32.00 32.00 320.000
1:ASN_27:HB1       1:LEU_28:HD1*       1.800  6.600 32.00 32.00 320.000
1:ASN_27:HB2       1:ASN_27:HD22       1.800  4.070 32.00 32.00 320.000
1:ASN_27:HB2       1:LEU_28:HN         1.800  5.500 32.00 32.00 320.000
1:ASN_27:HB2       1:LEU_28:HB*        1.800  6.380 32.00 32.00 320.000
1:ASN_27:HB2       1:LEU_28:HD1*       1.800  6.600 32.00 32.00 320.000
1:ASN_27:HB2       1:LEU_28:HD2*       1.800  6.600 32.00 32.00 320.000
1:LEU_28:HN        1:LEU_28:HB1        1.800  3.300 32.00 32.00 320.000
1:LEU_28:HN        1:LEU_28:HB2        1.800  3.520 32.00 32.00 320.000
1:LEU_28:HN        1:LEU_28:HB*        1.800  3.070 32.00 32.00 320.000
1:LEU_28:HN        1:LEU_28:HG         1.800  4.950 32.00 32.00 320.000
1:LEU_28:HN        1:LEU_28:HD1*       1.800  6.600 32.00 32.00 320.000
1:LEU_28:HN        1:LEU_28:HD2*       1.800  6.600 32.00 32.00 320.000
1:LEU_28:HN        1:GLU_29:HN         1.800  3.080 32.00 32.00 320.000
1:LEU_28:HA        1:LEU_28:HG         1.800  3.630 32.00 32.00 320.000
1:LEU_28:HA        1:LEU_28:HD1*       1.800  3.740 32.00 32.00 320.000
1:LEU_28:HA        1:LEU_28:HD2*       1.800  6.600 32.00 32.00 320.000
1:LEU_28:HB*       1:GLU_29:HN         1.800  4.290 32.00 32.00 320.000
1:LEU_28:HB*       1:GLU_29:HB2        1.800  6.380 32.00 32.00 320.000
1:GLU_29:HN        1:GLU_29:HB2        1.800  3.410 32.00 32.00 320.000
1:GLU_29:HN        1:GLU_29:HG1        1.800  3.960 32.00 32.00 320.000
1:GLU_29:HN        1:LYS_30:HN         1.800  5.500 32.00 32.00 320.000
1:GLU_29:HN        1:LYS_30:HA         1.800  5.500 32.00 32.00 320.000
1:GLU_29:HN        1:ALA_31:HN         1.800  5.280 32.00 32.00 320.000
1:GLU_29:HA        1:GLU_29:HB1        1.800  2.750 32.00 32.00 320.000
1:GLU_29:HA        1:GLU_29:HB2        1.800  2.750 32.00 32.00 320.000
1:GLU_29:HA        1:GLU_29:HG1        1.800  4.000 32.00 32.00 320.000
1:GLU_29:HA        1:LYS_30:HG*        1.800  6.380 32.00 32.00 320.000
1:GLU_29:HB1       1:GLU_29:HG2        1.800  2.860 32.00 32.00 320.000
1:GLU_29:HB1       1:ALA_31:HB*        1.800  5.390 32.00 32.00 320.000
1:GLU_29:HB1       1:PHE_49:CZ         1.800  5.720 32.00 32.00 320.000
1:GLU_29:HB2       1:ALA_31:HN         1.800  5.280 32.00 32.00 320.000
1:GLU_29:HB2       1:ALA_31:HB*        1.800  6.600 32.00 32.00 320.000
1:GLU_29:HG2       1:PHE_49:HZ         1.800  4.070 32.00 32.00 320.000
1:LYS_30:HN        1:LYS_30:HB2        1.800  5.500 32.00 32.00 320.000
1:LYS_30:HN        1:LYS_30:HG1        1.800  4.400 32.00 32.00 320.000
1:LYS_30:HN        1:LYS_30:HG2        1.800  4.400 32.00 32.00 320.000
1:LYS_30:HN        1:LYS_30:HG*        1.800  4.200 32.00 32.00 320.000
1:LYS_30:HN        1:LYS_30:HD*        1.800  5.830 32.00 32.00 320.000
1:LYS_30:HN        1:LYS_30:HE*        1.800  6.600 32.00 32.00 320.000
1:LYS_30:HN        1:ALA_31:HN         1.800  3.080 32.00 32.00 320.000
1:LYS_30:HA        1:LYS_30:HG*        1.800  3.610 32.00 32.00 320.000
1:LYS_30:HA        1:LYS_30:HD*        1.800  4.950 32.00 32.00 320.000
1:LYS_30:HB1       1:ALA_31:HN         1.800  4.620 32.00 32.00 320.000
1:ALA_31:HA        1:ARG_32:HN         1.800  3.080 32.00 32.00 320.000
1:ALA_31:HA        1:PHE_49:CG         1.800  5.830 32.00 32.00 320.000
1:ALA_31:HB*       1:ARG_32:HA         1.800  6.600 32.00 32.00 320.000
1:ALA_31:HB*       1:HISD_33:HN        1.800  5.830 32.00 32.00 320.000
1:ALA_31:HB*       1:GLY_34:HA1        1.800  6.600 32.00 32.00 320.000
1:ALA_31:HB*       1:CYS_47:HB1        1.800  5.500 32.00 32.00 320.000
1:ALA_31:HB*       1:TYR_48:HN         1.800  6.600 32.00 32.00 320.000
1:ALA_31:HB*       1:PHE_49:HA         1.800  6.600 32.00 32.00 320.000
1:ALA_31:HB*       1:PHE_49:CG         1.800  8.800 32.00 32.00 320.000
1:ALA_31:HB*       1:PHE_49:CZ         1.800  8.800 32.00 32.00 320.000
1:ALA_31:HB*       1:PHE_49:HZ         1.800  6.600 32.00 32.00 320.000
1:ALA_31:HB*       1:PRO_50:HD2        1.800  6.600 32.00 32.00 320.000
1:ARG_32:HN        1:ARG_32:HB*        1.800  3.580 32.00 32.00 320.000
1:ARG_32:HN        1:ARG_32:HG1        1.800  5.500 32.00 32.00 320.000
1:ARG_32:HN        1:ARG_32:HG2        1.800  5.500 32.00 32.00 320.000
1:ARG_32:HN        1:ARG_32:HD*        1.800  6.600 32.00 32.00 320.000
1:ARG_32:HN        1:HISD_33:HN        1.800  2.860 32.00 32.00 320.000
1:ARG_32:HN        1:PHE_49:HA         1.800  5.500 32.00 32.00 320.000
1:ARG_32:HN        1:PRO_50:HD2        1.800  5.500 32.00 32.00 320.000
1:ARG_32:HA        1:ARG_32:HD*        1.800  4.400 32.00 32.00 320.000
1:ARG_32:HB*       1:ARG_32:HE         1.800  6.380 32.00 32.00 320.000
1:ARG_32:HB*       1:HISD_33:HB*       1.800  6.820 32.00 32.00 320.000
1:ARG_32:HB*       1:PHE_49:HA         1.800  6.380 32.00 32.00 320.000
1:ARG_32:HB*       1:PRO_50:HD2        1.800  6.380 32.00 32.00 320.000
1:ARG_32:HG*       1:HISD_33:HE1       1.800  5.610 32.00 32.00 320.000
1:ARG_32:HG*       1:PHE_49:HA         1.800  6.380 32.00 32.00 320.000
1:ARG_32:HG*       1:PRO_50:HD1        1.800  4.510 32.00 32.00 320.000
1:ARG_32:HG*       1:PRO_50:HD2        1.800  6.380 32.00 32.00 320.000
1:HISD_33:HN       1:HISD_33:HA        1.800  4.500 32.00 32.00 320.000
1:HISD_33:HN       1:HISD_33:HB*       1.800  4.730 32.00 32.00 320.000
1:HISD_33:HA       1:HISD_33:HB*       1.800  4.070 32.00 32.00 320.000
1:HISD_33:HA       1:GLY_34:HN         1.800  4.000 32.00 32.00 320.000
1:HISD_33:HB*      1:GLY_34:HN         1.800  5.170 32.00 32.00 320.000
1:HISD_33:HB*      1:TYR_48:CG         1.800  8.030 32.00 32.00 320.000
1:HISD_33:HB*      1:HISD_33:HD2       1.800  5.100 32.00 32.00 320.000
1:HISD_33:HD2      1:SER_35:HB*        1.800  6.600 32.00 32.00 320.000
1:HISD_33:HD2      1:TYR_48:CG         1.800  6.600 32.00 32.00 320.000
1:HISD_33:HD2      1:TYR_48:CZ         1.800  6.490 32.00 32.00 320.000
1:HISD_33:HE1      1:HISD_33:HB*       1.800  6.600 32.00 32.00 320.000
1:GLY_34:HA1       1:TYR_48:HN         1.800  5.500 32.00 32.00 320.000
1:GLY_34:HA1       1:TYR_48:CG         1.800  5.170 32.00 32.00 320.000
1:GLY_34:HA1       1:TYR_48:CZ         1.800  5.830 32.00 32.00 320.000
1:GLY_34:HA2       1:SER_35:HN         1.800  3.080 32.00 32.00 320.000
1:GLY_34:HA2       1:CYS_47:HB2        1.800  5.500 32.00 32.00 320.000
1:GLY_34:HA2       1:TYR_48:CG         1.800  7.700 32.00 32.00 320.000
1:GLY_34:HA2       1:TYR_48:CZ         1.800  7.040 32.00 32.00 320.000
1:SER_35:HN        1:ILE_46:HN         1.800  5.500 32.00 32.00 320.000
1:SER_35:HN        1:CYS_47:HA         1.800  5.500 32.00 32.00 320.000
1:SER_35:HN        1:TYR_48:CZ         1.800  6.000 32.00 32.00 320.000
1:SER_35:HN        1:TYR_48:CG         1.800  7.700 32.00 32.00 320.000
1:SER_35:HB*       1:TYR_48:CG         1.800  7.700 32.00 32.00 320.000
1:SER_35:HB*       1:TYR_48:CZ         1.800  8.800 32.00 32.00 320.000
1:CYS_36:HN        1:CYS_36:HB1        1.800  3.080 32.00 32.00 320.000
1:CYS_36:HA        1:ASN_37:HN         1.800  2.860 32.00 32.00 320.000
1:ASN_37:HN        1:ASN_37:HB*        1.800  3.440 32.00 32.00 320.000
1:ASN_37:HN        1:LYS_44:HN         1.800  5.500 32.00 32.00 320.000
1:ASN_37:HN        1:CYS_45:HA         1.800  5.500 32.00 32.00 320.000
1:ASN_37:HN        1:ILE_46:HG2*       1.800  6.600 32.00 32.00 320.000
1:ASN_37:HB*       1:TYR_38:HN         1.800  3.850 32.00 32.00 320.000
1:ASN_37:HB*       1:VAL_39:HG*        1.800  9.040 32.00 32.00 320.000
1:ASN_37:HB*       1:ILE_46:HB         1.800  4.950 32.00 32.00 320.000
1:ASN_37:HB*       1:ILE_46:HG2*       1.800  7.480 32.00 32.00 320.000
1:ASN_37:HB*       1:ILE_46:HG11       1.800  4.180 32.00 32.00 320.000
1:ASN_37:HB*       1:ILE_46:HG12       1.800  3.960 32.00 32.00 320.000
1:ASN_37:HB*       1:ILE_46:HD1*       1.800  7.480 32.00 32.00 320.000
1:ASN_37:HD2*      1:TYR_38:HN         1.800  5.050 32.00 32.00 320.000
1:ASN_37:HD2*      1:TYR_38:HA         1.800  5.050 32.00 32.00 320.000
1:TYR_38:HN        1:TYR_38:HB1        1.800  2.970 32.00 32.00 320.000
1:TYR_38:HN        1:TYR_38:HB2        1.800  2.970 32.00 32.00 320.000
1:TYR_38:HN        1:VAL_39:HG*        1.800  8.160 32.00 32.00 320.000
1:TYR_38:HA        1:TYR_38:CZ         1.800  6.050 32.00 32.00 320.000
1:TYR_38:HA        1:VAL_39:HG*        1.800  8.160 32.00 32.00 320.000
1:TYR_38:HA        1:HISD_43:HA        1.800  2.970 32.00 32.00 320.000
1:TYR_38:HB2       1:TYR_38:CZ         1.800  6.000 32.00 32.00 320.000
1:TYR_38:CG        1:HISD_43:HA        1.800  6.600 32.00 32.00 320.000
1:TYR_38:CG        1:HISD_43:HD2       1.800  7.700 32.00 32.00 320.000
1:TYR_38:CZ        1:PHE_40:HN         1.800  7.700 32.00 32.00 320.000
1:TYR_38:CZ        1:PRO_41:HA         1.800  6.820 32.00 32.00 320.000
1:TYR_38:CZ        1:ALA_42:HA         1.800  6.930 32.00 32.00 320.000
1:TYR_38:CZ        1:HISD_43:HD2       1.800  7.700 32.00 32.00 320.000
1:VAL_39:HG*       1:PHE_40:HN         1.800  8.160 32.00 32.00 320.000
1:VAL_39:HG*       1:PRO_41:HA         1.800  8.160 32.00 32.00 320.000
1:VAL_39:HG*       1:HISD_43:HA        1.800  8.160 32.00 32.00 320.000
1:VAL_39:HG*       1:LYS_44:HN         1.800  8.160 32.00 32.00 320.000
1:VAL_39:HG*       1:LYS_44:HE*        1.800  9.260 32.00 32.00 320.000
1:VAL_39:HG*       1:ILE_46:HG11       1.800  8.160 32.00 32.00 320.000
1:PHE_40:HN        1:PHE_40:HB2        1.800  2.970 32.00 32.00 320.000
1:PHE_40:HA        1:PRO_41:HB1        1.800  5.500 32.00 32.00 320.000
1:PHE_40:HA        1:PRO_41:HB2        1.800  5.500 32.00 32.00 320.000
1:PHE_40:HA        1:ALA_42:HN         1.800  5.500 32.00 32.00 320.000
1:PHE_40:HB1       1:PRO_41:HA         1.800  3.410 32.00 32.00 320.000
1:PHE_40:HB2       1:PRO_41:HA         1.800  3.960 32.00 32.00 320.000
1:PHE_40:CG        1:PRO_41:HA         1.800  7.700 32.00 32.00 320.000
1:PHE_40:CG        1:PRO_41:HB2        1.800  7.040 32.00 32.00 320.000
1:PHE_40:CG        1:PRO_41:HD2        1.800  6.490 32.00 32.00 320.000
1:PHE_40:CG        1:LYS_44:HZ*        1.800  6.490 32.00 32.00 320.000
1:PHE_40:CZ        1:PRO_41:HA         1.800  6.820 32.00 32.00 320.000
1:PHE_40:CZ        1:PRO_41:HB2        1.800  6.490 32.00 32.00 320.000
1:PHE_40:CZ        1:PRO_41:HD2        1.800  6.820 32.00 32.00 320.000
1:PRO_41:HG2       1:ALA_42:HN         1.800  4.620 32.00 32.00 320.000
1:PRO_41:HD1       1:ALA_42:HN         1.800  3.850 32.00 32.00 320.000
1:PRO_41:HD1       1:ALA_42:HB*        1.800  6.600 32.00 32.00 320.000
1:PRO_41:HD2       1:ALA_42:HN         1.800  4.730 32.00 32.00 320.000
1:ALA_42:HN        1:LYS_44:HD*        1.800  6.600 32.00 32.00 320.000
1:ALA_42:HB*       1:HISD_43:HB1       1.800  6.600 32.00 32.00 320.000
1:ALA_42:HA        1:HISD_43:HN        1.800  5.500 32.00 32.00 320.000
1:HISD_43:HN       1:HISD_43:HB2       1.800  3.850 32.00 32.00 320.000
1:HISD_43:HA       1:HISD_43:HB1       1.800  2.640 32.00 32.00 320.000
1:HISD_43:HB2      1:LYS_44:HN         1.800  4.180 32.00 32.00 320.000
1:LYS_44:HN        1:LYS_44:HA         1.800  5.500 32.00 32.00 320.000
1:LYS_44:HN        1:LYS_44:HB*        1.800  3.530 32.00 32.00 320.000
1:LYS_44:HN        1:LYS_44:HG*        1.800  6.600 32.00 32.00 320.000
1:LYS_44:HA        1:LYS_44:HB2        1.800  2.860 32.00 32.00 320.000
1:LYS_44:HA        1:LYS_44:HB*        1.800  2.670 32.00 32.00 320.000
1:LYS_44:HA        1:LYS_44:HD*        1.800  5.610 32.00 32.00 320.000
1:LYS_44:HB*       1:LYS_44:HE*        1.800  7.480 32.00 32.00 320.000
1:LYS_44:HB*       1:LYS_44:HZ*        1.800  7.480 32.00 32.00 320.000
1:LYS_44:HB*       1:CYS_45:HN         1.800  4.510 32.00 32.00 320.000
1:LYS_44:HB*       1:ILE_46:HG11       1.800  6.380 32.00 32.00 320.000
1:LYS_44:HB*       1:ILE_46:HD1*       1.800  7.480 32.00 32.00 320.000
1:LYS_44:HD*       1:CYS_45:HN         1.800  6.600 32.00 32.00 320.000
1:LYS_44:HD*       1:ILE_46:HG2*       1.800  7.700 32.00 32.00 320.000
1:LYS_44:HD*       1:ILE_46:HD1*       1.800  7.700 32.00 32.00 320.000
1:ILE_46:HN        1:ILE_46:HB         1.800  2.970 32.00 32.00 320.000
1:ILE_46:HN        1:ILE_46:HG11       1.800  3.960 32.00 32.00 320.000
1:ILE_46:HN        1:ILE_46:HG12       1.800  4.840 32.00 32.00 320.000
1:ILE_46:HA        1:ILE_46:HG11       1.800  3.850 32.00 32.00 320.000
1:ILE_46:HA        1:ILE_46:HG12       1.800  4.180 32.00 32.00 320.000
1:ILE_46:HA        1:ILE_46:HD1*       1.800  3.740 32.00 32.00 320.000
1:ILE_46:HA        1:CYS_47:HN         1.800  2.640 32.00 32.00 320.000
1:ILE_46:HB        1:ILE_46:HG12       1.800  2.750 32.00 32.00 320.000
1:ILE_46:HB        1:TYR_48:CG         1.800  7.700 32.00 32.00 320.000
1:ILE_46:HB        1:TYR_48:CZ         1.800  5.830 32.00 32.00 320.000
1:ILE_46:HG2*      1:ILE_46:HG12       1.800  3.740 32.00 32.00 320.000
1:ILE_46:HG2*      1:CYS_47:HN         1.800  6.600 32.00 32.00 320.000
1:ILE_46:HG2*      1:CYS_47:HA         1.800  6.600 32.00 32.00 320.000
1:ILE_46:HG2*      1:CYS_47:HB2        1.800  6.600 32.00 32.00 320.000
1:ILE_46:HG2*      1:TYR_48:HA         1.800  6.600 32.00 32.00 320.000
1:ILE_46:HG2*      1:TYR_48:CG         1.800  8.800 32.00 32.00 320.000
1:ILE_46:HG2*      1:TYR_48:CZ         1.800  8.800 32.00 32.00 320.000
1:ILE_46:HD1*      1:CYS_47:HN         1.800  6.600 32.00 32.00 320.000
1:CYS_47:HN        1:CYS_47:HB1        1.800  3.520 32.00 32.00 320.000
1:CYS_47:HN        1:CYS_47:HB2        1.800  3.410 32.00 32.00 320.000
1:CYS_47:HA        1:CYS_47:HB1        1.800  2.860 32.00 32.00 320.000
1:CYS_47:HB1       1:TYR_48:HN         1.800  5.500 32.00 32.00 320.000
1:CYS_47:HB1       1:PHE_49:CG         1.800  7.700 32.00 32.00 320.000
1:CYS_47:HB1       1:PHE_49:CZ         1.800  7.700 32.00 32.00 320.000
1:CYS_47:HB1       1:PHE_49:HZ         1.800  5.500 32.00 32.00 320.000
1:CYS_47:HB2       1:TYR_48:HN         1.800  5.500 32.00 32.00 320.000
1:CYS_47:HB2       1:PHE_49:HZ         1.800  3.960 32.00 32.00 320.000
1:TYR_48:HN        1:PHE_49:HN         1.800  5.500 32.00 32.00 320.000
1:TYR_48:HA        1:TYR_48:HB*        1.800  3.960 32.00 32.00 320.000
1:TYR_48:HA        1:TYR_48:CZ         1.800  6.160 32.00 32.00 320.000
1:TYR_48:HA        1:PHE_49:HN         1.800  2.640 32.00 32.00 320.000
1:TYR_48:HA        1:PHE_49:CG         1.800  6.380 32.00 32.00 320.000
1:TYR_48:HB*       1:PHE_49:CZ         1.800  8.800 32.00 32.00 320.000
1:TYR_48:HB*       1:PHE_49:HN         1.800  6.600 32.00 32.00 320.000
1:PHE_49:HN        1:PHE_49:HB2        1.800  3.630 32.00 32.00 320.000
1:PHE_49:HA        1:PHE_49:HB2        1.800  2.750 32.00 32.00 320.000
1:PHE_49:HA        1:PRO_50:HD1        1.800  3.080 32.00 32.00 320.000
1:PHE_49:HA        1:PRO_50:HD2        1.800  2.640 32.00 32.00 320.000
1:PHE_49:HB1       1:PRO_50:HD1        1.800  3.410 32.00 32.00 320.000
1:PHE_49:HB2       1:PRO_50:HD2        1.800  5.500 32.00 32.00 320.000
1:PHE_49:CG        1:PRO_50:HD1        1.800  5.830 32.00 32.00 320.000
1:PHE_49:CG        1:PRO_50:HD2        1.800  6.270 32.00 32.00 320.000
1:PRO_50:HA        1:CYS_51:HN         1.800  3.410 32.00 32.00 320.000
1:PRO_50:HB*       1:CYS_51:HN         1.800  4.240 32.00 32.00 320.000
1:CYS_51:HN        1:CYS_51:HB2        1.800  3.300 32.00 32.00 320.000
1:CYS_51:HA        1:CYS_51:HB1        1.800  2.750 32.00 32.00 320.000
!
#mixing_times
-9.990000E+02 
!
#NMR_dihedral
1:PYR_1:CA        1:PYR_1:C         1:LYS_2:N          1:LYS_2:CA         170.000 -170.000 100.00 100.00 1000.000
1:PYR_1:C         1:LYS_2:N          1:LYS_2:CA         1:LYS_2:C          -90.000 -30.000 100.00 100.00 1000.000
1:LYS_2:N          1:LYS_2:CA         1:LYS_2:C          1:LEU_3:N          70.000 170.000 100.00 100.00 1000.000
1:LYS_2:CA         1:LYS_2:C          1:LEU_3:N          1:LEU_3:CA         170.000 -170.000 100.00 100.00 1000.000
1:LYS_2:C          1:LEU_3:N          1:LEU_3:CA         1:LEU_3:C          -135.000 -55.000 100.00 100.00 1000.000
1:LEU_3:N          1:LEU_3:CA         1:LEU_3:C          1:CYS_4:N          135.000 -105.000 100.00 100.00 1000.000
1:LEU_3:N          1:LEU_3:CA         1:LEU_3:CB         1:LEU_3:CG         -80.000 -20.000 100.00 100.00 1000.000
1:LEU_3:CA         1:LEU_3:C          1:CYS_4:N          1:CYS_4:CA         170.000 -170.000 100.00 100.00 1000.000
1:LEU_3:C          1:CYS_4:N          1:CYS_4:CA         1:CYS_4:C          -140.000 -80.000 100.00 100.00 1000.000
1:CYS_4:N          1:CYS_4:CA         1:CYS_4:C          1:GLU_5:N          65.000 165.000 100.00 100.00 1000.000
1:CYS_4:CA         1:CYS_4:C          1:GLU_5:N          1:GLU_5:CA         170.000 -170.000 100.00 100.00 1000.000
1:CYS_4:C          1:GLU_5:N          1:GLU_5:CA         1:GLU_5:C          35.000 -65.000 100.00 100.00 1000.000
1:GLU_5:CA         1:GLU_5:C          1:ARG_6:N          1:ARG_6:CA         170.000 -170.000 100.00 100.00 1000.000
1:GLU_5:N          1:GLU_5:CA         1:GLU_5:C          1:ARG_6:N          -105.000 -135.000 100.00 100.00 1000.000
1:GLU_5:N          1:GLU_5:CA         1:GLU_5:CB         1:GLU_5:CG         -5.000 -35.000 100.00 100.00 1000.000
1:GLU_5:C          1:ARG_6:N          1:ARG_6:CA         1:ARG_6:C          -135.000 75.000 100.00 100.00 1000.000
1:ARG_6:CA         1:ARG_6:C          1:PRO_7:N          1:PRO_7:CA         170.000 -170.000 100.00 100.00 1000.000
1:ARG_6:N          1:ARG_6:CA         1:ARG_6:C          1:PRO_7:N          -105.000 -135.000 100.00 100.00 1000.000
1:PRO_7:CA         1:PRO_7:C          1:SER_8:N          1:SER_8:CA         170.000 -170.000 100.00 100.00 1000.000
1:PRO_7:C          1:SER_8:N          1:SER_8:CA         1:SER_8:C          -85.000 -25.000 100.00 100.00 1000.000
1:SER_8:N          1:SER_8:CA         1:SER_8:C          1:GLY_9:N          85.000 -5.000 100.00 100.00 1000.000
1:SER_8:CA         1:SER_8:C          1:GLY_9:N          1:GLY_9:CA         170.000 -170.000 100.00 100.00 1000.000
1:GLY_9:CA         1:GLY_9:C          1:THR_10:N         1:THR_10:CA        170.000 -170.000 100.00 100.00 1000.000
1:GLY_9:C          1:THR_10:N         1:THR_10:CA        1:THR_10:C         -155.000 -85.000 100.00 100.00 1000.000
1:THR_10:N         1:THR_10:CA        1:THR_10:C         1:TRP_11:N         -105.000 -135.000 100.00 100.00 1000.000
1:THR_10:CA        1:THR_10:C         1:TRP_11:N         1:TRP_11:CA        170.000 -170.000 100.00 100.00 1000.000
1:THR_10:C         1:TRP_11:N         1:TRP_11:CA        1:TRP_11:C         -125.000 -65.000 100.00 100.00 1000.000
1:TRP_11:CA        1:TRP_11:C         1:SER_12:N         1:SER_12:CA        170.000 -170.000 100.00 100.00 1000.000
1:TRP_11:N         1:TRP_11:CA        1:TRP_11:C         1:SER_12:N         -105.000 -135.000 100.00 100.00 1000.000
1:TRP_11:N         1:TRP_11:CA        1:TRP_11:CB        1:TRP_11:CG        160.000 -140.000 100.00 100.00 1000.000
1:TRP_11:C         1:SER_12:N         1:SER_12:CA        1:SER_12:C         -150.000 -90.000 100.00 100.00 1000.000
1:SER_12:CA        1:SER_12:C         1:GLY_13:N         1:GLY_13:CA        170.000 -170.000 100.00 100.00 1000.000
1:SER_12:N         1:SER_12:CA        1:SER_12:C         1:GLY_13:N         -105.000 -135.000 100.00 100.00 1000.000
1:GLY_13:CA        1:GLY_13:C         1:VAL_14:N         1:VAL_14:CA        170.000 -170.000 100.00 100.00 1000.000
1:GLY_13:C         1:VAL_14:N         1:VAL_14:CA        1:VAL_14:C         -145.000 -55.000 100.00 100.00 1000.000
1:VAL_14:N         1:VAL_14:CA        1:VAL_14:C         1:CYS_15:N         115.000 -125.000 100.00 100.00 1000.000
1:VAL_14:N         1:VAL_14:CA        1:VAL_14:CB        1:VAL_14:CG1       130.000 -110.000 100.00 100.00 1000.000
1:VAL_14:CA        1:VAL_14:C         1:CYS_15:N         1:CYS_15:CA        170.000 -170.000 100.00 100.00 1000.000
1:VAL_14:C         1:CYS_15:N         1:CYS_15:CA        1:CYS_15:C         -165.000 -75.000 100.00 100.00 1000.000
1:CYS_15:N         1:CYS_15:CA        1:CYS_15:C         1:GLY_16:N         115.000 25.000 100.00 100.00 1000.000
1:CYS_15:CA        1:CYS_15:C         1:GLY_16:N         1:GLY_16:CA        170.000 -170.000 100.00 100.00 1000.000
1:CYS_15:N         1:CYS_15:CA        1:CYS_15:CB        1:CYS_15:SG        45.000 115.000 100.00 100.00 1000.000
1:GLY_16:C         1:ASN_17:N         1:ASN_17:CA        1:ASN_17:C         45.000 -75.000 100.00 100.00 1000.000
1:GLY_16:CA        1:GLY_16:C         1:ASN_17:N         1:ASN_17:CA        170.000 -170.000 100.00 100.00 1000.000
1:ASN_17:N         1:ASN_17:CA        1:ASN_17:C         1:ASN_18:N         -105.000 -135.000 100.00 100.00 1000.000
1:ASN_17:N         1:ASN_17:CA        1:ASN_17:CB        1:ASN_17:CG        95.000 -135.000 100.00 100.00 1000.000
1:ASN_17:CA        1:ASN_17:C         1:ASN_18:N         1:ASN_18:CA        170.000 -170.000 100.00 100.00 1000.000
1:ASN_17:C         1:ASN_18:N         1:ASN_18:CA        1:ASN_18:C         -95.000 -35.000 100.00 100.00 1000.000
1:ASN_18:N         1:ASN_18:CA        1:ASN_18:C         1:ASN_19:N         -125.000 -25.000 100.00 100.00 1000.000
1:ASN_18:CA        1:ASN_18:C         1:ASN_19:N         1:ASN_19:CA        170.000 -170.000 100.00 100.00 1000.000
1:ASN_18:C         1:ASN_19:N         1:ASN_19:CA        1:ASN_19:C         -95.000 -35.000 100.00 100.00 1000.000
1:ASN_19:N         1:ASN_19:CA        1:ASN_19:C         1:ALA_20:N         -100.000  0.000 100.00 100.00 1000.000
1:ASN_19:CA        1:ASN_19:C         1:ALA_20:N         1:ALA_20:CA        170.000 -170.000 100.00 100.00 1000.000
1:ALA_20:C         1:CYS_21:N         1:CYS_21:CA        1:CYS_21:C         -125.000 -45.000 100.00 100.00 1000.000
1:ALA_20:CA        1:ALA_20:C         1:CYS_21:N         1:CYS_21:CA        170.000 -170.000 100.00 100.00 1000.000
1:CYS_21:N         1:CYS_21:CA        1:CYS_21:C         1:LYS_22:N         -115.000  5.000 100.00 100.00 1000.000
1:CYS_21:N         1:CYS_21:CA        1:CYS_21:CB        1:CYS_21:SG        100.000 -140.000 100.00 100.00 1000.000
1:CYS_21:CA        1:CYS_21:C         1:LYS_22:N         1:LYS_22:CA        170.000 -170.000 100.00 100.00 1000.000
1:CYS_21:C         1:LYS_22:N         1:LYS_22:CA        1:LYS_22:C         35.000 -35.000 100.00 100.00 1000.000
1:LYS_22:N         1:LYS_22:CA        1:LYS_22:C         1:ASN_23:N         -105.000 -135.000 100.00 100.00 1000.000
1:LYS_22:CA        1:LYS_22:C         1:ASN_23:N         1:ASN_23:CA        170.000 -170.000 100.00 100.00 1000.000
1:LYS_22:C         1:ASN_23:N         1:ASN_23:CA        1:ASN_23:C         -90.000 -30.000 100.00 100.00 1000.000
1:ASN_23:N         1:ASN_23:CA        1:ASN_23:C         1:GLN_24:N         -175.000 -25.000 100.00 100.00 1000.000
1:ASN_23:CA        1:ASN_23:C         1:GLN_24:N         1:GLN_24:CA        170.000 -170.000 100.00 100.00 1000.000
1:ASN_23:C         1:GLN_24:N         1:GLN_24:CA        1:GLN_24:C         145.000 -35.000 100.00 100.00 1000.000
1:GLN_24:N         1:GLN_24:CA        1:GLN_24:C         1:CYS_25:N         -115.000  5.000 100.00 100.00 1000.000
1:GLN_24:C         1:CYS_25:N         1:CYS_25:CA        1:CYS_25:C         -110.000 -30.000 100.00 100.00 1000.000
1:GLN_24:CA        1:GLN_24:C         1:CYS_25:N         1:CYS_25:CA        170.000 -170.000 100.00 100.00 1000.000
1:CYS_25:N         1:CYS_25:CA        1:CYS_25:C         1:ILE_26:N         175.000 -55.000 100.00 100.00 1000.000
1:CYS_25:N         1:CYS_25:CA        1:CYS_25:CB        1:CYS_25:SG        150.000 -150.000 100.00 100.00 1000.000
1:CYS_25:C         1:ILE_26:N         1:ILE_26:CA        1:ILE_26:C         25.000 -25.000 100.00 100.00 1000.000
1:CYS_25:CA        1:CYS_25:C         1:ILE_26:N         1:ILE_26:CA        170.000 -170.000 100.00 100.00 1000.000
1:ILE_26:N         1:ILE_26:CA        1:ILE_26:C         1:ASN_27:N         -15.000 -125.000 100.00 100.00 1000.000
1:ILE_26:CA        1:ILE_26:C         1:ASN_27:N         1:ASN_27:CA        170.000 -170.000 100.00 100.00 1000.000
1:ILE_26:C         1:ASN_27:N         1:ASN_27:CA        1:ASN_27:C         -155.000 45.000 100.00 100.00 1000.000
1:ASN_27:N         1:ASN_27:CA        1:ASN_27:C         1:LEU_28:N         -105.000 -135.000 100.00 100.00 1000.000
1:ASN_27:CA        1:ASN_27:C         1:LEU_28:N         1:LEU_28:CA        170.000 -170.000 100.00 100.00 1000.000
1:ASN_27:C         1:LEU_28:N         1:LEU_28:CA        1:LEU_28:C         -150.000 -70.000 100.00 100.00 1000.000
1:LEU_28:N         1:LEU_28:CA        1:LEU_28:C         1:GLU_29:N         -110.000 10.000 100.00 100.00 1000.000
1:LEU_28:C         1:GLU_29:N         1:GLU_29:CA        1:GLU_29:C         -150.000 -90.000 100.00 100.00 1000.000
1:LEU_28:CA        1:LEU_28:C         1:GLU_29:N         1:GLU_29:CA        170.000 -170.000 100.00 100.00 1000.000
1:GLU_29:N         1:GLU_29:CA        1:GLU_29:C         1:LYS_30:N         -105.000 -135.000 100.00 100.00 1000.000
1:GLU_29:N         1:GLU_29:CA        1:GLU_29:CB        1:GLU_29:CG        35.000 95.000 100.00 100.00 1000.000
1:GLU_29:C         1:LYS_30:N         1:LYS_30:CA        1:LYS_30:C         165.000 -45.000 100.00 100.00 1000.000
1:GLU_29:CA        1:GLU_29:C         1:LYS_30:N         1:LYS_30:CA        170.000 -170.000 100.00 100.00 1000.000
1:LYS_30:N         1:LYS_30:CA        1:LYS_30:C         1:ALA_31:N         -130.000  10.000 100.00 100.00 1000.000
1:LYS_30:CA        1:LYS_30:C         1:ALA_31:N         1:ALA_31:CA        170.000 -170.000 100.00 100.00 1000.000
1:ALA_31:CA        1:ALA_31:C         1:ARG_32:N         1:ARG_32:CA        170.000 -170.000 100.00 100.00 1000.000
1:ALA_31:C         1:ARG_32:N         1:ARG_32:CA        1:ARG_32:C         -165.000 -75.000 100.00 100.00 1000.000
1:ARG_32:N         1:ARG_32:CA        1:ARG_32:C         1:HISD_33:N        -95.000  5.000 100.00 100.00 1000.000
1:ARG_32:C         1:HISD_33:N        1:HISD_33:CA       1:HISD_33:C        -105.000 95.000 100.00 100.00 1000.000
1:ARG_32:CA        1:ARG_32:C         1:HISD_33:N        1:HISD_33:CA       170.000 -170.000 100.00 100.00 1000.000
1:HISD_33:N        1:HISD_33:CA       1:HISD_33:C        1:GLY_34:N         135.000 -45.000 100.00 100.00 1000.000
1:HISD_33:CA       1:HISD_33:C        1:GLY_34:N         1:GLY_34:CA        170.000 -170.000 100.00 100.00 1000.000
1:GLY_34:CA        1:GLY_34:C         1:SER_35:N         1:SER_35:CA        170.000 -170.000 100.00 100.00 1000.000
1:GLY_34:C         1:SER_35:N         1:SER_35:CA        1:SER_35:C         35.000 -55.000 100.00 100.00 1000.000
1:SER_35:CA        1:SER_35:C         1:CYS_36:N         1:CYS_36:CA        170.000 -170.000 100.00 100.00 1000.000
1:SER_35:N         1:SER_35:CA        1:SER_35:C         1:CYS_36:N         -105.000 -135.000 100.00 100.00 1000.000
1:SER_35:C         1:CYS_36:N         1:CYS_36:CA        1:CYS_36:C         -165.000 -75.000 100.00 100.00 1000.000
1:CYS_36:N         1:CYS_36:CA        1:CYS_36:C         1:ASN_37:N         45.000 -165.000 100.00 100.00 1000.000
1:CYS_36:CA        1:CYS_36:C         1:ASN_37:N         1:ASN_37:CA        170.000 -170.000 100.00 100.00 1000.000
1:CYS_36:N         1:CYS_36:CA        1:CYS_36:CB        1:CYS_36:SG        165.000 -45.000 100.00 100.00 1000.000
1:ASN_37:CA        1:ASN_37:C         1:TYR_38:N         1:TYR_38:CA        170.000 -170.000 100.00 100.00 1000.000
1:ASN_37:C         1:TYR_38:N         1:TYR_38:CA        1:TYR_38:C         -125.000 -45.000 100.00 100.00 1000.000
1:TYR_38:N         1:TYR_38:CA        1:TYR_38:C         1:VAL_39:N         -115.000 -125.000 100.00 100.00 1000.000
1:TYR_38:N         1:TYR_38:CA        1:TYR_38:CB        1:TYR_38:CG        115.000 -125.000 100.00 100.00 1000.000
1:TYR_38:CA        1:TYR_38:C         1:VAL_39:N         1:VAL_39:CA        170.000 -170.000 100.00 100.00 1000.000
1:TYR_38:C         1:VAL_39:N         1:VAL_39:CA        1:VAL_39:C         35.000 -65.000 100.00 100.00 1000.000
1:VAL_39:N         1:VAL_39:CA        1:VAL_39:C         1:PHE_40:N         -105.000 -135.000 100.00 100.00 1000.000
1:VAL_39:CA        1:VAL_39:C         1:PHE_40:N         1:PHE_40:CA        170.000 -170.000 100.00 100.00 1000.000
1:VAL_39:C         1:PHE_40:N         1:PHE_40:CA        1:PHE_40:C         -90.000 -30.000 100.00 100.00 1000.000
1:PHE_40:N         1:PHE_40:CA        1:PHE_40:C         1:PRO_41:N         75.000 15.000 100.00 100.00 1000.000
1:PHE_40:CA        1:PHE_40:C         1:PRO_41:N         1:PRO_41:CA        -10.000 10.000 100.00 100.00 1000.000
1:PRO_41:CA        1:PRO_41:C         1:ALA_42:N         1:ALA_42:CA        170.000 -170.000 100.00 100.00 1000.000
1:ALA_42:CA        1:ALA_42:C         1:HISD_43:N        1:HISD_43:CA       170.000 -170.000 100.00 100.00 1000.000
1:ALA_42:C         1:HISD_43:N        1:HISD_43:CA       1:HISD_43:C        35.000 -65.000 100.00 100.00 1000.000
1:HISD_43:N        1:HISD_43:CA       1:HISD_43:C        1:LYS_44:N         115.000 -15.000 100.00 100.00 1000.000
1:HISD_43:CA       1:HISD_43:C        1:LYS_44:N         1:LYS_44:CA        170.000 -170.000 100.00 100.00 1000.000
1:HISD_43:C        1:LYS_44:N         1:LYS_44:CA        1:LYS_44:C         -155.000 -75.000 100.00 100.00 1000.000
1:LYS_44:N         1:LYS_44:CA        1:LYS_44:C         1:CYS_45:N         115.000 -45.000 100.00 100.00 1000.000
1:LYS_44:CA        1:LYS_44:C         1:CYS_45:N         1:CYS_45:CA        170.000 -170.000 100.00 100.00 1000.000
1:LYS_44:C         1:CYS_45:N         1:CYS_45:CA        1:CYS_45:C         35.000 -65.000 100.00 100.00 1000.000
1:CYS_45:CA        1:CYS_45:C         1:ILE_46:N         1:ILE_46:CA        170.000 -170.000 100.00 100.00 1000.000
1:CYS_45:N         1:CYS_45:CA        1:CYS_45:C         1:ILE_46:N         -115.000 -125.000 100.00 100.00 1000.000
1:CYS_45:C         1:ILE_46:N         1:ILE_46:CA        1:ILE_46:C         -160.000 -80.000 100.00 100.00 1000.000
1:ILE_46:CA        1:ILE_46:C         1:CYS_47:N         1:CYS_47:CA        170.000 -170.000 100.00 100.00 1000.000
1:ILE_46:N         1:ILE_46:CA        1:ILE_46:C         1:CYS_47:N         55.000 175.000 100.00 100.00 1000.000
1:ILE_46:N         1:ILE_46:CA        1:ILE_46:CB        1:ILE_46:CG1       -175.000 -35.000 100.00 100.00 1000.000
1:ILE_46:C         1:CYS_47:N         1:CYS_47:CA        1:CYS_47:C         -150.000 -90.000 100.00 100.00 1000.000
1:CYS_47:CA        1:CYS_47:C         1:TYR_48:N         1:TYR_48:CA        170.000 -170.000 100.00 100.00 1000.000
1:CYS_47:N         1:CYS_47:CA        1:CYS_47:C         1:TYR_48:N         -105.000 -135.000 100.00 100.00 1000.000
1:CYS_47:N         1:CYS_47:CA        1:CYS_47:CB        1:CYS_47:SG        160.000 -140.000 100.00 100.00 1000.000
1:CYS_47:C         1:TYR_48:N         1:TYR_48:CA        1:TYR_48:C         -155.000 -85.000 100.00 100.00 1000.000
1:TYR_48:CA        1:TYR_48:C         1:PHE_49:N         1:PHE_49:CA        170.000 -170.000 100.00 100.00 1000.000
1:TYR_48:N         1:TYR_48:CA        1:TYR_48:C         1:PHE_49:N         65.000 165.000 100.00 100.00 1000.000
1:TYR_48:C         1:PHE_49:N         1:PHE_49:CA        1:PHE_49:C         -155.000 -85.000 100.00 100.00 1000.000
1:PHE_49:N         1:PHE_49:CA        1:PHE_49:C         1:PRO_50:N         -105.000 -135.000 100.00 100.00 1000.000
1:PHE_49:CA        1:PHE_49:C         1:PRO_50:N         1:PRO_50:CA        170.000 -170.000 100.00 100.00 1000.000
1:PRO_50:CA        1:PRO_50:C         1:CYS_51:N         1:CYS_51:CA        170.000 -170.000 100.00 100.00 1000.000

  Entry H atom name         Submitted Coord H atom name
  Start of MODEL    1
    1    HA   PCA   1           HA       PYR   1   2.853   1.583   6.018
    2   1HB   PCA   1          1HB       PYR   1   0.771  -0.259   5.773
    3   2HB   PCA   1          2HB       PYR   1   1.089   0.731   7.212
    4   1HG   PCA   1          1HG       PYR   1  -1.009   1.231   5.116
    5   2HG   PCA   1          2HG       PYR   1  -1.034   1.579   6.872
    6    HN   PCA   1           HN       PYR   1   1.931   3.766   5.199
    7    H    LYS   2           H        LYS   2   0.403   0.343   3.799
    8    HA   LYS   2           HA       LYS   2   2.367  -0.111   1.685
    9   1HB   LYS   2          1HB       LYS   2   0.668  -1.771   2.206
   10   2HB   LYS   2          2HB       LYS   2  -0.626  -0.606   1.922
   11   1HG   LYS   2          1HG       LYS   2  -0.376  -2.233   0.114
   12   2HG   LYS   2          2HG       LYS   2  -0.193  -0.572  -0.441
   13   1HD   LYS   2          1HD       LYS   2   2.256  -0.833  -0.589
   14   2HD   LYS   2          2HD       LYS   2   2.152  -2.416   0.196
   15   1HE   LYS   2          1HE       LYS   2   2.464  -2.713  -2.204
   16   2HE   LYS   2          2HE       LYS   2   0.881  -3.328  -1.713
   17   1HZ   LYS   2          1HZ       LYS   2  -0.089  -1.258  -2.555
   18   2HZ   LYS   2          2HZ       LYS   2   1.380  -0.731  -3.029
   19   3HZ   LYS   2          3HZ       LYS   2   0.721  -2.061  -3.727
   20    H    LEU   3           H        LEU   3   2.837   2.295   1.756
   21    HA   LEU   3           HA       LEU   3   0.867   3.942   0.304
   22   1HB   LEU   3          1HB       LEU   3   3.513   4.671   1.483
   23   2HB   LEU   3          2HB       LEU   3   2.401   5.810   0.745
   24    HG   LEU   3           HG       LEU   3   1.354   4.114   3.011
   25   1HD1  LEU   3          2HD1      LEU   3   3.109   6.587   3.332
   26   2HD1  LEU   3          3HD1      LEU   3   2.165   5.831   4.632
   27   3HD1  LEU   3          1HD1      LEU   3   3.507   4.948   3.874
   28   1HD2  LEU   3          2HD2      LEU   3  -0.108   5.668   1.693
   29   2HD2  LEU   3          3HD2      LEU   3  -0.075   5.939   3.441
   30   3HD2  LEU   3          1HD2      LEU   3   0.811   7.023   2.362
   31    H    CYS   4           H        CYS   4   1.311   4.920  -1.627
   32    HA   CYS   4           HA       CYS   4   3.670   3.991  -3.228
   33   1HB   CYS   4          1HB       CYS   4   0.818   4.478  -4.134
   34   2HB   CYS   4          2HB       CYS   4   2.212   4.563  -5.224
   35    H    GLU   5           H        GLU   5   5.032   5.519  -3.597
   36    HA   GLU   5           HA       GLU   5   4.532   8.254  -2.708
   37   1HB   GLU   5          1HB       GLU   5   7.067   6.809  -3.642
   38   2HB   GLU   5          2HB       GLU   5   6.967   8.390  -2.862
   39   1HG   GLU   5          1HG       GLU   5   7.498   6.925  -1.096
   40   2HG   GLU   5          2HG       GLU   5   5.765   7.272  -0.943
   41    HE2  GLU   5           HE2      GLU   5   5.317   3.915  -0.486
   42    H    ARG   6           H        ARG   6   3.003   8.414  -4.561
   43    HA   ARG   6           HA       ARG   6   4.171   8.551  -7.266
   44   1HB   ARG   6          1HB       ARG   6   1.525   8.256  -6.216
   45   2HB   ARG   6          2HB       ARG   6   1.542   9.811  -7.017
   46   1HG   ARG   6          1HG       ARG   6   2.784   8.059  -8.869
   47   2HG   ARG   6          2HG       ARG   6   1.536   7.093  -8.099
   48   1HD   ARG   6          1HD       ARG   6   0.838   8.117 -10.214
   49   2HD   ARG   6          2HD       ARG   6  -0.194   8.599  -8.861
   50    HE   ARG   6           HE       ARG   6   1.617  10.631  -8.923
   51   1HH1  ARG   6          2HH2      ARG   6  -0.417   9.315 -11.509
   52   2HH1  ARG   6          1HH2      ARG   6  -0.628  10.863 -12.278
   53   1HH2  ARG   6          1HH1      ARG   6   1.227  12.602  -9.804
   54   2HH2  ARG   6          2HH1      ARG   6   0.480  12.850 -11.324
   55    HA   PRO   7           HA       PRO   7   4.882  13.058  -6.866
   56   1HB   PRO   7          1HB       PRO   7   4.652  13.853  -9.473
   57   2HB   PRO   7          2HB       PRO   7   6.110  13.036  -8.848
   58   1HG   PRO   7          1HG       PRO   7   3.813  11.798 -10.372
   59   2HG   PRO   7          2HG       PRO   7   5.562  11.559 -10.638
   60   1HD   PRO   7          1HD       PRO   7   4.034   9.805  -9.228
   61   2HD   PRO   7          2HD       PRO   7   5.726  10.107  -8.753
   62    H    SER   8           H        SER   8   3.158  14.502  -6.394
   63    HA   SER   8           HA       SER   8   0.740  13.475  -5.856
   64   1HB   SER   8          1HB       SER   8   1.286  16.350  -6.605
   65   2HB   SER   8          2HB       SER   8  -0.132  15.786  -5.695
   66    HG   SER   8           HG       SER   8   2.607  15.546  -4.935
   67    H    GLY   9           H        GLY   9  -1.323  13.335  -6.650
   68   1HA   GLY   9          1HA       GLY   9  -1.668  12.511  -9.345
   69   2HA   GLY   9          2HA       GLY   9  -2.942  12.892  -8.174
   70    H    THR  10           H        THR  10  -2.363  15.558  -7.600
   71    HA   THR  10           HA       THR  10  -3.246  16.949 -10.041
   72    HB   THR  10           HB       THR  10  -3.361  18.864  -8.406
   73    HG1  THR  10           HG1      THR  10  -2.799  18.575  -6.382
   74   1HG2  THR  10          3HG2      THR  10  -5.324  17.386  -8.752
   75   2HG2  THR  10          1HG2      THR  10  -4.739  16.286  -7.488
   76   3HG2  THR  10          2HG2      THR  10  -5.220  17.941  -7.070
   77    H    TRP  11           H        TRP  11  -0.854  17.798  -7.587
   78    HA   TRP  11           HA       TRP  11   0.741  19.322  -9.441
   79   1HB   TRP  11          1HB       TRP  11   0.307  19.854  -7.080
   80   2HB   TRP  11          2HB       TRP  11   1.362  18.545  -6.567
   81    HD1  TRP  11           HD1      TRP  11   3.388  19.848  -9.186
   82    HE1  TRP  11           HE1      TRP  11   4.956  21.747  -8.407
   83    HE3  TRP  11           HE3      TRP  11   1.141  21.040  -4.752
   84    HZ2  TRP  11           HZ2      TRP  11   5.108  23.614  -6.251
   85    HZ3  TRP  11           HZ3      TRP  11   2.026  22.859  -3.346
   86    HH2  TRP  11           HH2      TRP  11   4.065  24.096  -4.037
   87    H    SER  12           H        SER  12   0.956  17.376 -10.913
   88    HA   SER  12           HA       SER  12   2.972  15.372 -10.175
   89   1HB   SER  12          1HB       SER  12   1.593  16.034 -12.820
   90   2HB   SER  12          2HB       SER  12   2.612  14.619 -12.529
   91    HG   SER  12           HG       SER  12   0.541  15.007 -10.712
   92    H    GLY  13           H        GLY  13   4.446  17.459  -9.659
   93   1HA   GLY  13          1HA       GLY  13   6.437  17.633 -11.754
   94   2HA   GLY  13          2HA       GLY  13   5.412  19.077 -11.716
   95    H    VAL  14           H        VAL  14   7.499  20.066 -11.362
   96    HA   VAL  14           HA       VAL  14   9.130  19.668  -9.097
   97    HB   VAL  14           HB       VAL  14   8.786  22.147 -10.821
   98   1HG1  VAL  14          1HG1      VAL  14  11.053  21.338  -8.950
   99   2HG1  VAL  14          2HG1      VAL  14  11.100  22.690 -10.097
  100   3HG1  VAL  14          3HG1      VAL  14   9.962  22.728  -8.750
  101   1HG2  VAL  14          1HG2      VAL  14  10.744  19.805 -11.012
  102   2HG2  VAL  14          2HG2      VAL  14   9.444  20.162 -12.169
  103   3HG2  VAL  14          3HG2      VAL  14  10.805  21.275 -12.005
  104    H    CYS  15           H        CYS  15   9.159  20.609  -7.118
  105    HA   CYS  15           HA       CYS  15   6.567  21.739  -6.204
  106   1HB   CYS  15          1HB       CYS  15   7.315  20.894  -3.968
  107   2HB   CYS  15          2HB       CYS  15   7.032  19.698  -5.225
  108    H    GLY  16           H        GLY  16  10.059  22.096  -5.444
  109   1HA   GLY  16          1HA       GLY  16  11.194  23.710  -4.296
  110   2HA   GLY  16          2HA       GLY  16  10.166  24.868  -5.148
  111    H    ASN  17           H        ASN  17   8.447  22.683  -2.978
  112    HA   ASN  17           HA       ASN  17   8.797  24.214  -0.595
  113   1HB   ASN  17          1HB       ASN  17   7.491  25.920  -1.943
  114   2HB   ASN  17          2HB       ASN  17   6.143  24.785  -1.956
  115   1HD2  ASN  17          2HD2      ASN  17   7.151  26.877   1.446
  116   2HD2  ASN  17          1HD2      ASN  17   8.143  26.938   0.001
  117    H    ASN  18           H        ASN  18   8.723  22.513   0.750
  118    HA   ASN  18           HA       ASN  18   7.331  20.150   0.411
  119   1HB   ASN  18          1HB       ASN  18   9.384  20.918   1.875
  120   2HB   ASN  18          2HB       ASN  18   8.185  21.261   3.121
  121   1HD2  ASN  18          1HD2      ASN  18   7.352  17.750   3.421
  122   2HD2  ASN  18          2HD2      ASN  18   6.753  19.362   3.802
  123    H    ASN  19           H        ASN  19   6.614  22.830   2.560
  124    HA   ASN  19           HA       ASN  19   4.409  21.782   3.899
  125   1HB   ASN  19          1HB       ASN  19   5.504  23.820   4.656
  126   2HB   ASN  19          2HB       ASN  19   4.971  24.688   3.205
  127   1HD2  ASN  19          2HD2      ASN  19   2.120  25.755   5.022
  128   2HD2  ASN  19          1HD2      ASN  19   3.516  26.209   4.069
  129    H    ALA  20           H        ALA  20   4.396  23.884   1.016
  130    HA   ALA  20           HA       ALA  20   1.598  23.872   0.525
  131   1HB   ALA  20          2HB       ALA  20   3.154  25.488  -0.529
  132   2HB   ALA  20          3HB       ALA  20   3.875  24.160  -1.476
  133   3HB   ALA  20          1HB       ALA  20   2.178  24.610  -1.723
  134    H    CYS  21           H        CYS  21   4.293  21.903  -0.925
  135    HA   CYS  21           HA       CYS  21   2.785  20.344  -2.631
  136   1HB   CYS  21          1HB       CYS  21   5.150  20.111  -2.669
  137   2HB   CYS  21          2HB       CYS  21   5.221  19.628  -0.966
  138    H    LYS  22           H        LYS  22   3.597  19.488   0.742
  139    HA   LYS  22           HA       LYS  22   1.996  17.235   1.166
  140   1HB   LYS  22          1HB       LYS  22   3.563  18.068   2.843
  141   2HB   LYS  22          2HB       LYS  22   2.763  19.604   2.898
  142   1HG   LYS  22          1HG       LYS  22   0.715  18.478   3.926
  143   2HG   LYS  22          2HG       LYS  22   1.607  16.964   3.876
  144   1HD   LYS  22          1HD       LYS  22   1.587  18.099   6.098
  145   2HD   LYS  22          2HD       LYS  22   3.197  17.741   5.485
  146   1HE   LYS  22          1HE       LYS  22   2.894  20.000   6.611
  147   2HE   LYS  22          2HE       LYS  22   3.706  19.995   5.050
  148   1HZ   LYS  22          2HZ       LYS  22   0.835  20.625   5.349
  149   2HZ   LYS  22          3HZ       LYS  22   2.026  21.758   5.386
  150   3HZ   LYS  22          1HZ       LYS  22   1.797  20.913   4.026
  151    H    ASN  23           H        ASN  23   1.105  20.663   1.812
  152    HA   ASN  23           HA       ASN  23  -1.524  20.134   2.752
  153   1HB   ASN  23          1HB       ASN  23  -0.473  22.259   3.222
  154   2HB   ASN  23          2HB       ASN  23  -0.229  22.591   1.506
  155   1HD2  ASN  23          2HD2      ASN  23  -3.002  24.764   2.045
  156   2HD2  ASN  23          1HD2      ASN  23  -1.253  24.690   2.051
  157    H    GLN  24           H        GLN  24  -0.624  21.560  -0.386
  158    HA   GLN  24           HA       GLN  24  -3.065  21.387  -1.729
  159   1HB   GLN  24          1HB       GLN  24  -0.990  22.588  -2.390
  160   2HB   GLN  24          2HB       GLN  24  -0.197  21.066  -2.754
  161   1HG   GLN  24          1HG       GLN  24  -2.682  22.198  -4.139
  162   2HG   GLN  24          2HG       GLN  24  -1.032  22.345  -4.744
  163   1HE2  GLN  24          2HE2      GLN  24  -0.986  18.566  -5.191
  164   2HE2  GLN  24          1HE2      GLN  24  -0.148  19.628  -4.080
  165    H    CYS  25           H        CYS  25  -0.524  18.765  -1.527
  166    HA   CYS  25           HA       CYS  25  -1.952  17.027  -3.214
  167   1HB   CYS  25          1HB       CYS  25   0.313  16.459  -2.475
  168   2HB   CYS  25          2HB       CYS  25  -0.252  16.194  -0.828
  169    H    ILE  26           H        ILE  26  -2.058  17.094   0.416
  170    HA   ILE  26           HA       ILE  26  -4.144  15.041   0.313
  171    HB   ILE  26           HB       ILE  26  -3.938  14.858   2.618
  172   1HG1  ILE  26          1HG1      ILE  26  -2.561  17.568   2.655
  173   2HG1  ILE  26          2HG1      ILE  26  -4.133  17.137   3.365
  174   1HG2  ILE  26          2HG2      ILE  26  -2.001  14.157   1.149
  175   2HG2  ILE  26          3HG2      ILE  26  -1.149  15.631   1.639
  176   3HG2  ILE  26          1HG2      ILE  26  -1.586  14.428   2.837
  177   1HD1  ILE  26          3HD1      ILE  26  -2.954  15.531   4.887
  178   2HD1  ILE  26          1HD1      ILE  26  -1.404  16.177   4.292
  179   3HD1  ILE  26          2HD1      ILE  26  -2.537  17.238   5.140
  180    H    ASN  27           H        ASN  27  -4.112  18.446   0.224
  181    HA   ASN  27           HA       ASN  27  -6.727  18.929   1.399
  182   1HB   ASN  27          1HB       ASN  27  -4.861  20.481   1.423
  183   2HB   ASN  27          2HB       ASN  27  -4.922  20.657  -0.349
  184   1HD2  ASN  27          2HD2      ASN  27  -6.704  23.433   1.545
  185   2HD2  ASN  27          1HD2      ASN  27  -5.126  22.660   1.759
  186    H    LEU  28           H        LEU  28  -5.340  18.893  -1.968
  187    HA   LEU  28           HA       LEU  28  -8.025  18.859  -3.130
  188   1HB   LEU  28          1HB       LEU  28  -5.212  18.782  -4.252
  189   2HB   LEU  28          2HB       LEU  28  -6.611  18.305  -5.215
  190    HG   LEU  28           HG       LEU  28  -7.703  20.529  -4.601
  191   1HD1  LEU  28          1HD1      LEU  28  -4.848  21.161  -3.736
  192   2HD1  LEU  28          2HD1      LEU  28  -6.111  22.371  -4.035
  193   3HD1  LEU  28          3HD1      LEU  28  -6.299  21.220  -2.711
  194   1HD2  LEU  28          1HD2      LEU  28  -5.174  20.548  -6.281
  195   2HD2  LEU  28          2HD2      LEU  28  -6.796  20.068  -6.815
  196   3HD2  LEU  28          3HD2      LEU  28  -6.480  21.746  -6.346
  197    H    GLU  29           H        GLU  29  -5.325  16.364  -3.340
  198    HA   GLU  29           HA       GLU  29  -7.526  14.374  -3.708
  199   1HB   GLU  29          1HB       GLU  29  -5.836  12.777  -4.295
  200   2HB   GLU  29          2HB       GLU  29  -5.859  14.157  -5.373
  201   1HG   GLU  29          1HG       GLU  29  -3.802  14.039  -3.152
  202   2HG   GLU  29          2HG       GLU  29  -3.616  13.055  -4.606
  203    HE1  GLU  29           HE2      GLU  29  -3.559  16.950  -5.472
  204    H    LYS  30           H        LYS  30  -6.678  12.154  -2.378
  205    HA   LYS  30           HA       LYS  30  -6.787  13.175   0.428
  206   1HB   LYS  30          1HB       LYS  30  -8.342  10.954  -0.901
  207   2HB   LYS  30          2HB       LYS  30  -8.370  11.274   0.841
  208   1HG   LYS  30          1HG       LYS  30  -9.086  13.383  -1.251
  209   2HG   LYS  30          2HG       LYS  30 -10.259  12.329  -0.488
  210   1HD   LYS  30          1HD       LYS  30 -10.223  13.373   1.507
  211   2HD   LYS  30          2HD       LYS  30  -8.522  13.762   1.490
  212   1HE   LYS  30          1HE       LYS  30 -10.655  15.258  -0.109
  213   2HE   LYS  30          2HE       LYS  30  -9.982  15.747   1.452
  214   1HZ   LYS  30          3HZ       LYS  30  -7.745  15.798   0.290
  215   2HZ   LYS  30          1HZ       LYS  30  -8.555  15.698  -1.127
  216   3HZ   LYS  30          2HZ       LYS  30  -8.828  16.946  -0.144
  217    H    ALA  31           H        ALA  31  -4.472  12.088  -1.143
  218    HA   ALA  31           HA       ALA  31  -3.268   9.862   0.014
  219   1HB   ALA  31          3HB       ALA  31  -2.371  11.413  -1.762
  220   2HB   ALA  31          1HB       ALA  31  -2.156  12.635  -0.509
  221   3HB   ALA  31          2HB       ALA  31  -1.193  11.144  -0.444
  222    H    ARG  32           H        ARG  32  -1.428   9.929   1.711
  223    HA   ARG  32           HA       ARG  32  -2.638  11.054   4.183
  224   1HB   ARG  32          1HB       ARG  32  -0.356   9.077   3.775
  225   2HB   ARG  32          2HB       ARG  32  -0.997   9.557   5.348
  226   1HG   ARG  32          1HG       ARG  32  -2.672   8.182   3.211
  227   2HG   ARG  32          2HG       ARG  32  -1.709   7.312   4.387
  228   1HD   ARG  32          1HD       ARG  32  -3.992   7.359   5.195
  229   2HD   ARG  32          2HD       ARG  32  -2.917   8.240   6.268
  230    HE   ARG  32           HE       ARG  32  -4.169  10.105   5.972
  231   1HH1  ARG  32          1HH2      ARG  32  -4.843   7.984   3.223
  232   2HH1  ARG  32          2HH2      ARG  32  -5.647   9.250   2.299
  233   1HH2  ARG  32          2HH1      ARG  32  -5.316  11.737   4.728
  234   2HH2  ARG  32          1HH1      ARG  32  -5.819  11.313   3.113
  235    H    HIS  33           H        HIS  33   0.792  10.847   3.175
  236    HA   HIS  33           HA       HIS  33   1.054  13.662   4.099
  237   1HB   HIS  33          2HB       HIS  33   3.486  13.160   4.509
  238   2HB   HIS  33          1HB       HIS  33   2.315  12.586   5.689
  239    HD1  HIS  33           HD1      HIS  33   1.701   9.971   5.622
  240    HD2  HIS  33           HD2      HIS  33   5.241  11.168   3.733
  241    HE1  HIS  33           HE1      HIS  33   3.179   7.919   5.423
  242    H    GLY  34           H        GLY  34   2.824  14.809   2.947
  243   1HA   GLY  34          1HA       GLY  34   3.691  13.796   0.428
  244   2HA   GLY  34          2HA       GLY  34   2.608  15.201   0.254
  245    H    SER  35           H        SER  35   5.362  15.294  -0.491
  246    HA   SER  35           HA       SER  35   6.408  17.448   1.108
  247   1HB   SER  35          1HB       SER  35   7.529  14.639   1.504
  248   2HB   SER  35          2HB       SER  35   8.602  16.032   1.607
  249    HG   SER  35           HG       SER  35   6.211  15.776   3.109
  250    H    CYS  36           H        CYS  36   8.424  18.212   0.261
  251    HA   CYS  36           HA       CYS  36   8.372  18.030  -2.670
  252   1HB   CYS  36          1HB       CYS  36   8.195  20.189  -1.620
  253   2HB   CYS  36          2HB       CYS  36   9.693  19.945  -0.694
  254    H    ASN  37           H        ASN  37   9.190  15.756  -2.162
  255    HA   ASN  37           HA       ASN  37  11.785  15.309  -1.101
  256   1HB   ASN  37          1HB       ASN  37  10.175  13.497  -1.257
  257   2HB   ASN  37          2HB       ASN  37  10.113  13.679  -3.020
  258   1HD2  ASN  37          2HD2      ASN  37  12.737  11.372  -3.470
  259   2HD2  ASN  37          1HD2      ASN  37  11.225  12.040  -4.050
  260    H    TYR  38           H        TYR  38  13.723  14.667  -2.114
  261    HA   TYR  38           HA       TYR  38  14.301  16.155  -4.562
  262   1HB   TYR  38          1HB       TYR  38  15.769  16.504  -2.636
  263   2HB   TYR  38          2HB       TYR  38  16.213  14.805  -2.642
  264    HD1  TYR  38           HD1      TYR  38  15.897  17.505  -5.305
  265    HD2  TYR  38           HD2      TYR  38  18.462  14.569  -3.459
  266    HE1  TYR  38           HE1      TYR  38  17.393  17.583  -7.249
  267    HE2  TYR  38           HE2      TYR  38  19.883  14.559  -5.492
  268    HH   TYR  38           HH       TYR  38  18.947  16.382  -8.431
  269    H    VAL  39           H        VAL  39  16.489  13.679  -4.379
  270    HA   VAL  39           HA       VAL  39  17.077  12.039  -5.745
  271    HB   VAL  39           HB       VAL  39  14.103  11.578  -6.302
  272   1HG1  VAL  39          1HG1      VAL  39  16.537   9.862  -6.905
  273   2HG1  VAL  39          2HG1      VAL  39  14.853   9.309  -6.965
  274   3HG1  VAL  39          3HG1      VAL  39  15.396  10.559  -8.081
  275   1HG2  VAL  39          2HG2      VAL  39  14.765  11.299  -3.892
  276   2HG2  VAL  39          3HG2      VAL  39  14.337   9.766  -4.663
  277   3HG2  VAL  39          1HG2      VAL  39  16.042  10.182  -4.403
  278    H    PHE  40           H        PHE  40  17.508  11.723  -8.055
  279    HA   PHE  40           HA       PHE  40  17.826  14.102  -9.438
  280   1HB   PHE  40          1HB       PHE  40  19.135  12.187  -9.946
  281   2HB   PHE  40          2HB       PHE  40  17.719  11.214 -10.356
  282    HD1  PHE  40           HD1      PHE  40  16.528  11.532 -12.523
  283    HD2  PHE  40           HD2      PHE  40  20.247  13.534 -11.608
  284    HE1  PHE  40           HE1      PHE  40  16.831  12.080 -14.917
  285    HE2  PHE  40           HE2      PHE  40  20.544  14.060 -14.008
  286    HZ   PHE  40           HZ       PHE  40  18.834  13.348 -15.665
  287    HA   PRO  41           HA       PRO  41  17.868  15.062 -11.390
  288   1HB   PRO  41          1HB       PRO  41  16.880  17.044 -12.961
  289   2HB   PRO  41          2HB       PRO  41  17.123  15.377 -13.545
  290   1HG   PRO  41          1HG       PRO  41  14.532  16.680 -12.721
  291   2HG   PRO  41          2HG       PRO  41  14.847  15.573 -14.075
  292   1HD   PRO  41          1HD       PRO  41  13.801  14.776 -11.596
  293   2HD   PRO  41          2HD       PRO  41  14.668  13.697 -12.719
  294    H    ALA  42           H        ALA  42  14.788  16.767 -10.738
  295    HA   ALA  42           HA       ALA  42  16.116  18.596  -8.786
  296   1HB   ALA  42          3HB       ALA  42  15.342  19.718 -10.851
  297   2HB   ALA  42          1HB       ALA  42  13.705  19.079 -10.580
  298   3HB   ALA  42          2HB       ALA  42  14.413  20.235  -9.434
  299    H    HIS  43           H        HIS  43  14.263  19.502  -7.272
  300    HA   HIS  43           HA       HIS  43  13.047  17.301  -5.875
  301   1HB   HIS  43          2HB       HIS  43  12.608  20.318  -5.690
  302   2HB   HIS  43          1HB       HIS  43  11.863  19.119  -4.629
  303    HD1  HIS  43           HD1      HIS  43  12.942  18.518  -2.540
  304    HD2  HIS  43           HD2      HIS  43  15.582  20.341  -5.250
  305    HE1  HIS  43           HE1      HIS  43  15.152  18.869  -1.334
  306    H    LYS  44           H        LYS  44  10.796  16.762  -5.706
  307    HA   LYS  44           HA       LYS  44   8.926  18.062  -7.538
  308   1HB   LYS  44          1HB       LYS  44   8.239  16.124  -8.678
  309   2HB   LYS  44          2HB       LYS  44   9.967  16.321  -8.950
  310   1HG   LYS  44          1HG       LYS  44   8.735  14.401  -6.915
  311   2HG   LYS  44          2HG       LYS  44   9.070  13.945  -8.573
  312   1HD   LYS  44          1HD       LYS  44  11.261  14.921  -6.688
  313   2HD   LYS  44          2HD       LYS  44  10.787  13.241  -6.845
  314   1HE   LYS  44          1HE       LYS  44  11.420  13.112  -9.135
  315   2HE   LYS  44          2HE       LYS  44  11.623  14.866  -9.291
  316   1HZ   LYS  44          3HZ       LYS  44  13.262  13.443  -7.344
  317   2HZ   LYS  44          1HZ       LYS  44  13.690  13.432  -8.942
  318   3HZ   LYS  44          2HZ       LYS  44  13.559  14.828  -8.106
  319    H    CYS  45           H        CYS  45   6.707  17.593  -7.077
  320    HA   CYS  45           HA       CYS  45   6.440  17.429  -4.206
  321   1HB   CYS  45          1HB       CYS  45   5.058  19.027  -5.490
  322   2HB   CYS  45          2HB       CYS  45   4.310  17.694  -6.354
  323    H    ILE  46           H        ILE  46   7.101  15.263  -3.690
  324    HA   ILE  46           HA       ILE  46   5.593  12.986  -4.799
  325    HB   ILE  46           HB       ILE  46   7.685  13.204  -2.616
  326   1HG1  ILE  46          1HG1      ILE  46   8.647  13.509  -4.811
  327   2HG1  ILE  46          2HG1      ILE  46   9.104  11.930  -4.167
  328   1HG2  ILE  46          3HG2      ILE  46   6.228  10.721  -3.598
  329   2HG2  ILE  46          1HG2      ILE  46   7.753  10.690  -2.687
  330   3HG2  ILE  46          2HG2      ILE  46   6.305  11.356  -1.948
  331   1HD1  ILE  46          2HD1      ILE  46   7.327  10.873  -5.613
  332   2HD1  ILE  46          3HD1      ILE  46   7.082  12.466  -6.367
  333   3HD1  ILE  46          1HD1      ILE  46   8.645  11.660  -6.490
  334    H    CYS  47           H        CYS  47   3.987  11.840  -3.837
  335    HA   CYS  47           HA       CYS  47   3.102  12.647  -1.162
  336   1HB   CYS  47          1HB       CYS  47   2.034  14.126  -2.848
  337   2HB   CYS  47          2HB       CYS  47   1.277  12.706  -3.554
  338    H    TYR  48           H        TYR  48   1.998  11.145  -0.041
  339    HA   TYR  48           HA       TYR  48   2.587   8.388  -0.966
  340   1HB   TYR  48          1HB       TYR  48   2.222   9.654   1.772
  341   2HB   TYR  48          2HB       TYR  48   2.559   7.960   1.464
  342    HD1  TYR  48           HD1      TYR  48   4.026  11.377   0.756
  343    HD2  TYR  48           HD2      TYR  48   4.757   7.209   1.606
  344    HE1  TYR  48           HE1      TYR  48   6.439  11.808   0.754
  345    HE2  TYR  48           HE2      TYR  48   7.183   7.671   1.690
  346    HH   TYR  48           HH       TYR  48   8.547  10.911   1.062
  347    H    PHE  49           H        PHE  49   0.716   7.660  -2.066
  348    HA   PHE  49           HA       PHE  49  -1.879   8.071  -0.725
  349   1HB   PHE  49          1HB       PHE  49  -1.781   6.392  -3.136
  350   2HB   PHE  49          2HB       PHE  49  -2.936   7.576  -2.615
  351    HD1  PHE  49           HD2      PHE  49  -0.796   9.960  -2.431
  352    HD2  PHE  49           HD1      PHE  49  -2.040   7.109  -5.421
  353    HE1  PHE  49           HE2      PHE  49  -0.458  11.641  -4.192
  354    HE2  PHE  49           HE1      PHE  49  -1.647   8.795  -7.172
  355    HZ   PHE  49           HZ       PHE  49  -0.633  11.002  -6.576
  356    HA   PRO  50           HA       PRO  50  -1.474   3.902   1.033
  357   1HB   PRO  50          1HB       PRO  50  -3.970   3.490   1.951
  358   2HB   PRO  50          2HB       PRO  50  -2.895   4.746   2.633
  359   1HG   PRO  50          1HG       PRO  50  -5.049   5.130   0.519
  360   2HG   PRO  50          2HG       PRO  50  -4.857   6.045   2.040
  361   1HD   PRO  50          1HD       PRO  50  -3.814   6.950  -0.347
  362   2HD   PRO  50          2HD       PRO  50  -2.909   7.164   1.199
  363    H    CYS  51           H        CYS  51  -1.035   3.296  -1.186
  364    HA   CYS  51           HA       CYS  51  -3.095   2.334  -2.975
  365   1HB   CYS  51          1HB       CYS  51  -1.209   1.766  -4.421
  366   2HB   CYS  51          2HB       CYS  51  -0.996   3.322  -3.672
   
  No H/Q in entry =         366
  Start of MODEL    2
    1    HA   PCA   1           HA       PYR   1   4.406   2.733   5.666
    2   1HB   PCA   1          1HB       PYR   1   4.331  -0.270   5.934
    3   2HB   PCA   1          2HB       PYR   1   5.580   0.871   6.506
    4   1HG   PCA   1          1HG       PYR   1   3.603  -0.255   8.149
    5   2HG   PCA   1          2HG       PYR   1   4.331   1.351   8.464
    6    HN   PCA   1           HN       PYR   1   1.788   2.552   5.826
    7    H    LYS   2           H        LYS   2   2.191   0.131   4.602
    8    HA   LYS   2           HA       LYS   2   3.315   0.072   1.905
    9   1HB   LYS   2          1HB       LYS   2   2.304  -1.873   3.179
   10   2HB   LYS   2          2HB       LYS   2   0.709  -1.226   2.826
   11   1HG   LYS   2          1HG       LYS   2   2.844  -1.853   0.721
   12   2HG   LYS   2          2HG       LYS   2   1.724  -3.063   1.314
   13   1HD   LYS   2          1HD       LYS   2   0.914  -0.562  -0.258
   14   2HD   LYS   2          2HD       LYS   2   1.099  -2.195  -0.861
   15   1HE   LYS   2          1HE       LYS   2  -1.112  -2.400  -0.517
   16   2HE   LYS   2          2HE       LYS   2  -0.635  -2.757   1.146
   17   1HZ   LYS   2          1HZ       LYS   2  -0.927  -0.262   1.484
   18   2HZ   LYS   2          2HZ       LYS   2  -1.646  -0.208   0.034
   19   3HZ   LYS   2          3HZ       LYS   2  -2.311  -1.118   1.210
   20    H    LEU   3           H        LEU   3   3.071   2.488   1.770
   21    HA   LEU   3           HA       LEU   3   0.404   3.172   0.584
   22   1HB   LEU   3          1HB       LEU   3   2.596   5.050   1.459
   23   2HB   LEU   3          2HB       LEU   3   1.060   5.514   0.764
   24    HG   LEU   3           HG       LEU   3   0.310   3.904   2.945
   25   1HD1  LEU   3          3HD1      LEU   3   2.649   4.004   3.773
   26   2HD1  LEU   3          1HD1      LEU   3   2.604   5.766   3.723
   27   3HD1  LEU   3          2HD1      LEU   3   1.561   4.884   4.861
   28   1HD2  LEU   3          1HD2      LEU   3  -0.812   5.980   2.185
   29   2HD2  LEU   3          2HD2      LEU   3  -0.513   5.985   3.931
   30   3HD2  LEU   3          3HD2      LEU   3   0.514   6.943   2.854
   31    H    CYS   4           H        CYS   4   0.486   4.111  -1.521
   32    HA   CYS   4           HA       CYS   4   2.994   3.471  -3.047
   33   1HB   CYS   4          1HB       CYS   4   0.245   4.143  -4.096
   34   2HB   CYS   4          2HB       CYS   4   1.704   3.992  -5.068
   35    H    GLU   5           H        GLU   5   4.372   5.027  -3.382
   36    HA   GLU   5           HA       GLU   5   3.861   7.854  -2.809
   37   1HB   GLU   5          1HB       GLU   5   6.253   6.254  -3.838
   38   2HB   GLU   5          2HB       GLU   5   6.262   8.007  -3.636
   39   1HG   GLU   5          1HG       GLU   5   5.701   7.767  -1.261
   40   2HG   GLU   5          2HG       GLU   5   5.733   6.000  -1.396
   41    HE1  GLU   5           HE2      GLU   5   9.298   6.014  -1.921
   42    H    ARG   6           H        ARG   6   2.462   8.715  -4.355
   43    HA   ARG   6           HA       ARG   6   2.965   8.139  -7.220
   44   1HB   ARG   6          1HB       ARG   6   0.631   8.480  -5.923
   45   2HB   ARG   6          2HB       ARG   6   0.899  10.154  -6.486
   46   1HG   ARG   6          1HG       ARG   6   1.041   9.375  -8.785
   47   2HG   ARG   6          2HG       ARG   6   0.981   7.684  -8.225
   48   1HD   ARG   6          1HD       ARG   6  -1.175   7.990  -8.935
   49   2HD   ARG   6          2HD       ARG   6  -1.281   8.257  -7.184
   50    HE   ARG   6           HE       ARG   6  -0.845  10.634  -8.913
   51   1HH1  ARG   6          2HH2      ARG   6  -3.286   8.620  -7.315
   52   2HH1  ARG   6          1HH2      ARG   6  -4.516   9.848  -7.347
   53   1HH2  ARG   6          1HH1      ARG   6  -2.505  12.253  -8.974
   54   2HH2  ARG   6          2HH1      ARG   6  -3.856  12.064  -7.899
   55    HA   PRO   7           HA       PRO   7   5.420  12.008  -6.935
   56   1HB   PRO   7          1HB       PRO   7   6.573  11.945  -9.416
   57   2HB   PRO   7          2HB       PRO   7   7.151  10.963  -8.042
   58   1HG   PRO   7          1HG       PRO   7   5.458  10.063 -10.364
   59   2HG   PRO   7          2HG       PRO   7   6.781   9.206  -9.546
   60   1HD   PRO   7          1HD       PRO   7   4.085   8.772  -9.034
   61   2HD   PRO   7          2HD       PRO   7   5.391   8.446  -7.857
   62    H    SER   8           H        SER   8   3.796  11.080 -10.063
   63    HA   SER   8           HA       SER   8   2.730  13.736 -10.438
   64   1HB   SER   8          1HB       SER   8   1.761  11.120 -11.667
   65   2HB   SER   8          2HB       SER   8   1.613  12.761 -12.321
   66    HG   SER   8           HG       SER   8   3.979  12.753 -12.354
   67    H    GLY   9           H        GLY   9   1.915  13.980  -8.236
   68   1HA   GLY   9          1HA       GLY   9  -0.491  12.528  -7.407
   69   2HA   GLY   9          2HA       GLY   9   0.191  13.990  -6.677
   70    H    THR  10           H        THR  10  -0.564  15.964  -7.287
   71    HA   THR  10           HA       THR  10  -2.478  16.291  -9.565
   72    HB   THR  10           HB       THR  10  -2.825  18.495  -8.159
   73    HG1  THR  10           HG1      THR  10  -2.292  18.271  -6.024
   74   1HG2  THR  10          1HG2      THR  10  -3.781  15.794  -7.126
   75   2HG2  THR  10          2HG2      THR  10  -4.474  17.365  -6.667
   76   3HG2  THR  10          3HG2      THR  10  -4.576  16.801  -8.346
   77    H    TRP  11           H        TRP  11  -0.295  18.160  -7.601
   78    HA   TRP  11           HA       TRP  11   0.930  19.781  -9.592
   79   1HB   TRP  11          1HB       TRP  11   0.631  20.240  -7.192
   80   2HB   TRP  11          2HB       TRP  11   1.813  18.996  -6.789
   81    HD1  TRP  11           HD1      TRP  11   3.716  20.484  -9.362
   82    HE1  TRP  11           HE1      TRP  11   5.224  22.375  -8.477
   83    HE3  TRP  11           HE3      TRP  11   1.329  21.454  -4.960
   84    HZ2  TRP  11           HZ2      TRP  11   5.284  24.161  -6.232
   85    HZ3  TRP  11           HZ3      TRP  11   2.183  23.165  -3.413
   86    HH2  TRP  11           HH2      TRP  11   4.259  24.390  -3.958
   87    H    SER  12           H        SER  12   1.304  17.914 -11.073
   88    HA   SER  12           HA       SER  12   3.493  16.076 -10.487
   89   1HB   SER  12          1HB       SER  12   1.939  16.585 -13.067
   90   2HB   SER  12          2HB       SER  12   2.907  15.160 -12.670
   91    HG   SER  12           HG       SER  12   0.524  16.065 -11.361
   92    H    GLY  13           H        GLY  13   4.836  18.185 -10.066
   93   1HA   GLY  13          1HA       GLY  13   6.608  18.682 -12.339
   94   2HA   GLY  13          2HA       GLY  13   5.571  20.059 -11.910
   95    H    VAL  14           H        VAL  14   7.764  21.029 -11.499
   96    HA   VAL  14           HA       VAL  14   9.441  20.160  -9.392
   97    HB   VAL  14           HB       VAL  14   9.004  23.001 -10.375
   98   1HG1  VAL  14          2HG1      VAL  14  11.357  21.713  -8.924
   99   2HG1  VAL  14          3HG1      VAL  14  11.334  23.359  -9.588
  100   3HG1  VAL  14          1HG1      VAL  14  10.254  22.936  -8.257
  101   1HG2  VAL  14          2HG2      VAL  14  10.952  20.845 -11.329
  102   2HG2  VAL  14          3HG2      VAL  14   9.624  21.544 -12.279
  103   3HG2  VAL  14          1HG2      VAL  14  11.001  22.548 -11.824
  104    H    CYS  15           H        CYS  15   9.239  20.339  -7.248
  105    HA   CYS  15           HA       CYS  15   6.601  20.774  -6.217
  106   1HB   CYS  15          1HB       CYS  15   7.338  19.729  -4.310
  107   2HB   CYS  15          2HB       CYS  15   8.510  19.132  -5.487
  108    H    GLY  16           H        GLY  16   9.497  22.809  -6.154
  109   1HA   GLY  16          1HA       GLY  16   9.808  24.949  -5.376
  110   2HA   GLY  16          2HA       GLY  16   8.079  25.064  -5.042
  111    H    ASN  17           H        ASN  17   7.847  22.917  -3.113
  112    HA   ASN  17           HA       ASN  17   9.533  23.426  -0.843
  113   1HB   ASN  17          1HB       ASN  17   8.522  25.656  -0.894
  114   2HB   ASN  17          2HB       ASN  17   6.910  24.955  -1.085
  115   1HD2  ASN  17          2HD2      ASN  17   8.693  25.018   2.627
  116   2HD2  ASN  17          1HD2      ASN  17   9.638  25.356   1.189
  117    H    ASN  18           H        ASN  18   9.164  21.901   0.677
  118    HA   ASN  18           HA       ASN  18   7.637  19.646   0.303
  119   1HB   ASN  18          1HB       ASN  18   9.598  20.023   1.845
  120   2HB   ASN  18          2HB       ASN  18   8.548  20.876   2.955
  121   1HD2  ASN  18          2HD2      ASN  18   8.556  16.851   2.951
  122   2HD2  ASN  18          1HD2      ASN  18   9.586  17.709   1.831
  123    H    ASN  19           H        ASN  19   6.943  22.120   2.684
  124    HA   ASN  19           HA       ASN  19   4.497  21.077   3.583
  125   1HB   ASN  19          1HB       ASN  19   5.713  22.780   4.829
  126   2HB   ASN  19          2HB       ASN  19   5.381  23.987   3.576
  127   1HD2  ASN  19          2HD2      ASN  19   2.233  24.787   4.962
  128   2HD2  ASN  19          1HD2      ASN  19   3.563  25.260   3.922
  129    H    ALA  20           H        ALA  20   5.065  23.509   0.994
  130    HA   ALA  20           HA       ALA  20   2.329  23.963   0.360
  131   1HB   ALA  20          1HB       ALA  20   4.196  25.325  -0.549
  132   2HB   ALA  20          2HB       ALA  20   4.693  23.947  -1.565
  133   3HB   ALA  20          3HB       ALA  20   3.110  24.712  -1.811
  134    H    CYS  21           H        CYS  21   4.678  21.705  -1.202
  135    HA   CYS  21           HA       CYS  21   2.964  20.445  -2.962
  136   1HB   CYS  21          1HB       CYS  21   5.160  19.787  -3.233
  137   2HB   CYS  21          2HB       CYS  21   5.448  19.636  -1.501
  138    H    LYS  22           H        LYS  22   3.749  19.453   0.358
  139    HA   LYS  22           HA       LYS  22   2.118  17.229   0.754
  140   1HB   LYS  22          1HB       LYS  22   3.864  17.966   2.257
  141   2HB   LYS  22          2HB       LYS  22   3.049  19.475   2.590
  142   1HG   LYS  22          1HG       LYS  22   1.207  18.333   3.724
  143   2HG   LYS  22          2HG       LYS  22   1.992  16.777   3.527
  144   1HD   LYS  22          1HD       LYS  22   3.296  19.183   4.934
  145   2HD   LYS  22          2HD       LYS  22   2.188  18.101   5.758
  146   1HE   LYS  22          1HE       LYS  22   4.462  17.480   6.306
  147   2HE   LYS  22          2HE       LYS  22   3.642  16.177   5.433
  148   1HZ   LYS  22          2HZ       LYS  22   5.616  18.043   4.225
  149   2HZ   LYS  22          3HZ       LYS  22   5.869  16.462   4.587
  150   3HZ   LYS  22          1HZ       LYS  22   4.786  16.827   3.471
  151    H    ASN  23           H        ASN  23   1.365  20.590   1.753
  152    HA   ASN  23           HA       ASN  23  -1.253  20.132   2.636
  153   1HB   ASN  23          1HB       ASN  23   0.019  22.166   3.110
  154   2HB   ASN  23          2HB       ASN  23   0.000  22.642   1.412
  155   1HD2  ASN  23          2HD2      ASN  23  -2.668  24.441   3.453
  156   2HD2  ASN  23          1HD2      ASN  23  -0.969  24.129   3.760
  157    H    GLN  24           H        GLN  24  -0.232  21.556  -0.501
  158    HA   GLN  24           HA       GLN  24  -2.745  21.623  -1.755
  159   1HB   GLN  24          1HB       GLN  24  -0.752  22.755  -2.553
  160   2HB   GLN  24          2HB       GLN  24   0.083  21.238  -2.843
  161   1HG   GLN  24          1HG       GLN  24  -2.464  22.140  -4.277
  162   2HG   GLN  24          2HG       GLN  24  -0.837  22.424  -4.892
  163   1HE2  GLN  24          2HE2      GLN  24  -0.414  18.663  -5.215
  164   2HE2  GLN  24          1HE2      GLN  24   0.358  19.849  -4.172
  165    H    CYS  25           H        CYS  25  -0.418  18.830  -1.740
  166    HA   CYS  25           HA       CYS  25  -2.028  17.226  -3.410
  167   1HB   CYS  25          1HB       CYS  25   0.200  16.452  -2.773
  168   2HB   CYS  25          2HB       CYS  25  -0.287  16.323  -1.083
  169    H    ILE  26           H        ILE  26  -1.977  17.213   0.214
  170    HA   ILE  26           HA       ILE  26  -4.159  15.279   0.212
  171    HB   ILE  26           HB       ILE  26  -3.924  15.227   2.562
  172   1HG1  ILE  26          1HG1      ILE  26  -2.345  17.825   2.369
  173   2HG1  ILE  26          2HG1      ILE  26  -3.926  17.589   3.128
  174   1HG2  ILE  26          1HG2      ILE  26  -2.098  14.265   1.107
  175   2HG2  ILE  26          2HG2      ILE  26  -1.128  15.711   1.436
  176   3HG2  ILE  26          3HG2      ILE  26  -1.589  14.643   2.755
  177   1HD1  ILE  26          2HD1      ILE  26  -2.855  15.997   4.752
  178   2HD1  ILE  26          3HD1      ILE  26  -1.270  16.466   4.085
  179   3HD1  ILE  26          1HD1      ILE  26  -2.295  17.679   4.866
  180    H    ASN  27           H        ASN  27  -3.990  18.693   0.093
  181    HA   ASN  27           HA       ASN  27  -6.580  19.280   1.273
  182   1HB   ASN  27          1HB       ASN  27  -4.652  20.751   1.316
  183   2HB   ASN  27          2HB       ASN  27  -4.669  20.908  -0.458
  184   1HD2  ASN  27          2HD2      ASN  27  -6.247  23.882   1.152
  185   2HD2  ASN  27          1HD2      ASN  27  -4.692  23.052   1.308
  186    H    LEU  28           H        LEU  28  -5.205  19.313  -2.090
  187    HA   LEU  28           HA       LEU  28  -7.845  19.485  -3.284
  188   1HB   LEU  28          1HB       LEU  28  -5.024  19.212  -4.337
  189   2HB   LEU  28          2HB       LEU  28  -6.393  18.806  -5.367
  190    HG   LEU  28           HG       LEU  28  -7.409  21.034  -4.946
  191   1HD1  LEU  28          3HD1      LEU  28  -4.759  21.600  -3.544
  192   2HD1  LEU  28          1HD1      LEU  28  -5.913  22.843  -4.066
  193   3HD1  LEU  28          2HD1      LEU  28  -6.381  21.679  -2.822
  194   1HD2  LEU  28          3HD2      LEU  28  -6.048  20.551  -6.955
  195   2HD2  LEU  28          1HD2      LEU  28  -5.916  22.243  -6.448
  196   3HD2  LEU  28          2HD2      LEU  28  -4.599  21.110  -6.100
  197    H    GLU  29           H        GLU  29  -5.406  16.760  -3.366
  198    HA   GLU  29           HA       GLU  29  -7.739  14.969  -3.961
  199   1HB   GLU  29          1HB       GLU  29  -6.171  13.269  -4.616
  200   2HB   GLU  29          2HB       GLU  29  -6.045  14.729  -5.593
  201   1HG   GLU  29          1HG       GLU  29  -4.000  15.389  -4.359
  202   2HG   GLU  29          2HG       GLU  29  -4.077  13.868  -3.432
  203    HE2  GLU  29           HE2      GLU  29  -1.960  14.592  -4.953
  204    H    LYS  30           H        LYS  30  -7.203  12.679  -2.727
  205    HA   LYS  30           HA       LYS  30  -7.220  13.571   0.119
  206   1HB   LYS  30          1HB       LYS  30  -8.866  11.492  -1.314
  207   2HB   LYS  30          2HB       LYS  30  -8.857  11.694   0.447
  208   1HG   LYS  30          1HG       LYS  30  -9.485  13.976  -1.487
  209   2HG   LYS  30          2HG       LYS  30 -10.702  12.933  -0.784
  210   1HD   LYS  30          1HD       LYS  30 -10.684  13.925   1.206
  211   2HD   LYS  30          2HD       LYS  30  -8.946  14.050   1.332
  212   1HE   LYS  30          1HE       LYS  30 -10.649  15.912  -0.398
  213   2HE   LYS  30          2HE       LYS  30 -10.254  16.240   1.292
  214   1HZ   LYS  30          1HZ       LYS  30  -8.212  15.952  -0.828
  215   2HZ   LYS  30          2HZ       LYS  30  -8.770  17.359  -0.244
  216   3HZ   LYS  30          3HZ       LYS  30  -7.908  16.349   0.707
  217    H    ALA  31           H        ALA  31  -4.932  12.444  -1.540
  218    HA   ALA  31           HA       ALA  31  -3.867  10.119  -0.365
  219   1HB   ALA  31          2HB       ALA  31  -2.781  11.575  -2.134
  220   2HB   ALA  31          3HB       ALA  31  -2.561  12.798  -0.868
  221   3HB   ALA  31          1HB       ALA  31  -1.699  11.247  -0.763
  222    H    ARG  32           H        ARG  32  -2.292  10.020   1.526
  223    HA   ARG  32           HA       ARG  32  -3.660  11.417   3.786
  224   1HB   ARG  32          1HB       ARG  32  -1.861   8.987   3.774
  225   2HB   ARG  32          2HB       ARG  32  -2.695   9.660   5.182
  226   1HG   ARG  32          1HG       ARG  32  -4.068   8.538   2.681
  227   2HG   ARG  32          2HG       ARG  32  -3.827   7.692   4.204
  228   1HD   ARG  32          1HD       ARG  32  -6.078   8.420   4.223
  229   2HD   ARG  32          2HD       ARG  32  -5.185   9.427   5.371
  230    HE   ARG  32           HE       ARG  32  -5.723  10.393   2.559
  231   1HH1  ARG  32          2HH1      ARG  32  -6.853  10.634   5.868
  232   2HH1  ARG  32          1HH1      ARG  32  -7.125  12.350   5.817
  233   1HH2  ARG  32          2HH2      ARG  32  -5.750  12.645   2.542
  234   2HH2  ARG  32          1HH2      ARG  32  -6.580  13.535   3.796
  235    H    HIS  33           H        HIS  33  -0.251  10.659   3.012
  236    HA   HIS  33           HA       HIS  33   0.379  13.336   4.168
  237   1HB   HIS  33          2HB       HIS  33   2.740  12.412   4.493
  238   2HB   HIS  33          1HB       HIS  33   1.494  12.091   5.691
  239    HD1  HIS  33           HD1      HIS  33   0.283   9.656   5.511
  240    HD2  HIS  33           HD2      HIS  33   4.116  10.097   3.883
  241    HE1  HIS  33           HE1      HIS  33   1.290   7.340   5.332
  242    H    GLY  34           H        GLY  34   2.188  14.378   3.091
  243   1HA   GLY  34          1HA       GLY  34   2.976  13.459   0.480
  244   2HA   GLY  34          2HA       GLY  34   2.020  14.957   0.450
  245    H    SER  35           H        SER  35   4.817  14.794  -0.293
  246    HA   SER  35           HA       SER  35   6.010  16.793   1.416
  247   1HB   SER  35          1HB       SER  35   6.917  13.879   1.639
  248   2HB   SER  35          2HB       SER  35   8.048  15.195   1.892
  249    HG   SER  35           HG       SER  35   5.634  14.702   3.290
  250    H    CYS  36           H        CYS  36   7.819  17.655   0.425
  251    HA   CYS  36           HA       CYS  36   8.229  16.891  -2.403
  252   1HB   CYS  36          1HB       CYS  36   8.130  19.271  -1.895
  253   2HB   CYS  36          2HB       CYS  36   9.511  19.104  -0.771
  254    H    ASN  37           H        ASN  37   9.987  15.816  -3.088
  255    HA   ASN  37           HA       ASN  37  12.121  15.013  -1.144
  256   1HB   ASN  37          1HB       ASN  37  10.615  13.154  -1.859
  257   2HB   ASN  37          2HB       ASN  37  10.990  13.518  -3.554
  258   1HD2  ASN  37          2HD2      ASN  37  14.141  11.873  -3.453
  259   2HD2  ASN  37          1HD2      ASN  37  13.231  13.073  -4.354
  260    H    TYR  38           H        TYR  38  14.262  14.981  -2.129
  261    HA   TYR  38           HA       TYR  38  14.509  16.718  -4.506
  262   1HB   TYR  38          1HB       TYR  38  15.999  17.228  -2.653
  263   2HB   TYR  38          2HB       TYR  38  16.701  15.614  -2.740
  264    HD1  TYR  38           HD1      TYR  38  15.840  18.350  -5.259
  265    HD2  TYR  38           HD2      TYR  38  18.895  15.725  -3.713
  266    HE1  TYR  38           HE1      TYR  38  17.120  18.607  -7.342
  267    HE2  TYR  38           HE2      TYR  38  20.142  15.948  -5.844
  268    HH   TYR  38           HH       TYR  38  18.750  17.654  -8.667
  269    H    VAL  39           H        VAL  39  17.037  14.567  -4.576
  270    HA   VAL  39           HA       VAL  39  17.722  13.036  -6.033
  271    HB   VAL  39           HB       VAL  39  14.791  12.178  -6.196
  272   1HG1  VAL  39          1HG1      VAL  39  17.226  10.842  -7.399
  273   2HG1  VAL  39          2HG1      VAL  39  15.630  10.097  -7.182
  274   3HG1  VAL  39          3HG1      VAL  39  15.803  11.476  -8.267
  275   1HG2  VAL  39          3HG2      VAL  39  16.050  11.887  -3.991
  276   2HG2  VAL  39          1HG2      VAL  39  15.497  10.382  -4.748
  277   3HG2  VAL  39          2HG2      VAL  39  17.200  10.871  -4.870
  278    H    PHE  40           H        PHE  40  18.016  12.806  -8.347
  279    HA   PHE  40           HA       PHE  40  17.921  15.197  -9.713
  280   1HB   PHE  40          1HB       PHE  40  19.397  13.448 -10.353
  281   2HB   PHE  40          2HB       PHE  40  18.072  12.325 -10.673
  282    HD1  PHE  40           HD2      PHE  40  16.696  12.517 -12.739
  283    HD2  PHE  40           HD1      PHE  40  20.216  14.932 -12.069
  284    HE1  PHE  40           HE2      PHE  40  16.751  13.117 -15.140
  285    HE2  PHE  40           HE1      PHE  40  20.268  15.508 -14.476
  286    HZ   PHE  40           HZ       PHE  40  18.532  14.616 -16.013
  287    HA   PRO  41           HA       PRO  41  17.711  16.174 -11.641
  288   1HB   PRO  41          1HB       PRO  41  16.389  18.042 -13.102
  289   2HB   PRO  41          2HB       PRO  41  16.775  16.420 -13.734
  290   1HG   PRO  41          1HG       PRO  41  14.122  17.408 -12.696
  291   2HG   PRO  41          2HG       PRO  41  14.457  16.365 -14.095
  292   1HD   PRO  41          1HD       PRO  41  13.695  15.409 -11.572
  293   2HD   PRO  41          2HD       PRO  41  14.606  14.460 -12.774
  294    H    ALA  42           H        ALA  42  14.490  17.445 -10.716
  295    HA   ALA  42           HA       ALA  42  15.742  19.487  -8.934
  296   1HB   ALA  42          2HB       ALA  42  14.703  20.400 -10.985
  297   2HB   ALA  42          3HB       ALA  42  13.166  19.625 -10.544
  298   3HB   ALA  42          1HB       ALA  42  13.843  20.911  -9.524
  299    H    HIS  43           H        HIS  43  13.973  20.312  -7.377
  300    HA   HIS  43           HA       HIS  43  13.212  18.225  -5.577
  301   1HB   HIS  43          2HB       HIS  43  12.366  21.143  -5.759
  302   2HB   HIS  43          1HB       HIS  43  12.107  20.123  -4.370
  303    HD1  HIS  43           HD1      HIS  43  14.029  19.539  -2.788
  304    HD2  HIS  43           HD2      HIS  43  15.177  21.900  -6.059
  305    HE1  HIS  43           HE1      HIS  43  16.402  20.332  -2.353
  306    H    LYS  44           H        LYS  44  11.377  17.035  -5.542
  307    HA   LYS  44           HA       LYS  44   9.214  17.635  -7.521
  308   1HB   LYS  44          1HB       LYS  44   9.199  15.313  -8.185
  309   2HB   LYS  44          2HB       LYS  44  10.787  16.041  -8.467
  310   1HG   LYS  44          1HG       LYS  44  11.565  14.971  -6.276
  311   2HG   LYS  44          2HG       LYS  44   9.992  14.195  -6.159
  312   1HD   LYS  44          1HD       LYS  44  11.609  12.638  -7.045
  313   2HD   LYS  44          2HD       LYS  44  10.338  12.958  -8.225
  314   1HE   LYS  44          1HE       LYS  44  12.694  12.823  -9.143
  315   2HE   LYS  44          2HE       LYS  44  11.809  14.277  -9.609
  316   1HZ   LYS  44          3HZ       LYS  44  13.625  14.286  -7.283
  317   2HZ   LYS  44          1HZ       LYS  44  14.189  14.512  -8.780
  318   3HZ   LYS  44          2HZ       LYS  44  13.108  15.566  -8.149
  319    H    CYS  45           H        CYS  45   7.154  17.159  -6.889
  320    HA   CYS  45           HA       CYS  45   6.726  16.835  -4.037
  321   1HB   CYS  45          1HB       CYS  45   5.381  18.374  -5.421
  322   2HB   CYS  45          2HB       CYS  45   4.760  17.004  -6.350
  323    H    ILE  46           H        ILE  46   6.445  14.873  -2.996
  324    HA   ILE  46           HA       ILE  46   5.547  12.503  -4.592
  325    HB   ILE  46           HB       ILE  46   7.117  12.649  -1.981
  326   1HG1  ILE  46          1HG1      ILE  46   8.652  13.076  -3.805
  327   2HG1  ILE  46          2HG1      ILE  46   8.905  11.457  -3.164
  328   1HG2  ILE  46          1HG2      ILE  46   5.951  10.273  -3.465
  329   2HG2  ILE  46          2HG2      ILE  46   7.180  10.139  -2.185
  330   3HG2  ILE  46          3HG2      ILE  46   5.594  10.802  -1.821
  331   1HD1  ILE  46          3HD1      ILE  46   7.581  10.537  -5.111
  332   2HD1  ILE  46          1HD1      ILE  46   7.501  12.194  -5.762
  333   3HD1  ILE  46          2HD1      ILE  46   9.063  11.393  -5.567
  334    H    CYS  47           H        CYS  47   3.583  11.604  -3.938
  335    HA   CYS  47           HA       CYS  47   2.613  12.461  -1.279
  336   1HB   CYS  47          1HB       CYS  47   1.644  13.876  -3.170
  337   2HB   CYS  47          2HB       CYS  47   0.702  12.439  -3.598
  338    H    TYR  48           H        TYR  48   1.339  11.047  -0.123
  339    HA   TYR  48           HA       TYR  48   1.873   8.237  -0.936
  340   1HB   TYR  48          1HB       TYR  48   1.590   9.503   1.801
  341   2HB   TYR  48          2HB       TYR  48   1.940   7.815   1.447
  342    HD1  TYR  48           HD1      TYR  48   3.336  11.269   0.937
  343    HD2  TYR  48           HD2      TYR  48   4.153   7.073   1.455
  344    HE1  TYR  48           HE1      TYR  48   5.762  11.731   0.809
  345    HE2  TYR  48           HE2      TYR  48   6.576   7.554   1.440
  346    HH   TYR  48           HH       TYR  48   8.087   9.133   0.446
  347    H    PHE  49           H        PHE  49   0.153   7.035  -1.460
  348    HA   PHE  49           HA       PHE  49  -2.526   7.676  -0.327
  349   1HB   PHE  49          1HB       PHE  49  -1.857   6.247  -2.907
  350   2HB   PHE  49          2HB       PHE  49  -3.414   6.773  -2.391
  351    HD1  PHE  49           HD1      PHE  49  -0.028   8.253  -3.222
  352    HD2  PHE  49           HD2      PHE  49  -4.325   8.732  -3.348
  353    HE1  PHE  49           HE1      PHE  49   0.230  10.360  -4.419
  354    HE2  PHE  49           HE2      PHE  49  -4.034  10.648  -4.880
  355    HZ   PHE  49           HZ       PHE  49  -1.699  11.316  -5.605
  356    HA   PRO  50           HA       PRO  50  -2.263   3.799   1.731
  357   1HB   PRO  50          1HB       PRO  50  -4.861   2.868   1.724
  358   2HB   PRO  50          2HB       PRO  50  -4.309   4.273   2.677
  359   1HG   PRO  50          1HG       PRO  50  -5.629   4.307  -0.053
  360   2HG   PRO  50          2HG       PRO  50  -6.073   5.266   1.389
  361   1HD   PRO  50          1HD       PRO  50  -4.482   6.311  -0.566
  362   2HD   PRO  50          2HD       PRO  50  -4.131   6.644   1.165
  363    H    CYS  51           H        CYS  51  -3.508   3.815  -1.479
  364    HA   CYS  51           HA       CYS  51  -3.596   2.276  -3.191
  365   1HB   CYS  51          1HB       CYS  51  -1.373   3.311  -2.809
  366   2HB   CYS  51          2HB       CYS  51  -0.852   1.847  -1.993
   
  No H/Q in entry =         366
  Start of MODEL    3
    1    HA   PCA   1           HA       PYR   1  -3.562  -0.605   3.323
    2   1HB   PCA   1          1HB       PYR   1  -2.588  -1.287   5.877
    3   2HB   PCA   1          2HB       PYR   1  -3.913  -2.108   5.011
    4   1HG   PCA   1          1HG       PYR   1  -1.082  -3.037   5.320
    5   2HG   PCA   1          2HG       PYR   1  -2.574  -3.986   5.064
    6    HN   PCA   1           HN       PYR   1  -2.059  -1.800   1.727
    7    H    LYS   2           H        LYS   2  -0.288  -1.173   4.660
    8    HA   LYS   2           HA       LYS   2   0.423   1.408   5.384
    9   1HB   LYS   2          1HB       LYS   2   2.731   0.623   5.294
   10   2HB   LYS   2          2HB       LYS   2   1.680  -0.664   5.880
   11   1HG   LYS   2          1HG       LYS   2   2.766  -1.938   4.354
   12   2HG   LYS   2          2HG       LYS   2   1.608  -1.252   3.225
   13   1HD   LYS   2          1HD       LYS   2   3.583   0.674   3.089
   14   2HD   LYS   2          2HD       LYS   2   4.543  -0.697   3.634
   15   1HE   LYS   2          1HE       LYS   2   4.658  -0.795   1.262
   16   2HE   LYS   2          2HE       LYS   2   3.474  -2.039   1.696
   17   1HZ   LYS   2          2HZ       LYS   2   1.781  -0.184   1.287
   18   2HZ   LYS   2          3HZ       LYS   2   2.990   0.662   0.627
   19   3HZ   LYS   2          1HZ       LYS   2   2.556  -0.764  -0.060
   20    H    LEU   3           H        LEU   3   1.597   3.115   4.329
   21    HA   LEU   3           HA       LEU   3   0.379   3.831   2.020
   22   1HB   LEU   3          1HB       LEU   3   3.051   4.825   2.983
   23   2HB   LEU   3          2HB       LEU   3   2.073   5.646   1.790
   24    HG   LEU   3           HG       LEU   3   1.040   5.163   4.614
   25   1HD1  LEU   3          3HD1      LEU   3   2.502   7.597   3.480
   26   2HD1  LEU   3          1HD1      LEU   3   1.736   7.496   5.078
   27   3HD1  LEU   3          2HD1      LEU   3   3.142   6.486   4.703
   28   1HD2  LEU   3          3HD2      LEU   3   0.226   7.095   2.405
   29   2HD2  LEU   3          1HD2      LEU   3  -0.689   5.676   2.962
   30   3HD2  LEU   3          2HD2      LEU   3  -0.444   7.048   4.047
   31    H    CYS   4           H        CYS   4   0.946   4.277  -0.097
   32    HA   CYS   4           HA       CYS   4   3.394   3.074  -1.270
   33   1HB   CYS   4          1HB       CYS   4   0.538   2.673  -2.193
   34   2HB   CYS   4          2HB       CYS   4   1.827   2.839  -3.379
   35    H    GLU   5           H        GLU   5   4.304   4.434  -2.719
   36    HA   GLU   5           HA       GLU   5   3.444   7.228  -2.479
   37   1HB   GLU   5          1HB       GLU   5   5.685   7.806  -2.772
   38   2HB   GLU   5          2HB       GLU   5   5.707   6.360  -1.763
   39   1HG   GLU   5          1HG       GLU   5   6.455   6.609  -4.701
   40   2HG   GLU   5          2HG       GLU   5   7.488   6.169  -3.346
   41    HE2  GLU   5           HE2      GLU   5   5.365   4.800  -5.704
   42    H    ARG   6           H        ARG   6   3.247   8.667  -4.157
   43    HA   ARG   6           HA       ARG   6   3.605   7.770  -6.976
   44   1HB   ARG   6          1HB       ARG   6   1.295   9.395  -5.874
   45   2HB   ARG   6          2HB       ARG   6   1.721   9.392  -7.530
   46   1HG   ARG   6          1HG       ARG   6   1.455   6.939  -7.701
   47   2HG   ARG   6          2HG       ARG   6   1.076   6.833  -5.979
   48   1HD   ARG   6          1HD       ARG   6  -0.914   6.731  -7.532
   49   2HD   ARG   6          2HD       ARG   6  -0.988   7.917  -6.234
   50    HE   ARG   6           HE       ARG   6  -0.078   8.652  -9.000
   51   1HH1  ARG   6          1HH1      ARG   6  -2.577   9.081  -6.541
   52   2HH1  ARG   6          2HH1      ARG   6  -2.781  10.778  -6.858
   53   1HH2  ARG   6          2HH2      ARG   6  -0.361  10.902  -9.412
   54   2HH2  ARG   6          1HH2      ARG   6  -1.663  11.767  -8.697
   55    HA   PRO   7           HA       PRO   7   6.322  11.387  -6.267
   56   1HB   PRO   7          1HB       PRO   7   6.900  10.735  -9.164
   57   2HB   PRO   7          2HB       PRO   7   8.029  11.203  -7.865
   58   1HG   PRO   7          1HG       PRO   7   7.814   8.600  -8.610
   59   2HG   PRO   7          2HG       PRO   7   7.892   9.030  -6.875
   60   1HD   PRO   7          1HD       PRO   7   5.423   8.402  -8.521
   61   2HD   PRO   7          2HD       PRO   7   5.893   7.790  -6.905
   62    H    SER   8           H        SER   8   4.736  10.878  -9.526
   63    HA   SER   8           HA       SER   8   3.749  13.626  -9.584
   64   1HB   SER   8          1HB       SER   8   2.547  12.659 -11.607
   65   2HB   SER   8          2HB       SER   8   4.315  12.544 -11.656
   66    HG   SER   8           HG       SER   8   2.518  10.508 -10.833
   67    H    GLY   9           H        GLY   9   2.792  13.441  -7.406
   68   1HA   GLY   9          1HA       GLY   9   0.271  12.040  -6.989
   69   2HA   GLY   9          2HA       GLY   9   0.863  13.458  -6.104
   70    H    THR  10           H        THR  10   1.170  15.387  -7.562
   71    HA   THR  10           HA       THR  10  -0.703  15.822  -9.797
   72    HB   THR  10           HB       THR  10  -1.178  18.127  -8.784
   73    HG1  THR  10           HG1      THR  10  -1.012  18.175  -6.453
   74   1HG2  THR  10          1HG2      THR  10  -2.870  16.238  -8.699
   75   2HG2  THR  10          2HG2      THR  10  -2.276  15.914  -7.042
   76   3HG2  THR  10          3HG2      THR  10  -3.038  17.464  -7.427
   77    H    TRP  11           H        TRP  11   1.291  17.649  -7.635
   78    HA   TRP  11           HA       TRP  11   2.571  19.273  -9.491
   79   1HB   TRP  11          1HB       TRP  11   1.974  19.617  -7.090
   80   2HB   TRP  11          2HB       TRP  11   3.355  18.635  -6.626
   81    HD1  TRP  11           HD1      TRP  11   5.074  20.383  -9.118
   82    HE1  TRP  11           HE1      TRP  11   6.077  22.599  -8.292
   83    HE3  TRP  11           HE3      TRP  11   2.191  21.073  -4.949
   84    HZ2  TRP  11           HZ2      TRP  11   5.707  24.404  -6.085
   85    HZ3  TRP  11           HZ3      TRP  11   2.660  22.951  -3.427
   86    HH2  TRP  11           HH2      TRP  11   4.524  24.470  -3.866
   87    H    SER  12           H        SER  12   3.414  17.673 -10.981
   88    HA   SER  12           HA       SER  12   5.659  16.014 -10.188
   89   1HB   SER  12          1HB       SER  12   4.524  16.618 -12.948
   90   2HB   SER  12          2HB       SER  12   5.556  15.252 -12.493
   91    HG   SER  12           HG       SER  12   2.940  15.802 -11.446
   92    H    GLY  13           H        GLY  13   5.473  19.292 -11.107
   93   1HA   GLY  13          1HA       GLY  13   8.054  19.537 -12.466
   94   2HA   GLY  13          2HA       GLY  13   6.945  20.820 -11.979
   95    H    VAL  14           H        VAL  14   8.852  21.981 -11.260
   96    HA   VAL  14           HA       VAL  14  10.564  21.133  -9.139
   97    HB   VAL  14           HB       VAL  14   9.630  23.915  -9.850
   98   1HG1  VAL  14          1HG1      VAL  14  12.046  22.985  -8.263
   99   2HG1  VAL  14          2HG1      VAL  14  11.789  24.649  -8.822
  100   3HG1  VAL  14          3HG1      VAL  14  10.671  23.935  -7.660
  101   1HG2  VAL  14          2HG2      VAL  14  10.772  22.759 -11.804
  102   2HG2  VAL  14          3HG2      VAL  14  11.640  24.174 -11.200
  103   3HG2  VAL  14          1HG2      VAL  14  12.204  22.557 -10.762
  104    H    CYS  15           H        CYS  15   9.989  20.816  -7.084
  105    HA   CYS  15           HA       CYS  15   7.264  21.130  -6.221
  106   1HB   CYS  15          1HB       CYS  15   7.783  19.852  -4.413
  107   2HB   CYS  15          2HB       CYS  15   9.098  19.397  -5.496
  108    H    GLY  16           H        GLY  16  10.166  23.069  -5.668
  109   1HA   GLY  16          1HA       GLY  16  10.411  25.160  -4.762
  110   2HA   GLY  16          2HA       GLY  16   8.656  25.281  -4.611
  111    H    ASN  17           H        ASN  17   8.240  23.027  -2.809
  112    HA   ASN  17           HA       ASN  17   9.688  23.499  -0.357
  113   1HB   ASN  17          1HB       ASN  17   8.634  25.710  -0.464
  114   2HB   ASN  17          2HB       ASN  17   7.064  24.975  -0.812
  115   1HD2  ASN  17          2HD2      ASN  17   8.528  24.963   3.042
  116   2HD2  ASN  17          1HD2      ASN  17   9.600  25.310   1.699
  117    H    ASN  18           H        ASN  18   9.269  21.897   1.032
  118    HA   ASN  18           HA       ASN  18   7.818  19.628   0.573
  119   1HB   ASN  18          1HB       ASN  18   9.603  20.068   2.289
  120   2HB   ASN  18          2HB       ASN  18   8.443  20.919   3.282
  121   1HD2  ASN  18          2HD2      ASN  18   8.520  16.899   3.367
  122   2HD2  ASN  18          1HD2      ASN  18   9.692  17.799   2.426
  123    H    ASN  19           H        ASN  19   6.854  22.142   2.855
  124    HA   ASN  19           HA       ASN  19   4.373  21.020   3.562
  125   1HB   ASN  19          1HB       ASN  19   5.394  22.781   4.902
  126   2HB   ASN  19          2HB       ASN  19   5.106  23.976   3.626
  127   1HD2  ASN  19          2HD2      ASN  19   1.627  24.332   4.378
  128   2HD2  ASN  19          1HD2      ASN  19   2.904  24.743   3.250
  129    H    ALA  20           H        ALA  20   5.032  23.558   1.088
  130    HA   ALA  20           HA       ALA  20   2.334  23.880   0.242
  131   1HB   ALA  20          1HB       ALA  20   4.182  25.382  -0.458
  132   2HB   ALA  20          2HB       ALA  20   4.844  24.077  -1.475
  133   3HB   ALA  20          3HB       ALA  20   3.243  24.764  -1.828
  134    H    CYS  21           H        CYS  21   4.917  21.699  -1.051
  135    HA   CYS  21           HA       CYS  21   3.431  20.402  -2.983
  136   1HB   CYS  21          1HB       CYS  21   5.603  19.702  -3.059
  137   2HB   CYS  21          2HB       CYS  21   5.790  19.705  -1.312
  138    H    LYS  22           H        LYS  22   3.899  19.374   0.375
  139    HA   LYS  22           HA       LYS  22   2.295  17.108   0.573
  140   1HB   LYS  22          1HB       LYS  22   3.865  17.862   2.247
  141   2HB   LYS  22          2HB       LYS  22   3.003  19.353   2.519
  142   1HG   LYS  22          1HG       LYS  22   1.084  18.206   3.475
  143   2HG   LYS  22          2HG       LYS  22   1.870  16.650   3.325
  144   1HD   LYS  22          1HD       LYS  22   3.013  19.053   4.883
  145   2HD   LYS  22          2HD       LYS  22   1.891  17.905   5.588
  146   1HE   LYS  22          1HE       LYS  22   4.129  17.364   6.311
  147   2HE   LYS  22          2HE       LYS  22   3.454  16.054   5.332
  148   1HZ   LYS  22          2HZ       LYS  22   5.429  18.049   4.338
  149   2HZ   LYS  22          3HZ       LYS  22   5.741  16.483   4.718
  150   3HZ   LYS  22          1HZ       LYS  22   4.747  16.792   3.508
  151    H    ASN  23           H        ASN  23   1.417  20.407   1.500
  152    HA   ASN  23           HA       ASN  23  -1.268  20.043   2.104
  153   1HB   ASN  23          1HB       ASN  23  -0.085  22.083   2.649
  154   2HB   ASN  23          2HB       ASN  23   0.324  22.378   0.957
  155   1HD2  ASN  23          1HD2      ASN  23  -2.132  24.894   1.514
  156   2HD2  ASN  23          2HD2      ASN  23  -0.453  24.524   1.813
  157    H    GLN  24           H        GLN  24   0.064  21.300  -1.031
  158    HA   GLN  24           HA       GLN  24  -2.400  21.293  -2.385
  159   1HB   GLN  24          1HB       GLN  24   0.437  21.012  -3.422
  160   2HB   GLN  24          2HB       GLN  24  -1.003  21.131  -4.464
  161   1HG   GLN  24          1HG       GLN  24  -1.646  23.261  -3.353
  162   2HG   GLN  24          2HG       GLN  24  -0.205  23.170  -2.329
  163   1HE2  GLN  24          2HE2      GLN  24   0.797  23.739  -6.258
  164   2HE2  GLN  24          1HE2      GLN  24  -0.113  22.312  -5.798
  165    H    CYS  25           H        CYS  25  -0.067  18.485  -2.142
  166    HA   CYS  25           HA       CYS  25  -1.690  16.924  -3.883
  167   1HB   CYS  25          1HB       CYS  25   0.607  16.207  -3.059
  168   2HB   CYS  25          2HB       CYS  25  -0.184  15.683  -1.573
  169    H    ILE  26           H        ILE  26  -1.750  17.006  -0.255
  170    HA   ILE  26           HA       ILE  26  -3.944  15.086  -0.213
  171    HB   ILE  26           HB       ILE  26  -3.841  15.208   2.141
  172   1HG1  ILE  26          1HG1      ILE  26  -2.253  17.779   1.851
  173   2HG1  ILE  26          2HG1      ILE  26  -3.868  17.580   2.547
  174   1HG2  ILE  26          1HG2      ILE  26  -1.946  14.097   0.936
  175   2HG2  ILE  26          2HG2      ILE  26  -0.977  15.563   1.148
  176   3HG2  ILE  26          3HG2      ILE  26  -1.527  14.649   2.553
  177   1HD1  ILE  26          1HD1      ILE  26  -2.865  16.125   4.333
  178   2HD1  ILE  26          2HD1      ILE  26  -1.254  16.574   3.716
  179   3HD1  ILE  26          3HD1      ILE  26  -2.335  17.820   4.352
  180    H    ASN  27           H        ASN  27  -3.763  18.471  -0.548
  181    HA   ASN  27           HA       ASN  27  -6.438  19.117   0.401
  182   1HB   ASN  27          1HB       ASN  27  -4.499  20.584   0.566
  183   2HB   ASN  27          2HB       ASN  27  -4.396  20.703  -1.209
  184   1HD2  ASN  27          2HD2      ASN  27  -6.089  23.689   0.285
  185   2HD2  ASN  27          1HD2      ASN  27  -4.554  22.860   0.581
  186    H    LEU  28           H        LEU  28  -4.780  19.026  -2.839
  187    HA   LEU  28           HA       LEU  28  -7.264  19.336  -4.284
  188   1HB   LEU  28          1HB       LEU  28  -4.407  18.688  -5.059
  189   2HB   LEU  28          2HB       LEU  28  -5.721  18.484  -6.200
  190    HG   LEU  28           HG       LEU  28  -6.375  20.788  -6.084
  191   1HD1  LEU  28          2HD1      LEU  28  -4.110  21.204  -4.088
  192   2HD1  LEU  28          3HD1      LEU  28  -5.034  22.486  -4.884
  193   3HD1  LEU  28          1HD1      LEU  28  -5.848  21.397  -3.760
  194   1HD2  LEU  28          3HD2      LEU  28  -4.596  20.096  -7.659
  195   2HD2  LEU  28          1HD2      LEU  28  -4.369  21.771  -7.128
  196   3HD2  LEU  28          2HD2      LEU  28  -3.360  20.481  -6.440
  197    H    GLU  29           H        GLU  29  -5.053  16.457  -3.970
  198    HA   GLU  29           HA       GLU  29  -7.450  14.756  -4.558
  199   1HB   GLU  29          1HB       GLU  29  -5.930  12.890  -4.950
  200   2HB   GLU  29          2HB       GLU  29  -5.857  14.216  -6.097
  201   1HG   GLU  29          1HG       GLU  29  -3.731  15.003  -4.893
  202   2HG   GLU  29          2HG       GLU  29  -3.736  13.431  -4.059
  203    HE1  GLU  29           HE2      GLU  29  -3.007  13.755  -8.010
  204    H    LYS  30           H        LYS  30  -7.000  12.565  -3.082
  205    HA   LYS  30           HA       LYS  30  -7.190  13.747  -0.351
  206   1HB   LYS  30          1HB       LYS  30  -8.779  11.584  -1.726
  207   2HB   LYS  30          2HB       LYS  30  -8.855  11.851   0.022
  208   1HG   LYS  30          1HG       LYS  30  -9.357  14.072  -2.008
  209   2HG   LYS  30          2HG       LYS  30 -10.623  13.054  -1.344
  210   1HD   LYS  30          1HD       LYS  30 -10.719  14.131   0.598
  211   2HD   LYS  30          2HD       LYS  30  -8.990  14.157   0.855
  212   1HE   LYS  30          1HE       LYS  30 -10.472  16.085  -1.003
  213   2HE   LYS  30          2HE       LYS  30 -10.125  16.421   0.696
  214   1HZ   LYS  30          3HZ       LYS  30  -8.024  15.942  -1.327
  215   2HZ   LYS  30          1HZ       LYS  30  -8.506  17.398  -0.814
  216   3HZ   LYS  30          2HZ       LYS  30  -7.754  16.361   0.206
  217    H    ALA  31           H        ALA  31  -4.825  12.427  -1.728
  218    HA   ALA  31           HA       ALA  31  -3.815  10.197  -0.446
  219   1HB   ALA  31          1HB       ALA  31  -2.643  11.644  -2.098
  220   2HB   ALA  31          2HB       ALA  31  -2.514  12.921  -0.893
  221   3HB   ALA  31          3HB       ALA  31  -1.647  11.390  -0.649
  222    H    ARG  32           H        ARG  32  -2.334  10.028   1.453
  223    HA   ARG  32           HA       ARG  32  -3.515  11.484   3.794
  224   1HB   ARG  32          1HB       ARG  32  -1.670   9.071   3.658
  225   2HB   ARG  32          2HB       ARG  32  -2.248   9.807   5.155
  226   1HG   ARG  32          1HG       ARG  32  -4.090   8.587   3.086
  227   2HG   ARG  32          2HG       ARG  32  -3.336   7.668   4.388
  228   1HD   ARG  32          1HD       ARG  32  -5.589   8.210   5.095
  229   2HD   ARG  32          2HD       ARG  32  -4.404   9.018   6.110
  230    HE   ARG  32           HE       ARG  32  -5.308  11.016   5.539
  231   1HH1  ARG  32          1HH2      ARG  32  -6.293   8.717   3.034
  232   2HH1  ARG  32          2HH2      ARG  32  -6.721   9.982   1.889
  233   1HH2  ARG  32          1HH1      ARG  32  -5.996  12.661   4.012
  234   2HH2  ARG  32          2HH1      ARG  32  -6.467  12.132   2.423
  235    H    HIS  33           H        HIS  33  -0.290  10.608   2.499
  236    HA   HIS  33           HA       HIS  33   0.781  13.010   3.948
  237   1HB   HIS  33          2HB       HIS  33   2.239  10.432   3.262
  238   2HB   HIS  33          1HB       HIS  33   2.993  11.908   3.838
  239    HD1  HIS  33           HD1      HIS  33  -0.075  10.018   5.167
  240    HD2  HIS  33           HD2      HIS  33   3.718  11.320   6.358
  241    HE1  HIS  33           HE1      HIS  33   0.161   9.433   7.618
  242    H    GLY  34           H        GLY  34   2.536  14.039   2.887
  243   1HA   GLY  34          1HA       GLY  34   3.332  13.433   0.279
  244   2HA   GLY  34          2HA       GLY  34   2.297  14.889   0.245
  245    H    SER  35           H        SER  35   5.193  14.794  -0.252
  246    HA   SER  35           HA       SER  35   6.252  16.798   1.514
  247   1HB   SER  35          1HB       SER  35   7.080  13.873   1.922
  248   2HB   SER  35          2HB       SER  35   8.199  15.185   2.256
  249    HG   SER  35           HG       SER  35   5.661  14.732   3.412
  250    H    CYS  36           H        CYS  36   8.341  17.466   0.665
  251    HA   CYS  36           HA       CYS  36   8.679  16.625  -2.175
  252   1HB   CYS  36          1HB       CYS  36   8.330  18.994  -1.857
  253   2HB   CYS  36          2HB       CYS  36   9.653  19.069  -0.671
  254    H    ASN  37           H        ASN  37  10.611  15.817  -2.929
  255    HA   ASN  37           HA       ASN  37  12.925  15.675  -1.053
  256   1HB   ASN  37          1HB       ASN  37  11.956  13.435  -0.952
  257   2HB   ASN  37          2HB       ASN  37  11.824  13.375  -2.721
  258   1HD2  ASN  37          2HD2      ASN  37  15.108  12.157  -3.099
  259   2HD2  ASN  37          1HD2      ASN  37  13.433  12.083  -3.601
  260    H    TYR  38           H        TYR  38  14.996  15.379  -2.284
  261    HA   TYR  38           HA       TYR  38  14.974  16.972  -4.716
  262   1HB   TYR  38          1HB       TYR  38  16.850  17.113  -3.142
  263   2HB   TYR  38          2HB       TYR  38  17.288  15.446  -3.529
  264    HD1  TYR  38           HD2      TYR  38  16.904  18.893  -4.904
  265    HD2  TYR  38           HD1      TYR  38  18.353  14.910  -5.686
  266    HE1  TYR  38           HE2      TYR  38  17.686  19.619  -7.131
  267    HE2  TYR  38           HE1      TYR  38  19.096  15.630  -7.938
  268    HH   TYR  38           HH       TYR  38  18.533  18.926  -9.191
  269    H    VAL  39           H        VAL  39  13.909  16.053  -6.353
  270    HA   VAL  39           HA       VAL  39  15.201  13.784  -7.666
  271    HB   VAL  39           HB       VAL  39  12.166  13.971  -7.443
  272   1HG1  VAL  39          3HG1      VAL  39  13.999  11.864  -8.641
  273   2HG1  VAL  39          1HG1      VAL  39  12.276  11.601  -8.314
  274   3HG1  VAL  39          2HG1      VAL  39  12.750  12.830  -9.470
  275   1HG2  VAL  39          1HG2      VAL  39  14.021  12.104  -5.938
  276   2HG2  VAL  39          2HG2      VAL  39  12.927  13.336  -5.247
  277   3HG2  VAL  39          3HG2      VAL  39  12.259  11.918  -6.048
  278    H    PHE  40           H        PHE  40  14.378  13.891 -10.056
  279    HA   PHE  40           HA       PHE  40  14.920  16.406 -11.086
  280   1HB   PHE  40          1HB       PHE  40  14.586  15.520 -13.188
  281   2HB   PHE  40          2HB       PHE  40  14.961  14.096 -12.257
  282    HD1  PHE  40           HD1      PHE  40  13.127  12.425 -11.750
  283    HD2  PHE  40           HD2      PHE  40  12.436  15.888 -14.232
  284    HE1  PHE  40           HE1      PHE  40  11.025  11.419 -12.579
  285    HE2  PHE  40           HE2      PHE  40  10.376  14.844 -15.110
  286    HZ   PHE  40           HZ       PHE  40   9.665  12.601 -14.292
  287    HA   PRO  41           HA       PRO  41  14.153  17.816 -13.047
  288   1HB   PRO  41          1HB       PRO  41  13.531  20.475 -13.088
  289   2HB   PRO  41          2HB       PRO  41  12.616  19.237 -13.995
  290   1HG   PRO  41          1HG       PRO  41  11.921  20.411 -11.291
  291   2HG   PRO  41          2HG       PRO  41  10.854  20.235 -12.713
  292   1HD   PRO  41          1HD       PRO  41  10.875  18.423 -10.670
  293   2HD   PRO  41          2HD       PRO  41  10.679  17.891 -12.365
  294    H    ALA  42           H        ALA  42  13.290  19.375  -9.936
  295    HA   ALA  42           HA       ALA  42  15.914  19.162  -8.879
  296   1HB   ALA  42          2HB       ALA  42  15.156  21.940  -9.897
  297   2HB   ALA  42          3HB       ALA  42  16.467  21.603  -8.748
  298   3HB   ALA  42          1HB       ALA  42  16.563  20.979 -10.400
  299    H    HIS  43           H        HIS  43  14.333  18.253  -7.450
  300    HA   HIS  43           HA       HIS  43  13.433  18.342  -5.291
  301   1HB   HIS  43          2HB       HIS  43  12.610  21.229  -5.675
  302   2HB   HIS  43          1HB       HIS  43  12.463  20.261  -4.251
  303    HD1  HIS  43           HD1      HIS  43  15.016  22.154  -6.175
  304    HD2  HIS  43           HD2      HIS  43  14.770  19.871  -2.677
  305    HE1  HIS  43           HE1      HIS  43  17.168  22.574  -4.833
  306    H    LYS  44           H        LYS  44  11.637  17.142  -5.364
  307    HA   LYS  44           HA       LYS  44   9.471  17.834  -7.296
  308   1HB   LYS  44          1HB       LYS  44  11.228  16.052  -8.023
  309   2HB   LYS  44          2HB       LYS  44  10.358  15.054  -6.834
  310   1HG   LYS  44          1HG       LYS  44   8.205  15.592  -8.096
  311   2HG   LYS  44          2HG       LYS  44   9.227  16.419  -9.293
  312   1HD   LYS  44          1HD       LYS  44  10.571  14.117  -9.283
  313   2HD   LYS  44          2HD       LYS  44   9.133  13.477  -8.494
  314   1HE   LYS  44          1HE       LYS  44   9.062  13.029 -10.886
  315   2HE   LYS  44          2HE       LYS  44   7.763  14.167 -10.486
  316   1HZ   LYS  44          2HZ       LYS  44  10.401  15.065 -11.438
  317   2HZ   LYS  44          3HZ       LYS  44   9.201  14.674 -12.493
  318   3HZ   LYS  44          1HZ       LYS  44   8.984  15.906 -11.430
  319    H    CYS  45           H        CYS  45   7.445  17.431  -6.520
  320    HA   CYS  45           HA       CYS  45   7.096  16.899  -3.718
  321   1HB   CYS  45          1HB       CYS  45   5.570  18.312  -5.153
  322   2HB   CYS  45          2HB       CYS  45   5.053  16.827  -5.970
  323    H    ILE  46           H        ILE  46   6.477  14.944  -2.730
  324    HA   ILE  46           HA       ILE  46   5.980  12.570  -4.441
  325    HB   ILE  46           HB       ILE  46   7.266  12.587  -1.678
  326   1HG1  ILE  46          1HG1      ILE  46   8.907  13.545  -3.226
  327   2HG1  ILE  46          2HG1      ILE  46   9.384  11.969  -2.610
  328   1HG2  ILE  46          3HG2      ILE  46   6.778  10.357  -3.689
  329   2HG2  ILE  46          1HG2      ILE  46   7.735  10.196  -2.198
  330   3HG2  ILE  46          2HG2      ILE  46   6.010  10.572  -2.110
  331   1HD1  ILE  46          3HD1      ILE  46   8.220  12.468  -5.381
  332   2HD1  ILE  46          1HD1      ILE  46   9.922  12.206  -4.989
  333   3HD1  ILE  46          2HD1      ILE  46   8.756  10.897  -4.745
  334    H    CYS  47           H        CYS  47   4.066  11.501  -3.854
  335    HA   CYS  47           HA       CYS  47   2.600  12.554  -1.471
  336   1HB   CYS  47          1HB       CYS  47   1.904  13.580  -3.633
  337   2HB   CYS  47          2HB       CYS  47   1.402  11.965  -4.177
  338    H    TYR  48           H        TYR  48   1.118  11.006  -0.466
  339    HA   TYR  48           HA       TYR  48   1.702   8.167  -1.204
  340   1HB   TYR  48          1HB       TYR  48   1.848   9.251   1.581
  341   2HB   TYR  48          2HB       TYR  48   2.284   7.654   1.016
  342    HD1  TYR  48           HD1      TYR  48   3.319  11.224   0.983
  343    HD2  TYR  48           HD2      TYR  48   4.507   7.154   0.261
  344    HE1  TYR  48           HE1      TYR  48   5.691  11.936   0.924
  345    HE2  TYR  48           HE2      TYR  48   6.881   7.852   0.255
  346    HH   TYR  48           HH       TYR  48   8.365   9.608   0.524
  347    H    PHE  49           H        PHE  49   0.115   6.731  -0.914
  348    HA   PHE  49           HA       PHE  49  -2.449   7.564   0.310
  349   1HB   PHE  49          1HB       PHE  49  -2.227   5.718  -2.070
  350   2HB   PHE  49          2HB       PHE  49  -3.564   6.703  -1.561
  351    HD1  PHE  49           HD1      PHE  49  -0.137   6.877  -3.052
  352    HD2  PHE  49           HD2      PHE  49  -3.986   8.790  -2.748
  353    HE1  PHE  49           HE1      PHE  49   0.803   8.947  -3.931
  354    HE2  PHE  49           HE2      PHE  49  -3.170  10.598  -4.237
  355    HZ   PHE  49           HZ       PHE  49  -0.743  10.699  -4.868
  356    HA   PRO  50           HA       PRO  50  -1.936   3.612   2.429
  357   1HB   PRO  50          1HB       PRO  50  -4.530   2.765   2.744
  358   2HB   PRO  50          2HB       PRO  50  -3.808   4.104   3.680
  359   1HG   PRO  50          1HG       PRO  50  -5.509   4.305   1.180
  360   2HG   PRO  50          2HG       PRO  50  -5.697   5.216   2.706
  361   1HD   PRO  50          1HD       PRO  50  -4.395   6.280   0.563
  362   2HD   PRO  50          2HD       PRO  50  -3.759   6.547   2.226
  363    H    CYS  51           H        CYS  51  -1.304   1.665   1.503
  364    HA   CYS  51           HA       CYS  51  -1.930   1.410  -1.344
  365   1HB   CYS  51          1HB       CYS  51   0.311   1.179  -0.212
  366   2HB   CYS  51          2HB       CYS  51  -0.168  -0.469   0.233
   
  No H/Q in entry =         366
  Start of MODEL    4
    1    HA   PCA   1           HA       PYR   1  -2.848   1.700   5.879
    2   1HB   PCA   1          1HB       PYR   1  -1.333  -0.377   7.042
    3   2HB   PCA   1          2HB       PYR   1  -3.098  -0.362   6.828
    4   1HG   PCA   1          1HG       PYR   1  -1.089  -1.842   5.178
    5   2HG   PCA   1          2HG       PYR   1  -2.815  -2.202   5.474
    6    HN   PCA   1           HN       PYR   1  -2.649   1.247   3.396
    7    H    LYS   2           H        LYS   2   0.172  -0.113   5.349
    8    HA   LYS   2           HA       LYS   2   2.034   1.954   5.919
    9   1HB   LYS   2          1HB       LYS   2   2.648  -0.425   5.789
   10   2HB   LYS   2          2HB       LYS   2   2.090  -0.497   4.125
   11   1HG   LYS   2          1HG       LYS   2   4.048   1.439   3.853
   12   2HG   LYS   2          2HG       LYS   2   4.633   0.615   5.277
   13   1HD   LYS   2          1HD       LYS   2   5.607  -0.212   3.160
   14   2HD   LYS   2          2HD       LYS   2   4.811  -1.485   4.079
   15   1HE   LYS   2          1HE       LYS   2   4.477  -1.418   1.506
   16   2HE   LYS   2          2HE       LYS   2   3.070  -1.726   2.517
   17   1HZ   LYS   2          3HZ       LYS   2   3.701   0.935   1.351
   18   2HZ   LYS   2          1HZ       LYS   2   2.537  -0.137   0.834
   19   3HZ   LYS   2          2HZ       LYS   2   2.393   0.550   2.244
   20    H    LEU   3           H        LEU   3   2.634   3.753   4.656
   21    HA   LEU   3           HA       LEU   3   1.170   4.477   2.395
   22   1HB   LEU   3          1HB       LEU   3   3.931   5.364   3.175
   23   2HB   LEU   3          2HB       LEU   3   2.912   6.183   1.997
   24    HG   LEU   3           HG       LEU   3   2.131   5.854   4.927
   25   1HD1  LEU   3          2HD1      LEU   3   4.185   7.212   4.685
   26   2HD1  LEU   3          3HD1      LEU   3   3.382   8.246   3.498
   27   3HD1  LEU   3          1HD1      LEU   3   2.803   8.208   5.170
   28   1HD2  LEU   3          3HD2      LEU   3   0.970   7.518   2.645
   29   2HD2  LEU   3          1HD2      LEU   3   0.179   6.195   3.514
   30   3HD2  LEU   3          2HD2      LEU   3   0.541   7.711   4.351
   31    H    CYS   4           H        CYS   4   1.676   4.694   0.225
   32    HA   CYS   4           HA       CYS   4   4.044   3.325  -0.955
   33   1HB   CYS   4          1HB       CYS   4   1.181   3.318  -2.009
   34   2HB   CYS   4          2HB       CYS   4   2.589   2.929  -2.985
   35    H    GLU   5           H        GLU   5   4.954   4.591  -2.598
   36    HA   GLU   5           HA       GLU   5   4.283   7.448  -2.472
   37   1HB   GLU   5          1HB       GLU   5   6.569   6.041  -3.920
   38   2HB   GLU   5          2HB       GLU   5   6.409   7.767  -3.556
   39   1HG   GLU   5          1HG       GLU   5   6.360   7.121  -1.092
   40   2HG   GLU   5          2HG       GLU   5   6.835   5.487  -1.568
   41    HE1  GLU   5           HE2      GLU   5  10.012   6.716  -2.805
   42    H    ARG   6           H        ARG   6   3.306   8.538  -4.118
   43    HA   ARG   6           HA       ARG   6   3.358   7.447  -6.868
   44   1HB   ARG   6          1HB       ARG   6   1.038   7.448  -5.261
   45   2HB   ARG   6          2HB       ARG   6   0.867   8.873  -6.271
   46   1HG   ARG   6          1HG       ARG   6   1.367   6.020  -7.231
   47   2HG   ARG   6          2HG       ARG   6  -0.197   6.829  -7.147
   48   1HD   ARG   6          1HD       ARG   6   2.135   7.469  -8.976
   49   2HD   ARG   6          2HD       ARG   6   0.528   6.966  -9.451
   50    HE   ARG   6           HE       ARG   6   1.463   9.660  -8.802
   51   1HH1  ARG   6          1HH1      ARG   6  -1.453   7.675  -8.831
   52   2HH1  ARG   6          2HH1      ARG   6  -2.542   9.032  -8.869
   53   1HH2  ARG   6          2HH2      ARG   6   0.140  11.396  -8.748
   54   2HH2  ARG   6          1HH2      ARG   6  -1.583  11.279  -8.823
   55    HA   PRO   7           HA       PRO   7   4.936  11.760  -7.123
   56   1HB   PRO   7          1HB       PRO   7   4.262  11.089 -10.003
   57   2HB   PRO   7          2HB       PRO   7   5.634  12.055  -9.382
   58   1HG   PRO   7          1HG       PRO   7   6.048   9.466 -10.045
   59   2HG   PRO   7          2HG       PRO   7   6.689  10.070  -8.488
   60   1HD   PRO   7          1HD       PRO   7   4.167   8.481  -8.977
   61   2HD   PRO   7          2HD       PRO   7   5.403   8.260  -7.700
   62    H    SER   8           H        SER   8   3.639  13.606  -6.908
   63    HA   SER   8           HA       SER   8   0.982  13.323  -6.400
   64   1HB   SER   8          1HB       SER   8   0.819  15.806  -6.611
   65   2HB   SER   8          2HB       SER   8   2.196  15.251  -5.655
   66    HG   SER   8           HG       SER   8   3.564  15.714  -7.272
   67    H    GLY   9           H        GLY   9   2.270  14.507  -9.544
   68   1HA   GLY   9          1HA       GLY   9   1.290  14.015 -11.656
   69   2HA   GLY   9          2HA       GLY   9  -0.238  13.570 -10.886
   70    H    THR  10           H        THR  10  -0.216  15.962  -9.062
   71    HA   THR  10           HA       THR  10  -1.163  18.048 -10.874
   72    HB   THR  10           HB       THR  10  -1.273  19.190  -8.519
   73    HG1  THR  10           HG1      THR  10  -1.058  17.906  -6.830
   74   1HG2  THR  10          1HG2      THR  10  -3.277  18.315  -9.643
   75   2HG2  THR  10          2HG2      THR  10  -2.939  16.689  -8.990
   76   3HG2  THR  10          3HG2      THR  10  -3.325  18.038  -7.891
   77    H    TRP  11           H        TRP  11   1.578  17.393  -8.590
   78    HA   TRP  11           HA       TRP  11   2.969  19.791  -9.700
   79   1HB   TRP  11          1HB       TRP  11   1.839  20.113  -7.530
   80   2HB   TRP  11          2HB       TRP  11   2.878  18.905  -6.813
   81    HD1  TRP  11           HD1      TRP  11   5.163  20.696  -8.995
   82    HE1  TRP  11           HE1      TRP  11   6.308  22.670  -7.838
   83    HE3  TRP  11           HE3      TRP  11   2.120  21.103  -4.927
   84    HZ2  TRP  11           HZ2      TRP  11   5.908  24.264  -5.465
   85    HZ3  TRP  11           HZ3      TRP  11   2.549  22.815  -3.195
   86    HH2  TRP  11           HH2      TRP  11   4.536  24.266  -3.373
   87    H    SER  12           H        SER  12   3.519  17.805 -11.086
   88    HA   SER  12           HA       SER  12   5.866  16.330 -10.118
   89   1HB   SER  12          1HB       SER  12   4.645  16.542 -12.897
   90   2HB   SER  12          2HB       SER  12   5.791  15.315 -12.327
   91    HG   SER  12           HG       SER  12   3.529  14.670 -12.257
   92    H    GLY  13           H        GLY  13   5.422  19.488 -10.972
   93   1HA   GLY  13          1HA       GLY  13   7.863  20.043 -12.478
   94   2HA   GLY  13          2HA       GLY  13   6.765  21.185 -11.694
   95    H    VAL  14           H        VAL  14   8.744  22.246 -10.920
   96    HA   VAL  14           HA       VAL  14  10.534  20.929  -9.092
   97    HB   VAL  14           HB       VAL  14  10.029  23.905  -9.149
   98   1HG1  VAL  14          1HG1      VAL  14  11.570  22.958  -7.439
   99   2HG1  VAL  14          2HG1      VAL  14  12.544  22.243  -8.741
  100   3HG1  VAL  14          3HG1      VAL  14  12.412  24.006  -8.590
  101   1HG2  VAL  14          2HG2      VAL  14  11.605  22.292 -11.188
  102   2HG2  VAL  14          3HG2      VAL  14  10.275  23.423 -11.511
  103   3HG2  VAL  14          1HG2      VAL  14  11.824  24.034 -10.929
  104    H    CYS  15           H        CYS  15   9.990  20.391  -7.002
  105    HA   CYS  15           HA       CYS  15   7.358  20.991  -6.044
  106   1HB   CYS  15          1HB       CYS  15   7.650  19.290  -4.710
  107   2HB   CYS  15          2HB       CYS  15   9.290  19.093  -5.324
  108    H    GLY  16           H        GLY  16  10.513  22.418  -5.221
  109   1HA   GLY  16          1HA       GLY  16  10.980  24.386  -4.127
  110   2HA   GLY  16          2HA       GLY  16   9.254  24.742  -4.044
  111    H    ASN  17           H        ASN  17   8.315  22.538  -2.463
  112    HA   ASN  17           HA       ASN  17   9.796  22.563   0.042
  113   1HB   ASN  17          1HB       ASN  17   9.014  24.890   0.073
  114   2HB   ASN  17          2HB       ASN  17   7.369  24.370  -0.324
  115   1HD2  ASN  17          2HD2      ASN  17   8.787  23.909   3.524
  116   2HD2  ASN  17          1HD2      ASN  17   9.911  24.181   2.207
  117    H    ASN  18           H        ASN  18   9.253  20.966   1.308
  118    HA   ASN  18           HA       ASN  18   7.593  18.871   0.798
  119   1HB   ASN  18          1HB       ASN  18   9.406  19.076   2.529
  120   2HB   ASN  18          2HB       ASN  18   8.314  19.966   3.569
  121   1HD2  ASN  18          2HD2      ASN  18   7.973  15.939   3.301
  122   2HD2  ASN  18          1HD2      ASN  18   9.364  16.824   2.666
  123    H    ASN  19           H        ASN  19   6.889  21.388   3.182
  124    HA   ASN  19           HA       ASN  19   4.323  20.476   3.868
  125   1HB   ASN  19          1HB       ASN  19   5.560  22.017   5.283
  126   2HB   ASN  19          2HB       ASN  19   5.364  23.320   4.101
  127   1HD2  ASN  19          2HD2      ASN  19   2.063  24.091   5.139
  128   2HD2  ASN  19          1HD2      ASN  19   3.414  24.508   4.102
  129    H    ALA  20           H        ALA  20   5.162  23.064   1.526
  130    HA   ALA  20           HA       ALA  20   2.509  23.705   0.740
  131   1HB   ALA  20          3HB       ALA  20   4.507  24.991   0.013
  132   2HB   ALA  20          1HB       ALA  20   4.991  23.629  -1.031
  133   3HB   ALA  20          2HB       ALA  20   3.470  24.495  -1.341
  134    H    CYS  21           H        CYS  21   4.833  21.367  -0.711
  135    HA   CYS  21           HA       CYS  21   3.200  20.273  -2.657
  136   1HB   CYS  21          1HB       CYS  21   5.389  19.514  -2.737
  137   2HB   CYS  21          2HB       CYS  21   5.480  19.214  -1.004
  138    H    LYS  22           H        LYS  22   3.625  19.151   0.697
  139    HA   LYS  22           HA       LYS  22   1.934  16.954   0.790
  140   1HB   LYS  22          1HB       LYS  22   3.505  17.615   2.542
  141   2HB   LYS  22          2HB       LYS  22   2.559  19.044   2.933
  142   1HG   LYS  22          1HG       LYS  22   0.631  17.639   3.610
  143   2HG   LYS  22          2HG       LYS  22   1.562  16.208   3.288
  144   1HD   LYS  22          1HD       LYS  22   1.658  18.224   5.506
  145   2HD   LYS  22          2HD       LYS  22   1.814  16.479   5.628
  146   1HE   LYS  22          1HE       LYS  22   3.955  18.500   4.782
  147   2HE   LYS  22          2HE       LYS  22   3.863  17.686   6.335
  148   1HZ   LYS  22          1HZ       LYS  22   4.214  16.235   3.801
  149   2HZ   LYS  22          2HZ       LYS  22   5.462  16.803   4.677
  150   3HZ   LYS  22          3HZ       LYS  22   4.454  15.660   5.324
  151    H    ASN  23           H        ASN  23   1.178  20.270   1.831
  152    HA   ASN  23           HA       ASN  23  -1.515  19.827   2.408
  153   1HB   ASN  23          1HB       ASN  23  -0.565  21.894   3.163
  154   2HB   ASN  23          2HB       ASN  23   0.072  22.279   1.562
  155   1HD2  ASN  23          2HD2      ASN  23  -2.591  24.531   1.136
  156   2HD2  ASN  23          1HD2      ASN  23  -0.857  24.291   1.229
  157    H    GLN  24           H        GLN  24  -0.080  21.287  -0.570
  158    HA   GLN  24           HA       GLN  24  -2.376  21.458  -2.149
  159   1HB   GLN  24          1HB       GLN  24  -0.295  22.426  -2.810
  160   2HB   GLN  24          2HB       GLN  24   0.537  20.882  -2.835
  161   1HG   GLN  24          1HG       GLN  24  -1.792  21.586  -4.685
  162   2HG   GLN  24          2HG       GLN  24  -0.112  21.920  -5.093
  163   1HE2  GLN  24          2HE2      GLN  24   0.607  18.218  -5.143
  164   2HE2  GLN  24          1HE2      GLN  24   1.130  19.511  -4.093
  165    H    CYS  25           H        CYS  25  -0.261  18.508  -1.866
  166    HA   CYS  25           HA       CYS  25  -1.798  17.091  -3.745
  167   1HB   CYS  25          1HB       CYS  25   0.352  16.185  -2.891
  168   2HB   CYS  25          2HB       CYS  25  -0.434  15.799  -1.356
  169    H    ILE  26           H        ILE  26  -2.121  16.984  -0.121
  170    HA   ILE  26           HA       ILE  26  -4.425  15.209  -0.430
  171    HB   ILE  26           HB       ILE  26  -4.571  15.210   1.943
  172   1HG1  ILE  26          1HG1      ILE  26  -2.687  17.606   1.907
  173   2HG1  ILE  26          2HG1      ILE  26  -4.337  17.536   2.535
  174   1HG2  ILE  26          2HG2      ILE  26  -2.716  13.996   0.729
  175   2HG2  ILE  26          3HG2      ILE  26  -1.614  15.302   1.217
  176   3HG2  ILE  26          1HG2      ILE  26  -2.417  14.301   2.441
  177   1HD1  ILE  26          1HD1      ILE  26  -3.538  15.845   4.241
  178   2HD1  ILE  26          2HD1      ILE  26  -1.875  16.153   3.683
  179   3HD1  ILE  26          3HD1      ILE  26  -2.821  17.462   4.400
  180    H    ASN  27           H        ASN  27  -4.023  18.620  -0.502
  181    HA   ASN  27           HA       ASN  27  -6.703  19.320   0.382
  182   1HB   ASN  27          1HB       ASN  27  -4.695  20.657   0.685
  183   2HB   ASN  27          2HB       ASN  27  -4.568  20.944  -1.068
  184   1HD2  ASN  27          2HD2      ASN  27  -6.318  23.713   0.930
  185   2HD2  ASN  27          1HD2      ASN  27  -4.869  22.759   1.277
  186    H    LEU  28           H        LEU  28  -4.948  19.309  -2.771
  187    HA   LEU  28           HA       LEU  28  -7.380  19.629  -4.344
  188   1HB   LEU  28          1HB       LEU  28  -4.454  19.123  -4.945
  189   2HB   LEU  28          2HB       LEU  28  -5.678  18.823  -6.174
  190    HG   LEU  28           HG       LEU  28  -6.506  21.130  -5.993
  191   1HD1  LEU  28          2HD1      LEU  28  -4.206  21.510  -4.024
  192   2HD1  LEU  28          3HD1      LEU  28  -5.099  22.831  -4.803
  193   3HD1  LEU  28          1HD1      LEU  28  -5.940  21.743  -3.699
  194   1HD2  LEU  28          1HD2      LEU  28  -4.776  20.518  -7.645
  195   2HD2  LEU  28          2HD2      LEU  28  -4.578  22.190  -7.092
  196   3HD2  LEU  28          3HD2      LEU  28  -3.506  20.918  -6.471
  197    H    GLU  29           H        GLU  29  -5.045  16.812  -4.386
  198    HA   GLU  29           HA       GLU  29  -7.412  15.137  -5.041
  199   1HB   GLU  29          1HB       GLU  29  -5.817  13.357  -5.513
  200   2HB   GLU  29          2HB       GLU  29  -5.593  14.785  -6.510
  201   1HG   GLU  29          1HG       GLU  29  -3.888  14.381  -4.050
  202   2HG   GLU  29          2HG       GLU  29  -3.567  13.464  -5.516
  203    HE2  GLU  29           HE2      GLU  29  -1.756  15.960  -6.952
  204    H    LYS  30           H        LYS  30  -7.088  12.799  -3.892
  205    HA   LYS  30           HA       LYS  30  -7.440  13.507  -1.040
  206   1HB   LYS  30          1HB       LYS  30  -9.044  11.660  -2.794
  207   2HB   LYS  30          2HB       LYS  30  -9.268  11.809  -1.042
  208   1HG   LYS  30          1HG       LYS  30  -9.413  14.190  -2.958
  209   2HG   LYS  30          2HG       LYS  30 -10.803  13.263  -2.440
  210   1HD   LYS  30          1HD       LYS  30 -10.896  14.154  -0.389
  211   2HD   LYS  30          2HD       LYS  30  -9.179  14.228  -0.122
  212   1HE   LYS  30          1HE       LYS  30 -10.759  16.210  -1.834
  213   2HE   LYS  30          2HE       LYS  30 -10.288  16.439  -0.147
  214   1HZ   LYS  30          3HZ       LYS  30  -7.904  16.274  -0.934
  215   2HZ   LYS  30          1HZ       LYS  30  -8.470  16.368  -2.466
  216   3HZ   LYS  30          2HZ       LYS  30  -8.746  17.580  -1.447
  217    H    ALA  31           H        ALA  31  -4.992  12.467  -2.253
  218    HA   ALA  31           HA       ALA  31  -4.228   9.976  -1.149
  219   1HB   ALA  31          2HB       ALA  31  -2.912  11.564  -2.670
  220   2HB   ALA  31          3HB       ALA  31  -2.658  12.572  -1.238
  221   3HB   ALA  31          1HB       ALA  31  -1.988  10.924  -1.303
  222    H    ARG  32           H        ARG  32  -2.131  10.572   0.729
  223    HA   ARG  32           HA       ARG  32  -3.731  11.471   3.095
  224   1HB   ARG  32          1HB       ARG  32  -3.556   8.884   2.381
  225   2HB   ARG  32          2HB       ARG  32  -2.037   8.997   3.267
  226   1HG   ARG  32          1HG       ARG  32  -3.951   8.160   4.593
  227   2HG   ARG  32          2HG       ARG  32  -3.234   9.611   5.296
  228   1HD   ARG  32          1HD       ARG  32  -5.823   9.489   5.270
  229   2HD   ARG  32          2HD       ARG  32  -5.081  10.966   4.729
  230    HE   ARG  32           HE       ARG  32  -5.761  10.650   2.554
  231   1HH1  ARG  32          1HH1      ARG  32  -6.325   7.674   4.356
  232   2HH1  ARG  32          2HH1      ARG  32  -7.320   6.932   3.138
  233   1HH2  ARG  32          2HH2      ARG  32  -7.046   9.713   0.917
  234   2HH2  ARG  32          1HH2      ARG  32  -7.730   8.133   1.114
  235    H    HIS  33           H        HIS  33  -0.446  10.602   2.025
  236    HA   HIS  33           HA       HIS  33   0.498  12.884   3.699
  237   1HB   HIS  33          2HB       HIS  33   1.671  10.125   3.416
  238   2HB   HIS  33          1HB       HIS  33   2.779  11.510   3.449
  239    HD1  HIS  33           HD1      HIS  33  -0.373  11.739   5.492
  240    HD2  HIS  33           HD2      HIS  33   3.675  10.728   5.981
  241    HE1  HIS  33           HE1      HIS  33   0.087  11.646   7.998
  242    H    GLY  34           H        GLY  34   2.506  13.839   2.749
  243   1HA   GLY  34          1HA       GLY  34   3.068  13.372   0.022
  244   2HA   GLY  34          2HA       GLY  34   2.196  14.895   0.179
  245    H    SER  35           H        SER  35   5.064  14.458  -0.552
  246    HA   SER  35           HA       SER  35   6.398  16.255   1.236
  247   1HB   SER  35          1HB       SER  35   6.890  13.257   1.500
  248   2HB   SER  35          2HB       SER  35   8.234  14.365   1.736
  249    HG   SER  35           HG       SER  35   5.750  14.477   3.074
  250    H    CYS  36           H        CYS  36   8.900  16.088   0.598
  251    HA   CYS  36           HA       CYS  36   9.073  15.696  -2.356
  252   1HB   CYS  36          1HB       CYS  36  10.261  17.963  -0.714
  253   2HB   CYS  36          2HB       CYS  36  10.517  17.669  -2.432
  254    H    ASN  37           H        ASN  37  11.143  15.144  -3.067
  255    HA   ASN  37           HA       ASN  37  13.322  14.607  -1.205
  256   1HB   ASN  37          1HB       ASN  37  12.316  12.396  -1.177
  257   2HB   ASN  37          2HB       ASN  37  11.923  12.487  -2.903
  258   1HD2  ASN  37          2HD2      ASN  37  15.014  11.194  -3.946
  259   2HD2  ASN  37          1HD2      ASN  37  13.288  11.307  -4.199
  260    H    TYR  38           H        TYR  38  15.335  14.340  -2.637
  261    HA   TYR  38           HA       TYR  38  15.180  16.145  -4.898
  262   1HB   TYR  38          1HB       TYR  38  17.253  15.975  -3.626
  263   2HB   TYR  38          2HB       TYR  38  17.424  14.276  -4.081
  264    HD1  TYR  38           HD2      TYR  38  17.463  17.784  -5.352
  265    HD2  TYR  38           HD1      TYR  38  18.145  13.643  -6.349
  266    HE1  TYR  38           HE2      TYR  38  18.092  18.428  -7.667
  267    HE2  TYR  38           HE1      TYR  38  18.593  14.288  -8.698
  268    HH   TYR  38           HH       TYR  38  18.028  17.595  -9.881
  269    H    VAL  39           H        VAL  39  14.076  15.582  -6.625
  270    HA   VAL  39           HA       VAL  39  14.850  13.205  -8.138
  271    HB   VAL  39           HB       VAL  39  11.927  14.056  -7.846
  272   1HG1  VAL  39          2HG1      VAL  39  13.236  11.624  -9.161
  273   2HG1  VAL  39          3HG1      VAL  39  11.491  11.903  -9.028
  274   3HG1  VAL  39          1HG1      VAL  39  12.473  12.976 -10.021
  275   1HG2  VAL  39          1HG2      VAL  39  13.346  11.672  -6.584
  276   2HG2  VAL  39          2HG2      VAL  39  12.544  13.009  -5.727
  277   3HG2  VAL  39          3HG2      VAL  39  11.586  11.869  -6.668
  278    H    PHE  40           H        PHE  40  14.456  13.741 -10.482
  279    HA   PHE  40           HA       PHE  40  15.511  16.228 -11.016
  280   1HB   PHE  40          1HB       PHE  40  15.399  15.713 -13.275
  281   2HB   PHE  40          2HB       PHE  40  15.418  14.136 -12.526
  282    HD1  PHE  40           HD1      PHE  40  13.285  12.751 -12.503
  283    HD2  PHE  40           HD2      PHE  40  13.516  16.558 -14.527
  284    HE1  PHE  40           HE1      PHE  40  11.224  12.215 -13.767
  285    HE2  PHE  40           HE2      PHE  40  11.440  16.028 -15.760
  286    HZ   PHE  40           HZ       PHE  40  10.294  13.849 -15.394
  287    HA   PRO  41           HA       PRO  41  15.596  17.948 -12.507
  288   1HB   PRO  41          1HB       PRO  41  15.370  20.621 -12.596
  289   2HB   PRO  41          2HB       PRO  41  14.563  19.567 -13.797
  290   1HG   PRO  41          1HG       PRO  41  13.334  20.810 -11.328
  291   2HG   PRO  41          2HG       PRO  41  12.702  20.846 -12.998
  292   1HD   PRO  41          1HD       PRO  41  11.864  18.984 -11.143
  293   2HD   PRO  41          2HD       PRO  41  12.004  18.592 -12.880
  294    H    ALA  42           H        ALA  42  13.737  19.244  -9.741
  295    HA   ALA  42           HA       ALA  42  15.969  19.083  -7.922
  296   1HB   ALA  42          2HB       ALA  42  15.039  21.853  -8.788
  297   2HB   ALA  42          3HB       ALA  42  16.117  21.498  -7.421
  298   3HB   ALA  42          1HB       ALA  42  16.652  21.156  -9.076
  299    H    HIS  43           H        HIS  43  13.967  17.742  -7.544
  300    HA   HIS  43           HA       HIS  43  12.713  17.185  -5.714
  301   1HB   HIS  43          2HB       HIS  43  12.018  20.116  -5.233
  302   2HB   HIS  43          1HB       HIS  43  11.499  18.773  -4.286
  303    HD1  HIS  43           HD1      HIS  43  14.494  20.872  -4.963
  304    HD2  HIS  43           HD2      HIS  43  13.457  17.603  -2.565
  305    HE1  HIS  43           HE1      HIS  43  16.385  20.542  -3.260
  306    H    LYS  44           H        LYS  44  10.684  16.392  -5.897
  307    HA   LYS  44           HA       LYS  44   8.701  17.710  -7.694
  308   1HB   LYS  44          1HB       LYS  44   9.606  14.819  -7.547
  309   2HB   LYS  44          2HB       LYS  44   7.929  15.217  -7.965
  310   1HG   LYS  44          1HG       LYS  44   8.531  16.486  -9.837
  311   2HG   LYS  44          2HG       LYS  44  10.267  16.448  -9.448
  312   1HD   LYS  44          1HD       LYS  44  10.493  14.183  -9.948
  313   2HD   LYS  44          2HD       LYS  44   8.788  13.816  -9.715
  314   1HE   LYS  44          1HE       LYS  44   9.635  13.735 -12.124
  315   2HE   LYS  44          2HE       LYS  44   8.147  14.646 -11.836
  316   1HZ   LYS  44          3HZ       LYS  44  10.761  15.961 -11.940
  317   2HZ   LYS  44          1HZ       LYS  44   9.842  15.734 -13.279
  318   3HZ   LYS  44          2HZ       LYS  44   9.249  16.644 -12.039
  319    H    CYS  45           H        CYS  45   6.491  17.342  -6.944
  320    HA   CYS  45           HA       CYS  45   6.383  16.909  -4.049
  321   1HB   CYS  45          1HB       CYS  45   4.960  18.629  -5.074
  322   2HB   CYS  45          2HB       CYS  45   4.199  17.385  -6.078
  323    H    ILE  46           H        ILE  46   6.700  14.835  -3.466
  324    HA   ILE  46           HA       ILE  46   5.602  12.594  -5.078
  325    HB   ILE  46           HB       ILE  46   7.312  12.548  -2.563
  326   1HG1  ILE  46          1HG1      ILE  46   8.706  13.575  -4.195
  327   2HG1  ILE  46          2HG1      ILE  46   9.195  11.894  -4.039
  328   1HG2  ILE  46          3HG2      ILE  46   6.563  10.383  -4.575
  329   2HG2  ILE  46          1HG2      ILE  46   7.711  10.193  -3.229
  330   3HG2  ILE  46          2HG2      ILE  46   6.003  10.512  -2.902
  331   1HD1  ILE  46          2HD1      ILE  46   7.951  11.345  -6.144
  332   2HD1  ILE  46          3HD1      ILE  46   7.523  13.064  -6.313
  333   3HD1  ILE  46          1HD1      ILE  46   9.215  12.561  -6.380
  334    H    CYS  47           H        CYS  47   3.588  11.796  -4.501
  335    HA   CYS  47           HA       CYS  47   2.507  12.765  -1.902
  336   1HB   CYS  47          1HB       CYS  47   1.416  13.550  -3.972
  337   2HB   CYS  47          2HB       CYS  47   0.868  11.882  -4.246
  338    H    TYR  48           H        TYR  48   1.256  11.209  -0.624
  339    HA   TYR  48           HA       TYR  48   2.209   8.408  -1.042
  340   1HB   TYR  48          1HB       TYR  48   2.372  10.178   1.383
  341   2HB   TYR  48          2HB       TYR  48   2.563   8.426   1.428
  342    HD1  TYR  48           HD1      TYR  48   4.014  11.490  -0.195
  343    HD2  TYR  48           HD2      TYR  48   4.747   7.572   1.430
  344    HE1  TYR  48           HE1      TYR  48   6.441  11.861  -0.412
  345    HE2  TYR  48           HE2      TYR  48   7.176   7.985   1.302
  346    HH   TYR  48           HH       TYR  48   8.734   9.275  -0.008
  347    H    PHE  49           H        PHE  49   0.723   6.844  -0.586
  348    HA   PHE  49           HA       PHE  49  -1.844   7.630   0.644
  349   1HB   PHE  49          1HB       PHE  49  -1.608   5.725  -1.678
  350   2HB   PHE  49          2HB       PHE  49  -2.989   6.544  -1.066
  351    HD1  PHE  49           HD2      PHE  49   0.340   7.547  -2.634
  352    HD2  PHE  49           HD1      PHE  49  -3.954   7.969  -2.672
  353    HE1  PHE  49           HE2      PHE  49   0.541   9.486  -4.121
  354    HE2  PHE  49           HE1      PHE  49  -3.742   9.559  -4.555
  355    HZ   PHE  49           HZ       PHE  49  -1.459  10.280  -5.327
  356    HA   PRO  50           HA       PRO  50  -1.001   3.785   2.899
  357   1HB   PRO  50          1HB       PRO  50  -3.552   3.083   3.647
  358   2HB   PRO  50          2HB       PRO  50  -2.676   4.471   4.349
  359   1HG   PRO  50          1HG       PRO  50  -4.701   4.495   2.092
  360   2HG   PRO  50          2HG       PRO  50  -4.674   5.528   3.552
  361   1HD   PRO  50          1HD       PRO  50  -3.627   6.372   1.153
  362   2HD   PRO  50          2HD       PRO  50  -2.832   6.790   2.713
  363    H    CYS  51           H        CYS  51  -0.501   1.822   1.921
  364    HA   CYS  51           HA       CYS  51  -2.388   0.482   0.102
  365   1HB   CYS  51          1HB       CYS  51  -1.756   1.821  -1.607
  366   2HB   CYS  51          2HB       CYS  51  -0.344   2.406  -0.759
   
  No H/Q in entry =         366
  Start of MODEL    5
    1    HA   PCA   1           HA       PYR   1  -0.806  -2.694   4.114
    2   1HB   PCA   1          1HB       PYR   1   1.865  -3.490   3.505
    3   2HB   PCA   1          2HB       PYR   1   0.421  -4.532   3.552
    4   1HG   PCA   1          1HG       PYR   1   1.818  -3.463   1.150
    5   2HG   PCA   1          2HG       PYR   1   0.706  -4.857   1.289
    6    HN   PCA   1           HN       PYR   1  -1.425  -1.477   1.941
    7    H    LYS   2           H        LYS   2   1.838  -1.306   2.126
    8    HA   LYS   2           HA       LYS   2   2.223   0.868   4.133
    9   1HB   LYS   2          1HB       LYS   2   4.227   1.415   3.031
   10   2HB   LYS   2          2HB       LYS   2   4.272  -0.312   3.380
   11   1HG   LYS   2          1HG       LYS   2   3.963  -0.901   1.072
   12   2HG   LYS   2          2HG       LYS   2   3.413   0.724   0.651
   13   1HD   LYS   2          1HD       LYS   2   5.754   1.556   1.414
   14   2HD   LYS   2          2HD       LYS   2   6.229  -0.141   1.418
   15   1HE   LYS   2          1HE       LYS   2   6.881   1.033  -0.645
   16   2HE   LYS   2          2HE       LYS   2   5.764  -0.289  -1.015
   17   1HZ   LYS   2          2HZ       LYS   2   4.693   2.415  -0.599
   18   2HZ   LYS   2          3HZ       LYS   2   5.417   2.089  -2.019
   19   3HZ   LYS   2          1HZ       LYS   2   4.108   1.215  -1.523
   20    H    LEU   3           H        LEU   3   2.576   3.087   3.014
   21    HA   LEU   3           HA       LEU   3   0.280   3.687   1.332
   22   1HB   LEU   3          1HB       LEU   3   2.659   5.446   1.885
   23   2HB   LEU   3          2HB       LEU   3   1.101   5.902   1.213
   24    HG   LEU   3           HG       LEU   3   0.221   4.807   3.542
   25   1HD1  LEU   3          1HD1      LEU   3   2.962   6.054   4.141
   26   2HD1  LEU   3          2HD1      LEU   3   1.739   5.660   5.366
   27   3HD1  LEU   3          3HD1      LEU   3   2.516   4.370   4.449
   28   1HD2  LEU   3          1HD2      LEU   3  -0.339   7.038   2.652
   29   2HD2  LEU   3          2HD2      LEU   3   0.007   7.073   4.394
   30   3HD2  LEU   3          3HD2      LEU   3   1.212   7.663   3.249
   31    H    CYS   4           H        CYS   4   0.301   4.254  -0.807
   32    HA   CYS   4           HA       CYS   4   2.596   3.356  -2.489
   33   1HB   CYS   4          1HB       CYS   4  -0.307   3.908  -3.107
   34   2HB   CYS   4          2HB       CYS   4   0.949   3.954  -4.355
   35    H    GLU   5           H        GLU   5   4.087   4.850  -2.396
   36    HA   GLU   5           HA       GLU   5   3.726   7.683  -2.426
   37   1HB   GLU   5          1HB       GLU   5   6.068   7.794  -2.766
   38   2HB   GLU   5          2HB       GLU   5   5.744   6.479  -1.640
   39   1HG   GLU   5          1HG       GLU   5   6.664   6.304  -4.525
   40   2HG   GLU   5          2HG       GLU   5   7.487   5.748  -3.076
   41    HE2  GLU   5           HE2      GLU   5   5.321   4.826  -5.508
   42    H    ARG   6           H        ARG   6   2.959   8.900  -4.106
   43    HA   ARG   6           HA       ARG   6   3.714   8.189  -6.882
   44   1HB   ARG   6          1HB       ARG   6   1.119   7.753  -6.008
   45   2HB   ARG   6          2HB       ARG   6   1.035   9.446  -6.468
   46   1HG   ARG   6          1HG       ARG   6   2.337   8.326  -8.656
   47   2HG   ARG   6          2HG       ARG   6   1.341   6.983  -8.099
   48   1HD   ARG   6          1HD       ARG   6   0.227   8.163  -9.842
   49   2HD   ARG   6          2HD       ARG   6  -0.672   8.443  -8.344
   50    HE   ARG   6           HE       ARG   6   0.887  10.599  -8.288
   51   1HH1  ARG   6          1HH2      ARG   6  -0.862   9.390 -11.134
   52   2HH1  ARG   6          2HH2      ARG   6  -0.829  10.936 -11.933
   53   1HH2  ARG   6          1HH1      ARG   6   0.838  12.561  -9.253
   54   2HH2  ARG   6          2HH1      ARG   6   0.255  12.835 -10.846
   55    HA   PRO   7           HA       PRO   7   4.715  12.617  -6.594
   56   1HB   PRO   7          1HB       PRO   7   3.848  12.547  -9.497
   57   2HB   PRO   7          2HB       PRO   7   5.233  13.421  -8.777
   58   1HG   PRO   7          1HG       PRO   7   5.658  11.073 -10.072
   59   2HG   PRO   7          2HG       PRO   7   6.453  11.363  -8.496
   60   1HD   PRO   7          1HD       PRO   7   3.966   9.733  -9.049
   61   2HD   PRO   7          2HD       PRO   7   5.357   9.352  -7.993
   62    H    SER   8           H        SER   8   3.194  14.377  -6.162
   63    HA   SER   8           HA       SER   8   0.665  13.750  -5.405
   64   1HB   SER   8          1HB       SER   8   1.500  15.822  -4.725
   65   2HB   SER   8          2HB       SER   8   1.795  16.328  -6.394
   66    HG   SER   8           HG       SER   8  -0.813  15.941  -5.275
   67    H    GLY   9           H        GLY   9  -1.380  13.617  -6.139
   68   1HA   GLY   9          1HA       GLY   9  -1.919  12.682  -8.767
   69   2HA   GLY   9          2HA       GLY   9  -3.100  13.212  -7.557
   70    H    THR  10           H        THR  10  -2.373  15.860  -7.143
   71    HA   THR  10           HA       THR  10  -3.265  17.148  -9.644
   72    HB   THR  10           HB       THR  10  -3.197  19.183  -8.081
   73    HG1  THR  10           HG1      THR  10  -1.846  18.467  -6.446
   74   1HG2  THR  10          1HG2      THR  10  -4.892  16.753  -7.334
   75   2HG2  THR  10          2HG2      THR  10  -5.202  18.420  -6.810
   76   3HG2  THR  10          3HG2      THR  10  -5.284  18.003  -8.532
   77    H    TRP  11           H        TRP  11  -0.478  17.400  -7.337
   78    HA   TRP  11           HA       TRP  11   0.807  19.269  -9.222
   79   1HB   TRP  11          1HB       TRP  11   0.525  19.664  -6.777
   80   2HB   TRP  11          2HB       TRP  11   1.730  18.438  -6.457
   81    HD1  TRP  11           HD1      TRP  11   3.609  19.623  -9.039
   82    HE1  TRP  11           HE1      TRP  11   5.086  21.641  -8.443
   83    HE3  TRP  11           HE3      TRP  11   1.146  21.254  -4.862
   84    HZ2  TRP  11           HZ2      TRP  11   5.146  23.721  -6.484
   85    HZ3  TRP  11           HZ3      TRP  11   2.039  23.155  -3.568
   86    HH2  TRP  11           HH2      TRP  11   4.081  24.331  -4.312
   87    H    SER  12           H        SER  12   0.784  17.339 -10.717
   88    HA   SER  12           HA       SER  12   2.974  15.377 -10.315
   89   1HB   SER  12          1HB       SER  12   1.095  15.939 -12.655
   90   2HB   SER  12          2HB       SER  12   2.238  14.591 -12.564
   91    HG   SER  12           HG       SER  12   0.483  14.921 -10.402
   92    H    GLY  13           H        GLY  13   4.403  17.426 -10.004
   93   1HA   GLY  13          1HA       GLY  13   5.925  17.938 -12.434
   94   2HA   GLY  13          2HA       GLY  13   4.964  19.331 -11.894
   95    H    VAL  14           H        VAL  14   7.242  20.210 -11.737
   96    HA   VAL  14           HA       VAL  14   9.105  19.285  -9.859
   97    HB   VAL  14           HB       VAL  14   8.644  22.122 -10.858
   98   1HG1  VAL  14          1HG1      VAL  14  11.079  20.867  -9.514
   99   2HG1  VAL  14          2HG1      VAL  14  11.059  22.455 -10.306
  100   3HG1  VAL  14          3HG1      VAL  14  10.075  22.183  -8.867
  101   1HG2  VAL  14          2HG2      VAL  14  10.496  19.902 -11.848
  102   2HG2  VAL  14          3HG2      VAL  14   9.078  20.533 -12.713
  103   3HG2  VAL  14          1HG2      VAL  14  10.483  21.570 -12.451
  104    H    CYS  15           H        CYS  15   9.378  19.726  -7.634
  105    HA   CYS  15           HA       CYS  15   6.897  20.044  -6.313
  106   1HB   CYS  15          1HB       CYS  15   7.888  19.185  -4.498
  107   2HB   CYS  15          2HB       CYS  15   9.275  18.916  -5.547
  108    H    GLY  16           H        GLY  16   9.513  22.451  -6.614
  109   1HA   GLY  16          1HA       GLY  16   9.494  24.699  -6.103
  110   2HA   GLY  16          2HA       GLY  16   7.763  24.601  -5.773
  111    H    ASN  17           H        ASN  17   7.709  22.768  -3.613
  112    HA   ASN  17           HA       ASN  17   9.343  23.636  -1.421
  113   1HB   ASN  17          1HB       ASN  17   8.257  25.810  -1.737
  114   2HB   ASN  17          2HB       ASN  17   6.668  25.037  -1.799
  115   1HD2  ASN  17          2HD2      ASN  17   8.541  25.620   1.825
  116   2HD2  ASN  17          1HD2      ASN  17   9.435  25.807   0.330
  117    H    ASN  18           H        ASN  18   9.096  22.209   0.199
  118    HA   ASN  18           HA       ASN  18   7.608  19.906   0.165
  119   1HB   ASN  18          1HB       ASN  18   9.594  20.527   1.596
  120   2HB   ASN  18          2HB       ASN  18   8.533  21.439   2.646
  121   1HD2  ASN  18          2HD2      ASN  18   8.775  17.462   3.088
  122   2HD2  ASN  18          1HD2      ASN  18   9.845  18.335   2.014
  123    H    ASN  19           H        ASN  19   6.905  22.607   2.295
  124    HA   ASN  19           HA       ASN  19   4.526  21.584   3.375
  125   1HB   ASN  19          1HB       ASN  19   5.711  23.425   4.423
  126   2HB   ASN  19          2HB       ASN  19   5.344  24.501   3.063
  127   1HD2  ASN  19          2HD2      ASN  19   2.087  25.266   4.235
  128   2HD2  ASN  19          1HD2      ASN  19   3.328  25.571   3.033
  129    H    ALA  20           H        ALA  20   4.885  23.887   0.630
  130    HA   ALA  20           HA       ALA  20   2.111  24.169   0.084
  131   1HB   ALA  20          2HB       ALA  20   3.865  25.616  -0.901
  132   2HB   ALA  20          3HB       ALA  20   4.415  24.251  -1.902
  133   3HB   ALA  20          1HB       ALA  20   2.788  24.928  -2.126
  134    H    CYS  21           H        CYS  21   4.535  21.930  -1.378
  135    HA   CYS  21           HA       CYS  21   2.881  20.464  -3.053
  136   1HB   CYS  21          1HB       CYS  21   5.176  20.005  -3.195
  137   2HB   CYS  21          2HB       CYS  21   5.349  19.774  -1.456
  138    H    LYS  22           H        LYS  22   3.756  19.642   0.284
  139    HA   LYS  22           HA       LYS  22   2.212  17.386   0.793
  140   1HB   LYS  22          1HB       LYS  22   3.943  18.299   2.232
  141   2HB   LYS  22          2HB       LYS  22   3.044  19.763   2.530
  142   1HG   LYS  22          1HG       LYS  22   1.295  18.581   3.734
  143   2HG   LYS  22          2HG       LYS  22   2.122  17.047   3.547
  144   1HD   LYS  22          1HD       LYS  22   3.372  19.517   4.888
  145   2HD   LYS  22          2HD       LYS  22   2.334  18.398   5.755
  146   1HE   LYS  22          1HE       LYS  22   4.644  17.876   6.246
  147   2HE   LYS  22          2HE       LYS  22   3.865  16.535   5.395
  148   1HZ   LYS  22          2HZ       LYS  22   5.712  18.491   4.131
  149   2HZ   LYS  22          3HZ       LYS  22   6.057  16.924   4.494
  150   3HZ   LYS  22          1HZ       LYS  22   4.932  17.229   3.405
  151    H    ASN  23           H        ASN  23   1.367  20.774   1.617
  152    HA   ASN  23           HA       ASN  23  -1.231  20.276   2.537
  153   1HB   ASN  23          1HB       ASN  23  -0.285  22.431   2.995
  154   2HB   ASN  23          2HB       ASN  23   0.096  22.712   1.291
  155   1HD2  ASN  23          2HD2      ASN  23  -2.824  24.614   0.896
  156   2HD2  ASN  23          1HD2      ASN  23  -1.099  24.457   0.636
  157    H    GLN  24           H        GLN  24  -0.332  21.591  -0.725
  158    HA   GLN  24           HA       GLN  24  -2.973  21.516  -1.722
  159   1HB   GLN  24          1HB       GLN  24  -0.284  21.309  -3.123
  160   2HB   GLN  24          2HB       GLN  24  -1.836  21.418  -3.983
  161   1HG   GLN  24          1HG       GLN  24  -2.345  23.557  -2.861
  162   2HG   GLN  24          2HG       GLN  24  -0.834  23.458  -1.941
  163   1HE2  GLN  24          2HE2      GLN  24  -0.221  24.003  -5.972
  164   2HE2  GLN  24          1HE2      GLN  24  -1.271  22.699  -5.445
  165    H    CYS  25           H        CYS  25  -0.478  18.891  -1.836
  166    HA   CYS  25           HA       CYS  25  -2.041  17.148  -3.373
  167   1HB   CYS  25          1HB       CYS  25   0.272  16.555  -2.720
  168   2HB   CYS  25          2HB       CYS  25  -0.258  16.304  -1.062
  169    H    ILE  26           H        ILE  26  -1.879  17.205   0.264
  170    HA   ILE  26           HA       ILE  26  -3.995  15.169   0.305
  171    HB   ILE  26           HB       ILE  26  -3.609  15.051   2.631
  172   1HG1  ILE  26          1HG1      ILE  26  -2.287  17.780   2.444
  173   2HG1  ILE  26          2HG1      ILE  26  -3.767  17.337   3.313
  174   1HG2  ILE  26          2HG2      ILE  26  -1.797  14.202   1.152
  175   2HG2  ILE  26          3HG2      ILE  26  -0.918  15.731   1.335
  176   3HG2  ILE  26          1HG2      ILE  26  -1.187  14.707   2.723
  177   1HD1  ILE  26          1HD1      ILE  26  -2.400  15.840   4.789
  178   2HD1  ILE  26          2HD1      ILE  26  -0.935  16.518   4.030
  179   3HD1  ILE  26          3HD1      ILE  26  -2.035  17.573   4.925
  180    H    ASN  27           H        ASN  27  -3.915  18.600   0.282
  181    HA   ASN  27           HA       ASN  27  -6.432  19.074   1.642
  182   1HB   ASN  27          1HB       ASN  27  -4.569  20.641   1.545
  183   2HB   ASN  27          2HB       ASN  27  -4.783  20.845  -0.214
  184   1HD2  ASN  27          2HD2      ASN  27  -6.451  23.558   1.883
  185   2HD2  ASN  27          1HD2      ASN  27  -4.855  22.804   1.982
  186    H    LEU  28           H        LEU  28  -5.321  19.164  -1.824
  187    HA   LEU  28           HA       LEU  28  -8.058  19.239  -2.804
  188   1HB   LEU  28          1HB       LEU  28  -5.337  18.976  -4.105
  189   2HB   LEU  28          2HB       LEU  28  -6.824  18.668  -4.989
  190    HG   LEU  28           HG       LEU  28  -7.674  20.909  -4.502
  191   1HD1  LEU  28          2HD1      LEU  28  -4.985  21.384  -3.144
  192   2HD1  LEU  28          3HD1      LEU  28  -6.132  22.654  -3.605
  193   3HD1  LEU  28          1HD1      LEU  28  -6.593  21.475  -2.382
  194   1HD2  LEU  28          3HD2      LEU  28  -6.392  20.507  -6.554
  195   2HD2  LEU  28          1HD2      LEU  28  -6.089  22.141  -5.948
  196   3HD2  LEU  28          2HD2      LEU  28  -4.873  20.869  -5.702
  197    H    GLU  29           H        GLU  29  -5.489  16.636  -3.192
  198    HA   GLU  29           HA       GLU  29  -7.761  14.754  -3.578
  199   1HB   GLU  29          1HB       GLU  29  -6.169  13.135  -4.314
  200   2HB   GLU  29          2HB       GLU  29  -6.110  14.590  -5.291
  201   1HG   GLU  29          1HG       GLU  29  -4.078  14.139  -3.076
  202   2HG   GLU  29          2HG       GLU  29  -3.940  13.312  -4.632
  203    HE1  GLU  29           HE2      GLU  29  -3.767  17.241  -5.256
  204    H    LYS  30           H        LYS  30  -7.468  12.587  -2.426
  205    HA   LYS  30           HA       LYS  30  -7.450  13.317   0.423
  206   1HB   LYS  30          1HB       LYS  30  -8.958  11.454  -1.320
  207   2HB   LYS  30          2HB       LYS  30  -8.666  10.889   0.318
  208   1HG   LYS  30          1HG       LYS  30 -10.794  12.135  -0.026
  209   2HG   LYS  30          2HG       LYS  30  -9.810  12.664   1.324
  210   1HD   LYS  30          1HD       LYS  30  -9.473  14.167  -1.280
  211   2HD   LYS  30          2HD       LYS  30 -11.013  14.306  -0.477
  212   1HE   LYS  30          1HE       LYS  30 -10.312  15.760   1.014
  213   2HE   LYS  30          2HE       LYS  30  -8.987  14.738   1.568
  214   1HZ   LYS  30          3HZ       LYS  30  -8.724  16.365  -0.873
  215   2HZ   LYS  30          1HZ       LYS  30  -8.431  17.005   0.577
  216   3HZ   LYS  30          2HZ       LYS  30  -7.527  15.752   0.092
  217    H    ALA  31           H        ALA  31  -4.975  12.457  -1.193
  218    HA   ALA  31           HA       ALA  31  -3.718  10.215  -0.108
  219   1HB   ALA  31          3HB       ALA  31  -2.770  11.768  -1.817
  220   2HB   ALA  31          1HB       ALA  31  -2.650  13.028  -0.584
  221   3HB   ALA  31          2HB       ALA  31  -1.663  11.553  -0.436
  222    H    ARG  32           H        ARG  32  -2.014  10.169   1.668
  223    HA   ARG  32           HA       ARG  32  -3.257  11.261   4.134
  224   1HB   ARG  32          1HB       ARG  32  -0.966   9.301   3.723
  225   2HB   ARG  32          2HB       ARG  32  -1.623   9.755   5.297
  226   1HG   ARG  32          1HG       ARG  32  -3.260   8.402   3.123
  227   2HG   ARG  32          2HG       ARG  32  -2.312   7.513   4.293
  228   1HD   ARG  32          1HD       ARG  32  -4.602   7.540   5.086
  229   2HD   ARG  32          2HD       ARG  32  -3.547   8.421   6.178
  230    HE   ARG  32           HE       ARG  32  -4.792  10.288   5.869
  231   1HH1  ARG  32          2HH1      ARG  32  -5.483   8.145   3.144
  232   2HH1  ARG  32          1HH1      ARG  32  -6.218   9.422   2.180
  233   1HH2  ARG  32          1HH2      ARG  32  -5.854  11.939   4.575
  234   2HH2  ARG  32          2HH2      ARG  32  -6.351  11.504   2.964
  235    H    HIS  33           H        HIS  33   0.184  10.980   3.263
  236    HA   HIS  33           HA       HIS  33   0.507  13.816   4.095
  237   1HB   HIS  33          2HB       HIS  33   2.868  13.267   4.661
  238   2HB   HIS  33          1HB       HIS  33   1.637  12.668   5.766
  239    HD1  HIS  33           HD1      HIS  33   1.120  10.082   5.766
  240    HD2  HIS  33           HD2      HIS  33   4.560  11.268   3.692
  241    HE1  HIS  33           HE1      HIS  33   2.556   8.020   5.454
  242    H    GLY  34           H        GLY  34   2.409  14.799   2.990
  243   1HA   GLY  34          1HA       GLY  34   3.357  13.658   0.558
  244   2HA   GLY  34          2HA       GLY  34   2.357  15.105   0.270
  245    H    SER  35           H        SER  35   5.113  15.090  -0.350
  246    HA   SER  35           HA       SER  35   6.233  17.191   1.258
  247   1HB   SER  35          1HB       SER  35   7.267  14.336   1.653
  248   2HB   SER  35          2HB       SER  35   8.302  15.734   1.902
  249    HG   SER  35           HG       SER  35   5.870  15.152   3.225
  250    H    CYS  36           H        CYS  36   8.304  17.817   0.441
  251    HA   CYS  36           HA       CYS  36   8.578  17.290  -2.454
  252   1HB   CYS  36          1HB       CYS  36   8.590  19.583  -1.748
  253   2HB   CYS  36          2HB       CYS  36   9.911  19.280  -0.588
  254    H    ASN  37           H        ASN  37  10.052  15.867  -3.170
  255    HA   ASN  37           HA       ASN  37  12.328  14.973  -1.437
  256   1HB   ASN  37          1HB       ASN  37  10.980  13.097  -2.172
  257   2HB   ASN  37          2HB       ASN  37  10.891  13.760  -3.820
  258   1HD2  ASN  37          2HD2      ASN  37  14.467  12.078  -2.638
  259   2HD2  ASN  37          1HD2      ASN  37  13.366  12.688  -1.421
  260    H    TYR  38           H        TYR  38  14.443  14.972  -2.434
  261    HA   TYR  38           HA       TYR  38  14.640  16.455  -4.984
  262   1HB   TYR  38          1HB       TYR  38  15.208  17.849  -2.980
  263   2HB   TYR  38          2HB       TYR  38  16.545  16.756  -2.642
  264    HD1  TYR  38           HD1      TYR  38  15.167  18.545  -5.676
  265    HD2  TYR  38           HD2      TYR  38  18.671  17.540  -3.387
  266    HE1  TYR  38           HE1      TYR  38  16.587  19.307  -7.533
  267    HE2  TYR  38           HE2      TYR  38  20.099  18.288  -5.271
  268    HH   TYR  38           HH       TYR  38  18.690  19.027  -8.460
  269    H    VAL  39           H        VAL  39  14.504  13.723  -5.179
  270    HA   VAL  39           HA       VAL  39  17.251  12.757  -5.601
  271    HB   VAL  39           HB       VAL  39  14.519  11.929  -6.675
  272   1HG1  VAL  39          1HG1      VAL  39  17.236  10.738  -7.385
  273   2HG1  VAL  39          2HG1      VAL  39  15.672   9.958  -7.688
  274   3HG1  VAL  39          3HG1      VAL  39  16.067  11.466  -8.510
  275   1HG2  VAL  39          2HG2      VAL  39  15.181  11.303  -4.313
  276   2HG2  VAL  39          3HG2      VAL  39  14.929   9.905  -5.368
  277   3HG2  VAL  39          1HG2      VAL  39  16.576  10.442  -4.972
  278    H    PHE  40           H        PHE  40  18.387  12.975  -7.653
  279    HA   PHE  40           HA       PHE  40  18.184  15.506  -8.814
  280   1HB   PHE  40          1HB       PHE  40  19.924  14.749 -10.322
  281   2HB   PHE  40          2HB       PHE  40  20.195  14.010  -8.766
  282    HD1  PHE  40           HD2      PHE  40  19.880  11.537  -8.479
  283    HD2  PHE  40           HD1      PHE  40  19.268  13.472 -12.295
  284    HE1  PHE  40           HE2      PHE  40  19.741   9.330  -9.587
  285    HE2  PHE  40           HE1      PHE  40  19.146  11.258 -13.389
  286    HZ   PHE  40           HZ       PHE  40  19.366   9.184 -12.039
  287    HA   PRO  41           HA       PRO  41  18.751  16.500 -10.868
  288   1HB   PRO  41          1HB       PRO  41  17.918  17.993 -12.930
  289   2HB   PRO  41          2HB       PRO  41  18.710  16.410 -13.180
  290   1HG   PRO  41          1HG       PRO  41  15.748  17.020 -13.280
  291   2HG   PRO  41          2HG       PRO  41  16.718  16.052 -14.415
  292   1HD   PRO  41          1HD       PRO  41  15.249  14.939 -12.333
  293   2HD   PRO  41          2HD       PRO  41  16.726  14.197 -12.994
  294    H    ALA  42           H        ALA  42  15.216  16.943 -11.231
  295    HA   ALA  42           HA       ALA  42  15.319  19.469  -9.661
  296   1HB   ALA  42          3HB       ALA  42  14.478  19.632 -11.971
  297   2HB   ALA  42          1HB       ALA  42  13.231  18.417 -11.608
  298   3HB   ALA  42          2HB       ALA  42  13.208  19.991 -10.786
  299    H    HIS  43           H        HIS  43  13.554  19.915  -8.273
  300    HA   HIS  43           HA       HIS  43  13.104  17.957  -6.274
  301   1HB   HIS  43          2HB       HIS  43  11.707  20.640  -6.803
  302   2HB   HIS  43          1HB       HIS  43  11.618  19.695  -5.338
  303    HD1  HIS  43           HD1      HIS  43  13.377  20.021  -3.559
  304    HD2  HIS  43           HD2      HIS  43  14.406  21.780  -7.227
  305    HE1  HIS  43           HE1      HIS  43  15.479  21.391  -3.181
  306    H    LYS  44           H        LYS  44  11.295  16.730  -5.728
  307    HA   LYS  44           HA       LYS  44   9.129  16.533  -7.802
  308   1HB   LYS  44          1HB       LYS  44  10.468  14.331  -6.184
  309   2HB   LYS  44          2HB       LYS  44   9.185  14.124  -7.392
  310   1HG   LYS  44          1HG       LYS  44  10.680  15.003  -9.151
  311   2HG   LYS  44          2HG       LYS  44  11.940  15.298  -7.932
  312   1HD   LYS  44          1HD       LYS  44  12.108  12.912  -7.422
  313   2HD   LYS  44          2HD       LYS  44  10.816  12.548  -8.570
  314   1HE   LYS  44          1HE       LYS  44  13.087  12.129  -9.522
  315   2HE   LYS  44          2HE       LYS  44  12.160  13.307 -10.461
  316   1HZ   LYS  44          2HZ       LYS  44  14.218  14.048  -8.467
  317   2HZ   LYS  44          3HZ       LYS  44  14.509  13.910 -10.043
  318   3HZ   LYS  44          1HZ       LYS  44  13.481  15.079  -9.467
  319    H    CYS  45           H        CYS  45   7.115  16.910  -6.977
  320    HA   CYS  45           HA       CYS  45   6.695  17.024  -4.080
  321   1HB   CYS  45          1HB       CYS  45   5.511  18.629  -5.443
  322   2HB   CYS  45          2HB       CYS  45   4.811  17.353  -6.448
  323    H    ILE  46           H        ILE  46   6.954  14.942  -3.209
  324    HA   ILE  46           HA       ILE  46   5.598  12.645  -4.509
  325    HB   ILE  46           HB       ILE  46   7.242  12.763  -1.962
  326   1HG1  ILE  46          1HG1      ILE  46   8.678  13.339  -3.806
  327   2HG1  ILE  46          2HG1      ILE  46   9.042  11.705  -3.256
  328   1HG2  ILE  46          1HG2      ILE  46   6.164  10.400  -3.568
  329   2HG2  ILE  46          2HG2      ILE  46   7.364  10.276  -2.266
  330   3HG2  ILE  46          3HG2      ILE  46   5.739  10.856  -1.918
  331   1HD1  ILE  46          2HD1      ILE  46   7.746  10.793  -5.205
  332   2HD1  ILE  46          3HD1      ILE  46   7.482  12.461  -5.770
  333   3HD1  ILE  46          1HD1      ILE  46   9.120  11.804  -5.678
  334    H    CYS  47           H        CYS  47   3.769  11.654  -3.668
  335    HA   CYS  47           HA       CYS  47   2.740  12.641  -1.100
  336   1HB   CYS  47          1HB       CYS  47   1.768  13.937  -3.071
  337   2HB   CYS  47          2HB       CYS  47   0.962  12.419  -3.510
  338    H    TYR  48           H        TYR  48   1.389  11.139  -0.005
  339    HA   TYR  48           HA       TYR  48   1.956   8.343  -0.943
  340   1HB   TYR  48          1HB       TYR  48   1.944   9.493   1.852
  341   2HB   TYR  48          2HB       TYR  48   2.320   7.835   1.368
  342    HD1  TYR  48           HD1      TYR  48   3.529  11.354   1.175
  343    HD2  TYR  48           HD2      TYR  48   4.488   7.196   0.583
  344    HE1  TYR  48           HE1      TYR  48   5.921  11.943   0.937
  345    HE2  TYR  48           HE2      TYR  48   6.884   7.782   0.387
  346    HH   TYR  48           HH       TYR  48   8.454   9.475   0.461
  347    H    PHE  49           H        PHE  49   0.163   7.252  -1.495
  348    HA   PHE  49           HA       PHE  49  -2.445   8.118  -0.373
  349   1HB   PHE  49          1HB       PHE  49  -1.959   6.129  -2.579
  350   2HB   PHE  49          2HB       PHE  49  -3.421   6.996  -2.239
  351    HD1  PHE  49           HD2      PHE  49  -1.494   9.760  -2.042
  352    HD2  PHE  49           HD1      PHE  49  -2.628   6.763  -4.927
  353    HE1  PHE  49           HE2      PHE  49  -1.023  11.340  -3.870
  354    HE2  PHE  49           HE1      PHE  49  -2.273   8.390  -6.742
  355    HZ   PHE  49           HZ       PHE  49  -1.278  10.623  -6.244
  356    HA   PRO  50           HA       PRO  50  -2.541   4.153   1.876
  357   1HB   PRO  50          1HB       PRO  50  -5.220   3.685   2.050
  358   2HB   PRO  50          2HB       PRO  50  -4.433   4.995   2.978
  359   1HG   PRO  50          1HG       PRO  50  -5.911   5.220   0.341
  360   2HG   PRO  50          2HG       PRO  50  -6.121   6.235   1.793
  361   1HD   PRO  50          1HD       PRO  50  -4.516   6.943  -0.347
  362   2HD   PRO  50          2HD       PRO  50  -4.106   7.424   1.325
  363    H    CYS  51           H        CYS  51  -2.408   1.998   1.030
  364    HA   CYS  51           HA       CYS  51  -3.931   1.163  -1.264
  365   1HB   CYS  51          1HB       CYS  51  -2.280   1.184  -2.935
  366   2HB   CYS  51          2HB       CYS  51  -2.016   2.725  -2.160
   
  No H/Q in entry =         366
  Start of MODEL    6
    1    HA   PCA   1           HA       PYR   1  -1.808  -1.698   2.188
    2   1HB   PCA   1          1HB       PYR   1   0.256  -2.990   3.624
    3   2HB   PCA   1          2HB       PYR   1  -1.336  -3.683   3.214
    4   1HG   PCA   1          1HG       PYR   1   1.294  -4.222   1.903
    5   2HG   PCA   1          2HG       PYR   1  -0.173  -5.244   1.968
    6    HN   PCA   1           HN       PYR   1  -1.050  -1.947  -0.213
    7    H    LYS   2           H        LYS   2   1.555  -1.799   1.023
    8    HA   LYS   2           HA       LYS   2   2.689   0.150   2.682
    9   1HB   LYS   2          1HB       LYS   2   4.401   0.405   0.961
   10   2HB   LYS   2          2HB       LYS   2   4.023  -1.296   1.238
   11   1HG   LYS   2          1HG       LYS   2   2.672  -1.393  -0.794
   12   2HG   LYS   2          2HG       LYS   2   2.872   0.326  -1.096
   13   1HD   LYS   2          1HD       LYS   2   5.148  -1.711  -0.970
   14   2HD   LYS   2          2HD       LYS   2   4.342  -1.248  -2.463
   15   1HE   LYS   2          1HE       LYS   2   5.941   0.644  -0.658
   16   2HE   LYS   2          2HE       LYS   2   6.514  -0.089  -2.156
   17   1HZ   LYS   2          3HZ       LYS   2   4.240   1.762  -1.946
   18   2HZ   LYS   2          1HZ       LYS   2   5.701   2.192  -2.461
   19   3HZ   LYS   2          2HZ       LYS   2   4.816   1.123  -3.352
   20    H    LEU   3           H        LEU   3   3.409   2.371   2.126
   21    HA   LEU   3           HA       LEU   3   1.298   4.046   1.119
   22   1HB   LEU   3          1HB       LEU   3   4.236   4.640   1.380
   23   2HB   LEU   3          2HB       LEU   3   2.975   5.846   1.174
   24    HG   LEU   3           HG       LEU   3   3.155   4.024   3.623
   25   1HD1  LEU   3          2HD1      LEU   3   4.138   6.879   3.213
   26   2HD1  LEU   3          3HD1      LEU   3   4.099   6.010   4.762
   27   3HD1  LEU   3          1HD1      LEU   3   5.155   5.448   3.456
   28   1HD2  LEU   3          1HD2      LEU   3   1.567   6.568   3.042
   29   2HD2  LEU   3          2HD2      LEU   3   0.907   4.925   3.232
   30   3HD2  LEU   3          3HD2      LEU   3   1.651   5.736   4.611
   31    H    CYS   4           H        CYS   4   1.245   5.142  -0.885
   32    HA   CYS   4           HA       CYS   4   3.005   4.106  -3.097
   33   1HB   CYS   4          1HB       CYS   4   0.192   5.184  -3.066
   34   2HB   CYS   4          2HB       CYS   4   1.253   5.603  -4.416
   35    H    GLU   5           H        GLU   5   4.788   5.342  -3.097
   36    HA   GLU   5           HA       GLU   5   4.798   8.106  -2.205
   37   1HB   GLU   5          1HB       GLU   5   6.977   6.740  -3.843
   38   2HB   GLU   5          2HB       GLU   5   7.100   8.061  -2.683
   39   1HG   GLU   5          1HG       GLU   5   7.798   6.410  -1.294
   40   2HG   GLU   5          2HG       GLU   5   6.077   6.121  -1.040
   41    HE2  GLU   5           HE2      GLU   5   8.451   3.497  -3.003
   42    H    ARG   6           H        ARG   6   2.995   8.670  -3.577
   43    HA   ARG   6           HA       ARG   6   2.774   8.299  -6.363
   44   1HB   ARG   6          1HB       ARG   6   0.906   8.756  -4.887
   45   2HB   ARG   6          2HB       ARG   6   1.534  10.360  -4.532
   46   1HG   ARG   6          1HG       ARG   6   1.299  10.142  -7.403
   47   2HG   ARG   6          2HG       ARG   6  -0.164   9.490  -6.705
   48   1HD   ARG   6          1HD       ARG   6  -0.545  11.780  -7.142
   49   2HD   ARG   6          2HD       ARG   6  -0.463  11.629  -5.386
   50    HE   ARG   6           HE       ARG   6   2.141  12.283  -6.275
   51   1HH1  ARG   6          2HH1      ARG   6  -1.033  13.828  -6.095
   52   2HH1  ARG   6          1HH1      ARG   6  -0.481  15.418  -6.481
   53   1HH2  ARG   6          2HH2      ARG   6   2.971  14.336  -6.703
   54   2HH2  ARG   6          1HH2      ARG   6   1.960  15.687  -6.979
   55    HA   PRO   7           HA       PRO   7   5.464  11.856  -7.492
   56   1HB   PRO   7          1HB       PRO   7   5.911  11.181 -10.113
   57   2HB   PRO   7          2HB       PRO   7   6.817  10.492  -8.743
   58   1HG   PRO   7          1HG       PRO   7   4.664   9.166 -10.352
   59   2HG   PRO   7          2HG       PRO   7   6.077   8.463  -9.545
   60   1HD   PRO   7          1HD       PRO   7   3.413   8.552  -8.552
   61   2HD   PRO   7          2HD       PRO   7   4.872   8.089  -7.640
   62    H    SER   8           H        SER   8   3.533  10.743 -10.295
   63    HA   SER   8           HA       SER   8   2.423  13.364 -10.625
   64   1HB   SER   8          1HB       SER   8   1.854  10.804 -12.162
   65   2HB   SER   8          2HB       SER   8   1.597  12.470 -12.718
   66    HG   SER   8           HG       SER   8   3.596  11.586 -13.479
   67    H    GLY   9           H        GLY   9   0.248  13.925 -10.791
   68   1HA   GLY   9          1HA       GLY   9  -2.012  12.412 -10.711
   69   2HA   GLY   9          2HA       GLY   9  -1.693  12.712  -8.987
   70    H    THR  10           H        THR  10  -1.602  14.897  -8.225
   71    HA   THR  10           HA       THR  10  -2.930  16.963  -9.873
   72    HB   THR  10           HB       THR  10  -2.649  18.250  -7.681
   73    HG1  THR  10           HG1      THR  10  -2.357  16.563  -5.913
   74   1HG2  THR  10          1HG2      THR  10  -4.738  17.078  -8.310
   75   2HG2  THR  10          2HG2      THR  10  -4.160  15.621  -7.465
   76   3HG2  THR  10          3HG2      THR  10  -4.463  17.128  -6.569
   77    H    TRP  11           H        TRP  11  -0.445  17.685  -7.586
   78    HA   TRP  11           HA       TRP  11   1.106  19.265  -9.443
   79   1HB   TRP  11          1HB       TRP  11   0.774  19.670  -7.010
   80   2HB   TRP  11          2HB       TRP  11   1.790  18.288  -6.645
   81    HD1  TRP  11           HD1      TRP  11   4.023  19.314  -9.037
   82    HE1  TRP  11           HE1      TRP  11   5.588  21.239  -8.377
   83    HE3  TRP  11           HE3      TRP  11   1.385  21.157  -5.083
   84    HZ2  TRP  11           HZ2      TRP  11   5.624  23.381  -6.419
   85    HZ3  TRP  11           HZ3      TRP  11   2.229  23.095  -3.810
   86    HH2  TRP  11           HH2      TRP  11   4.405  24.119  -4.381
   87    H    SER  12           H        SER  12   1.674  17.841 -11.079
   88    HA   SER  12           HA       SER  12   3.293  15.433 -10.462
   89   1HB   SER  12          1HB       SER  12   2.040  16.377 -13.081
   90   2HB   SER  12          2HB       SER  12   2.683  14.771 -12.711
   91    HG   SER  12           HG       SER  12   0.403  16.081 -11.573
   92    H    GLY  13           H        GLY  13   5.064  17.216  -9.828
   93   1HA   GLY  13          1HA       GLY  13   7.049  17.208 -11.851
   94   2HA   GLY  13          2HA       GLY  13   6.201  18.766 -11.907
   95    H    VAL  14           H        VAL  14   8.369  19.526 -11.430
   96    HA   VAL  14           HA       VAL  14   9.714  19.146  -8.961
   97    HB   VAL  14           HB       VAL  14   9.741  21.520 -10.863
   98   1HG1  VAL  14          2HG1      VAL  14  11.676  20.703  -8.660
   99   2HG1  VAL  14          3HG1      VAL  14  12.017  21.930  -9.894
  100   3HG1  VAL  14          1HG1      VAL  14  10.717  22.199  -8.735
  101   1HG2  VAL  14          3HG2      VAL  14  11.547  19.061 -10.668
  102   2HG2  VAL  14          1HG2      VAL  14  10.419  19.410 -11.996
  103   3HG2  VAL  14          2HG2      VAL  14  11.822  20.451 -11.739
  104    H    CYS  15           H        CYS  15   9.746  20.457  -7.126
  105    HA   CYS  15           HA       CYS  15   7.143  21.802  -6.555
  106   1HB   CYS  15          1HB       CYS  15   7.441  20.842  -4.247
  107   2HB   CYS  15          2HB       CYS  15   7.105  19.720  -5.564
  108    H    GLY  16           H        GLY  16  10.533  21.630  -5.397
  109   1HA   GLY  16          1HA       GLY  16  11.752  23.060  -4.103
  110   2HA   GLY  16          2HA       GLY  16  11.034  24.343  -5.083
  111    H    ASN  17           H        ASN  17   8.848  22.425  -3.050
  112    HA   ASN  17           HA       ASN  17   9.119  24.063  -0.708
  113   1HB   ASN  17          1HB       ASN  17   8.010  25.729  -2.254
  114   2HB   ASN  17          2HB       ASN  17   6.617  24.648  -2.327
  115   1HD2  ASN  17          2HD2      ASN  17   7.409  26.880   1.045
  116   2HD2  ASN  17          1HD2      ASN  17   8.540  26.814  -0.296
  117    H    ASN  18           H        ASN  18   8.891  22.436   0.689
  118    HA   ASN  18           HA       ASN  18   7.439  20.106   0.405
  119   1HB   ASN  18          1HB       ASN  18   9.267  20.650   2.066
  120   2HB   ASN  18          2HB       ASN  18   8.095  21.533   3.032
  121   1HD2  ASN  18          2HD2      ASN  18   8.044  17.451   2.991
  122   2HD2  ASN  18          1HD2      ASN  18   9.271  18.362   2.110
  123    H    ASN  19           H        ASN  19   6.563  22.769   2.434
  124    HA   ASN  19           HA       ASN  19   4.111  21.956   3.430
  125   1HB   ASN  19          1HB       ASN  19   5.214  23.915   4.297
  126   2HB   ASN  19          2HB       ASN  19   5.045  24.773   2.759
  127   1HD2  ASN  19          2HD2      ASN  19   1.743  25.859   3.430
  128   2HD2  ASN  19          1HD2      ASN  19   3.100  25.880   2.319
  129    H    ALA  20           H        ALA  20   4.600  23.938   0.472
  130    HA   ALA  20           HA       ALA  20   1.808  24.095  -0.147
  131   1HB   ALA  20          3HB       ALA  20   3.480  25.645  -1.100
  132   2HB   ALA  20          1HB       ALA  20   4.178  24.306  -2.044
  133   3HB   ALA  20          2HB       ALA  20   2.515  24.856  -2.355
  134    H    CYS  21           H        CYS  21   4.419  21.908  -1.391
  135    HA   CYS  21           HA       CYS  21   2.836  20.384  -3.129
  136   1HB   CYS  21          1HB       CYS  21   5.158  19.998  -3.202
  137   2HB   CYS  21          2HB       CYS  21   5.260  19.692  -1.464
  138    H    LYS  22           H        LYS  22   3.589  19.732   0.276
  139    HA   LYS  22           HA       LYS  22   2.059  17.463   0.809
  140   1HB   LYS  22          1HB       LYS  22   3.671  18.503   2.330
  141   2HB   LYS  22          2HB       LYS  22   2.656  19.922   2.527
  142   1HG   LYS  22          1HG       LYS  22   0.850  18.502   3.539
  143   2HG   LYS  22          2HG       LYS  22   1.921  17.132   3.460
  144   1HD   LYS  22          1HD       LYS  22   1.943  19.607   5.180
  145   2HD   LYS  22          2HD       LYS  22   2.157  17.938   5.690
  146   1HE   LYS  22          1HE       LYS  22   4.198  19.765   4.315
  147   2HE   LYS  22          2HE       LYS  22   4.212  19.281   6.004
  148   1HZ   LYS  22          2HZ       LYS  22   4.472  17.351   3.792
  149   2HZ   LYS  22          3HZ       LYS  22   5.740  18.108   4.494
  150   3HZ   LYS  22          1HZ       LYS  22   4.784  17.093   5.390
  151    H    ASN  23           H        ASN  23   1.123  20.871   1.388
  152    HA   ASN  23           HA       ASN  23  -1.451  20.347   2.269
  153   1HB   ASN  23          1HB       ASN  23  -0.333  22.512   2.534
  154   2HB   ASN  23          2HB       ASN  23  -0.368  22.809   0.795
  155   1HD2  ASN  23          2HD2      ASN  23  -3.228  24.497   2.771
  156   2HD2  ASN  23          1HD2      ASN  23  -1.544  24.263   3.209
  157    H    GLN  24           H        GLN  24  -0.453  21.486  -1.016
  158    HA   GLN  24           HA       GLN  24  -2.982  21.304  -2.214
  159   1HB   GLN  24          1HB       GLN  24  -0.195  21.021  -3.381
  160   2HB   GLN  24          2HB       GLN  24  -1.682  21.007  -4.355
  161   1HG   GLN  24          1HG       GLN  24  -2.331  23.223  -3.464
  162   2HG   GLN  24          2HG       GLN  24  -0.883  23.263  -2.449
  163   1HE2  GLN  24          2HE2      GLN  24  -0.057  23.426  -6.484
  164   2HE2  GLN  24          1HE2      GLN  24  -1.090  22.143  -5.877
  165    H    CYS  25           H        CYS  25  -0.495  18.665  -1.859
  166    HA   CYS  25           HA       CYS  25  -1.974  16.833  -3.382
  167   1HB   CYS  25          1HB       CYS  25   0.245  16.214  -2.629
  168   2HB   CYS  25          2HB       CYS  25  -0.314  16.124  -0.954
  169    H    ILE  26           H        ILE  26  -1.999  17.165   0.204
  170    HA   ILE  26           HA       ILE  26  -4.105  15.196   0.476
  171    HB   ILE  26           HB       ILE  26  -3.889  15.496   2.811
  172   1HG1  ILE  26          1HG1      ILE  26  -2.446  18.107   2.267
  173   2HG1  ILE  26          2HG1      ILE  26  -4.033  17.891   3.027
  174   1HG2  ILE  26          3HG2      ILE  26  -2.011  14.380   1.622
  175   2HG2  ILE  26          1HG2      ILE  26  -1.121  15.908   1.572
  176   3HG2  ILE  26          2HG2      ILE  26  -1.485  15.157   3.112
  177   1HD1  ILE  26          1HD1      ILE  26  -2.914  16.614   4.879
  178   2HD1  ILE  26          2HD1      ILE  26  -1.345  17.105   4.191
  179   3HD1  ILE  26          3HD1      ILE  26  -2.480  18.331   4.767
  180    H    ASN  27           H        ASN  27  -4.105  18.543  -0.124
  181    HA   ASN  27           HA       ASN  27  -6.781  19.138   0.846
  182   1HB   ASN  27          1HB       ASN  27  -4.918  20.702   0.810
  183   2HB   ASN  27          2HB       ASN  27  -4.851  20.642  -0.968
  184   1HD2  ASN  27          2HD2      ASN  27  -6.616  23.714   0.141
  185   2HD2  ASN  27          1HD2      ASN  27  -5.030  22.989   0.441
  186    H    LEU  28           H        LEU  28  -5.267  18.975  -2.478
  187    HA   LEU  28           HA       LEU  28  -7.849  19.046  -3.752
  188   1HB   LEU  28          1HB       LEU  28  -5.018  18.593  -4.718
  189   2HB   LEU  28          2HB       LEU  28  -6.403  18.327  -5.765
  190    HG   LEU  28           HG       LEU  28  -7.170  20.593  -5.561
  191   1HD1  LEU  28          3HD1      LEU  28  -4.778  21.082  -3.740
  192   2HD1  LEU  28          1HD1      LEU  28  -5.792  22.344  -4.457
  193   3HD1  LEU  28          2HD1      LEU  28  -6.495  21.221  -3.292
  194   1HD2  LEU  28          1HD2      LEU  28  -5.497  20.011  -7.289
  195   2HD2  LEU  28          2HD2      LEU  28  -5.315  21.691  -6.755
  196   3HD2  LEU  28          3HD2      LEU  28  -4.185  20.449  -6.171
  197    H    GLU  29           H        GLU  29  -5.636  16.373  -2.906
  198    HA   GLU  29           HA       GLU  29  -7.820  14.484  -3.645
  199   1HB   GLU  29          1HB       GLU  29  -6.349  12.693  -4.009
  200   2HB   GLU  29          2HB       GLU  29  -6.021  13.962  -5.170
  201   1HG   GLU  29          1HG       GLU  29  -4.243  13.839  -2.729
  202   2HG   GLU  29          2HG       GLU  29  -4.156  12.521  -3.891
  203    HE1  GLU  29           HE2      GLU  29  -4.052  15.980  -3.865
  204    H    LYS  30           H        LYS  30  -7.419  12.438  -2.051
  205    HA   LYS  30           HA       LYS  30  -7.665  13.773   0.591
  206   1HB   LYS  30          1HB       LYS  30  -8.799  11.175  -0.443
  207   2HB   LYS  30          2HB       LYS  30  -9.060  11.838   1.174
  208   1HG   LYS  30          1HG       LYS  30  -9.931  13.148  -1.446
  209   2HG   LYS  30          2HG       LYS  30 -10.928  12.319  -0.269
  210   1HD   LYS  30          1HD       LYS  30 -11.368  14.330   0.523
  211   2HD   LYS  30          2HD       LYS  30  -9.884  14.154   1.429
  212   1HE   LYS  30          1HE       LYS  30  -9.523  15.363  -1.314
  213   2HE   LYS  30          2HE       LYS  30 -10.673  16.227  -0.311
  214   1HZ   LYS  30          1HZ       LYS  30  -8.904  16.391   1.404
  215   2HZ   LYS  30          2HZ       LYS  30  -7.810  15.841   0.296
  216   3HZ   LYS  30          3HZ       LYS  30  -8.640  17.183  -0.004
  217    H    ALA  31           H        ALA  31  -5.095  12.626  -0.696
  218    HA   ALA  31           HA       ALA  31  -4.054  10.493   0.703
  219   1HB   ALA  31          1HB       ALA  31  -2.752  13.111  -0.138
  220   2HB   ALA  31          2HB       ALA  31  -1.849  11.671   0.339
  221   3HB   ALA  31          3HB       ALA  31  -2.887  11.635  -1.113
  222    H    ARG  32           H        ARG  32  -2.299  10.514   2.387
  223    HA   ARG  32           HA       ARG  32  -3.280  11.936   4.784
  224   1HB   ARG  32          1HB       ARG  32  -1.238   9.698   4.474
  225   2HB   ARG  32          2HB       ARG  32  -1.803  10.351   6.012
  226   1HG   ARG  32          1HG       ARG  32  -3.607   8.942   3.995
  227   2HG   ARG  32          2HG       ARG  32  -2.720   8.126   5.269
  228   1HD   ARG  32          1HD       ARG  32  -4.989   8.415   6.042
  229   2HD   ARG  32          2HD       ARG  32  -3.856   9.321   7.033
  230    HE   ARG  32           HE       ARG  32  -4.986  11.220   6.557
  231   1HH1  ARG  32          2HH2      ARG  32  -5.793   8.907   3.995
  232   2HH1  ARG  32          1HH2      ARG  32  -6.492  10.142   2.956
  233   1HH2  ARG  32          1HH1      ARG  32  -6.012  12.804   5.166
  234   2HH2  ARG  32          2HH1      ARG  32  -6.525  12.278   3.587
  235    H    HIS  33           H        HIS  33   0.067  11.234   3.532
  236    HA   HIS  33           HA       HIS  33   0.727  14.002   4.379
  237   1HB   HIS  33          2HB       HIS  33   3.030  13.318   4.837
  238   2HB   HIS  33          1HB       HIS  33   1.827  12.726   5.971
  239    HD1  HIS  33           HD1      HIS  33   0.961  10.084   5.213
  240    HD2  HIS  33           HD2      HIS  33   4.895  11.355   4.554
  241    HE1  HIS  33           HE1      HIS  33   2.407   8.010   5.080
  242    H    GLY  34           H        GLY  34   2.647  14.865   3.198
  243   1HA   GLY  34          1HA       GLY  34   3.280  13.785   0.642
  244   2HA   GLY  34          2HA       GLY  34   2.281  15.238   0.490
  245    H    SER  35           H        SER  35   5.084  15.106  -0.352
  246    HA   SER  35           HA       SER  35   6.168  17.340   1.155
  247   1HB   SER  35          1HB       SER  35   7.212  14.512   1.611
  248   2HB   SER  35          2HB       SER  35   8.352  15.851   1.595
  249    HG   SER  35           HG       SER  35   6.017  15.662   3.186
  250    H    CYS  36           H        CYS  36   7.885  18.254   0.198
  251    HA   CYS  36           HA       CYS  36   8.279  17.716  -2.657
  252   1HB   CYS  36          1HB       CYS  36   8.026  19.998  -1.839
  253   2HB   CYS  36          2HB       CYS  36   9.425  19.807  -0.754
  254    H    ASN  37           H        ASN  37   9.037  15.490  -1.922
  255    HA   ASN  37           HA       ASN  37  11.480  15.213  -0.459
  256   1HB   ASN  37          1HB       ASN  37   9.661  13.455  -0.934
  257   2HB   ASN  37          2HB       ASN  37  10.465  13.185  -2.489
  258   1HD2  ASN  37          2HD2      ASN  37  13.316  11.581  -0.903
  259   2HD2  ASN  37          1HD2      ASN  37  12.889  12.434  -2.363
  260    H    TYR  38           H        TYR  38  13.636  14.731  -1.238
  261    HA   TYR  38           HA       TYR  38  14.354  16.069  -3.701
  262   1HB   TYR  38          1HB       TYR  38  15.994  15.923  -1.899
  263   2HB   TYR  38          2HB       TYR  38  16.020  14.159  -2.043
  264    HD1  TYR  38           HD2      TYR  38  16.817  17.359  -3.794
  265    HD2  TYR  38           HD1      TYR  38  17.198  13.070  -3.910
  266    HE1  TYR  38           HE2      TYR  38  17.876  17.513  -6.024
  267    HE2  TYR  38           HE1      TYR  38  18.249  13.233  -6.149
  268    HH   TYR  38           HH       TYR  38  18.413  16.307  -7.957
  269    H    VAL  39           H        VAL  39  14.452  15.238  -5.683
  270    HA   VAL  39           HA       VAL  39  14.897  12.497  -6.302
  271    HB   VAL  39           HB       VAL  39  12.351  13.817  -7.382
  272   1HG1  VAL  39          2HG1      VAL  39  13.562  11.036  -7.753
  273   2HG1  VAL  39          3HG1      VAL  39  11.929  11.474  -8.277
  274   3HG1  VAL  39          1HG1      VAL  39  13.317  12.271  -9.010
  275   1HG2  VAL  39          2HG2      VAL  39  12.553  11.551  -5.359
  276   2HG2  VAL  39          3HG2      VAL  39  11.818  13.157  -5.099
  277   3HG2  VAL  39          1HG2      VAL  39  11.079  12.018  -6.214
  278    H    PHE  40           H        PHE  40  15.484  12.544  -8.723
  279    HA   PHE  40           HA       PHE  40  16.821  14.932  -9.464
  280   1HB   PHE  40          1HB       PHE  40  17.309  13.906 -11.491
  281   2HB   PHE  40          2HB       PHE  40  17.179  12.557 -10.390
  282    HD1  PHE  40           HD2      PHE  40  15.193  10.991 -10.577
  283    HD2  PHE  40           HD1      PHE  40  15.775  14.276 -13.321
  284    HE1  PHE  40           HE2      PHE  40  13.596   9.961 -12.162
  285    HE2  PHE  40           HE1      PHE  40  14.175  13.243 -14.895
  286    HZ   PHE  40           HZ       PHE  40  13.099  11.072 -14.333
  287    HA   PRO  41           HA       PRO  41  17.218  16.298 -11.246
  288   1HB   PRO  41          1HB       PRO  41  16.915  18.841 -12.075
  289   2HB   PRO  41          2HB       PRO  41  16.527  17.435 -13.115
  290   1HG   PRO  41          1HG       PRO  41  14.579  19.142 -11.550
  291   2HG   PRO  41          2HG       PRO  41  14.466  18.599 -13.241
  292   1HD   PRO  41          1HD       PRO  41  13.241  17.263 -11.136
  293   2HD   PRO  41          2HD       PRO  41  13.800  16.441 -12.617
  294    H    ALA  42           H        ALA  42  14.731  18.345  -9.639
  295    HA   ALA  42           HA       ALA  42  16.521  18.855  -7.332
  296   1HB   ALA  42          1HB       ALA  42  15.268  21.040  -9.039
  297   2HB   ALA  42          2HB       ALA  42  16.112  21.269  -7.491
  298   3HB   ALA  42          3HB       ALA  42  17.007  20.678  -8.906
  299    H    HIS  43           H        HIS  43  14.738  17.172  -6.908
  300    HA   HIS  43           HA       HIS  43  13.100  16.681  -5.435
  301   1HB   HIS  43          2HB       HIS  43  12.349  19.628  -5.208
  302   2HB   HIS  43          1HB       HIS  43  11.769  18.285  -4.258
  303    HD1  HIS  43           HD1      HIS  43  12.702  18.123  -2.027
  304    HD2  HIS  43           HD2      HIS  43  15.421  19.841  -4.721
  305    HE1  HIS  43           HE1      HIS  43  14.816  18.672  -0.730
  306    H    LYS  44           H        LYS  44  10.820  16.285  -5.435
  307    HA   LYS  44           HA       LYS  44   9.237  17.347  -7.680
  308   1HB   LYS  44          1HB       LYS  44   9.918  14.410  -7.290
  309   2HB   LYS  44          2HB       LYS  44   8.440  14.936  -8.114
  310   1HG   LYS  44          1HG       LYS  44   9.688  16.119  -9.813
  311   2HG   LYS  44          2HG       LYS  44  11.231  15.775  -9.004
  312   1HD   LYS  44          1HD       LYS  44  11.027  13.434  -9.341
  313   2HD   LYS  44          2HD       LYS  44   9.378  13.567  -9.963
  314   1HE   LYS  44          1HE       LYS  44  10.055  14.205 -12.068
  315   2HE   LYS  44          2HE       LYS  44  11.348  15.240 -11.451
  316   1HZ   LYS  44          2HZ       LYS  44  11.582  12.309 -11.620
  317   2HZ   LYS  44          3HZ       LYS  44  12.220  13.383 -12.688
  318   3HZ   LYS  44          1HZ       LYS  44  12.732  13.396 -11.146
  319    H    CYS  45           H        CYS  45   6.962  17.210  -7.228
  320    HA   CYS  45           HA       CYS  45   6.455  17.130  -4.369
  321   1HB   CYS  45          1HB       CYS  45   5.195  18.726  -5.717
  322   2HB   CYS  45          2HB       CYS  45   4.478  17.409  -6.645
  323    H    ILE  46           H        ILE  46   7.079  15.018  -3.807
  324    HA   ILE  46           HA       ILE  46   5.513  12.760  -4.862
  325    HB   ILE  46           HB       ILE  46   7.545  12.750  -2.617
  326   1HG1  ILE  46          1HG1      ILE  46   8.754  13.523  -4.539
  327   2HG1  ILE  46          2HG1      ILE  46   9.121  11.822  -4.311
  328   1HG2  ILE  46          2HG2      ILE  46   6.335  10.557  -4.361
  329   2HG2  ILE  46          3HG2      ILE  46   7.670  10.327  -3.218
  330   3HG2  ILE  46          1HG2      ILE  46   6.063  10.793  -2.633
  331   1HD1  ILE  46          2HD1      ILE  46   7.490  11.247  -6.140
  332   2HD1  ILE  46          3HD1      ILE  46   7.225  12.991  -6.396
  333   3HD1  ILE  46          1HD1      ILE  46   8.814  12.281  -6.680
  334    H    CYS  47           H        CYS  47   3.667  12.045  -3.971
  335    HA   CYS  47           HA       CYS  47   2.873  13.150  -1.309
  336   1HB   CYS  47          1HB       CYS  47   1.445  13.760  -3.264
  337   2HB   CYS  47          2HB       CYS  47   0.967  12.067  -3.358
  338    H    TYR  48           H        TYR  48   1.957  11.650   0.275
  339    HA   TYR  48           HA       TYR  48   2.814   8.815  -0.215
  340   1HB   TYR  48          1HB       TYR  48   3.371  10.631   2.127
  341   2HB   TYR  48          2HB       TYR  48   3.706   8.898   2.080
  342    HD1  TYR  48           HD1      TYR  48   4.761  12.226   0.897
  343    HD2  TYR  48           HD2      TYR  48   5.595   8.007   0.777
  344    HE1  TYR  48           HE1      TYR  48   6.970  12.699  -0.117
  345    HE2  TYR  48           HE2      TYR  48   7.862   8.489  -0.096
  346    HH   TYR  48           HH       TYR  48   9.382  10.139  -0.690
  347    H    PHE  49           H        PHE  49   0.870   7.787  -0.251
  348    HA   PHE  49           HA       PHE  49  -0.857   8.039   2.128
  349   1HB   PHE  49          1HB       PHE  49  -2.815   7.696   0.452
  350   2HB   PHE  49          2HB       PHE  49  -2.128   9.286   0.728
  351    HD1  PHE  49           HD2      PHE  49  -0.571  10.339  -0.903
  352    HD2  PHE  49           HD1      PHE  49  -2.665   6.685  -1.820
  353    HE1  PHE  49           HE2      PHE  49  -0.936  11.115  -3.215
  354    HE2  PHE  49           HE1      PHE  49  -2.656   7.311  -4.227
  355    HZ   PHE  49           HZ       PHE  49  -1.793   9.584  -4.912
  356    HA   PRO  50           HA       PRO  50  -0.694   3.567   2.089
  357   1HB   PRO  50          1HB       PRO  50  -3.647   3.744   2.659
  358   2HB   PRO  50          2HB       PRO  50  -2.408   2.745   3.472
  359   1HG   PRO  50          1HG       PRO  50  -3.287   5.015   4.657
  360   2HG   PRO  50          2HG       PRO  50  -1.529   4.678   4.613
  361   1HD   PRO  50          1HD       PRO  50  -3.126   6.466   2.751
  362   2HD   PRO  50          2HD       PRO  50  -1.598   6.814   3.611
  363    H    CYS  51           H        CYS  51  -0.900   2.075   0.446
  364    HA   CYS  51           HA       CYS  51  -3.213   2.218  -1.404
  365   1HB   CYS  51          1HB       CYS  51  -2.009   2.666  -3.347
  366   2HB   CYS  51          2HB       CYS  51  -1.339   3.784  -2.178
   
  No H/Q in entry =         366
  Start of MODEL    7
    1    HA   PCA   1           HA       PYR   1   1.029  -1.917   4.306
    2   1HB   PCA   1          1HB       PYR   1   3.525  -2.958   3.468
    3   2HB   PCA   1          2HB       PYR   1   2.067  -3.901   3.853
    4   1HG   PCA   1          1HG       PYR   1   3.141  -3.256   1.145
    5   2HG   PCA   1          2HG       PYR   1   2.065  -4.589   1.659
    6    HN   PCA   1           HN       PYR   1   0.038  -1.124   2.081
    7    H    LYS   2           H        LYS   2   3.580  -1.230   1.892
    8    HA   LYS   2           HA       LYS   2   4.323   1.265   3.249
    9   1HB   LYS   2          1HB       LYS   2   5.969   1.456   1.444
   10   2HB   LYS   2          2HB       LYS   2   6.126  -0.015   2.383
   11   1HG   LYS   2          1HG       LYS   2   5.654  -1.409   0.684
   12   2HG   LYS   2          2HG       LYS   2   4.448  -0.399  -0.064
   13   1HD   LYS   2          1HD       LYS   2   7.470  -0.102  -0.281
   14   2HD   LYS   2          2HD       LYS   2   6.371  -0.681  -1.531
   15   1HE   LYS   2          1HE       LYS   2   6.652   2.167  -0.464
   16   2HE   LYS   2          2HE       LYS   2   6.995   1.582  -2.082
   17   1HZ   LYS   2          3HZ       LYS   2   4.284   1.648  -0.897
   18   2HZ   LYS   2          1HZ       LYS   2   4.923   2.814  -1.822
   19   3HZ   LYS   2          2HZ       LYS   2   4.669   1.312  -2.468
   20    H    LEU   3           H        LEU   3   3.386   3.214   2.799
   21    HA   LEU   3           HA       LEU   3   1.222   3.591   1.105
   22   1HB   LEU   3          1HB       LEU   3   3.287   5.666   1.811
   23   2HB   LEU   3          2HB       LEU   3   1.664   5.986   1.240
   24    HG   LEU   3           HG       LEU   3   1.213   4.333   3.465
   25   1HD1  LEU   3          1HD1      LEU   3   3.611   4.656   4.154
   26   2HD1  LEU   3          2HD1      LEU   3   3.377   6.408   4.097
   27   3HD1  LEU   3          3HD1      LEU   3   2.496   5.432   5.290
   28   1HD2  LEU   3          1HD2      LEU   3  -0.126   6.281   2.785
   29   2HD2  LEU   3          2HD2      LEU   3   0.311   6.360   4.495
   30   3HD2  LEU   3          3HD2      LEU   3   1.165   7.372   3.313
   31    H    CYS   4           H        CYS   4   0.931   4.511  -0.909
   32    HA   CYS   4           HA       CYS   4   3.042   3.942  -2.895
   33   1HB   CYS   4          1HB       CYS   4   0.073   4.417  -3.075
   34   2HB   CYS   4          2HB       CYS   4   1.127   4.679  -4.480
   35    H    GLU   5           H        GLU   5   4.467   5.398  -3.234
   36    HA   GLU   5           HA       GLU   5   4.261   8.137  -2.367
   37   1HB   GLU   5          1HB       GLU   5   6.476   6.698  -3.908
   38   2HB   GLU   5          2HB       GLU   5   6.602   8.179  -2.962
   39   1HG   GLU   5          1HG       GLU   5   7.294   6.838  -1.312
   40   2HG   GLU   5          2HG       GLU   5   5.582   6.501  -1.055
   41    HE2  GLU   5           HE2      GLU   5   8.395   5.066  -1.192
   42    H    ARG   6           H        ARG   6   2.432   8.672  -3.834
   43    HA   ARG   6           HA       ARG   6   2.849   8.451  -6.690
   44   1HB   ARG   6          1HB       ARG   6   0.604   8.508  -5.243
   45   2HB   ARG   6          2HB       ARG   6   0.648  10.223  -5.632
   46   1HG   ARG   6          1HG       ARG   6   0.918   7.975  -7.689
   47   2HG   ARG   6          2HG       ARG   6  -0.633   8.617  -7.204
   48   1HD   ARG   6          1HD       ARG   6   1.348  10.667  -8.173
   49   2HD   ARG   6          2HD       ARG   6   0.781   9.499  -9.344
   50    HE   ARG   6           HE       ARG   6  -1.369  10.233  -9.238
   51   1HH1  ARG   6          2HH1      ARG   6   0.627  12.378  -7.178
   52   2HH1  ARG   6          1HH1      ARG   6  -0.783  13.207  -6.544
   53   1HH2  ARG   6          2HH2      ARG   6  -3.089  11.588  -8.683
   54   2HH2  ARG   6          1HH2      ARG   6  -2.860  12.913  -7.587
   55    HA   PRO   7           HA       PRO   7   5.019  12.439  -6.721
   56   1HB   PRO   7          1HB       PRO   7   5.856  12.512  -9.315
   57   2HB   PRO   7          2HB       PRO   7   6.456  11.300  -8.160
   58   1HG   PRO   7          1HG       PRO   7   4.170  10.961 -10.127
   59   2HG   PRO   7          2HG       PRO   7   5.628   9.936  -9.968
   60   1HD   PRO   7          1HD       PRO   7   3.305   9.297  -8.726
   61   2HD   PRO   7          2HD       PRO   7   4.875   9.030  -7.915
   62    H    SER   8           H        SER   8   4.947  14.257  -8.813
   63    HA   SER   8           HA       SER   8   2.591  15.676  -8.571
   64   1HB   SER   8          1HB       SER   8   4.567  15.731 -10.895
   65   2HB   SER   8          2HB       SER   8   3.591  17.068 -10.285
   66    HG   SER   8           HG       SER   8   5.650  17.254  -9.487
   67    H    GLY   9           H        GLY   9   0.982  13.962  -8.941
   68   1HA   GLY   9          1HA       GLY   9   0.036  13.915 -11.815
   69   2HA   GLY   9          2HA       GLY   9  -0.345  12.685 -10.586
   70    H    THR  10           H        THR  10  -0.239  16.008  -9.725
   71    HA   THR  10           HA       THR  10  -3.040  16.573  -9.912
   72    HB   THR  10           HB       THR  10  -1.955  16.179  -7.063
   73    HG1  THR  10           HG1      THR  10  -3.323  14.510  -8.820
   74   1HG2  THR  10          2HG2      THR  10  -4.738  16.709  -8.171
   75   2HG2  THR  10          3HG2      THR  10  -4.316  16.474  -6.457
   76   3HG2  THR  10          1HG2      THR  10  -3.711  17.900  -7.334
   77    H    TRP  11           H        TRP  11  -0.150  17.118  -7.883
   78    HA   TRP  11           HA       TRP  11  -0.023  19.988  -8.294
   79   1HB   TRP  11          1HB       TRP  11   1.129  18.799  -6.432
   80   2HB   TRP  11          2HB       TRP  11   2.071  17.875  -7.606
   81    HD1  TRP  11           HD1      TRP  11   3.848  19.354  -9.129
   82    HE1  TRP  11           HE1      TRP  11   5.134  21.530  -8.595
   83    HE3  TRP  11           HE3      TRP  11   1.248  20.853  -4.983
   84    HZ2  TRP  11           HZ2      TRP  11   5.092  23.565  -6.595
   85    HZ3  TRP  11           HZ3      TRP  11   2.075  22.757  -3.645
   86    HH2  TRP  11           HH2      TRP  11   4.021  24.058  -4.389
   87    H    SER  12           H        SER  12   1.277  20.987  -9.969
   88    HA   SER  12           HA       SER  12   1.677  19.242 -12.336
   89   1HB   SER  12          1HB       SER  12   1.470  22.272 -12.088
   90   2HB   SER  12          2HB       SER  12   1.642  21.366 -13.601
   91    HG   SER  12           HG       SER  12  -0.460  20.843 -11.760
   92    H    GLY  13           H        GLY  13   3.666  18.520 -12.691
   93   1HA   GLY  13          1HA       GLY  13   5.891  18.559 -13.167
   94   2HA   GLY  13          2HA       GLY  13   5.763  20.320 -13.219
   95    H    VAL  14           H        VAL  14   7.464  21.063 -12.062
   96    HA   VAL  14           HA       VAL  14   8.820  19.457 -10.169
   97    HB   VAL  14           HB       VAL  14   9.136  22.422 -10.778
   98   1HG1  VAL  14          3HG1      VAL  14  11.049  20.456  -9.444
   99   2HG1  VAL  14          1HG1      VAL  14  11.465  22.101  -9.960
  100   3HG1  VAL  14          2HG1      VAL  14  10.278  21.864  -8.678
  101   1HG2  VAL  14          3HG2      VAL  14  10.522  19.959 -11.940
  102   2HG2  VAL  14          1HG2      VAL  14   9.435  21.057 -12.816
  103   3HG2  VAL  14          2HG2      VAL  14  11.001  21.640 -12.252
  104    H    CYS  15           H        CYS  15   8.854  19.506  -7.935
  105    HA   CYS  15           HA       CYS  15   6.383  20.319  -6.749
  106   1HB   CYS  15          1HB       CYS  15   6.862  18.910  -5.147
  107   2HB   CYS  15          2HB       CYS  15   8.277  18.454  -6.098
  108    H    GLY  16           H        GLY  16   9.615  21.793  -6.603
  109   1HA   GLY  16          1HA       GLY  16  10.234  23.894  -5.900
  110   2HA   GLY  16          2HA       GLY  16   8.539  24.292  -5.615
  111    H    ASN  17           H        ASN  17   7.770  22.512  -3.615
  112    HA   ASN  17           HA       ASN  17   9.628  22.846  -1.352
  113   1HB   ASN  17          1HB       ASN  17   8.750  25.111  -1.574
  114   2HB   ASN  17          2HB       ASN  17   7.094  24.495  -1.661
  115   1HD2  ASN  17          2HD2      ASN  17   9.018  24.687   1.983
  116   2HD2  ASN  17          1HD2      ASN  17   9.937  24.831   0.498
  117    H    ASN  18           H        ASN  18   9.297  21.392   0.176
  118    HA   ASN  18           HA       ASN  18   7.681  19.215   0.204
  119   1HB   ASN  18          1HB       ASN  18   9.621  19.691   1.672
  120   2HB   ASN  18          2HB       ASN  18   8.636  20.770   2.639
  121   1HD2  ASN  18          2HD2      ASN  18   8.097  16.723   2.954
  122   2HD2  ASN  18          1HD2      ASN  18   9.152  17.357   1.689
  123    H    ASN  19           H        ASN  19   7.076  22.028   2.207
  124    HA   ASN  19           HA       ASN  19   4.623  21.120   3.254
  125   1HB   ASN  19          1HB       ASN  19   5.963  22.814   4.374
  126   2HB   ASN  19          2HB       ASN  19   5.607  23.988   3.095
  127   1HD2  ASN  19          2HD2      ASN  19   2.441  24.827   4.453
  128   2HD2  ASN  19          1HD2      ASN  19   3.693  25.200   3.282
  129    H    ALA  20           H        ALA  20   5.221  23.398   0.532
  130    HA   ALA  20           HA       ALA  20   2.475  23.953  -0.015
  131   1HB   ALA  20          2HB       ALA  20   4.350  25.213  -1.039
  132   2HB   ALA  20          3HB       ALA  20   4.755  23.786  -2.027
  133   3HB   ALA  20          1HB       ALA  20   3.191  24.604  -2.233
  134    H    CYS  21           H        CYS  21   4.681  21.469  -1.448
  135    HA   CYS  21           HA       CYS  21   2.786  20.200  -3.061
  136   1HB   CYS  21          1HB       CYS  21   5.034  19.557  -3.369
  137   2HB   CYS  21          2HB       CYS  21   5.258  19.183  -1.653
  138    H    LYS  22           H        LYS  22   3.711  19.432   0.290
  139    HA   LYS  22           HA       LYS  22   2.038  17.302   0.915
  140   1HB   LYS  22          1HB       LYS  22   3.790  18.110   2.337
  141   2HB   LYS  22          2HB       LYS  22   3.043  19.675   2.521
  142   1HG   LYS  22          1HG       LYS  22   1.165  18.767   3.774
  143   2HG   LYS  22          2HG       LYS  22   1.862  17.159   3.746
  144   1HD   LYS  22          1HD       LYS  22   3.274  19.645   4.890
  145   2HD   LYS  22          2HD       LYS  22   2.152  18.675   5.825
  146   1HE   LYS  22          1HE       LYS  22   4.440  18.066   6.387
  147   2HE   LYS  22          2HE       LYS  22   3.555  16.700   5.690
  148   1HZ   LYS  22          2HZ       LYS  22   5.530  18.357   4.212
  149   2HZ   LYS  22          3HZ       LYS  22   5.773  16.829   4.736
  150   3HZ   LYS  22          1HZ       LYS  22   4.643  17.077   3.642
  151    H    ASN  23           H        ASN  23   1.338  20.765   1.568
  152    HA   ASN  23           HA       ASN  23  -1.325  20.427   2.417
  153   1HB   ASN  23          1HB       ASN  23  -0.298  22.565   2.764
  154   2HB   ASN  23          2HB       ASN  23   0.159  22.706   1.063
  155   1HD2  ASN  23          2HD2      ASN  23  -2.541  24.948   0.746
  156   2HD2  ASN  23          1HD2      ASN  23  -0.801  24.758   0.798
  157    H    GLN  24           H        GLN  24  -0.206  21.450  -0.871
  158    HA   GLN  24           HA       GLN  24  -2.806  21.450  -1.940
  159   1HB   GLN  24          1HB       GLN  24  -0.094  21.127  -3.252
  160   2HB   GLN  24          2HB       GLN  24  -1.616  21.259  -4.170
  161   1HG   GLN  24          1HG       GLN  24  -2.114  23.416  -3.050
  162   2HG   GLN  24          2HG       GLN  24  -0.606  23.296  -2.124
  163   1HE2  GLN  24          2HE2      GLN  24   0.072  23.837  -6.136
  164   2HE2  GLN  24          1HE2      GLN  24  -0.924  22.491  -5.612
  165    H    CYS  25           H        CYS  25  -0.476  18.709  -1.778
  166    HA   CYS  25           HA       CYS  25  -2.060  16.888  -3.260
  167   1HB   CYS  25          1HB       CYS  25   0.163  16.187  -2.544
  168   2HB   CYS  25          2HB       CYS  25  -0.298  16.297  -0.844
  169    H    ILE  26           H        ILE  26  -1.956  17.207   0.360
  170    HA   ILE  26           HA       ILE  26  -4.134  15.296   0.528
  171    HB   ILE  26           HB       ILE  26  -3.877  15.373   2.856
  172   1HG1  ILE  26          1HG1      ILE  26  -2.458  18.030   2.506
  173   2HG1  ILE  26          2HG1      ILE  26  -3.989  17.695   3.343
  174   1HG2  ILE  26          2HG2      ILE  26  -2.041  14.341   1.536
  175   2HG2  ILE  26          3HG2      ILE  26  -1.105  15.842   1.657
  176   3HG2  ILE  26          1HG2      ILE  26  -1.493  14.932   3.104
  177   1HD1  ILE  26          2HD1      ILE  26  -2.724  16.288   4.992
  178   2HD1  ILE  26          3HD1      ILE  26  -1.211  16.867   4.245
  179   3HD1  ILE  26          1HD1      ILE  26  -2.315  18.016   5.009
  180    H    ASN  27           H        ASN  27  -4.009  18.673   0.107
  181    HA   ASN  27           HA       ASN  27  -6.649  19.296   1.151
  182   1HB   ASN  27          1HB       ASN  27  -4.711  20.782   1.113
  183   2HB   ASN  27          2HB       ASN  27  -4.751  20.842  -0.664
  184   1HD2  ASN  27          2HD2      ASN  27  -6.417  23.821   0.938
  185   2HD2  ASN  27          1HD2      ASN  27  -4.856  23.023   1.173
  186    H    LEU  28           H        LEU  28  -5.230  19.268  -2.221
  187    HA   LEU  28           HA       LEU  28  -7.859  19.414  -3.409
  188   1HB   LEU  28          1HB       LEU  28  -5.060  19.027  -4.521
  189   2HB   LEU  28          2HB       LEU  28  -6.494  18.863  -5.511
  190    HG   LEU  28           HG       LEU  28  -7.215  21.123  -5.086
  191   1HD1  LEU  28          1HD1      LEU  28  -4.712  21.419  -3.375
  192   2HD1  LEU  28          2HD1      LEU  28  -5.719  22.761  -3.946
  193   3HD1  LEU  28          3HD1      LEU  28  -6.400  21.579  -2.829
  194   1HD2  LEU  28          2HD2      LEU  28  -5.662  20.645  -6.952
  195   2HD2  LEU  28          3HD2      LEU  28  -5.413  22.277  -6.306
  196   3HD2  LEU  28          1HD2      LEU  28  -4.277  20.977  -5.888
  197    H    GLU  29           H        GLU  29  -5.399  16.759  -3.185
  198    HA   GLU  29           HA       GLU  29  -7.587  14.846  -3.903
  199   1HB   GLU  29          1HB       GLU  29  -5.878  13.140  -4.187
  200   2HB   GLU  29          2HB       GLU  29  -5.828  14.454  -5.356
  201   1HG   GLU  29          1HG       GLU  29  -3.877  15.438  -4.143
  202   2HG   GLU  29          2HG       GLU  29  -3.874  13.992  -3.089
  203    HE2  GLU  29           HE2      GLU  29  -1.688  14.529  -4.474
  204    H    LYS  30           H        LYS  30  -7.284  12.779  -2.377
  205    HA   LYS  30           HA       LYS  30  -7.482  13.979   0.348
  206   1HB   LYS  30          1HB       LYS  30  -9.084  11.775  -0.916
  207   2HB   LYS  30          2HB       LYS  30  -9.284  12.339   0.747
  208   1HG   LYS  30          1HG       LYS  30  -9.518  14.324  -1.570
  209   2HG   LYS  30          2HG       LYS  30 -10.820  13.234  -1.175
  210   1HD   LYS  30          1HD       LYS  30 -11.189  15.410  -0.182
  211   2HD   LYS  30          2HD       LYS  30 -11.133  14.112   0.999
  212   1HE   LYS  30          1HE       LYS  30 -10.095  16.138   1.871
  213   2HE   LYS  30          2HE       LYS  30  -8.938  14.818   1.787
  214   1HZ   LYS  30          3HZ       LYS  30  -8.121  15.875  -0.306
  215   2HZ   LYS  30          1HZ       LYS  30  -9.041  17.191  -0.034
  216   3HZ   LYS  30          2HZ       LYS  30  -7.877  16.741   1.011
  217    H    ALA  31           H        ALA  31  -5.152  12.569  -0.974
  218    HA   ALA  31           HA       ALA  31  -4.263  10.322   0.390
  219   1HB   ALA  31          2HB       ALA  31  -3.035  11.660  -1.339
  220   2HB   ALA  31          3HB       ALA  31  -2.826  12.945  -0.139
  221   3HB   ALA  31          1HB       ALA  31  -2.027  11.381   0.108
  222    H    ARG  32           H        ARG  32  -2.720  10.219   2.276
  223    HA   ARG  32           HA       ARG  32  -3.906  11.666   4.568
  224   1HB   ARG  32          1HB       ARG  32  -1.813   9.446   4.461
  225   2HB   ARG  32          2HB       ARG  32  -2.546  10.079   5.936
  226   1HG   ARG  32          1HG       ARG  32  -4.127   8.698   3.726
  227   2HG   ARG  32          2HG       ARG  32  -3.346   7.842   5.041
  228   1HD   ARG  32          1HD       ARG  32  -5.709   8.131   5.588
  229   2HD   ARG  32          2HD       ARG  32  -4.660   8.952   6.733
  230    HE   ARG  32           HE       ARG  32  -5.679  10.912   6.249
  231   1HH1  ARG  32          2HH2      ARG  32  -6.317   8.752   3.512
  232   2HH1  ARG  32          1HH2      ARG  32  -6.879  10.058   2.476
  233   1HH2  ARG  32          2HH1      ARG  32  -6.496  12.600   4.841
  234   2HH2  ARG  32          1HH1      ARG  32  -6.898  12.163   3.201
  235    H    HIS  33           H        HIS  33  -0.468  10.959   3.842
  236    HA   HIS  33           HA       HIS  33   0.095  13.781   4.598
  237   1HB   HIS  33          2HB       HIS  33   2.363  13.062   5.241
  238   2HB   HIS  33          1HB       HIS  33   1.068  12.541   6.315
  239    HD1  HIS  33           HD1      HIS  33   0.335   9.969   6.175
  240    HD2  HIS  33           HD2      HIS  33   4.006  10.980   4.427
  241    HE1  HIS  33           HE1      HIS  33   1.657   7.824   5.914
  242    H    GLY  34           H        GLY  34   1.741  14.799   3.420
  243   1HA   GLY  34          1HA       GLY  34   2.722  13.501   1.012
  244   2HA   GLY  34          2HA       GLY  34   1.887  15.054   0.782
  245    H    SER  35           H        SER  35   4.722  14.571   0.254
  246    HA   SER  35           HA       SER  35   6.042  16.576   1.772
  247   1HB   SER  35          1HB       SER  35   5.898  14.021   3.184
  248   2HB   SER  35          2HB       SER  35   7.548  14.238   2.623
  249    HG   SER  35           HG       SER  35   7.333  15.178   4.603
  250    H    CYS  36           H        CYS  36   6.868  17.216  -0.124
  251    HA   CYS  36           HA       CYS  36   8.040  15.427  -2.085
  252   1HB   CYS  36          1HB       CYS  36   7.140  17.482  -2.874
  253   2HB   CYS  36          2HB       CYS  36   8.006  18.432  -1.682
  254    H    ASN  37           H        ASN  37  10.184  15.168  -2.555
  255    HA   ASN  37           HA       ASN  37  12.259  15.874  -0.540
  256   1HB   ASN  37          1HB       ASN  37  11.607  13.550  -0.127
  257   2HB   ASN  37          2HB       ASN  37  11.614  13.194  -1.858
  258   1HD2  ASN  37          2HD2      ASN  37  15.009  12.241  -1.779
  259   2HD2  ASN  37          1HD2      ASN  37  13.391  11.928  -2.377
  260    H    TYR  38           H        TYR  38  14.482  15.568  -1.623
  261    HA   TYR  38           HA       TYR  38  14.456  16.597  -4.397
  262   1HB   TYR  38          1HB       TYR  38  16.119  17.444  -2.732
  263   2HB   TYR  38          2HB       TYR  38  16.768  15.815  -2.570
  264    HD1  TYR  38           HD2      TYR  38  15.999  18.422  -5.183
  265    HD2  TYR  38           HD1      TYR  38  18.596  15.197  -3.982
  266    HE1  TYR  38           HE2      TYR  38  17.206  18.601  -7.323
  267    HE2  TYR  38           HE1      TYR  38  19.796  15.368  -6.144
  268    HH   TYR  38           HH       TYR  38  18.565  17.431  -8.769
  269    H    VAL  39           H        VAL  39  13.102  14.670  -4.928
  270    HA   VAL  39           HA       VAL  39  14.643  12.209  -5.483
  271    HB   VAL  39           HB       VAL  39  11.966  13.158  -6.603
  272   1HG1  VAL  39          2HG1      VAL  39  13.367  10.438  -6.651
  273   2HG1  VAL  39          3HG1      VAL  39  11.721  10.757  -7.230
  274   3HG1  VAL  39          1HG1      VAL  39  13.106  11.481  -8.059
  275   1HG2  VAL  39          3HG2      VAL  39  12.660  11.269  -4.314
  276   2HG2  VAL  39          1HG2      VAL  39  11.806  12.828  -4.191
  277   3HG2  VAL  39          2HG2      VAL  39  11.044  11.460  -5.015
  278    H    PHE  40           H        PHE  40  16.437  12.847  -6.621
  279    HA   PHE  40           HA       PHE  40  16.963  14.764  -8.382
  280   1HB   PHE  40          1HB       PHE  40  18.596  13.199  -7.641
  281   2HB   PHE  40          2HB       PHE  40  17.790  11.845  -8.430
  282    HD1  PHE  40           HD2      PHE  40  17.954  11.519 -10.898
  283    HD2  PHE  40           HD1      PHE  40  20.226  14.543  -8.807
  284    HE1  PHE  40           HE2      PHE  40  19.452  11.759 -12.855
  285    HE2  PHE  40           HE1      PHE  40  21.722  14.762 -10.763
  286    HZ   PHE  40           HZ       PHE  40  21.335  13.382 -12.796
  287    HA   PRO  41           HA       PRO  41  17.971  15.374 -10.242
  288   1HB   PRO  41          1HB       PRO  41  17.812  16.778 -12.550
  289   2HB   PRO  41          2HB       PRO  41  18.422  15.100 -12.514
  290   1HG   PRO  41          1HG       PRO  41  15.633  16.029 -13.249
  291   2HG   PRO  41          2HG       PRO  41  16.676  14.878 -14.125
  292   1HD   PRO  41          1HD       PRO  41  14.721  14.061 -12.359
  293   2HD   PRO  41          2HD       PRO  41  16.237  13.154 -12.592
  294    H    ALA  42           H        ALA  42  14.660  16.217 -11.259
  295    HA   ALA  42           HA       ALA  42  14.819  18.758  -9.693
  296   1HB   ALA  42          2HB       ALA  42  14.287  19.061 -12.084
  297   2HB   ALA  42          3HB       ALA  42  12.913  17.942 -11.926
  298   3HB   ALA  42          1HB       ALA  42  12.911  19.486 -11.047
  299    H    HIS  43           H        HIS  43  13.192  19.159  -8.206
  300    HA   HIS  43           HA       HIS  43  12.386  17.018  -6.573
  301   1HB   HIS  43          2HB       HIS  43  11.478  19.935  -6.811
  302   2HB   HIS  43          1HB       HIS  43  10.818  18.820  -5.648
  303    HD1  HIS  43           HD1      HIS  43  12.324  17.827  -3.770
  304    HD2  HIS  43           HD2      HIS  43  13.920  21.058  -5.919
  305    HE1  HIS  43           HE1      HIS  43  14.130  18.888  -2.322
  306    H    LYS  44           H        LYS  44  10.412  15.899  -6.389
  307    HA   LYS  44           HA       LYS  44   8.248  16.434  -8.401
  308   1HB   LYS  44          1HB       LYS  44   9.290  13.805  -7.301
  309   2HB   LYS  44          2HB       LYS  44   7.897  13.971  -8.387
  310   1HG   LYS  44          1HG       LYS  44   9.306  14.772 -10.194
  311   2HG   LYS  44          2HG       LYS  44  10.674  14.964  -9.096
  312   1HD   LYS  44          1HD       LYS  44  10.572  12.448  -8.653
  313   2HD   LYS  44          2HD       LYS  44   9.409  12.341  -9.972
  314   1HE   LYS  44          1HE       LYS  44  11.702  11.810 -10.724
  315   2HE   LYS  44          2HE       LYS  44  11.095  13.246 -11.563
  316   1HZ   LYS  44          2HZ       LYS  44  12.809  13.429  -9.157
  317   2HZ   LYS  44          3HZ       LYS  44  13.447  13.322 -10.619
  318   3HZ   LYS  44          1HZ       LYS  44  12.498  14.618 -10.188
  319    H    CYS  45           H        CYS  45   6.124  16.365  -7.534
  320    HA   CYS  45           HA       CYS  45   6.062  16.848  -4.688
  321   1HB   CYS  45          1HB       CYS  45   4.659  18.167  -6.170
  322   2HB   CYS  45          2HB       CYS  45   3.833  16.715  -6.730
  323    H    ILE  46           H        ILE  46   6.886  14.810  -3.945
  324    HA   ILE  46           HA       ILE  46   5.388  12.397  -4.415
  325    HB   ILE  46           HB       ILE  46   7.306  12.858  -2.113
  326   1HG1  ILE  46          1HG1      ILE  46   8.649  13.427  -3.979
  327   2HG1  ILE  46          2HG1      ILE  46   9.028  11.775  -3.547
  328   1HG2  ILE  46          1HG2      ILE  46   6.347  10.369  -3.587
  329   2HG2  ILE  46          2HG2      ILE  46   7.585  10.389  -2.313
  330   3HG2  ILE  46          3HG2      ILE  46   5.916  10.834  -1.944
  331   1HD1  ILE  46          1HD1      ILE  46   7.520  10.963  -5.412
  332   2HD1  ILE  46          2HD1      ILE  46   7.284  12.659  -5.890
  333   3HD1  ILE  46          3HD1      ILE  46   8.892  11.927  -5.962
  334    H    CYS  47           H        CYS  47   3.497  11.868  -3.597
  335    HA   CYS  47           HA       CYS  47   2.811  12.732  -0.857
  336   1HB   CYS  47          1HB       CYS  47   1.588  13.975  -2.654
  337   2HB   CYS  47          2HB       CYS  47   0.846  12.437  -3.127
  338    H    TYR  48           H        TYR  48   1.756  11.181   0.475
  339    HA   TYR  48           HA       TYR  48   2.435   8.423  -0.443
  340   1HB   TYR  48          1HB       TYR  48   2.242   9.578   2.340
  341   2HB   TYR  48          2HB       TYR  48   2.862   7.994   1.885
  342    HD1  TYR  48           HD1      TYR  48   3.566  11.605   1.971
  343    HD2  TYR  48           HD2      TYR  48   5.096   7.745   0.854
  344    HE1  TYR  48           HE1      TYR  48   5.699  12.647   1.274
  345    HE2  TYR  48           HE2      TYR  48   7.283   8.791   0.275
  346    HH   TYR  48           HH       TYR  48   7.735  12.346   0.273
  347    H    PHE  49           H        PHE  49   0.564   7.455  -1.223
  348    HA   PHE  49           HA       PHE  49  -1.988   8.019   0.177
  349   1HB   PHE  49          1HB       PHE  49  -1.596   6.201  -2.180
  350   2HB   PHE  49          2HB       PHE  49  -3.060   6.922  -1.620
  351    HD1  PHE  49           HD2      PHE  49  -1.202   9.788  -1.444
  352    HD2  PHE  49           HD1      PHE  49  -2.701   6.973  -4.362
  353    HE1  PHE  49           HE2      PHE  49  -1.273  11.565  -3.132
  354    HE2  PHE  49           HE1      PHE  49  -2.858   8.803  -6.020
  355    HZ   PHE  49           HZ       PHE  49  -2.102  11.096  -5.406
  356    HA   PRO  50           HA       PRO  50  -1.559   3.965   2.191
  357   1HB   PRO  50          1HB       PRO  50  -4.189   3.344   2.669
  358   2HB   PRO  50          2HB       PRO  50  -3.338   4.624   3.584
  359   1HG   PRO  50          1HG       PRO  50  -5.162   4.960   1.189
  360   2HG   PRO  50          2HG       PRO  50  -5.193   5.872   2.723
  361   1HD   PRO  50          1HD       PRO  50  -3.912   6.761   0.419
  362   2HD   PRO  50          2HD       PRO  50  -3.308   7.171   2.067
  363    H    CYS  51           H        CYS  51  -1.306   1.980   1.166
  364    HA   CYS  51           HA       CYS  51  -2.961   1.024  -0.968
  365   1HB   CYS  51          1HB       CYS  51  -1.657   1.528  -2.838
  366   2HB   CYS  51          2HB       CYS  51  -1.375   2.982  -1.918
   
  No H/Q in entry =         366
  Start of MODEL    8
    1    HA   PCA   1           HA       PYR   1  -2.223   1.408   6.823
    2   1HB   PCA   1          1HB       PYR   1  -1.341  -1.240   6.606
    3   2HB   PCA   1          2HB       PYR   1  -2.987  -0.745   7.058
    4   1HG   PCA   1          1HG       PYR   1  -2.086  -1.777   4.391
    5   2HG   PCA   1          2HG       PYR   1  -3.687  -1.877   5.182
    6    HN   PCA   1           HN       PYR   1  -2.955   2.028   4.495
    7    H    LYS   2           H        LYS   2  -0.292  -0.761   4.771
    8    HA   LYS   2           HA       LYS   2   2.121   0.806   4.949
    9   1HB   LYS   2          1HB       LYS   2   2.099  -1.644   4.491
   10   2HB   LYS   2          2HB       LYS   2   1.231  -1.345   2.989
   11   1HG   LYS   2          1HG       LYS   2   3.425   0.274   2.562
   12   2HG   LYS   2          2HG       LYS   2   4.110  -0.831   3.727
   13   1HD   LYS   2          1HD       LYS   2   4.554  -1.476   1.392
   14   2HD   LYS   2          2HD       LYS   2   3.701  -2.737   2.277
   15   1HE   LYS   2          1HE       LYS   2   2.969  -2.227  -0.158
   16   2HE   LYS   2          2HE       LYS   2   1.709  -2.444   1.054
   17   1HZ   LYS   2          1HZ       LYS   2   2.638   0.228   0.134
   18   2HZ   LYS   2          2HZ       LYS   2   1.243  -0.564  -0.317
   19   3HZ   LYS   2          3HZ       LYS   2   1.429  -0.093   1.185
   20    H    LEU   3           H        LEU   3   2.403   2.759   3.879
   21    HA   LEU   3           HA       LEU   3   0.629   3.760   1.944
   22   1HB   LEU   3          1HB       LEU   3   3.515   4.428   2.474
   23   2HB   LEU   3          2HB       LEU   3   2.479   5.387   1.435
   24    HG   LEU   3           HG       LEU   3   1.807   4.934   4.372
   25   1HD1  LEU   3          2HD1      LEU   3   4.043   6.009   4.162
   26   2HD1  LEU   3          3HD1      LEU   3   3.353   7.235   3.083
   27   3HD1  LEU   3          1HD1      LEU   3   2.829   7.141   4.776
   28   1HD2  LEU   3          3HD2      LEU   3   0.897   6.975   2.299
   29   2HD2  LEU   3          1HD2      LEU   3  -0.082   5.693   3.042
   30   3HD2  LEU   3          2HD2      LEU   3   0.506   7.040   4.025
   31    H    CYS   4           H        CYS   4   0.979   4.227  -0.296
   32    HA   CYS   4           HA       CYS   4   3.093   2.688  -1.763
   33   1HB   CYS   4          1HB       CYS   4   0.222   3.183  -2.631
   34   2HB   CYS   4          2HB       CYS   4   1.525   2.831  -3.756
   35    H    GLU   5           H        GLU   5   4.265   4.019  -3.084
   36    HA   GLU   5           HA       GLU   5   3.910   6.908  -2.623
   37   1HB   GLU   5          1HB       GLU   5   6.291   5.702  -4.031
   38   2HB   GLU   5          2HB       GLU   5   6.175   7.113  -2.987
   39   1HG   GLU   5          1HG       GLU   5   7.281   5.673  -1.581
   40   2HG   GLU   5          2HG       GLU   5   5.634   5.247  -1.110
   41    HE2  GLU   5           HE2      GLU   5   8.023   2.548  -2.788
   42    H    ARG   6           H        ARG   6   3.554   8.395  -4.287
   43    HA   ARG   6           HA       ARG   6   3.903   7.521  -7.099
   44   1HB   ARG   6          1HB       ARG   6   1.478   8.960  -5.927
   45   2HB   ARG   6          2HB       ARG   6   1.916   9.060  -7.587
   46   1HG   ARG   6          1HG       ARG   6   1.657   6.631  -7.904
   47   2HG   ARG   6          2HG       ARG   6   1.196   6.439  -6.205
   48   1HD   ARG   6          1HD       ARG   6  -0.727   6.593  -7.937
   49   2HD   ARG   6          2HD       ARG   6  -0.837   7.604  -6.493
   50    HE   ARG   6           HE       ARG   6   0.321   8.667  -9.037
   51   1HH1  ARG   6          1HH2      ARG   6  -2.523   8.948  -7.024
   52   2HH1  ARG   6          2HH2      ARG   6  -2.449  10.692  -6.900
   53   1HH2  ARG   6          1HH1      ARG   6   0.682  10.974  -8.509
   54   2HH2  ARG   6          2HH1      ARG   6  -0.653  11.857  -7.886
   55    HA   PRO   7           HA       PRO   7   5.469  11.789  -7.178
   56   1HB   PRO   7          1HB       PRO   7   5.220  12.419  -9.820
   57   2HB   PRO   7          2HB       PRO   7   6.460  11.262  -9.248
   58   1HG   PRO   7          1HG       PRO   7   3.738  10.624 -10.420
   59   2HG   PRO   7          2HG       PRO   7   5.314   9.917 -10.875
   60   1HD   PRO   7          1HD       PRO   7   3.610   8.680  -9.138
   61   2HD   PRO   7          2HD       PRO   7   5.379   8.594  -8.907
   62    H    SER   8           H        SER   8   4.342  13.811  -7.149
   63    HA   SER   8           HA       SER   8   1.982  14.258  -6.206
   64   1HB   SER   8          1HB       SER   8   1.921  16.391  -7.561
   65   2HB   SER   8          2HB       SER   8   3.477  16.025  -6.804
   66    HG   SER   8           HG       SER   8   3.766  16.590  -9.015
   67    H    GLY   9           H        GLY   9   2.103  14.568  -9.737
   68   1HA   GLY   9          1HA       GLY   9   0.550  13.807 -11.379
   69   2HA   GLY   9          2HA       GLY   9  -0.539  13.216 -10.119
   70    H    THR  10           H        THR  10  -0.480  15.700  -8.505
   71    HA   THR  10           HA       THR  10  -2.221  17.497 -10.033
   72    HB   THR  10           HB       THR  10  -1.983  18.664  -7.682
   73    HG1  THR  10           HG1      THR  10  -1.303  16.955  -6.124
   74   1HG2  THR  10          3HG2      THR  10  -3.187  15.871  -7.890
   75   2HG2  THR  10          1HG2      THR  10  -3.497  17.028  -6.575
   76   3HG2  THR  10          2HG2      THR  10  -3.995  17.414  -8.231
   77    H    TRP  11           H        TRP  11   0.484  18.002  -7.865
   78    HA   TRP  11           HA       TRP  11   1.477  20.379  -9.064
   79   1HB   TRP  11          1HB       TRP  11   1.692  19.549  -6.681
   80   2HB   TRP  11          2HB       TRP  11   3.002  18.508  -7.213
   81    HD1  TRP  11           HD1      TRP  11   4.881  20.301  -8.817
   82    HE1  TRP  11           HE1      TRP  11   6.002  22.377  -7.859
   83    HE3  TRP  11           HE3      TRP  11   1.699  21.229  -4.876
   84    HZ2  TRP  11           HZ2      TRP  11   5.612  24.192  -5.692
   85    HZ3  TRP  11           HZ3      TRP  11   2.252  23.021  -3.287
   86    HH2  TRP  11           HH2      TRP  11   4.287  24.395  -3.609
   87    H    SER  12           H        SER  12   1.526  19.574 -11.299
   88    HA   SER  12           HA       SER  12   3.504  17.585 -12.051
   89   1HB   SER  12          1HB       SER  12   1.764  19.417 -13.757
   90   2HB   SER  12          2HB       SER  12   2.604  17.949 -14.285
   91    HG   SER  12           HG       SER  12   0.531  18.105 -12.308
   92    H    GLY  13           H        GLY  13   5.191  19.075 -10.876
   93   1HA   GLY  13          1HA       GLY  13   6.926  20.229 -12.851
   94   2HA   GLY  13          2HA       GLY  13   6.090  21.499 -11.930
   95    H    VAL  14           H        VAL  14   8.491  21.849 -11.431
   96    HA   VAL  14           HA       VAL  14   9.913  20.183  -9.610
   97    HB   VAL  14           HB       VAL  14  10.014  23.208 -10.052
   98   1HG1  VAL  14          3HG1      VAL  14  12.020  21.321  -8.761
   99   2HG1  VAL  14          1HG1      VAL  14  12.345  23.015  -9.173
  100   3HG1  VAL  14          2HG1      VAL  14  11.141  22.631  -7.941
  101   1HG2  VAL  14          1HG2      VAL  14  11.633  20.926 -11.275
  102   2HG2  VAL  14          2HG2      VAL  14  10.486  21.969 -12.140
  103   3HG2  VAL  14          3HG2      VAL  14  11.980  22.653 -11.495
  104    H    CYS  15           H        CYS  15  10.001  20.279  -7.297
  105    HA   CYS  15           HA       CYS  15   7.381  20.593  -6.199
  106   1HB   CYS  15          1HB       CYS  15   8.148  19.380  -4.477
  107   2HB   CYS  15          2HB       CYS  15   9.611  19.171  -5.439
  108    H    GLY  16           H        GLY  16  10.213  22.757  -5.891
  109   1HA   GLY  16          1HA       GLY  16  10.326  24.896  -5.063
  110   2HA   GLY  16          2HA       GLY  16   8.566  24.935  -4.969
  111    H    ASN  17           H        ASN  17   8.208  22.743  -3.047
  112    HA   ASN  17           HA       ASN  17   9.555  23.396  -0.599
  113   1HB   ASN  17          1HB       ASN  17   8.482  25.600  -0.862
  114   2HB   ASN  17          2HB       ASN  17   6.916  24.821  -1.117
  115   1HD2  ASN  17          2HD2      ASN  17   8.500  25.115   2.680
  116   2HD2  ASN  17          1HD2      ASN  17   9.508  25.418   1.277
  117    H    ASN  18           H        ASN  18   9.163  21.823   0.825
  118    HA   ASN  18           HA       ASN  18   7.591  19.594   0.353
  119   1HB   ASN  18          1HB       ASN  18   9.595  19.888   1.910
  120   2HB   ASN  18          2HB       ASN  18   8.523  20.639   3.075
  121   1HD2  ASN  18          2HD2      ASN  18   8.378  16.605   2.575
  122   2HD2  ASN  18          1HD2      ASN  18   9.511  17.512   1.599
  123    H    ASN  19           H        ASN  19   6.940  21.950   2.829
  124    HA   ASN  19           HA       ASN  19   4.458  21.029   3.709
  125   1HB   ASN  19          1HB       ASN  19   5.655  22.760   4.899
  126   2HB   ASN  19          2HB       ASN  19   5.382  23.921   3.591
  127   1HD2  ASN  19          1HD2      ASN  19   2.082  24.704   4.628
  128   2HD2  ASN  19          2HD2      ASN  19   3.367  25.010   3.474
  129    H    ALA  20           H        ALA  20   4.997  23.428   1.093
  130    HA   ALA  20           HA       ALA  20   2.218  23.797   0.500
  131   1HB   ALA  20          1HB       ALA  20   3.954  25.347  -0.295
  132   2HB   ALA  20          2HB       ALA  20   4.607  24.076  -1.357
  133   3HB   ALA  20          3HB       ALA  20   2.969  24.721  -1.629
  134    H    CYS  21           H        CYS  21   4.703  21.717  -1.093
  135    HA   CYS  21           HA       CYS  21   3.122  20.364  -2.925
  136   1HB   CYS  21          1HB       CYS  21   5.402  19.860  -3.014
  137   2HB   CYS  21          2HB       CYS  21   5.524  19.594  -1.279
  138    H    LYS  22           H        LYS  22   3.770  19.473   0.426
  139    HA   LYS  22           HA       LYS  22   2.259  17.163   0.716
  140   1HB   LYS  22          1HB       LYS  22   3.911  17.956   2.296
  141   2HB   LYS  22          2HB       LYS  22   2.973  19.387   2.682
  142   1HG   LYS  22          1HG       LYS  22   1.189  18.045   3.697
  143   2HG   LYS  22          2HG       LYS  22   2.067  16.578   3.360
  144   1HD   LYS  22          1HD       LYS  22   2.523  18.766   5.368
  145   2HD   LYS  22          2HD       LYS  22   2.632  17.030   5.617
  146   1HE   LYS  22          1HE       LYS  22   4.703  18.868   4.301
  147   2HE   LYS  22          2HE       LYS  22   4.810  18.181   5.913
  148   1HZ   LYS  22          3HZ       LYS  22   4.739  16.523   3.483
  149   2HZ   LYS  22          1HZ       LYS  22   6.124  17.076   4.137
  150   3HZ   LYS  22          2HZ       LYS  22   5.153  16.047   4.989
  151    H    ASN  23           H        ASN  23   1.273  20.461   1.730
  152    HA   ASN  23           HA       ASN  23  -1.357  19.788   2.406
  153   1HB   ASN  23          1HB       ASN  23  -0.577  21.969   3.031
  154   2HB   ASN  23          2HB       ASN  23  -0.079  22.345   1.378
  155   1HD2  ASN  23          2HD2      ASN  23  -2.996  24.299   1.111
  156   2HD2  ASN  23          1HD2      ASN  23  -1.246  24.274   1.165
  157    H    GLN  24           H        GLN  24  -0.213  21.226  -0.725
  158    HA   GLN  24           HA       GLN  24  -2.771  21.135  -1.924
  159   1HB   GLN  24          1HB       GLN  24   0.007  21.003  -3.194
  160   2HB   GLN  24          2HB       GLN  24  -1.518  21.176  -4.096
  161   1HG   GLN  24          1HG       GLN  24  -2.039  23.249  -2.833
  162   2HG   GLN  24          2HG       GLN  24  -0.509  23.101  -1.949
  163   1HE2  GLN  24          2HE2      GLN  24   0.230  23.780  -5.907
  164   2HE2  GLN  24          1HE2      GLN  24  -0.612  22.322  -5.418
  165    H    CYS  25           H        CYS  25  -0.224  18.563  -1.967
  166    HA   CYS  25           HA       CYS  25  -1.743  16.853  -3.646
  167   1HB   CYS  25          1HB       CYS  25   0.627  16.363  -2.970
  168   2HB   CYS  25          2HB       CYS  25   0.042  15.936  -1.367
  169    H    ILE  26           H        ILE  26  -1.588  16.772  -0.007
  170    HA   ILE  26           HA       ILE  26  -3.578  14.674   0.000
  171    HB   ILE  26           HB       ILE  26  -3.405  14.720   2.386
  172   1HG1  ILE  26          1HG1      ILE  26  -2.145  17.471   2.123
  173   2HG1  ILE  26          2HG1      ILE  26  -3.675  17.052   2.890
  174   1HG2  ILE  26          3HG2      ILE  26  -1.454  13.873   1.025
  175   2HG2  ILE  26          1HG2      ILE  26  -0.630  15.408   1.334
  176   3HG2  ILE  26          2HG2      ILE  26  -1.056  14.347   2.678
  177   1HD1  ILE  26          1HD1      ILE  26  -2.419  15.669   4.565
  178   2HD1  ILE  26          2HD1      ILE  26  -0.902  16.300   3.875
  179   3HD1  ILE  26          3HD1      ILE  26  -2.064  17.408   4.618
  180    H    ASN  27           H        ASN  27  -3.834  18.072  -0.183
  181    HA   ASN  27           HA       ASN  27  -6.530  18.301   0.903
  182   1HB   ASN  27          1HB       ASN  27  -4.748  19.989   1.051
  183   2HB   ASN  27          2HB       ASN  27  -4.791  20.224  -0.711
  184   1HD2  ASN  27          2HD2      ASN  27  -6.761  22.819   1.202
  185   2HD2  ASN  27          1HD2      ASN  27  -5.133  22.154   1.390
  186    H    LEU  28           H        LEU  28  -5.015  18.655  -2.391
  187    HA   LEU  28           HA       LEU  28  -7.583  18.719  -3.716
  188   1HB   LEU  28          1HB       LEU  28  -4.705  18.564  -4.658
  189   2HB   LEU  28          2HB       LEU  28  -6.043  18.302  -5.757
  190    HG   LEU  28           HG       LEU  28  -6.984  20.473  -5.363
  191   1HD1  LEU  28          1HD1      LEU  28  -4.692  20.968  -3.415
  192   2HD1  LEU  28          2HD1      LEU  28  -5.796  22.205  -4.040
  193   3HD1  LEU  28          3HD1      LEU  28  -6.426  20.915  -3.016
  194   1HD2  LEU  28          1HD2      LEU  28  -5.218  20.198  -7.075
  195   2HD2  LEU  28          2HD2      LEU  28  -5.188  21.825  -6.372
  196   3HD2  LEU  28          3HD2      LEU  28  -3.980  20.622  -5.871
  197    H    GLU  29           H        GLU  29  -4.962  16.179  -3.671
  198    HA   GLU  29           HA       GLU  29  -7.074  14.247  -4.575
  199   1HB   GLU  29          1HB       GLU  29  -5.420  12.707  -5.218
  200   2HB   GLU  29          2HB       GLU  29  -5.105  14.267  -5.968
  201   1HG   GLU  29          1HG       GLU  29  -3.383  14.617  -4.082
  202   2HG   GLU  29          2HG       GLU  29  -3.501  12.869  -3.798
  203    HE2  GLU  29           HE2      GLU  29  -1.280  14.307  -6.685
  204    H    LYS  30           H        LYS  30  -6.352  11.968  -3.301
  205    HA   LYS  30           HA       LYS  30  -6.910  12.798  -0.483
  206   1HB   LYS  30          1HB       LYS  30  -8.023  10.495  -2.090
  207   2HB   LYS  30          2HB       LYS  30  -8.361  10.798  -0.379
  208   1HG   LYS  30          1HG       LYS  30  -8.946  12.819  -2.606
  209   2HG   LYS  30          2HG       LYS  30 -10.112  11.667  -1.994
  210   1HD   LYS  30          1HD       LYS  30 -10.512  12.764  -0.080
  211   2HD   LYS  30          2HD       LYS  30  -8.866  13.266   0.194
  212   1HE   LYS  30          1HE       LYS  30 -10.820  14.613  -1.740
  213   2HE   LYS  30          2HE       LYS  30 -10.383  15.157  -0.118
  214   1HZ   LYS  30          2HZ       LYS  30  -7.978  15.135  -1.146
  215   2HZ   LYS  30          3HZ       LYS  30  -8.792  15.356  -2.546
  216   3HZ   LYS  30          1HZ       LYS  30  -8.960  16.410  -1.337
  217    H    ALA  31           H        ALA  31  -4.327  11.953  -1.934
  218    HA   ALA  31           HA       ALA  31  -3.110   9.784  -0.588
  219   1HB   ALA  31          1HB       ALA  31  -2.052  11.386  -2.315
  220   2HB   ALA  31          2HB       ALA  31  -2.056  12.611  -1.052
  221   3HB   ALA  31          3HB       ALA  31  -1.078  11.139  -0.855
  222    H    ARG  32           H        ARG  32  -2.057   9.758   1.558
  223    HA   ARG  32           HA       ARG  32  -3.332  11.747   3.438
  224   1HB   ARG  32          1HB       ARG  32  -2.252   8.985   4.009
  225   2HB   ARG  32          2HB       ARG  32  -2.793  10.150   5.222
  226   1HG   ARG  32          1HG       ARG  32  -4.526   8.883   3.069
  227   2HG   ARG  32          2HG       ARG  32  -4.497   8.531   4.801
  228   1HD   ARG  32          1HD       ARG  32  -6.415   9.850   4.540
  229   2HD   ARG  32          2HD       ARG  32  -5.193  10.949   5.210
  230    HE   ARG  32           HE       ARG  32  -5.500  10.891   2.250
  231   1HH1  ARG  32          1HH2      ARG  32  -6.842  12.411   5.124
  232   2HH1  ARG  32          2HH2      ARG  32  -6.987  13.992   4.411
  233   1HH2  ARG  32          1HH1      ARG  32  -5.327  13.014   1.449
  234   2HH2  ARG  32          2HH1      ARG  32  -6.198  14.336   2.119
  235    H    HIS  33           H        HIS  33  -0.198  10.539   2.290
  236    HA   HIS  33           HA       HIS  33   0.946  12.825   3.867
  237   1HB   HIS  33          2HB       HIS  33   2.483  10.377   3.007
  238   2HB   HIS  33          1HB       HIS  33   3.116  11.810   3.809
  239    HD1  HIS  33           HD1      HIS  33  -0.018  11.155   5.463
  240    HD2  HIS  33           HD2      HIS  33   3.830   9.525   5.600
  241    HE1  HIS  33           HE1      HIS  33  -0.027   9.482   7.347
  242    H    GLY  34           H        GLY  34   2.346  14.149   2.734
  243   1HA   GLY  34          1HA       GLY  34   2.912  13.646  -0.048
  244   2HA   GLY  34          2HA       GLY  34   1.937  15.095   0.239
  245    H    SER  35           H        SER  35   4.887  14.791  -0.595
  246    HA   SER  35           HA       SER  35   6.087  16.628   1.287
  247   1HB   SER  35          1HB       SER  35   6.141  13.854   2.092
  248   2HB   SER  35          2HB       SER  35   7.732  14.174   1.428
  249    HG   SER  35           HG       SER  35   7.616  14.681   3.629
  250    H    CYS  36           H        CYS  36   7.700  17.613   0.293
  251    HA   CYS  36           HA       CYS  36   8.503  16.903  -2.438
  252   1HB   CYS  36          1HB       CYS  36   8.326  19.268  -1.828
  253   2HB   CYS  36          2HB       CYS  36   9.474  19.016  -0.479
  254    H    ASN  37           H        ASN  37  10.451  15.952  -2.986
  255    HA   ASN  37           HA       ASN  37  12.516  15.629  -0.880
  256   1HB   ASN  37          1HB       ASN  37  11.105  13.471  -1.225
  257   2HB   ASN  37          2HB       ASN  37  11.891  13.353  -2.805
  258   1HD2  ASN  37          2HD2      ASN  37  15.089  12.488  -1.317
  259   2HD2  ASN  37          1HD2      ASN  37  14.395  13.154  -2.778
  260    H    TYR  38           H        TYR  38  14.682  15.554  -1.830
  261    HA   TYR  38           HA       TYR  38  14.923  16.962  -4.350
  262   1HB   TYR  38          1HB       TYR  38  16.695  17.170  -2.683
  263   2HB   TYR  38          2HB       TYR  38  17.038  15.439  -2.805
  264    HD1  TYR  38           HD2      TYR  38  17.216  18.708  -4.587
  265    HD2  TYR  38           HD1      TYR  38  18.207  14.519  -4.784
  266    HE1  TYR  38           HE2      TYR  38  18.159  19.023  -6.853
  267    HE2  TYR  38           HE1      TYR  38  18.940  14.810  -7.133
  268    HH   TYR  38           HH       TYR  38  18.380  17.812  -8.976
  269    H    VAL  39           H        VAL  39  15.162  16.121  -6.346
  270    HA   VAL  39           HA       VAL  39  16.235  13.689  -7.075
  271    HB   VAL  39           HB       VAL  39  14.268  12.533  -6.292
  272   1HG1  VAL  39          1HG1      VAL  39  12.650  14.590  -7.819
  273   2HG1  VAL  39          2HG1      VAL  39  11.991  13.083  -7.126
  274   3HG1  VAL  39          3HG1      VAL  39  12.659  14.326  -6.064
  275   1HG2  VAL  39          2HG2      VAL  39  15.138  11.835  -8.527
  276   2HG2  VAL  39          3HG2      VAL  39  13.448  11.426  -8.201
  277   3HG2  VAL  39          1HG2      VAL  39  13.818  12.782  -9.270
  278    H    PHE  40           H        PHE  40  15.908  13.560  -9.582
  279    HA   PHE  40           HA       PHE  40  16.676  16.003 -10.591
  280   1HB   PHE  40          1HB       PHE  40  16.795  15.016 -12.680
  281   2HB   PHE  40          2HB       PHE  40  16.948  13.645 -11.612
  282    HD1  PHE  40           HD2      PHE  40  14.992  12.027 -11.385
  283    HD2  PHE  40           HD1      PHE  40  14.960  15.298 -14.204
  284    HE1  PHE  40           HE2      PHE  40  13.151  10.942 -12.635
  285    HE2  PHE  40           HE1      PHE  40  13.133  14.198 -15.456
  286    HZ   PHE  40           HZ       PHE  40  12.229  12.014 -14.681
  287    HA   PRO  41           HA       PRO  41  16.611  17.364 -12.426
  288   1HB   PRO  41          1HB       PRO  41  16.036  19.919 -13.037
  289   2HB   PRO  41          2HB       PRO  41  15.472  18.549 -14.044
  290   1HG   PRO  41          1HG       PRO  41  13.884  20.059 -11.954
  291   2HG   PRO  41          2HG       PRO  41  13.399  19.652 -13.621
  292   1HD   PRO  41          1HD       PRO  41  12.689  18.097 -11.454
  293   2HD   PRO  41          2HD       PRO  41  13.007  17.396 -13.066
  294    H    ALA  42           H        ALA  42  14.395  18.941 -10.075
  295    HA   ALA  42           HA       ALA  42  16.572  19.523  -8.237
  296   1HB   ALA  42          3HB       ALA  42  16.944  21.317  -9.899
  297   2HB   ALA  42          1HB       ALA  42  15.252  21.834  -9.712
  298   3HB   ALA  42          2HB       ALA  42  16.386  21.971  -8.350
  299    H    HIS  43           H        HIS  43  14.558  17.999  -7.702
  300    HA   HIS  43           HA       HIS  43  13.387  17.714  -5.733
  301   1HB   HIS  43          2HB       HIS  43  12.470  20.628  -5.824
  302   2HB   HIS  43          1HB       HIS  43  12.020  19.437  -4.680
  303    HD1  HIS  43           HD1      HIS  43  14.895  21.592  -5.616
  304    HD2  HIS  43           HD2      HIS  43  13.917  18.783  -2.671
  305    HE1  HIS  43           HE1      HIS  43  16.666  21.776  -3.762
  306    H    LYS  44           H        LYS  44  11.549  16.572  -5.828
  307    HA   LYS  44           HA       LYS  44   9.371  17.516  -7.652
  308   1HB   LYS  44          1HB       LYS  44  10.311  14.666  -7.247
  309   2HB   LYS  44          2HB       LYS  44   8.740  15.107  -7.900
  310   1HG   LYS  44          1HG       LYS  44   9.681  16.208  -9.805
  311   2HG   LYS  44          2HG       LYS  44  11.343  15.984  -9.219
  312   1HD   LYS  44          1HD       LYS  44  11.267  13.623  -9.513
  313   2HD   LYS  44          2HD       LYS  44   9.505  13.601  -9.468
  314   1HE   LYS  44          1HE       LYS  44   9.952  13.098 -11.691
  315   2HE   LYS  44          2HE       LYS  44   9.502  14.806 -11.722
  316   1HZ   LYS  44          1HZ       LYS  44  11.945  15.253 -11.690
  317   2HZ   LYS  44          2HZ       LYS  44  12.235  13.676 -11.858
  318   3HZ   LYS  44          3HZ       LYS  44  11.445  14.460 -13.054
  319    H    CYS  45           H        CYS  45   7.335  17.132  -6.914
  320    HA   CYS  45           HA       CYS  45   6.970  16.925  -4.009
  321   1HB   CYS  45          1HB       CYS  45   5.759  18.650  -5.178
  322   2HB   CYS  45          2HB       CYS  45   5.113  17.494  -6.339
  323    H    ILE  46           H        ILE  46   6.988  14.847  -3.191
  324    HA   ILE  46           HA       ILE  46   5.942  12.621  -4.874
  325    HB   ILE  46           HB       ILE  46   7.486  12.493  -2.263
  326   1HG1  ILE  46          1HG1      ILE  46   8.985  13.554  -3.826
  327   2HG1  ILE  46          2HG1      ILE  46   9.475  11.886  -3.572
  328   1HG2  ILE  46          2HG2      ILE  46   6.822  10.391  -4.369
  329   2HG2  ILE  46          3HG2      ILE  46   7.931  10.148  -3.003
  330   3HG2  ILE  46          1HG2      ILE  46   6.223  10.468  -2.709
  331   1HD1  ILE  46          1HD1      ILE  46   8.436  11.243  -5.750
  332   2HD1  ILE  46          2HD1      ILE  46   7.969  12.940  -6.012
  333   3HD1  ILE  46          3HD1      ILE  46   9.677  12.491  -5.925
  334    H    CYS  47           H        CYS  47   4.305  11.219  -3.922
  335    HA   CYS  47           HA       CYS  47   3.049  12.221  -1.488
  336   1HB   CYS  47          1HB       CYS  47   2.197  13.509  -3.589
  337   2HB   CYS  47          2HB       CYS  47   1.324  12.006  -3.957
  338    H    TYR  48           H        TYR  48   1.452  10.840  -0.519
  339    HA   TYR  48           HA       TYR  48   1.838   8.017  -1.356
  340   1HB   TYR  48          1HB       TYR  48   2.269   8.900   1.475
  341   2HB   TYR  48          2HB       TYR  48   2.756   7.417   0.683
  342    HD1  TYR  48           HD2      TYR  48   3.506  11.082   0.919
  343    HD2  TYR  48           HD1      TYR  48   4.933   7.199  -0.257
  344    HE1  TYR  48           HE2      TYR  48   5.758  12.029   0.535
  345    HE2  TYR  48           HE1      TYR  48   7.216   8.123  -0.533
  346    HH   TYR  48           HH       TYR  48   8.554  10.009  -0.374
  347    H    PHE  49           H        PHE  49   0.182   6.693  -0.988
  348    HA   PHE  49           HA       PHE  49  -2.181   7.658   0.502
  349   1HB   PHE  49          1HB       PHE  49  -2.440   5.616  -1.675
  350   2HB   PHE  49          2HB       PHE  49  -3.538   6.860  -1.162
  351    HD1  PHE  49           HD1      PHE  49  -0.292   6.377  -2.999
  352    HD2  PHE  49           HD2      PHE  49  -3.904   8.688  -2.710
  353    HE1  PHE  49           HE1      PHE  49   0.837   8.264  -4.069
  354    HE2  PHE  49           HE2      PHE  49  -2.968  10.299  -4.348
  355    HZ   PHE  49           HZ       PHE  49  -0.534  10.220  -4.903
  356    HA   PRO  50           HA       PRO  50  -1.632   3.730   2.792
  357   1HB   PRO  50          1HB       PRO  50  -4.262   3.249   3.494
  358   2HB   PRO  50          2HB       PRO  50  -3.226   4.464   4.306
  359   1HG   PRO  50          1HG       PRO  50  -5.250   4.895   2.100
  360   2HG   PRO  50          2HG       PRO  50  -5.058   5.834   3.608
  361   1HD   PRO  50          1HD       PRO  50  -4.015   6.656   1.230
  362   2HD   PRO  50          2HD       PRO  50  -3.098   6.917   2.763
  363    H    CYS  51           H        CYS  51  -1.363   1.752   1.755
  364    HA   CYS  51           HA       CYS  51  -3.333   0.818  -0.264
  365   1HB   CYS  51          1HB       CYS  51  -2.152   2.509  -1.469
  366   2HB   CYS  51          2HB       CYS  51  -0.625   2.039  -0.737
   
  No H/Q in entry =         366
  Start of MODEL    9
    1    HA   PCA   1           HA       PYR   1   0.366   1.973   6.069
    2   1HB   PCA   1          1HB       PYR   1  -1.595  -0.277   5.667
    3   2HB   PCA   1          2HB       PYR   1  -0.885   0.343   7.178
    4   1HG   PCA   1          1HG       PYR   1  -3.491   0.926   6.253
    5   2HG   PCA   1          2HG       PYR   1  -2.573   1.960   7.389
    6    HN   PCA   1           HN       PYR   1  -0.884   3.209   4.141
    7    H    LYS   2           H        LYS   2  -1.413   0.178   3.510
    8    HA   LYS   2           HA       LYS   2   1.082  -0.852   2.300
    9   1HB   LYS   2          1HB       LYS   2  -1.027  -2.184   2.365
   10   2HB   LYS   2          2HB       LYS   2  -1.828  -0.947   1.412
   11   1HG   LYS   2          1HG       LYS   2   0.317  -1.492  -0.249
   12   2HG   LYS   2          2HG       LYS   2   0.258  -2.986   0.671
   13   1HD   LYS   2          1HD       LYS   2  -1.077  -3.499  -1.135
   14   2HD   LYS   2          2HD       LYS   2  -2.302  -3.026   0.039
   15   1HE   LYS   2          1HE       LYS   2  -1.100  -1.279  -2.193
   16   2HE   LYS   2          2HE       LYS   2  -2.677  -2.077  -2.258
   17   1HZ   LYS   2          2HZ       LYS   2  -3.367  -0.652  -0.407
   18   2HZ   LYS   2          3HZ       LYS   2  -1.885   0.083  -0.440
   19   3HZ   LYS   2          1HZ       LYS   2  -2.890   0.222  -1.711
   20    H    LEU   3           H        LEU   3   1.800   1.488   2.290
   21    HA   LEU   3           HA       LEU   3   0.429   3.437   0.684
   22   1HB   LEU   3          1HB       LEU   3   3.213   3.434   1.796
   23   2HB   LEU   3          2HB       LEU   3   2.433   4.844   1.088
   24    HG   LEU   3           HG       LEU   3   1.326   3.390   3.527
   25   1HD1  LEU   3          1HD1      LEU   3   3.581   4.363   3.941
   26   2HD1  LEU   3          2HD1      LEU   3   2.970   5.941   3.407
   27   3HD1  LEU   3          3HD1      LEU   3   2.298   5.165   4.858
   28   1HD2  LEU   3          3HD2      LEU   3   0.683   6.084   2.237
   29   2HD2  LEU   3          1HD2      LEU   3  -0.402   4.684   2.347
   30   3HD2  LEU   3          2HD2      LEU   3   0.075   5.549   3.814
   31    H    CYS   4           H        CYS   4   1.106   4.541  -1.134
   32    HA   CYS   4           HA       CYS   4   3.254   3.352  -2.824
   33   1HB   CYS   4          1HB       CYS   4   0.657   4.596  -3.856
   34   2HB   CYS   4          2HB       CYS   4   1.992   3.943  -4.799
   35    H    GLU   5           H        GLU   5   4.796   4.905  -3.105
   36    HA   GLU   5           HA       GLU   5   4.295   7.705  -2.350
   37   1HB   GLU   5          1HB       GLU   5   6.772   6.333  -3.522
   38   2HB   GLU   5          2HB       GLU   5   6.646   7.999  -2.947
   39   1HG   GLU   5          1HG       GLU   5   5.923   7.044  -0.694
   40   2HG   GLU   5          2HG       GLU   5   6.386   5.447  -1.296
   41    HE2  GLU   5           HE2      GLU   5   9.332   6.463   0.392
   42    H    ARG   6           H        ARG   6   2.812   8.493  -3.856
   43    HA   ARG   6           HA       ARG   6   3.303   8.051  -6.746
   44   1HB   ARG   6          1HB       ARG   6   0.998   7.815  -5.760
   45   2HB   ARG   6          2HB       ARG   6   1.076   9.519  -5.332
   46   1HG   ARG   6          1HG       ARG   6  -0.103   9.585  -7.288
   47   2HG   ARG   6          2HG       ARG   6   1.502   9.960  -7.877
   48   1HD   ARG   6          1HD       ARG   6   0.314   7.135  -7.874
   49   2HD   ARG   6          2HD       ARG   6  -0.055   8.269  -9.156
   50    HE   ARG   6           HE       ARG   6   2.380   6.759  -8.790
   51   1HH1  ARG   6          1HH2      ARG   6   1.093   9.784 -10.150
   52   2HH1  ARG   6          2HH2      ARG   6   2.392  10.022 -11.244
   53   1HH2  ARG   6          2HH1      ARG   6   3.964   6.895 -10.495
   54   2HH2  ARG   6          1HH1      ARG   6   3.928   8.234 -11.599
   55    HA   PRO   7           HA       PRO   7   5.162  12.223  -6.476
   56   1HB   PRO   7          1HB       PRO   7   6.152  12.391  -9.052
   57   2HB   PRO   7          2HB       PRO   7   6.980  11.594  -7.693
   58   1HG   PRO   7          1HG       PRO   7   5.378  10.281  -9.880
   59   2HG   PRO   7          2HG       PRO   7   6.905   9.748  -9.140
   60   1HD   PRO   7          1HD       PRO   7   4.454   8.735  -8.437
   61   2HD   PRO   7          2HD       PRO   7   5.793   8.836  -7.279
   62    H    SER   8           H        SER   8   3.879  11.570  -9.829
   63    HA   SER   8           HA       SER   8   2.259  13.952  -9.741
   64   1HB   SER   8          1HB       SER   8   1.416  12.689 -11.933
   65   2HB   SER   8          2HB       SER   8   2.973  13.508 -11.834
   66    HG   SER   8           HG       SER   8   3.410  11.549 -12.669
   67    H    GLY   9           H        GLY   9   1.173  13.428  -7.721
   68   1HA   GLY   9          1HA       GLY   9  -1.205  11.640  -7.923
   69   2HA   GLY   9          2HA       GLY   9  -0.763  12.703  -6.564
   70    H    THR  10           H        THR  10  -0.366  15.037  -7.640
   71    HA   THR  10           HA       THR  10  -2.444  15.871  -9.564
   72    HB   THR  10           HB       THR  10  -2.584  18.015  -7.981
   73    HG1  THR  10           HG1      THR  10  -2.023  15.869  -6.193
   74   1HG2  THR  10          1HG2      THR  10  -4.513  16.686  -8.674
   75   2HG2  THR  10          2HG2      THR  10  -4.176  15.488  -7.407
   76   3HG2  THR  10          3HG2      THR  10  -4.639  17.156  -6.974
   77    H    TRP  11           H        TRP  11   0.043  17.089  -7.363
   78    HA   TRP  11           HA       TRP  11   1.129  19.022  -9.046
   79   1HB   TRP  11          1HB       TRP  11   1.270  18.647  -6.511
   80   2HB   TRP  11          2HB       TRP  11   2.679  17.654  -6.829
   81    HD1  TRP  11           HD1      TRP  11   4.195  19.486  -8.943
   82    HE1  TRP  11           HE1      TRP  11   5.045  21.830  -8.349
   83    HE3  TRP  11           HE3      TRP  11   1.344  20.348  -4.790
   84    HZ2  TRP  11           HZ2      TRP  11   4.506  23.844  -6.380
   85    HZ3  TRP  11           HZ3      TRP  11   1.524  22.509  -3.586
   86    HH2  TRP  11           HH2      TRP  11   3.186  24.185  -4.293
   87    H    SER  12           H        SER  12   1.218  17.666 -11.025
   88    HA   SER  12           HA       SER  12   3.467  15.816 -11.324
   89   1HB   SER  12          1HB       SER  12   1.494  16.916 -13.374
   90   2HB   SER  12          2HB       SER  12   2.513  15.477 -13.536
   91    HG   SER  12           HG       SER  12   0.394  15.920 -11.658
   92    H    GLY  13           H        GLY  13   4.843  17.841 -10.545
   93   1HA   GLY  13          1HA       GLY  13   6.377  18.811 -12.768
   94   2HA   GLY  13          2HA       GLY  13   5.269  20.071 -12.181
   95    H    VAL  14           H        VAL  14   7.552  21.010 -11.820
   96    HA   VAL  14           HA       VAL  14   9.219  20.092  -9.716
   97    HB   VAL  14           HB       VAL  14   8.786  22.938 -10.705
   98   1HG1  VAL  14          3HG1      VAL  14  11.122  21.677  -9.206
   99   2HG1  VAL  14          1HG1      VAL  14  11.106  23.312  -9.896
  100   3HG1  VAL  14          2HG1      VAL  14  10.008  22.909  -8.574
  101   1HG2  VAL  14          1HG2      VAL  14  10.745  20.780 -11.621
  102   2HG2  VAL  14          2HG2      VAL  14   9.434  21.482 -12.590
  103   3HG2  VAL  14          3HG2      VAL  14  10.807  22.483 -12.119
  104    H    CYS  15           H        CYS  15   9.097  20.358  -7.538
  105    HA   CYS  15           HA       CYS  15   6.453  20.708  -6.492
  106   1HB   CYS  15          1HB       CYS  15   7.224  19.776  -4.568
  107   2HB   CYS  15          2HB       CYS  15   8.411  19.179  -5.730
  108    H    GLY  16           H        GLY  16   9.291  22.828  -6.498
  109   1HA   GLY  16          1HA       GLY  16   9.526  25.017  -5.811
  110   2HA   GLY  16          2HA       GLY  16   7.801  25.087  -5.441
  111    H    ASN  17           H        ASN  17   7.582  23.035  -3.468
  112    HA   ASN  17           HA       ASN  17   9.380  23.605  -1.267
  113   1HB   ASN  17          1HB       ASN  17   8.316  25.802  -1.362
  114   2HB   ASN  17          2HB       ASN  17   6.715  25.058  -1.482
  115   1HD2  ASN  17          2HD2      ASN  17   8.600  25.260   2.176
  116   2HD2  ASN  17          1HD2      ASN  17   9.516  25.529   0.706
  117    H    ASN  18           H        ASN  18   9.096  22.183   0.383
  118    HA   ASN  18           HA       ASN  18   7.622  19.862   0.131
  119   1HB   ASN  18          1HB       ASN  18   9.647  20.333   1.585
  120   2HB   ASN  18          2HB       ASN  18   8.608  21.170   2.720
  121   1HD2  ASN  18          2HD2      ASN  18   8.566  17.118   2.654
  122   2HD2  ASN  18          1HD2      ASN  18   9.621  17.948   1.514
  123    H    ASN  19           H        ASN  19   6.975  22.411   2.441
  124    HA   ASN  19           HA       ASN  19   4.543  21.462   3.465
  125   1HB   ASN  19          1HB       ASN  19   5.692  23.285   4.536
  126   2HB   ASN  19          2HB       ASN  19   5.402  24.357   3.161
  127   1HD2  ASN  19          2HD2      ASN  19   2.169  25.254   4.245
  128   2HD2  ASN  19          1HD2      ASN  19   3.492  25.549   3.134
  129    H    ALA  20           H        ALA  20   4.972  23.662   0.641
  130    HA   ALA  20           HA       ALA  20   2.192  23.879   0.072
  131   1HB   ALA  20          2HB       ALA  20   3.954  25.314  -0.969
  132   2HB   ALA  20          3HB       ALA  20   4.443  23.929  -1.980
  133   3HB   ALA  20          1HB       ALA  20   2.808  24.610  -2.120
  134    H    CYS  21           H        CYS  21   4.646  21.638  -1.357
  135    HA   CYS  21           HA       CYS  21   2.979  20.138  -2.990
  136   1HB   CYS  21          1HB       CYS  21   5.236  19.631  -3.192
  137   2HB   CYS  21          2HB       CYS  21   5.481  19.522  -1.450
  138    H    LYS  22           H        LYS  22   3.863  19.397   0.351
  139    HA   LYS  22           HA       LYS  22   2.309  17.161   0.931
  140   1HB   LYS  22          1HB       LYS  22   4.049  18.114   2.344
  141   2HB   LYS  22          2HB       LYS  22   3.134  19.593   2.591
  142   1HG   LYS  22          1HG       LYS  22   1.370  18.318   3.815
  143   2HG   LYS  22          2HG       LYS  22   2.343  16.878   3.683
  144   1HD   LYS  22          1HD       LYS  22   2.700  19.393   5.298
  145   2HD   LYS  22          2HD       LYS  22   2.882  17.729   5.835
  146   1HE   LYS  22          1HE       LYS  22   4.859  19.390   4.181
  147   2HE   LYS  22          2HE       LYS  22   5.023  18.984   5.882
  148   1HZ   LYS  22          2HZ       LYS  22   4.956  16.942   3.761
  149   2HZ   LYS  22          3HZ       LYS  22   6.332  17.648   4.255
  150   3HZ   LYS  22          1HZ       LYS  22   5.434  16.743   5.307
  151    H    ASN  23           H        ASN  23   1.499  20.579   1.630
  152    HA   ASN  23           HA       ASN  23  -1.047  20.093   2.650
  153   1HB   ASN  23          1HB       ASN  23   0.184  22.192   2.955
  154   2HB   ASN  23          2HB       ASN  23   0.050  22.582   1.238
  155   1HD2  ASN  23          2HD2      ASN  23  -2.582  24.325   3.421
  156   2HD2  ASN  23          1HD2      ASN  23  -0.870  24.048   3.690
  157    H    GLN  24           H        GLN  24  -0.229  21.384  -0.643
  158    HA   GLN  24           HA       GLN  24  -2.875  21.299  -1.616
  159   1HB   GLN  24          1HB       GLN  24  -0.922  22.486  -2.652
  160   2HB   GLN  24          2HB       GLN  24  -0.362  20.921  -3.278
  161   1HG   GLN  24          1HG       GLN  24  -2.420  20.671  -4.583
  162   2HG   GLN  24          2HG       GLN  24  -3.150  22.068  -3.771
  163   1HE2  GLN  24          2HE2      GLN  24  -0.344  22.773  -6.696
  164   2HE2  GLN  24          1HE2      GLN  24  -0.292  21.263  -5.802
  165    H    CYS  25           H        CYS  25  -0.386  18.644  -1.678
  166    HA   CYS  25           HA       CYS  25  -2.004  16.887  -3.163
  167   1HB   CYS  25          1HB       CYS  25   0.316  16.291  -2.536
  168   2HB   CYS  25          2HB       CYS  25  -0.205  16.026  -0.871
  169    H    ILE  26           H        ILE  26  -1.784  16.995   0.469
  170    HA   ILE  26           HA       ILE  26  -3.939  15.029   0.625
  171    HB   ILE  26           HB       ILE  26  -3.618  15.116   2.979
  172   1HG1  ILE  26          1HG1      ILE  26  -2.139  17.744   2.582
  173   2HG1  ILE  26          2HG1      ILE  26  -3.668  17.483   3.433
  174   1HG2  ILE  26          2HG2      ILE  26  -1.810  14.106   1.539
  175   2HG2  ILE  26          3HG2      ILE  26  -0.870  15.594   1.738
  176   3HG2  ILE  26          1HG2      ILE  26  -1.264  14.604   3.139
  177   1HD1  ILE  26          1HD1      ILE  26  -2.450  16.025   5.077
  178   2HD1  ILE  26          2HD1      ILE  26  -0.923  16.527   4.309
  179   3HD1  ILE  26          3HD1      ILE  26  -1.963  17.733   5.078
  180    H    ASN  27           H        ASN  27  -3.842  18.445   0.421
  181    HA   ASN  27           HA       ASN  27  -6.385  19.028   1.685
  182   1HB   ASN  27          1HB       ASN  27  -4.506  20.559   1.545
  183   2HB   ASN  27          2HB       ASN  27  -4.632  20.620  -0.232
  184   1HD2  ASN  27          2HD2      ASN  27  -6.213  23.638   1.259
  185   2HD2  ASN  27          1HD2      ASN  27  -4.620  22.875   1.351
  186    H    LEU  28           H        LEU  28  -5.199  18.902  -1.746
  187    HA   LEU  28           HA       LEU  28  -7.902  18.948  -2.822
  188   1HB   LEU  28          1HB       LEU  28  -5.129  18.606  -3.970
  189   2HB   LEU  28          2HB       LEU  28  -6.532  18.140  -4.915
  190    HG   LEU  28           HG       LEU  28  -7.501  20.354  -4.771
  191   1HD1  LEU  28          3HD1      LEU  28  -5.085  21.049  -3.053
  192   2HD1  LEU  28          1HD1      LEU  28  -6.130  22.256  -3.831
  193   3HD1  LEU  28          2HD1      LEU  28  -6.798  21.174  -2.606
  194   1HD2  LEU  28          1HD2      LEU  28  -5.925  19.841  -6.588
  195   2HD2  LEU  28          2HD2      LEU  28  -5.818  21.549  -6.125
  196   3HD2  LEU  28          3HD2      LEU  28  -4.568  20.405  -5.592
  197    H    GLU  29           H        GLU  29  -5.407  16.258  -3.024
  198    HA   GLU  29           HA       GLU  29  -7.752  14.425  -3.256
  199   1HB   GLU  29          1HB       GLU  29  -6.186  12.701  -3.826
  200   2HB   GLU  29          2HB       GLU  29  -6.082  14.057  -4.937
  201   1HG   GLU  29          1HG       GLU  29  -4.112  13.952  -2.643
  202   2HG   GLU  29          2HG       GLU  29  -3.950  12.788  -3.948
  203    HE1  GLU  29           HE2      GLU  29  -3.505  16.624  -5.118
  204    H    LYS  30           H        LYS  30  -7.519  12.345  -1.846
  205    HA   LYS  30           HA       LYS  30  -7.330  13.458   0.882
  206   1HB   LYS  30          1HB       LYS  30  -8.663  10.885   0.105
  207   2HB   LYS  30          2HB       LYS  30  -8.823  11.823   1.586
  208   1HG   LYS  30          1HG       LYS  30 -10.159  12.147  -1.025
  209   2HG   LYS  30          2HG       LYS  30 -10.761  12.427   0.595
  210   1HD   LYS  30          1HD       LYS  30  -9.273  14.335  -1.238
  211   2HD   LYS  30          2HD       LYS  30 -10.892  14.435  -0.645
  212   1HE   LYS  30          1HE       LYS  30 -10.336  15.661   1.097
  213   2HE   LYS  30          2HE       LYS  30  -9.145  14.504   1.675
  214   1HZ   LYS  30          1HZ       LYS  30  -8.579  16.459  -0.500
  215   2HZ   LYS  30          2HZ       LYS  30  -8.309  16.808   1.052
  216   3HZ   LYS  30          3HZ       LYS  30  -7.471  15.609   0.373
  217    H    ALA  31           H        ALA  31  -5.025  12.294  -0.769
  218    HA   ALA  31           HA       ALA  31  -3.736  10.179   0.437
  219   1HB   ALA  31          3HB       ALA  31  -2.838  11.579  -1.415
  220   2HB   ALA  31          1HB       ALA  31  -2.654  12.934  -0.290
  221   3HB   ALA  31          2HB       ALA  31  -1.677  11.467  -0.059
  222    H    ARG  32           H        ARG  32  -2.006  10.125   2.110
  223    HA   ARG  32           HA       ARG  32  -3.237  11.402   4.504
  224   1HB   ARG  32          1HB       ARG  32  -1.247   9.119   4.426
  225   2HB   ARG  32          2HB       ARG  32  -2.187   9.706   5.803
  226   1HG   ARG  32          1HG       ARG  32  -3.116   8.163   3.370
  227   2HG   ARG  32          2HG       ARG  32  -3.274   7.739   5.070
  228   1HD   ARG  32          1HD       ARG  32  -4.856   9.752   3.458
  229   2HD   ARG  32          2HD       ARG  32  -5.448   8.317   4.262
  230    HE   ARG  32           HE       ARG  32  -4.830   9.418   6.442
  231   1HH1  ARG  32          2HH2      ARG  32  -5.842  11.434   3.635
  232   2HH1  ARG  32          1HH2      ARG  32  -6.354  12.739   4.635
  233   1HH2  ARG  32          1HH1      ARG  32  -5.596  11.151   7.713
  234   2HH2  ARG  32          2HH1      ARG  32  -6.278  12.558   6.971
  235    H    HIS  33           H        HIS  33   0.126  10.707   3.495
  236    HA   HIS  33           HA       HIS  33   0.844  13.392   4.555
  237   1HB   HIS  33          2HB       HIS  33   3.196  12.478   4.817
  238   2HB   HIS  33          1HB       HIS  33   1.993  12.111   6.045
  239    HD1  HIS  33           HD1      HIS  33   0.805   9.650   5.812
  240    HD2  HIS  33           HD2      HIS  33   4.608  10.205   4.150
  241    HE1  HIS  33           HE1      HIS  33   1.846   7.356   5.542
  242    H    GLY  34           H        GLY  34   2.631  14.389   3.392
  243   1HA   GLY  34          1HA       GLY  34   3.365  13.428   0.802
  244   2HA   GLY  34          2HA       GLY  34   2.314  14.861   0.713
  245    H    SER  35           H        SER  35   5.065  14.868  -0.099
  246    HA   SER  35           HA       SER  35   6.203  17.007   1.448
  247   1HB   SER  35          1HB       SER  35   6.895  14.205   2.211
  248   2HB   SER  35          2HB       SER  35   8.301  15.127   1.701
  249    HG   SER  35           HG       SER  35   7.804  15.303   3.956
  250    H    CYS  36           H        CYS  36   7.821  17.934   0.265
  251    HA   CYS  36           HA       CYS  36   8.359  16.862  -2.443
  252   1HB   CYS  36          1HB       CYS  36   7.968  19.289  -2.214
  253   2HB   CYS  36          2HB       CYS  36   9.351  19.398  -1.089
  254    H    ASN  37           H        ASN  37  10.295  15.980  -3.005
  255    HA   ASN  37           HA       ASN  37  12.527  16.036  -1.026
  256   1HB   ASN  37          1HB       ASN  37  11.567  13.775  -0.915
  257   2HB   ASN  37          2HB       ASN  37  11.612  13.649  -2.686
  258   1HD2  ASN  37          2HD2      ASN  37  14.894  12.372  -2.581
  259   2HD2  ASN  37          1HD2      ASN  37  13.245  12.138  -3.142
  260    H    TYR  38           H        TYR  38  14.635  15.761  -2.105
  261    HA   TYR  38           HA       TYR  38  14.624  16.877  -4.864
  262   1HB   TYR  38          1HB       TYR  38  15.895  18.209  -3.232
  263   2HB   TYR  38          2HB       TYR  38  16.888  16.802  -2.856
  264    HD1  TYR  38           HD2      TYR  38  15.880  19.125  -5.615
  265    HD2  TYR  38           HD1      TYR  38  18.688  16.113  -4.343
  266    HE1  TYR  38           HE2      TYR  38  17.118  19.383  -7.734
  267    HE2  TYR  38           HE1      TYR  38  19.873  16.317  -6.512
  268    HH   TYR  38           HH       TYR  38  18.702  18.464  -9.121
  269    H    VAL  39           H        VAL  39  15.326  15.747  -6.449
  270    HA   VAL  39           HA       VAL  39  17.299  13.690  -6.365
  271    HB   VAL  39           HB       VAL  39  14.602  12.990  -7.633
  272   1HG1  VAL  39          3HG1      VAL  39  17.144  11.371  -7.234
  273   2HG1  VAL  39          1HG1      VAL  39  15.616  10.729  -7.867
  274   3HG1  VAL  39          2HG1      VAL  39  16.483  11.960  -8.778
  275   1HG2  VAL  39          1HG2      VAL  39  15.743  11.869  -5.045
  276   2HG2  VAL  39          2HG2      VAL  39  14.236  12.806  -5.233
  277   3HG2  VAL  39          3HG2      VAL  39  14.363  11.193  -5.933
  278    H    PHE  40           H        PHE  40  18.046  13.600  -8.767
  279    HA   PHE  40           HA       PHE  40  17.912  16.125  -9.947
  280   1HB   PHE  40          1HB       PHE  40  19.115  15.231 -11.760
  281   2HB   PHE  40          2HB       PHE  40  19.603  14.276 -10.383
  282    HD1  PHE  40           HD1      PHE  40  18.768  11.881 -10.169
  283    HD2  PHE  40           HD2      PHE  40  17.910  14.310 -13.639
  284    HE1  PHE  40           HE1      PHE  40  17.940   9.885 -11.374
  285    HE2  PHE  40           HE2      PHE  40  17.096  12.304 -14.833
  286    HZ   PHE  40           HZ       PHE  40  17.092  10.093 -13.701
  287    HA   PRO  41           HA       PRO  41  17.937  17.144 -12.030
  288   1HB   PRO  41          1HB       PRO  41  16.617  18.975 -13.496
  289   2HB   PRO  41          2HB       PRO  41  17.115  17.392 -14.165
  290   1HG   PRO  41          1HG       PRO  41  14.368  18.176 -13.168
  291   2HG   PRO  41          2HG       PRO  41  14.799  17.322 -14.671
  292   1HD   PRO  41          1HD       PRO  41  14.010  16.000 -12.372
  293   2HD   PRO  41          2HD       PRO  41  15.147  15.293 -13.547
  294    H    ALA  42           H        ALA  42  14.563  17.934 -11.078
  295    HA   ALA  42           HA       ALA  42  15.543  20.085  -9.253
  296   1HB   ALA  42          1HB       ALA  42  14.468  20.918 -11.316
  297   2HB   ALA  42          2HB       ALA  42  13.008  19.986 -10.922
  298   3HB   ALA  42          3HB       ALA  42  13.529  21.318  -9.869
  299    H    HIS  43           H        HIS  43  13.791  20.718  -7.690
  300    HA   HIS  43           HA       HIS  43  13.283  18.608  -5.856
  301   1HB   HIS  43          2HB       HIS  43  12.166  21.441  -6.085
  302   2HB   HIS  43          1HB       HIS  43  11.967  20.422  -4.678
  303    HD1  HIS  43           HD1      HIS  43  14.546  22.593  -6.327
  304    HD2  HIS  43           HD2      HIS  43  14.204  19.993  -3.052
  305    HE1  HIS  43           HE1      HIS  43  16.620  22.894  -4.903
  306    H    LYS  44           H        LYS  44  11.489  17.311  -5.579
  307    HA   LYS  44           HA       LYS  44   9.212  17.662  -7.483
  308   1HB   LYS  44          1HB       LYS  44   9.393  15.228  -7.962
  309   2HB   LYS  44          2HB       LYS  44  10.676  16.252  -8.623
  310   1HG   LYS  44          1HG       LYS  44  12.216  15.548  -6.797
  311   2HG   LYS  44          2HG       LYS  44  10.920  14.609  -6.063
  312   1HD   LYS  44          1HD       LYS  44  12.398  13.144  -7.302
  313   2HD   LYS  44          2HD       LYS  44  10.788  13.133  -7.998
  314   1HE   LYS  44          1HE       LYS  44  12.657  13.156  -9.681
  315   2HE   LYS  44          2HE       LYS  44  11.452  14.424  -9.910
  316   1HZ   LYS  44          1HZ       LYS  44  14.031  14.921  -8.528
  317   2HZ   LYS  44          2HZ       LYS  44  13.845  15.055 -10.109
  318   3HZ   LYS  44          3HZ       LYS  44  12.999  16.041  -9.079
  319    H    CYS  45           H        CYS  45   7.272  17.083  -6.800
  320    HA   CYS  45           HA       CYS  45   6.875  16.851  -3.953
  321   1HB   CYS  45          1HB       CYS  45   5.453  18.263  -5.373
  322   2HB   CYS  45          2HB       CYS  45   4.923  16.836  -6.275
  323    H    ILE  46           H        ILE  46   6.539  14.943  -2.800
  324    HA   ILE  46           HA       ILE  46   5.776  12.472  -4.299
  325    HB   ILE  46           HB       ILE  46   7.340  12.728  -1.698
  326   1HG1  ILE  46          1HG1      ILE  46   8.796  13.421  -3.526
  327   2HG1  ILE  46          2HG1      ILE  46   9.286  11.870  -2.854
  328   1HG2  ILE  46          3HG2      ILE  46   6.507  10.311  -3.328
  329   2HG2  ILE  46          1HG2      ILE  46   7.676  10.271  -1.985
  330   3HG2  ILE  46          2HG2      ILE  46   5.998  10.730  -1.688
  331   1HD1  ILE  46          2HD1      ILE  46   8.253  10.686  -4.780
  332   2HD1  ILE  46          3HD1      ILE  46   7.751  12.251  -5.463
  333   3HD1  ILE  46          1HD1      ILE  46   9.468  11.866  -5.293
  334    H    CYS  47           H        CYS  47   3.840  11.549  -3.603
  335    HA   CYS  47           HA       CYS  47   2.775  12.507  -1.001
  336   1HB   CYS  47          1HB       CYS  47   1.783  13.720  -2.989
  337   2HB   CYS  47          2HB       CYS  47   1.056  12.175  -3.448
  338    H    TYR  48           H        TYR  48   1.603  11.065   0.220
  339    HA   TYR  48           HA       TYR  48   2.120   8.224  -0.526
  340   1HB   TYR  48          1HB       TYR  48   1.998   9.639   2.152
  341   2HB   TYR  48          2HB       TYR  48   2.192   7.912   1.923
  342    HD1  TYR  48           HD2      TYR  48   3.824  11.193   1.033
  343    HD2  TYR  48           HD1      TYR  48   4.357   7.002   1.881
  344    HE1  TYR  48           HE2      TYR  48   6.270  11.485   0.913
  345    HE2  TYR  48           HE1      TYR  48   6.801   7.340   1.958
  346    HH   TYR  48           HH       TYR  48   8.334  10.423   1.010
  347    H    PHE  49           H        PHE  49   0.292   7.197  -1.120
  348    HA   PHE  49           HA       PHE  49  -2.043   7.353   0.666
  349   1HB   PHE  49          1HB       PHE  49  -3.394   7.035  -1.623
  350   2HB   PHE  49          2HB       PHE  49  -3.086   8.581  -0.880
  351    HD1  PHE  49           HD1      PHE  49  -1.074   9.994  -1.660
  352    HD2  PHE  49           HD2      PHE  49  -2.822   6.783  -3.950
  353    HE1  PHE  49           HE1      PHE  49  -0.975  11.380  -3.695
  354    HE2  PHE  49           HE2      PHE  49  -2.484   8.100  -6.020
  355    HZ   PHE  49           HZ       PHE  49  -1.624  10.456  -5.860
  356    HA   PRO  50           HA       PRO  50  -1.618   3.024   0.276
  357   1HB   PRO  50          1HB       PRO  50  -3.941   2.048   1.189
  358   2HB   PRO  50          2HB       PRO  50  -2.857   3.068   2.183
  359   1HG   PRO  50          1HG       PRO  50  -5.292   3.978   0.613
  360   2HG   PRO  50          2HG       PRO  50  -4.943   4.283   2.341
  361   1HD   PRO  50          1HD       PRO  50  -4.312   6.085   0.373
  362   2HD   PRO  50          2HD       PRO  50  -3.276   5.874   1.811
  363    H    CYS  51           H        CYS  51  -1.707   3.879  -2.107
  364    HA   CYS  51           HA       CYS  51  -3.886   3.632  -3.807
  365   1HB   CYS  51          1HB       CYS  51  -2.415   4.298  -5.436
  366   2HB   CYS  51          2HB       CYS  51  -1.396   4.555  -4.088
   
  No H/Q in entry =         366
  Start of MODEL   10
    1    HA   PCA   1           HA       PYR   1  -1.500  -0.167   6.141
    2   1HB   PCA   1          1HB       PYR   1   0.859  -1.606   6.653
    3   2HB   PCA   1          2HB       PYR   1  -0.786  -2.178   7.026
    4   1HG   PCA   1          1HG       PYR   1   0.983  -3.117   4.836
    5   2HG   PCA   1          2HG       PYR   1  -0.484  -3.870   5.526
    6    HN   PCA   1           HN       PYR   1  -1.928  -0.663   3.683
    7    H    LYS   2           H        LYS   2   1.447  -1.147   4.384
    8    HA   LYS   2           HA       LYS   2   2.747   1.332   4.257
    9   1HB   LYS   2          1HB       LYS   2   4.025   0.334   2.367
   10   2HB   LYS   2          2HB       LYS   2   3.874  -0.728   3.764
   11   1HG   LYS   2          1HG       LYS   2   3.522  -2.201   2.044
   12   2HG   LYS   2          2HG       LYS   2   1.877  -1.819   2.509
   13   1HD   LYS   2          1HD       LYS   2   2.377   0.070   0.492
   14   2HD   LYS   2          2HD       LYS   2   3.425  -1.236   0.012
   15   1HE   LYS   2          1HE       LYS   2   1.207  -1.358  -1.054
   16   2HE   LYS   2          2HE       LYS   2   1.523  -2.808  -0.089
   17   1HZ   LYS   2          2HZ       LYS   2   0.048  -0.548   1.062
   18   2HZ   LYS   2          3HZ       LYS   2  -0.734  -1.590   0.087
   19   3HZ   LYS   2          1HZ       LYS   2  -0.060  -2.141   1.471
   20    H    LEU   3           H        LEU   3   2.789   2.973   2.728
   21    HA   LEU   3           HA       LEU   3   0.303   3.379   1.215
   22   1HB   LEU   3          1HB       LEU   3   2.664   5.216   1.675
   23   2HB   LEU   3          2HB       LEU   3   1.134   5.664   0.946
   24    HG   LEU   3           HG       LEU   3   0.204   4.647   3.304
   25   1HD1  LEU   3          3HD1      LEU   3   2.934   5.905   3.910
   26   2HD1  LEU   3          1HD1      LEU   3   1.688   5.542   5.121
   27   3HD1  LEU   3          2HD1      LEU   3   2.481   4.230   4.255
   28   1HD2  LEU   3          3HD2      LEU   3  -0.297   6.890   2.319
   29   2HD2  LEU   3          1HD2      LEU   3  -0.058   6.906   4.080
   30   3HD2  LEU   3          2HD2      LEU   3   1.220   7.493   3.022
   31    H    CYS   4           H        CYS   4   0.701   4.506  -1.012
   32    HA   CYS   4           HA       CYS   4   3.136   3.475  -2.410
   33   1HB   CYS   4          1HB       CYS   4   0.307   3.426  -3.522
   34   2HB   CYS   4          2HB       CYS   4   1.768   3.296  -4.493
   35    H    GLU   5           H        GLU   5   3.986   4.947  -3.870
   36    HA   GLU   5           HA       GLU   5   3.337   7.716  -3.163
   37   1HB   GLU   5          1HB       GLU   5   5.673   6.443  -4.642
   38   2HB   GLU   5          2HB       GLU   5   5.532   8.165  -4.267
   39   1HG   GLU   5          1HG       GLU   5   5.439   7.678  -1.868
   40   2HG   GLU   5          2HG       GLU   5   5.615   5.942  -2.177
   41    HE1  GLU   5           HE2      GLU   5   8.999   6.503  -3.402
   42    H    ARG   6           H        ARG   6   2.978   9.369  -4.649
   43    HA   ARG   6           HA       ARG   6   2.998   8.735  -7.536
   44   1HB   ARG   6          1HB       ARG   6   0.545   8.922  -6.373
   45   2HB   ARG   6          2HB       ARG   6   0.887  10.641  -6.604
   46   1HG   ARG   6          1HG       ARG   6  -0.098  10.186  -8.611
   47   2HG   ARG   6          2HG       ARG   6   1.570   9.843  -9.061
   48   1HD   ARG   6          1HD       ARG   6  -0.698   7.923  -8.398
   49   2HD   ARG   6          2HD       ARG   6   0.224   8.075  -9.909
   50    HE   ARG   6           HE       ARG   6   1.738   7.258  -7.483
   51   1HH1  ARG   6          2HH1      ARG   6  -0.115   6.014 -10.216
   52   2HH1  ARG   6          1HH1      ARG   6   0.627   4.444 -10.174
   53   1HH2  ARG   6          2HH2      ARG   6   2.712   5.316  -7.404
   54   2HH2  ARG   6          1HH2      ARG   6   2.306   4.011  -8.497
   55    HA   PRO   7           HA       PRO   7   5.681  12.313  -6.958
   56   1HB   PRO   7          1HB       PRO   7   5.650  12.144  -9.976
   57   2HB   PRO   7          2HB       PRO   7   7.031  12.449  -8.886
   58   1HG   PRO   7          1HG       PRO   7   6.667   9.978  -9.955
   59   2HG   PRO   7          2HG       PRO   7   7.093  10.145  -8.224
   60   1HD   PRO   7          1HD       PRO   7   4.347   9.681  -9.425
   61   2HD   PRO   7          2HD       PRO   7   5.141   8.877  -8.031
   62    H    SER   8           H        SER   8   3.231  12.166  -9.608
   63    HA   SER   8           HA       SER   8   2.746  15.000  -9.600
   64   1HB   SER   8          1HB       SER   8   0.741  14.157 -10.994
   65   2HB   SER   8          2HB       SER   8   2.359  13.796 -11.620
   66    HG   SER   8           HG       SER   8   1.054  11.928 -11.638
   67    H    GLY   9           H        GLY   9   0.315  12.560  -9.176
   68   1HA   GLY   9          1HA       GLY   9  -1.416  12.262  -7.605
   69   2HA   GLY   9          2HA       GLY   9  -0.668  13.491  -6.559
   70    H    THR  10           H        THR  10  -0.436  15.591  -7.852
   71    HA   THR  10           HA       THR  10  -2.558  16.439  -9.717
   72    HB   THR  10           HB       THR  10  -2.712  18.590  -8.277
   73    HG1  THR  10           HG1      THR  10  -2.377  18.222  -6.081
   74   1HG2  THR  10          1HG2      THR  10  -4.602  16.992  -8.508
   75   2HG2  THR  10          2HG2      THR  10  -3.973  16.080  -7.122
   76   3HG2  THR  10          3HG2      THR  10  -4.537  17.745  -6.902
   77    H    TRP  11           H        TRP  11  -0.065  17.677  -7.575
   78    HA   TRP  11           HA       TRP  11   1.067  19.589  -9.286
   79   1HB   TRP  11          1HB       TRP  11   1.114  19.396  -6.785
   80   2HB   TRP  11          2HB       TRP  11   2.435  18.251  -6.929
   81    HD1  TRP  11           HD1      TRP  11   4.250  19.859  -9.043
   82    HE1  TRP  11           HE1      TRP  11   5.438  22.011  -8.301
   83    HE3  TRP  11           HE3      TRP  11   1.268  21.153  -5.093
   84    HZ2  TRP  11           HZ2      TRP  11   5.241  23.918  -6.192
   85    HZ3  TRP  11           HZ3      TRP  11   1.855  23.073  -3.669
   86    HH2  TRP  11           HH2      TRP  11   3.906  24.385  -4.141
   87    H    SER  12           H        SER  12   1.275  18.292 -11.235
   88    HA   SER  12           HA       SER  12   3.373  16.276 -11.413
   89   1HB   SER  12          1HB       SER  12   1.750  17.646 -13.600
   90   2HB   SER  12          2HB       SER  12   2.637  16.118 -13.722
   91    HG   SER  12           HG       SER  12   0.407  16.667 -12.003
   92    H    GLY  13           H        GLY  13   4.919  18.061 -10.448
   93   1HA   GLY  13          1HA       GLY  13   6.803  18.748 -12.468
   94   2HA   GLY  13          2HA       GLY  13   5.834  20.185 -12.083
   95    H    VAL  14           H        VAL  14   8.030  20.933 -11.479
   96    HA   VAL  14           HA       VAL  14   9.488  19.983  -9.236
   97    HB   VAL  14           HB       VAL  14   9.267  22.790 -10.381
   98   1HG1  VAL  14          3HG1      VAL  14  10.398  22.738  -8.151
   99   2HG1  VAL  14          1HG1      VAL  14  11.574  21.582  -8.818
  100   3HG1  VAL  14          2HG1      VAL  14  11.468  23.222  -9.469
  101   1HG2  VAL  14          1HG2      VAL  14  11.170  20.507 -11.087
  102   2HG2  VAL  14          2HG2      VAL  14   9.953  21.225 -12.163
  103   3HG2  VAL  14          3HG2      VAL  14  11.346  22.181 -11.654
  104    H    CYS  15           H        CYS  15   9.173  20.328  -7.088
  105    HA   CYS  15           HA       CYS  15   6.641  21.604  -6.193
  106   1HB   CYS  15          1HB       CYS  15   7.074  20.668  -4.026
  107   2HB   CYS  15          2HB       CYS  15   7.089  19.397  -5.229
  108    H    GLY  16           H        GLY  16  10.170  21.805  -5.554
  109   1HA   GLY  16          1HA       GLY  16  11.442  23.532  -4.713
  110   2HA   GLY  16          2HA       GLY  16  10.067  24.631  -4.868
  111    H    ASN  17           H        ASN  17   8.165  23.629  -3.255
  112    HA   ASN  17           HA       ASN  17   9.376  23.895  -0.529
  113   1HB   ASN  17          1HB       ASN  17   8.302  25.941  -1.356
  114   2HB   ASN  17          2HB       ASN  17   6.790  25.054  -1.604
  115   1HD2  ASN  17          2HD2      ASN  17   7.911  26.194   2.178
  116   2HD2  ASN  17          1HD2      ASN  17   8.987  26.431   0.816
  117    H    ASN  18           H        ASN  18   9.136  22.114   0.643
  118    HA   ASN  18           HA       ASN  18   7.622  19.898   0.229
  119   1HB   ASN  18          1HB       ASN  18   9.485  20.259   1.889
  120   2HB   ASN  18          2HB       ASN  18   8.384  21.119   2.943
  121   1HD2  ASN  18          2HD2      ASN  18   8.269  17.075   2.872
  122   2HD2  ASN  18          1HD2      ASN  18   9.542  17.965   2.039
  123    H    ASN  19           H        ASN  19   6.834  22.413   2.550
  124    HA   ASN  19           HA       ASN  19   4.397  21.463   3.487
  125   1HB   ASN  19          1HB       ASN  19   5.536  23.294   4.573
  126   2HB   ASN  19          2HB       ASN  19   5.255  24.365   3.192
  127   1HD2  ASN  19          2HD2      ASN  19   1.927  25.145   4.141
  128   2HD2  ASN  19          1HD2      ASN  19   3.217  25.396   2.979
  129    H    ALA  20           H        ALA  20   4.878  23.693   0.707
  130    HA   ALA  20           HA       ALA  20   2.122  24.000   0.096
  131   1HB   ALA  20          1HB       ALA  20   3.909  25.411  -0.876
  132   2HB   ALA  20          2HB       ALA  20   4.462  24.022  -1.847
  133   3HB   ALA  20          3HB       ALA  20   2.837  24.703  -2.100
  134    H    CYS  21           H        CYS  21   4.546  21.759  -1.376
  135    HA   CYS  21           HA       CYS  21   2.787  20.420  -3.086
  136   1HB   CYS  21          1HB       CYS  21   4.942  19.828  -3.535
  137   2HB   CYS  21          2HB       CYS  21   5.409  19.785  -1.832
  138    H    LYS  22           H        LYS  22   3.731  19.519   0.227
  139    HA   LYS  22           HA       LYS  22   2.151  17.259   0.696
  140   1HB   LYS  22          1HB       LYS  22   3.881  18.152   2.205
  141   2HB   LYS  22          2HB       LYS  22   2.929  19.588   2.524
  142   1HG   LYS  22          1HG       LYS  22   1.109  18.126   3.532
  143   2HG   LYS  22          2HG       LYS  22   2.201  16.777   3.400
  144   1HD   LYS  22          1HD       LYS  22   2.265  19.242   5.141
  145   2HD   LYS  22          2HD       LYS  22   2.441  17.564   5.637
  146   1HE   LYS  22          1HE       LYS  22   4.501  19.352   4.257
  147   2HE   LYS  22          2HE       LYS  22   4.547  18.816   5.931
  148   1HZ   LYS  22          2HZ       LYS  22   4.662  16.949   3.658
  149   2HZ   LYS  22          3HZ       LYS  22   5.989  17.653   4.296
  150   3HZ   LYS  22          1HZ       LYS  22   5.061  16.642   5.227
  151    H    ASN  23           H        ASN  23   1.357  20.620   1.649
  152    HA   ASN  23           HA       ASN  23  -1.197  20.058   2.624
  153   1HB   ASN  23          1HB       ASN  23  -0.262  22.184   3.196
  154   2HB   ASN  23          2HB       ASN  23   0.063  22.590   1.505
  155   1HD2  ASN  23          2HD2      ASN  23  -2.966  24.317   1.136
  156   2HD2  ASN  23          1HD2      ASN  23  -1.284  24.128   0.685
  157    H    GLN  24           H        GLN  24  -0.306  21.523  -0.542
  158    HA   GLN  24           HA       GLN  24  -2.843  21.575  -1.724
  159   1HB   GLN  24          1HB       GLN  24  -0.838  22.662  -2.596
  160   2HB   GLN  24          2HB       GLN  24  -0.058  21.118  -2.900
  161   1HG   GLN  24          1HG       GLN  24  -2.608  22.093  -4.271
  162   2HG   GLN  24          2HG       GLN  24  -0.983  22.300  -4.926
  163   1HE2  GLN  24          2HE2      GLN  24  -0.668  18.562  -5.281
  164   2HE2  GLN  24          1HE2      GLN  24   0.158  19.726  -4.250
  165    H    CYS  25           H        CYS  25  -0.509  18.772  -1.794
  166    HA   CYS  25           HA       CYS  25  -2.183  17.164  -3.375
  167   1HB   CYS  25          1HB       CYS  25   0.102  16.455  -2.757
  168   2HB   CYS  25          2HB       CYS  25  -0.400  16.169  -1.098
  169    H    ILE  26           H        ILE  26  -2.013  17.188   0.231
  170    HA   ILE  26           HA       ILE  26  -4.234  15.292   0.312
  171    HB   ILE  26           HB       ILE  26  -3.825  15.085   2.596
  172   1HG1  ILE  26          1HG1      ILE  26  -2.310  17.715   2.495
  173   2HG1  ILE  26          2HG1      ILE  26  -3.834  17.368   3.343
  174   1HG2  ILE  26          2HG2      ILE  26  -2.073  14.245   0.997
  175   2HG2  ILE  26          3HG2      ILE  26  -1.106  15.693   1.330
  176   3HG2  ILE  26          1HG2      ILE  26  -1.451  14.557   2.614
  177   1HD1  ILE  26          1HD1      ILE  26  -2.611  15.709   4.769
  178   2HD1  ILE  26          2HD1      ILE  26  -1.087  16.276   4.039
  179   3HD1  ILE  26          3HD1      ILE  26  -2.089  17.395   4.971
  180    H    ASN  27           H        ASN  27  -4.013  18.687   0.217
  181    HA   ASN  27           HA       ASN  27  -6.483  19.307   1.639
  182   1HB   ASN  27          1HB       ASN  27  -4.504  20.758   1.548
  183   2HB   ASN  27          2HB       ASN  27  -4.750  21.025  -0.193
  184   1HD2  ASN  27          2HD2      ASN  27  -6.303  23.643   2.211
  185   2HD2  ASN  27          1HD2      ASN  27  -4.783  22.755   2.354
  186    H    LEU  28           H        LEU  28  -5.345  19.341  -1.811
  187    HA   LEU  28           HA       LEU  28  -8.064  19.566  -2.843
  188   1HB   LEU  28          1HB       LEU  28  -5.325  19.111  -4.062
  189   2HB   LEU  28          2HB       LEU  28  -6.780  18.722  -4.970
  190    HG   LEU  28           HG       LEU  28  -7.646  21.031  -4.607
  191   1HD1  LEU  28          3HD1      LEU  28  -4.845  21.514  -3.497
  192   2HD1  LEU  28          1HD1      LEU  28  -5.978  22.791  -3.982
  193   3HD1  LEU  28          2HD1      LEU  28  -6.380  21.730  -2.628
  194   1HD2  LEU  28          2HD2      LEU  28  -6.528  20.340  -6.692
  195   2HD2  LEU  28          3HD2      LEU  28  -6.190  22.037  -6.313
  196   3HD2  LEU  28          1HD2      LEU  28  -4.959  20.799  -6.012
  197    H    GLU  29           H        GLU  29  -5.678  16.805  -3.113
  198    HA   GLU  29           HA       GLU  29  -8.088  15.051  -3.420
  199   1HB   GLU  29          1HB       GLU  29  -6.529  13.333  -4.226
  200   2HB   GLU  29          2HB       GLU  29  -6.662  14.783  -5.219
  201   1HG   GLU  29          1HG       GLU  29  -4.494  15.609  -4.328
  202   2HG   GLU  29          2HG       GLU  29  -4.331  14.121  -3.364
  203    HE1  GLU  29           HE2      GLU  29  -4.330  13.538  -7.350
  204    H    LYS  30           H        LYS  30  -7.432  12.744  -2.284
  205    HA   LYS  30           HA       LYS  30  -7.194  13.620   0.549
  206   1HB   LYS  30          1HB       LYS  30  -9.008  11.581  -0.728
  207   2HB   LYS  30          2HB       LYS  30  -8.867  11.823   1.023
  208   1HG   LYS  30          1HG       LYS  30  -9.576  14.072  -0.925
  209   2HG   LYS  30          2HG       LYS  30 -10.760  13.094  -0.085
  210   1HD   LYS  30          1HD       LYS  30 -10.495  14.105   1.894
  211   2HD   LYS  30          2HD       LYS  30  -8.763  14.261   1.800
  212   1HE   LYS  30          1HE       LYS  30 -10.765  16.089   0.383
  213   2HE   LYS  30          2HE       LYS  30  -9.941  16.422   1.909
  214   1HZ   LYS  30          3HZ       LYS  30  -7.787  16.270   0.598
  215   2HZ   LYS  30          1HZ       LYS  30  -8.703  16.320  -0.760
  216   3HZ   LYS  30          2HZ       LYS  30  -8.765  17.542   0.280
  217    H    ALA  31           H        ALA  31  -5.030  12.501  -1.196
  218    HA   ALA  31           HA       ALA  31  -3.913  10.153  -0.144
  219   1HB   ALA  31          2HB       ALA  31  -2.945  11.609  -1.941
  220   2HB   ALA  31          3HB       ALA  31  -2.644  12.852  -0.723
  221   3HB   ALA  31          1HB       ALA  31  -1.768  11.308  -0.650
  222    H    ARG  32           H        ARG  32  -2.021  10.112   1.518
  223    HA   ARG  32           HA       ARG  32  -3.183  11.193   4.032
  224   1HB   ARG  32          1HB       ARG  32  -0.959   9.173   3.541
  225   2HB   ARG  32          2HB       ARG  32  -1.577   9.607   5.136
  226   1HG   ARG  32          1HG       ARG  32  -3.305   8.361   2.966
  227   2HG   ARG  32          2HG       ARG  32  -2.342   7.407   4.072
  228   1HD   ARG  32          1HD       ARG  32  -4.612   7.470   4.932
  229   2HD   ARG  32          2HD       ARG  32  -3.491   8.261   6.026
  230    HE   ARG  32           HE       ARG  32  -4.682  10.180   5.848
  231   1HH1  ARG  32          2HH2      ARG  32  -5.518   8.206   3.040
  232   2HH1  ARG  32          1HH2      ARG  32  -6.253   9.550   2.171
  233   1HH2  ARG  32          1HH1      ARG  32  -5.734  11.928   4.678
  234   2HH2  ARG  32          2HH1      ARG  32  -6.296  11.593   3.063
  235    H    HIS  33           H        HIS  33   0.230  10.856   3.052
  236    HA   HIS  33           HA       HIS  33   0.623  13.652   3.979
  237   1HB   HIS  33          2HB       HIS  33   3.014  13.024   4.443
  238   2HB   HIS  33          1HB       HIS  33   1.794  12.491   5.592
  239    HD1  HIS  33           HD1      HIS  33   1.163   9.944   5.658
  240    HD2  HIS  33           HD2      HIS  33   4.568  10.929   3.427
  241    HE1  HIS  33           HE1      HIS  33   2.491   7.814   5.340
  242    H    GLY  34           H        GLY  34   2.505  14.653   2.878
  243   1HA   GLY  34          1HA       GLY  34   3.367  13.588   0.379
  244   2HA   GLY  34          2HA       GLY  34   2.357  15.046   0.170
  245    H    SER  35           H        SER  35   5.081  15.080  -0.551
  246    HA   SER  35           HA       SER  35   6.226  17.137   1.093
  247   1HB   SER  35          1HB       SER  35   7.158  14.260   1.431
  248   2HB   SER  35          2HB       SER  35   8.363  15.534   1.473
  249    HG   SER  35           HG       SER  35   6.046  15.305   3.071
  250    H    CYS  36           H        CYS  36   8.259  17.832   0.292
  251    HA   CYS  36           HA       CYS  36   8.689  17.447  -2.600
  252   1HB   CYS  36          1HB       CYS  36   9.889  19.147  -0.400
  253   2HB   CYS  36          2HB       CYS  36  10.875  18.780  -1.808
  254    H    ASN  37           H        ASN  37  10.184  16.014  -3.379
  255    HA   ASN  37           HA       ASN  37  12.217  14.816  -1.523
  256   1HB   ASN  37          1HB       ASN  37  10.598  13.164  -2.340
  257   2HB   ASN  37          2HB       ASN  37  10.913  13.664  -4.024
  258   1HD2  ASN  37          2HD2      ASN  37  13.963  11.834  -4.249
  259   2HD2  ASN  37          1HD2      ASN  37  13.142  13.220  -4.944
  260    H    TYR  38           H        TYR  38  14.339  14.749  -2.471
  261    HA   TYR  38           HA       TYR  38  14.743  16.715  -4.626
  262   1HB   TYR  38          1HB       TYR  38  16.255  16.810  -2.710
  263   2HB   TYR  38          2HB       TYR  38  16.843  15.190  -3.071
  264    HD1  TYR  38           HD1      TYR  38  16.201  18.425  -4.987
  265    HD2  TYR  38           HD2      TYR  38  19.004  15.259  -4.136
  266    HE1  TYR  38           HE1      TYR  38  17.475  18.994  -7.021
  267    HE2  TYR  38           HE2      TYR  38  20.223  15.795  -6.227
  268    HH   TYR  38           HH       TYR  38  18.961  18.170  -8.590
  269    H    VAL  39           H        VAL  39  17.090  14.404  -5.020
  270    HA   VAL  39           HA       VAL  39  17.659  13.070  -6.714
  271    HB   VAL  39           HB       VAL  39  14.670  12.486  -7.027
  272   1HG1  VAL  39          2HG1      VAL  39  17.038  11.182  -8.395
  273   2HG1  VAL  39          3HG1      VAL  39  15.383  10.541  -8.342
  274   3HG1  VAL  39          1HG1      VAL  39  15.699  12.064  -9.173
  275   1HG2  VAL  39          1HG2      VAL  39  15.841  11.738  -4.886
  276   2HG2  VAL  39          2HG2      VAL  39  15.206  10.422  -5.891
  277   3HG2  VAL  39          3HG2      VAL  39  16.941  10.798  -5.900
  278    H    PHE  40           H        PHE  40  17.959  13.273  -9.061
  279    HA   PHE  40           HA       PHE  40  17.968  15.959  -9.813
  280   1HB   PHE  40          1HB       PHE  40  18.852  15.231 -11.899
  281   2HB   PHE  40          2HB       PHE  40  19.415  14.082 -10.713
  282    HD1  PHE  40           HD1      PHE  40  18.435  11.741 -10.677
  283    HD2  PHE  40           HD2      PHE  40  17.329  14.641 -13.684
  284    HE1  PHE  40           HE1      PHE  40  17.295   9.973 -11.977
  285    HE2  PHE  40           HE2      PHE  40  16.206  12.858 -14.979
  286    HZ   PHE  40           HZ       PHE  40  16.171  10.527 -14.123
  287    HA   PRO  41           HA       PRO  41  17.905  17.241 -11.752
  288   1HB   PRO  41          1HB       PRO  41  16.659  19.338 -12.892
  289   2HB   PRO  41          2HB       PRO  41  16.939  17.802 -13.764
  290   1HG   PRO  41          1HG       PRO  41  14.370  18.738 -12.477
  291   2HG   PRO  41          2HG       PRO  41  14.605  17.976 -14.068
  292   1HD   PRO  41          1HD       PRO  41  13.861  16.562 -11.786
  293   2HD   PRO  41          2HD       PRO  41  14.763  15.838 -13.140
  294    H    ALA  42           H        ALA  42  14.716  18.301 -10.491
  295    HA   ALA  42           HA       ALA  42  16.023  19.978  -8.399
  296   1HB   ALA  42          3HB       ALA  42  15.183  21.347 -10.273
  297   2HB   ALA  42          1HB       ALA  42  13.574  20.619 -10.083
  298   3HB   ALA  42          2HB       ALA  42  14.255  21.633  -8.791
  299    H    HIS  43           H        HIS  43  14.176  20.646  -6.794
  300    HA   HIS  43           HA       HIS  43  13.273  18.300  -5.463
  301   1HB   HIS  43          2HB       HIS  43  12.639  21.238  -5.174
  302   2HB   HIS  43          1HB       HIS  43  11.917  20.062  -4.104
  303    HD1  HIS  43           HD1      HIS  43  14.918  22.120  -4.352
  304    HD2  HIS  43           HD2      HIS  43  13.930  18.404  -2.676
  305    HE1  HIS  43           HE1      HIS  43  16.759  21.513  -2.717
  306    H    LYS  44           H        LYS  44  11.491  17.174  -5.724
  307    HA   LYS  44           HA       LYS  44   9.339  18.099  -7.597
  308   1HB   LYS  44          1HB       LYS  44   9.251  15.852  -8.517
  309   2HB   LYS  44          2HB       LYS  44  10.853  16.572  -8.731
  310   1HG   LYS  44          1HG       LYS  44  11.587  15.258  -6.631
  311   2HG   LYS  44          2HG       LYS  44  10.008  14.488  -6.655
  312   1HD   LYS  44          1HD       LYS  44  11.689  13.061  -7.667
  313   2HD   LYS  44          2HD       LYS  44  10.431  13.490  -8.826
  314   1HE   LYS  44          1HE       LYS  44  12.816  13.505  -9.703
  315   2HE   LYS  44          2HE       LYS  44  11.896  14.972 -10.036
  316   1HZ   LYS  44          1HZ       LYS  44  13.694  14.775  -7.703
  317   2HZ   LYS  44          2HZ       LYS  44  14.246  15.199  -9.159
  318   3HZ   LYS  44          3HZ       LYS  44  13.138  16.139  -8.403
  319    H    CYS  45           H        CYS  45   7.226  17.412  -7.058
  320    HA   CYS  45           HA       CYS  45   6.831  16.993  -4.226
  321   1HB   CYS  45          1HB       CYS  45   5.263  18.287  -5.739
  322   2HB   CYS  45          2HB       CYS  45   4.818  16.765  -6.498
  323    H    ILE  46           H        ILE  46   6.131  15.106  -3.163
  324    HA   ILE  46           HA       ILE  46   5.607  12.650  -4.735
  325    HB   ILE  46           HB       ILE  46   7.290  12.854  -2.198
  326   1HG1  ILE  46          1HG1      ILE  46   8.660  13.288  -4.216
  327   2HG1  ILE  46          2HG1      ILE  46   9.098  11.817  -3.339
  328   1HG2  ILE  46          3HG2      ILE  46   6.189  10.406  -3.634
  329   2HG2  ILE  46          1HG2      ILE  46   7.418  10.361  -2.350
  330   3HG2  ILE  46          2HG2      ILE  46   5.794  10.955  -2.008
  331   1HD1  ILE  46          2HD1      ILE  46   7.999  10.419  -5.034
  332   2HD1  ILE  46          3HD1      ILE  46   7.532  11.884  -5.929
  333   3HD1  ILE  46          1HD1      ILE  46   9.236  11.473  -5.734
  334    H    CYS  47           H        CYS  47   3.601  11.913  -4.096
  335    HA   CYS  47           HA       CYS  47   2.667  12.698  -1.373
  336   1HB   CYS  47          1HB       CYS  47   1.629  14.055  -3.203
  337   2HB   CYS  47          2HB       CYS  47   0.873  12.566  -3.793
  338    H    TYR  48           H        TYR  48   1.439  11.170  -0.233
  339    HA   TYR  48           HA       TYR  48   1.967   8.382  -1.176
  340   1HB   TYR  48          1HB       TYR  48   1.926   9.543   1.628
  341   2HB   TYR  48          2HB       TYR  48   2.190   7.858   1.163
  342    HD1  TYR  48           HD1      TYR  48   3.684  11.279   0.746
  343    HD2  TYR  48           HD2      TYR  48   4.329   7.020   0.906
  344    HE1  TYR  48           HE1      TYR  48   6.130  11.637   0.548
  345    HE2  TYR  48           HE2      TYR  48   6.764   7.386   0.719
  346    HH   TYR  48           HH       TYR  48   8.238   8.984  -0.300
  347    H    PHE  49           H        PHE  49   0.248   7.065  -1.410
  348    HA   PHE  49           HA       PHE  49  -2.380   7.968  -0.378
  349   1HB   PHE  49          1HB       PHE  49  -1.757   6.212  -2.749
  350   2HB   PHE  49          2HB       PHE  49  -3.309   6.798  -2.310
  351    HD1  PHE  49           HD1      PHE  49   0.077   8.111  -3.354
  352    HD2  PHE  49           HD2      PHE  49  -4.196   8.767  -3.270
  353    HE1  PHE  49           HE1      PHE  49   0.383  10.312  -4.391
  354    HE2  PHE  49           HE2      PHE  49  -3.876  10.839  -4.591
  355    HZ   PHE  49           HZ       PHE  49  -1.567  11.637  -5.104
  356    HA   PRO  50           HA       PRO  50  -2.468   4.240   2.034
  357   1HB   PRO  50          1HB       PRO  50  -5.128   3.921   2.479
  358   2HB   PRO  50          2HB       PRO  50  -4.249   5.363   3.064
  359   1HG   PRO  50          1HG       PRO  50  -5.877   5.114   0.505
  360   2HG   PRO  50          2HG       PRO  50  -6.026   6.373   1.756
  361   1HD   PRO  50          1HD       PRO  50  -4.471   6.700  -0.519
  362   2HD   PRO  50          2HD       PRO  50  -4.009   7.409   1.059
  363    H    CYS  51           H        CYS  51  -1.577   3.143   0.251
  364    HA   CYS  51           HA       CYS  51  -2.961   2.000  -1.897
  365   1HB   CYS  51          1HB       CYS  51  -0.594   2.592  -1.614
  366   2HB   CYS  51          2HB       CYS  51  -0.306   1.124  -0.688
   
  No H/Q in entry =         366
  Start of MODEL   11
    1    HA   PCA   1           HA       PYR   1   0.319   1.865   6.773
    2   1HB   PCA   1          1HB       PYR   1   1.547   4.319   6.353
    3   2HB   PCA   1          2HB       PYR   1   0.655   3.882   7.835
    4   1HG   PCA   1          1HG       PYR   1   3.636   3.893   7.419
    5   2HG   PCA   1          2HG       PYR   1   2.694   4.310   8.888
    6    HN   PCA   1           HN       PYR   1   2.046   0.415   7.915
    7    H    LYS   2           H        LYS   2   1.046   0.070   5.330
    8    HA   LYS   2           HA       LYS   2   3.261   0.481   3.507
    9   1HB   LYS   2          1HB       LYS   2   2.412  -1.749   4.301
   10   2HB   LYS   2          2HB       LYS   2   0.956  -1.465   3.352
   11   1HG   LYS   2          1HG       LYS   2   2.813  -1.069   1.379
   12   2HG   LYS   2          2HG       LYS   2   3.823  -1.963   2.493
   13   1HD   LYS   2          1HD       LYS   2   2.847  -3.481   0.860
   14   2HD   LYS   2          2HD       LYS   2   2.252  -3.864   2.474
   15   1HE   LYS   2          1HE       LYS   2   0.498  -3.960   0.680
   16   2HE   LYS   2          2HE       LYS   2   0.075  -2.882   2.007
   17   1HZ   LYS   2          2HZ       LYS   2   1.176  -1.970  -0.575
   18   2HZ   LYS   2          3HZ       LYS   2  -0.402  -1.926  -0.136
   19   3HZ   LYS   2          1HZ       LYS   2   0.674  -1.027   0.681
   20    H    LEU   3           H        LEU   3   2.423   2.671   3.028
   21    HA   LEU   3           HA       LEU   3   0.219   3.137   1.230
   22   1HB   LEU   3          1HB       LEU   3   2.755   4.688   1.733
   23   2HB   LEU   3          2HB       LEU   3   1.359   5.326   0.869
   24    HG   LEU   3           HG       LEU   3   0.870   4.348   3.675
   25   1HD1  LEU   3          2HD1      LEU   3   2.349   6.950   3.050
   26   2HD1  LEU   3          3HD1      LEU   3   1.692   6.482   4.628
   27   3HD1  LEU   3          1HD1      LEU   3   3.017   5.553   3.910
   28   1HD2  LEU   3          2HD2      LEU   3  -0.086   6.788   2.132
   29   2HD2  LEU   3          3HD2      LEU   3  -0.958   5.259   2.358
   30   3HD2  LEU   3          1HD2      LEU   3  -0.601   6.287   3.752
   31    H    CYS   4           H        CYS   4   0.610   4.104  -0.990
   32    HA   CYS   4           HA       CYS   4   3.053   3.190  -2.419
   33   1HB   CYS   4          1HB       CYS   4   0.189   2.939  -3.455
   34   2HB   CYS   4          2HB       CYS   4   1.641   2.864  -4.459
   35    H    GLU   5           H        GLU   5   3.631   4.794  -4.050
   36    HA   GLU   5           HA       GLU   5   2.404   7.399  -3.384
   37   1HB   GLU   5          1HB       GLU   5   4.617   8.384  -3.814
   38   2HB   GLU   5          2HB       GLU   5   4.531   7.315  -2.418
   39   1HG   GLU   5          1HG       GLU   5   5.687   5.532  -3.597
   40   2HG   GLU   5          2HG       GLU   5   5.633   6.446  -5.118
   41    HE2  GLU   5           HE2      GLU   5   8.550   8.112  -4.381
   42    H    ARG   6           H        ARG   6   2.247   9.013  -4.818
   43    HA   ARG   6           HA       ARG   6   2.456   8.422  -7.730
   44   1HB   ARG   6          1HB       ARG   6   0.073   8.575  -6.867
   45   2HB   ARG   6          2HB       ARG   6   0.451  10.215  -6.329
   46   1HG   ARG   6          1HG       ARG   6  -0.780  10.245  -8.347
   47   2HG   ARG   6          2HG       ARG   6   0.791  11.016  -8.504
   48   1HD   ARG   6          1HD       ARG   6   0.513   8.111  -9.334
   49   2HD   ARG   6          2HD       ARG   6  -0.292   9.294 -10.351
   50    HE   ARG   6           HE       ARG   6   2.471   8.706 -10.363
   51   1HH1  ARG   6          1HH2      ARG   6   0.265  11.456 -10.591
   52   2HH1  ARG   6          2HH2      ARG   6   1.512  12.534 -11.202
   53   1HH2  ARG   6          1HH1      ARG   6   4.063  10.205 -11.368
   54   2HH2  ARG   6          2HH1      ARG   6   3.542  11.862 -11.612
   55    HA   PRO   7           HA       PRO   7   5.220  12.033  -7.009
   56   1HB   PRO   7          1HB       PRO   7   5.673  11.490  -9.937
   57   2HB   PRO   7          2HB       PRO   7   6.869  11.906  -8.678
   58   1HG   PRO   7          1HG       PRO   7   6.628   9.331  -9.502
   59   2HG   PRO   7          2HG       PRO   7   6.761   9.694  -7.756
   60   1HD   PRO   7          1HD       PRO   7   4.244   9.115  -9.334
   61   2HD   PRO   7          2HD       PRO   7   4.755   8.465  -7.753
   62    H    SER   8           H        SER   8   5.492  14.067  -8.772
   63    HA   SER   8           HA       SER   8   3.240  15.508  -8.720
   64   1HB   SER   8          1HB       SER   8   5.282  15.729 -10.957
   65   2HB   SER   8          2HB       SER   8   4.349  17.022 -10.172
   66    HG   SER   8           HG       SER   8   6.392  17.009  -9.300
   67    H    GLY   9           H        GLY   9   1.760  16.371 -10.380
   68   1HA   GLY   9          1HA       GLY   9   0.941  15.424 -12.768
   69   2HA   GLY   9          2HA       GLY   9   0.390  14.122 -11.692
   70    H    THR  10           H        THR  10  -0.454  15.220  -9.435
   71    HA   THR  10           HA       THR  10  -2.699  16.976 -10.145
   72    HB   THR  10           HB       THR  10  -1.820  16.343  -7.311
   73    HG1  THR  10           HG1      THR  10  -3.053  14.528  -9.108
   74   1HG2  THR  10          2HG2      THR  10  -3.804  17.755  -7.703
   75   2HG2  THR  10          3HG2      THR  10  -4.555  16.444  -8.642
   76   3HG2  THR  10          1HG2      THR  10  -4.223  16.227  -6.911
   77    H    TRP  11           H        TRP  11   0.321  16.991  -8.213
   78    HA   TRP  11           HA       TRP  11   0.406  19.918  -7.999
   79   1HB   TRP  11          1HB       TRP  11   1.418  18.507  -6.260
   80   2HB   TRP  11          2HB       TRP  11   2.445  17.732  -7.474
   81    HD1  TRP  11           HD1      TRP  11   4.387  19.306  -8.588
   82    HE1  TRP  11           HE1      TRP  11   5.457  21.551  -7.891
   83    HE3  TRP  11           HE3      TRP  11   1.251  20.546  -4.771
   84    HZ2  TRP  11           HZ2      TRP  11   5.108  23.511  -5.822
   85    HZ3  TRP  11           HZ3      TRP  11   1.633  22.614  -3.447
   86    HH2  TRP  11           HH2      TRP  11   3.575  24.062  -3.938
   87    H    SER  12           H        SER  12   1.701  21.220  -9.348
   88    HA   SER  12           HA       SER  12   2.039  20.097 -11.946
   89   1HB   SER  12          1HB       SER  12   2.616  22.960 -11.054
   90   2HB   SER  12          2HB       SER  12   2.101  22.410 -12.658
   91    HG   SER  12           HG       SER  12   0.119  21.701 -11.572
   92    H    GLY  13           H        GLY  13   3.754  18.678 -11.343
   93   1HA   GLY  13          1HA       GLY  13   5.882  18.004 -11.970
   94   2HA   GLY  13          2HA       GLY  13   6.106  19.592 -12.703
   95    H    VAL  14           H        VAL  14   7.273  21.183 -11.557
   96    HA   VAL  14           HA       VAL  14   9.103  20.053  -9.587
   97    HB   VAL  14           HB       VAL  14   8.988  22.885 -10.680
   98   1HG1  VAL  14          2HG1      VAL  14  11.216  21.325  -9.300
   99   2HG1  VAL  14          3HG1      VAL  14  11.375  22.944 -10.005
  100   3HG1  VAL  14          1HG1      VAL  14  10.322  22.699  -8.609
  101   1HG2  VAL  14          1HG2      VAL  14  10.569  20.447 -11.630
  102   2HG2  VAL  14          2HG2      VAL  14   9.306  21.296 -12.546
  103   3HG2  VAL  14          3HG2      VAL  14  10.833  22.111 -12.192
  104    H    CYS  15           H        CYS  15   9.094  20.457  -7.412
  105    HA   CYS  15           HA       CYS  15   6.788  22.024  -6.349
  106   1HB   CYS  15          1HB       CYS  15   6.930  20.547  -4.386
  107   2HB   CYS  15          2HB       CYS  15   6.590  19.741  -5.906
  108    H    GLY  16           H        GLY  16  10.172  21.334  -5.515
  109   1HA   GLY  16          1HA       GLY  16  11.700  22.610  -4.323
  110   2HA   GLY  16          2HA       GLY  16  10.643  24.007  -4.505
  111    H    ASN  17           H        ASN  17   8.423  23.440  -3.234
  112    HA   ASN  17           HA       ASN  17   9.330  23.541  -0.419
  113   1HB   ASN  17          1HB       ASN  17   8.228  25.491  -1.422
  114   2HB   ASN  17          2HB       ASN  17   6.750  24.548  -1.638
  115   1HD2  ASN  17          1HD2      ASN  17   7.389  26.325   1.898
  116   2HD2  ASN  17          2HD2      ASN  17   8.197  26.766   0.408
  117    H    ASN  18           H        ASN  18   9.105  21.814   0.780
  118    HA   ASN  18           HA       ASN  18   7.569  19.551   0.282
  119   1HB   ASN  18          1HB       ASN  18   9.592  19.843   1.803
  120   2HB   ASN  18          2HB       ASN  18   8.514  20.518   3.015
  121   1HD2  ASN  18          2HD2      ASN  18   8.360  16.517   2.215
  122   2HD2  ASN  18          1HD2      ASN  18   9.380  17.521   1.180
  123    H    ASN  19           H        ASN  19   6.937  21.849   2.795
  124    HA   ASN  19           HA       ASN  19   4.478  20.964   3.709
  125   1HB   ASN  19          1HB       ASN  19   5.912  22.897   4.576
  126   2HB   ASN  19          2HB       ASN  19   5.070  23.928   3.415
  127   1HD2  ASN  19          2HD2      ASN  19   1.893  23.034   5.410
  128   2HD2  ASN  19          1HD2      ASN  19   2.349  22.511   3.802
  129    H    ALA  20           H        ALA  20   5.047  23.171   0.921
  130    HA   ALA  20           HA       ALA  20   2.288  23.635   0.375
  131   1HB   ALA  20          1HB       ALA  20   4.149  25.019  -0.536
  132   2HB   ALA  20          2HB       ALA  20   4.573  23.677  -1.629
  133   3HB   ALA  20          3HB       ALA  20   2.989  24.473  -1.757
  134    H    CYS  21           H        CYS  21   4.615  21.349  -1.194
  135    HA   CYS  21           HA       CYS  21   2.781  20.046  -2.879
  136   1HB   CYS  21          1HB       CYS  21   5.052  19.507  -3.204
  137   2HB   CYS  21          2HB       CYS  21   5.290  19.118  -1.495
  138    H    LYS  22           H        LYS  22   3.746  19.139   0.402
  139    HA   LYS  22           HA       LYS  22   2.116  16.920   0.862
  140   1HB   LYS  22          1HB       LYS  22   3.931  17.754   2.294
  141   2HB   LYS  22          2HB       LYS  22   3.024  19.203   2.701
  142   1HG   LYS  22          1HG       LYS  22   1.293  17.845   3.848
  143   2HG   LYS  22          2HG       LYS  22   2.192  16.395   3.498
  144   1HD   LYS  22          1HD       LYS  22   2.710  18.654   5.417
  145   2HD   LYS  22          2HD       LYS  22   2.845  16.928   5.718
  146   1HE   LYS  22          1HE       LYS  22   4.835  18.729   4.231
  147   2HE   LYS  22          2HE       LYS  22   5.027  18.097   5.858
  148   1HZ   LYS  22          1HZ       LYS  22   4.857  16.368   3.480
  149   2HZ   LYS  22          2HZ       LYS  22   6.257  16.923   4.086
  150   3HZ   LYS  22          3HZ       LYS  22   5.299  15.923   4.986
  151    H    ASN  23           H        ASN  23   1.390  20.297   1.864
  152    HA   ASN  23           HA       ASN  23  -1.193  19.728   2.796
  153   1HB   ASN  23          1HB       ASN  23  -0.291  21.839   3.443
  154   2HB   ASN  23          2HB       ASN  23   0.125  22.266   1.777
  155   1HD2  ASN  23          2HD2      ASN  23  -2.811  24.124   1.356
  156   2HD2  ASN  23          1HD2      ASN  23  -1.100  23.935   1.040
  157    H    GLN  24           H        GLN  24  -0.221  21.232  -0.356
  158    HA   GLN  24           HA       GLN  24  -2.835  21.412  -1.373
  159   1HB   GLN  24          1HB       GLN  24  -0.777  22.553  -2.238
  160   2HB   GLN  24          2HB       GLN  24  -0.280  21.026  -2.993
  161   1HG   GLN  24          1HG       GLN  24  -2.214  21.061  -4.455
  162   2HG   GLN  24          2HG       GLN  24  -2.985  22.339  -3.498
  163   1HE2  GLN  24          2HE2      GLN  24  -0.151  23.404  -6.250
  164   2HE2  GLN  24          1HE2      GLN  24  -0.263  21.729  -5.739
  165    H    CYS  25           H        CYS  25  -0.527  18.626  -1.647
  166    HA   CYS  25           HA       CYS  25  -2.257  17.064  -3.250
  167   1HB   CYS  25          1HB       CYS  25   0.065  16.318  -2.660
  168   2HB   CYS  25          2HB       CYS  25  -0.483  15.999  -1.022
  169    H    ILE  26           H        ILE  26  -1.962  16.886   0.374
  170    HA   ILE  26           HA       ILE  26  -4.192  15.037   0.432
  171    HB   ILE  26           HB       ILE  26  -3.876  14.897   2.759
  172   1HG1  ILE  26          1HG1      ILE  26  -2.287  17.481   2.603
  173   2HG1  ILE  26          2HG1      ILE  26  -3.828  17.202   3.436
  174   1HG2  ILE  26          3HG2      ILE  26  -2.110  13.959   1.215
  175   2HG2  ILE  26          1HG2      ILE  26  -1.099  15.365   1.590
  176   3HG2  ILE  26          2HG2      ILE  26  -1.571  14.242   2.869
  177   1HD1  ILE  26          3HD1      ILE  26  -2.669  15.556   4.935
  178   2HD1  ILE  26          1HD1      ILE  26  -1.122  16.052   4.203
  179   3HD1  ILE  26          2HD1      ILE  26  -2.100  17.232   5.087
  180    H    ASN  27           H        ASN  27  -4.032  18.436   0.380
  181    HA   ASN  27           HA       ASN  27  -6.587  18.972   1.666
  182   1HB   ASN  27          1HB       ASN  27  -4.607  20.417   1.710
  183   2HB   ASN  27          2HB       ASN  27  -4.777  20.742  -0.031
  184   1HD2  ASN  27          2HD2      ASN  27  -6.351  23.358   2.290
  185   2HD2  ASN  27          1HD2      ASN  27  -4.813  22.492   2.389
  186    H    LEU  28           H        LEU  28  -5.301  19.168  -1.743
  187    HA   LEU  28           HA       LEU  28  -7.956  19.514  -2.861
  188   1HB   LEU  28          1HB       LEU  28  -5.188  19.075  -4.002
  189   2HB   LEU  28          2HB       LEU  28  -6.607  18.883  -5.009
  190    HG   LEU  28           HG       LEU  28  -7.348  21.136  -4.645
  191   1HD1  LEU  28          3HD1      LEU  28  -4.967  21.416  -2.768
  192   2HD1  LEU  28          1HD1      LEU  28  -5.887  22.782  -3.430
  193   3HD1  LEU  28          2HD1      LEU  28  -6.683  21.620  -2.366
  194   1HD2  LEU  28          1HD2      LEU  28  -5.738  20.674  -6.444
  195   2HD2  LEU  28          2HD2      LEU  28  -5.468  22.295  -5.780
  196   3HD2  LEU  28          3HD2      LEU  28  -4.385  20.959  -5.337
  197    H    GLU  29           H        GLU  29  -5.622  16.733  -3.009
  198    HA   GLU  29           HA       GLU  29  -7.967  14.961  -3.605
  199   1HB   GLU  29          1HB       GLU  29  -6.362  13.240  -4.231
  200   2HB   GLU  29          2HB       GLU  29  -6.328  14.666  -5.261
  201   1HG   GLU  29          1HG       GLU  29  -4.276  15.460  -4.111
  202   2HG   GLU  29          2HG       GLU  29  -4.254  13.960  -3.153
  203    HE2  GLU  29           HE2      GLU  29  -2.499  14.124  -6.582
  204    H    LYS  30           H        LYS  30  -7.242  12.657  -2.333
  205    HA   LYS  30           HA       LYS  30  -7.274  13.593   0.508
  206   1HB   LYS  30          1HB       LYS  30  -9.005  11.587  -0.935
  207   2HB   LYS  30          2HB       LYS  30  -8.934  11.677   0.829
  208   1HG   LYS  30          1HG       LYS  30  -9.570  14.099  -0.908
  209   2HG   LYS  30          2HG       LYS  30 -10.796  13.016  -0.274
  210   1HD   LYS  30          1HD       LYS  30 -10.698  13.802   1.817
  211   2HD   LYS  30          2HD       LYS  30  -8.954  13.929   1.877
  212   1HE   LYS  30          1HE       LYS  30 -10.751  15.925   0.418
  213   2HE   LYS  30          2HE       LYS  30 -10.221  16.112   2.095
  214   1HZ   LYS  30          3HZ       LYS  30  -8.363  15.962  -0.199
  215   2HZ   LYS  30          1HZ       LYS  30  -8.826  17.333   0.525
  216   3HZ   LYS  30          2HZ       LYS  30  -7.923  16.228   1.329
  217    H    ALA  31           H        ALA  31  -5.057  12.362  -1.188
  218    HA   ALA  31           HA       ALA  31  -4.004  10.017  -0.147
  219   1HB   ALA  31          3HB       ALA  31  -2.741  12.738  -0.618
  220   2HB   ALA  31          1HB       ALA  31  -1.825  11.225  -0.476
  221   3HB   ALA  31          2HB       ALA  31  -2.931  11.475  -1.840
  222    H    ARG  32           H        ARG  32  -2.309   9.746   1.568
  223    HA   ARG  32           HA       ARG  32  -3.241  11.014   4.113
  224   1HB   ARG  32          1HB       ARG  32  -1.379   8.653   3.610
  225   2HB   ARG  32          2HB       ARG  32  -1.862   9.230   5.207
  226   1HG   ARG  32          1HG       ARG  32  -3.820   8.152   3.160
  227   2HG   ARG  32          2HG       ARG  32  -2.957   7.138   4.309
  228   1HD   ARG  32          1HD       ARG  32  -5.169   7.559   5.219
  229   2HD   ARG  32          2HD       ARG  32  -3.923   8.279   6.226
  230    HE   ARG  32           HE       ARG  32  -4.874  10.314   5.926
  231   1HH1  ARG  32          2HH1      ARG  32  -6.022   8.258   3.284
  232   2HH1  ARG  32          1HH1      ARG  32  -6.589   9.618   2.325
  233   1HH2  ARG  32          2HH2      ARG  32  -5.733  12.085   4.646
  234   2HH2  ARG  32          1HH2      ARG  32  -6.344  11.708   3.059
  235    H    HIS  33           H        HIS  33  -0.100  10.259   2.554
  236    HA   HIS  33           HA       HIS  33   1.069  12.566   4.083
  237   1HB   HIS  33          2HB       HIS  33   2.504  10.112   2.970
  238   2HB   HIS  33          1HB       HIS  33   3.261  11.527   3.675
  239    HD1  HIS  33           HD1      HIS  33   0.374   9.379   5.026
  240    HD2  HIS  33           HD2      HIS  33   4.271  10.581   5.962
  241    HE1  HIS  33           HE1      HIS  33   0.894   8.435   7.315
  242    H    GLY  34           H        GLY  34   2.640  13.792   2.862
  243   1HA   GLY  34          1HA       GLY  34   3.150  13.259   0.167
  244   2HA   GLY  34          2HA       GLY  34   2.050  14.659   0.269
  245    H    SER  35           H        SER  35   4.789  14.728  -0.653
  246    HA   SER  35           HA       SER  35   6.073  16.626   1.105
  247   1HB   SER  35          1HB       SER  35   6.587  13.722   1.484
  248   2HB   SER  35          2HB       SER  35   8.051  14.589   1.043
  249    HG   SER  35           HG       SER  35   7.610  14.539   3.316
  250    H    CYS  36           H        CYS  36   7.486  17.733  -0.029
  251    HA   CYS  36           HA       CYS  36   7.958  17.192  -2.876
  252   1HB   CYS  36          1HB       CYS  36   7.653  19.532  -2.055
  253   2HB   CYS  36          2HB       CYS  36   9.140  19.333  -1.075
  254    H    ASN  37           H        ASN  37   9.599  15.935  -3.492
  255    HA   ASN  37           HA       ASN  37  11.842  15.232  -1.646
  256   1HB   ASN  37          1HB       ASN  37  10.575  13.283  -2.354
  257   2HB   ASN  37          2HB       ASN  37  10.516  13.885  -4.027
  258   1HD2  ASN  37          2HD2      ASN  37  14.098  12.325  -2.717
  259   2HD2  ASN  37          1HD2      ASN  37  12.966  12.953  -1.536
  260    H    TYR  38           H        TYR  38  13.996  15.204  -2.596
  261    HA   TYR  38           HA       TYR  38  14.254  16.656  -5.154
  262   1HB   TYR  38          1HB       TYR  38  14.780  18.064  -3.149
  263   2HB   TYR  38          2HB       TYR  38  16.086  16.954  -2.756
  264    HD1  TYR  38           HD2      TYR  38  14.873  18.658  -5.911
  265    HD2  TYR  38           HD1      TYR  38  18.235  17.776  -3.364
  266    HE1  TYR  38           HE2      TYR  38  16.394  19.490  -7.644
  267    HE2  TYR  38           HE1      TYR  38  19.769  18.528  -5.162
  268    HH   TYR  38           HH       TYR  38  18.547  19.240  -8.437
  269    H    VAL  39           H        VAL  39  14.130  13.902  -5.319
  270    HA   VAL  39           HA       VAL  39  16.890  12.951  -5.664
  271    HB   VAL  39           HB       VAL  39  14.192  12.084  -6.786
  272   1HG1  VAL  39          3HG1      VAL  39  16.936  10.924  -7.442
  273   2HG1  VAL  39          1HG1      VAL  39  15.389  10.123  -7.771
  274   3HG1  VAL  39          2HG1      VAL  39  15.781  11.633  -8.592
  275   1HG2  VAL  39          2HG2      VAL  39  14.829  11.484  -4.406
  276   2HG2  VAL  39          3HG2      VAL  39  14.610  10.075  -5.455
  277   3HG2  VAL  39          1HG2      VAL  39  16.243  10.636  -5.041
  278    H    PHE  40           H        PHE  40  18.114  13.219  -7.611
  279    HA   PHE  40           HA       PHE  40  17.949  15.714  -8.802
  280   1HB   PHE  40          1HB       PHE  40  19.780  14.964 -10.202
  281   2HB   PHE  40          2HB       PHE  40  19.953  14.211  -8.641
  282    HD1  PHE  40           HD1      PHE  40  19.595  11.736  -8.395
  283    HD2  PHE  40           HD2      PHE  40  19.259  13.709 -12.226
  284    HE1  PHE  40           HE1      PHE  40  19.525   9.541  -9.531
  285    HE2  PHE  40           HE2      PHE  40  19.204  11.506 -13.347
  286    HZ   PHE  40           HZ       PHE  40  19.321   9.419 -12.005
  287    HA   PRO  41           HA       PRO  41  18.663  16.703 -10.843
  288   1HB   PRO  41          1HB       PRO  41  17.926  18.229 -12.919
  289   2HB   PRO  41          2HB       PRO  41  18.716  16.641 -13.155
  290   1HG   PRO  41          1HG       PRO  41  15.762  17.270 -13.356
  291   2HG   PRO  41          2HG       PRO  41  16.769  16.320 -14.476
  292   1HD   PRO  41          1HD       PRO  41  15.226  15.166 -12.480
  293   2HD   PRO  41          2HD       PRO  41  16.738  14.442 -13.080
  294    H    ALA  42           H        ALA  42  15.147  17.165 -11.308
  295    HA   ALA  42           HA       ALA  42  15.194  19.646  -9.659
  296   1HB   ALA  42          2HB       ALA  42  14.466  19.923 -11.997
  297   2HB   ALA  42          3HB       ALA  42  13.199  18.698 -11.749
  298   3HB   ALA  42          1HB       ALA  42  13.143  20.233 -10.857
  299    H    HIS  43           H        HIS  43  13.300  20.021  -8.354
  300    HA   HIS  43           HA       HIS  43  12.786  17.934  -6.504
  301   1HB   HIS  43          2HB       HIS  43  11.400  20.625  -6.956
  302   2HB   HIS  43          1HB       HIS  43  11.206  19.619  -5.529
  303    HD1  HIS  43           HD1      HIS  43  12.858  19.721  -3.660
  304    HD2  HIS  43           HD2      HIS  43  14.018  21.906  -7.050
  305    HE1  HIS  43           HE1      HIS  43  14.847  21.152  -2.996
  306    H    LYS  44           H        LYS  44  10.776  16.875  -5.954
  307    HA   LYS  44           HA       LYS  44   8.707  16.780  -8.100
  308   1HB   LYS  44          1HB       LYS  44  10.021  14.338  -6.802
  309   2HB   LYS  44          2HB       LYS  44   8.827  14.321  -8.112
  310   1HG   LYS  44          1HG       LYS  44  10.486  15.329  -9.640
  311   2HG   LYS  44          2HG       LYS  44  11.651  15.450  -8.300
  312   1HD   LYS  44          1HD       LYS  44  11.684  13.026  -7.996
  313   2HD   LYS  44          2HD       LYS  44  10.487  12.820  -9.275
  314   1HE   LYS  44          1HE       LYS  44  12.814  12.368 -10.060
  315   2HE   LYS  44          2HE       LYS  44  12.028  13.662 -10.974
  316   1HZ   LYS  44          2HZ       LYS  44  13.932  14.152  -8.753
  317   2HZ   LYS  44          3HZ       LYS  44  14.357  14.109 -10.302
  318   3HZ   LYS  44          1HZ       LYS  44  13.326  15.277  -9.739
  319    H    CYS  45           H        CYS  45   6.633  16.518  -7.357
  320    HA   CYS  45           HA       CYS  45   6.335  16.707  -4.436
  321   1HB   CYS  45          1HB       CYS  45   5.025  18.252  -5.842
  322   2HB   CYS  45          2HB       CYS  45   4.311  16.900  -6.698
  323    H    ILE  46           H        ILE  46   6.483  14.688  -3.436
  324    HA   ILE  46           HA       ILE  46   5.301  12.333  -4.824
  325    HB   ILE  46           HB       ILE  46   6.845  12.413  -2.221
  326   1HG1  ILE  46          1HG1      ILE  46   8.344  13.343  -3.838
  327   2HG1  ILE  46          2HG1      ILE  46   8.830  11.690  -3.472
  328   1HG2  ILE  46          3HG2      ILE  46   6.173  10.190  -4.194
  329   2HG2  ILE  46          1HG2      ILE  46   7.242  10.026  -2.785
  330   3HG2  ILE  46          2HG2      ILE  46   5.524  10.398  -2.561
  331   1HD1  ILE  46          3HD1      ILE  46   7.794  10.927  -5.625
  332   2HD1  ILE  46          1HD1      ILE  46   7.379  12.619  -5.993
  333   3HD1  ILE  46          2HD1      ILE  46   9.072  12.129  -5.852
  334    H    CYS  47           H        CYS  47   3.304  11.560  -4.194
  335    HA   CYS  47           HA       CYS  47   2.357  12.323  -1.481
  336   1HB   CYS  47          1HB       CYS  47   1.382  13.744  -3.367
  337   2HB   CYS  47          2HB       CYS  47   0.504  12.275  -3.851
  338    H    TYR  48           H        TYR  48   0.967  10.811  -0.438
  339    HA   TYR  48           HA       TYR  48   1.436   8.032  -1.448
  340   1HB   TYR  48          1HB       TYR  48   1.516   9.190   1.333
  341   2HB   TYR  48          2HB       TYR  48   1.692   7.495   0.934
  342    HD1  TYR  48           HD1      TYR  48   3.377  10.812   0.564
  343    HD2  TYR  48           HD2      TYR  48   3.735   6.521   0.287
  344    HE1  TYR  48           HE1      TYR  48   5.815  11.034   0.165
  345    HE2  TYR  48           HE2      TYR  48   6.164   6.752  -0.082
  346    HH   TYR  48           HH       TYR  48   7.703   8.285  -0.962
  347    H    PHE  49           H        PHE  49  -0.216   6.595  -1.440
  348    HA   PHE  49           HA       PHE  49  -2.732   7.294  -0.061
  349   1HB   PHE  49          1HB       PHE  49  -2.529   5.694  -2.601
  350   2HB   PHE  49          2HB       PHE  49  -3.917   6.443  -1.904
  351    HD1  PHE  49           HD1      PHE  49  -0.616   7.320  -3.478
  352    HD2  PHE  49           HD2      PHE  49  -4.697   8.537  -2.761
  353    HE1  PHE  49           HE1      PHE  49  -0.140   9.524  -4.427
  354    HE2  PHE  49           HE2      PHE  49  -4.314  10.546  -4.166
  355    HZ   PHE  49           HZ       PHE  49  -2.015  11.067  -4.991
  356    HA   PRO  50           HA       PRO  50  -2.178   3.286   1.836
  357   1HB   PRO  50          1HB       PRO  50  -4.639   2.790   2.794
  358   2HB   PRO  50          2HB       PRO  50  -3.669   4.192   3.338
  359   1HG   PRO  50          1HG       PRO  50  -5.835   4.185   1.195
  360   2HG   PRO  50          2HG       PRO  50  -5.722   5.268   2.613
  361   1HD   PRO  50          1HD       PRO  50  -4.713   5.998   0.144
  362   2HD   PRO  50          2HD       PRO  50  -3.869   6.426   1.683
  363    H    CYS  51           H        CYS  51  -1.699   2.481  -0.338
  364    HA   CYS  51           HA       CYS  51  -3.637   1.050  -1.914
  365   1HB   CYS  51          1HB       CYS  51  -1.688   0.147  -3.097
  366   2HB   CYS  51          2HB       CYS  51  -1.567   1.859  -2.790
   
  No H/Q in entry =         366
  Start of MODEL   12
    1    HA   PCA   1           HA       PYR   1  -3.389   2.102   6.538
    2   1HB   PCA   1          1HB       PYR   1  -4.357   1.799   3.692
    3   2HB   PCA   1          2HB       PYR   1  -4.808   0.831   5.126
    4   1HG   PCA   1          1HG       PYR   1  -6.400   2.878   4.105
    5   2HG   PCA   1          2HG       PYR   1  -6.345   2.495   5.853
    6    HN   PCA   1           HN       PYR   1  -3.111   4.623   5.736
    7    H    LYS   2           H        LYS   2  -2.300   0.321   4.784
    8    HA   LYS   2           HA       LYS   2   0.402   0.956   4.614
    9   1HB   LYS   2          1HB       LYS   2  -0.478  -1.337   4.467
   10   2HB   LYS   2          2HB       LYS   2  -1.253  -0.946   2.932
   11   1HG   LYS   2          1HG       LYS   2   1.456  -0.280   2.474
   12   2HG   LYS   2          2HG       LYS   2   1.570  -1.672   3.530
   13   1HD   LYS   2          1HD       LYS   2   0.509  -3.101   2.008
   14   2HD   LYS   2          2HD       LYS   2  -0.326  -1.805   1.155
   15   1HE   LYS   2          1HE       LYS   2   2.699  -2.196   1.031
   16   2HE   LYS   2          2HE       LYS   2   1.542  -2.860  -0.133
   17   1HZ   LYS   2          2HZ       LYS   2   0.784  -0.572  -0.545
   18   2HZ   LYS   2          3HZ       LYS   2   2.002   0.024   0.353
   19   3HZ   LYS   2          1HZ       LYS   2   2.344  -0.830  -0.993
   20    H    LEU   3           H        LEU   3   1.469   2.417   3.386
   21    HA   LEU   3           HA       LEU   3   0.046   3.797   1.304
   22   1HB   LEU   3          1HB       LEU   3   2.807   4.143   2.451
   23   2HB   LEU   3          2HB       LEU   3   2.063   5.275   1.326
   24    HG   LEU   3           HG       LEU   3   0.830   4.603   4.035
   25   1HD1  LEU   3          2HD1      LEU   3   3.071   5.611   4.348
   26   2HD1  LEU   3          3HD1      LEU   3   2.634   6.945   3.268
   27   3HD1  LEU   3          1HD1      LEU   3   1.789   6.741   4.812
   28   1HD2  LEU   3          2HD2      LEU   3   0.336   6.885   2.089
   29   2HD2  LEU   3          3HD2      LEU   3  -0.767   5.528   2.419
   30   3HD2  LEU   3          1HD2      LEU   3  -0.385   6.674   3.698
   31    H    CYS   4           H        CYS   4   0.903   4.420  -0.711
   32    HA   CYS   4           HA       CYS   4   3.191   2.994  -1.927
   33   1HB   CYS   4          1HB       CYS   4   0.501   3.502  -3.275
   34   2HB   CYS   4          2HB       CYS   4   1.966   3.000  -4.100
   35    H    GLU   5           H        GLU   5   4.380   4.525  -3.167
   36    HA   GLU   5           HA       GLU   5   3.688   7.331  -2.647
   37   1HB   GLU   5          1HB       GLU   5   5.898   7.848  -3.422
   38   2HB   GLU   5          2HB       GLU   5   5.948   6.581  -2.193
   39   1HG   GLU   5          1HG       GLU   5   6.249   4.861  -3.983
   40   2HG   GLU   5          2HG       GLU   5   6.243   6.148  -5.201
   41    HE1  GLU   5           HE2      GLU   5   9.398   7.387  -4.120
   42    H    ARG   6           H        ARG   6   3.409   8.891  -4.221
   43    HA   ARG   6           HA       ARG   6   3.234   8.113  -7.061
   44   1HB   ARG   6          1HB       ARG   6   0.900   8.189  -6.117
   45   2HB   ARG   6          2HB       ARG   6   1.240   9.803  -5.493
   46   1HG   ARG   6          1HG       ARG   6   0.010  10.150  -7.459
   47   2HG   ARG   6          2HG       ARG   6   1.663  10.562  -7.882
   48   1HD   ARG   6          1HD       ARG   6   1.841   8.195  -8.893
   49   2HD   ARG   6          2HD       ARG   6   0.102   8.038  -8.567
   50    HE   ARG   6           HE       ARG   6   0.723  10.489  -9.981
   51   1HH1  ARG   6          1HH1      ARG   6   0.343   7.041 -10.598
   52   2HH1  ARG   6          2HH1      ARG   6  -0.093   7.249 -12.268
   53   1HH2  ARG   6          2HH2      ARG   6   0.211  10.816 -12.055
   54   2HH2  ARG   6          1HH2      ARG   6  -0.193   9.512 -13.153
   55    HA   PRO   7           HA       PRO   7   5.498  12.106  -6.836
   56   1HB   PRO   7          1HB       PRO   7   6.488  12.207  -9.374
   57   2HB   PRO   7          2HB       PRO   7   7.152  11.147  -8.111
   58   1HG   PRO   7          1HG       PRO   7   5.308  10.342 -10.364
   59   2HG   PRO   7          2HG       PRO   7   6.718   9.487  -9.703
   60   1HD   PRO   7          1HD       PRO   7   4.060   8.980  -9.019
   61   2HD   PRO   7          2HD       PRO   7   5.460   8.562  -7.986
   62    H    SER   8           H        SER   8   4.450  12.081 -10.250
   63    HA   SER   8           HA       SER   8   2.864  14.445  -9.888
   64   1HB   SER   8          1HB       SER   8   2.397  13.883 -12.360
   65   2HB   SER   8          2HB       SER   8   4.102  14.115 -11.913
   66    HG   SER   8           HG       SER   8   2.741  11.642 -12.135
   67    H    GLY   9           H        GLY   9   1.411  13.600  -8.239
   68   1HA   GLY   9          1HA       GLY   9  -0.896  11.958  -9.216
   69   2HA   GLY   9          2HA       GLY   9  -0.658  12.619  -7.584
   70    H    THR  10           H        THR  10  -1.088  14.829  -7.178
   71    HA   THR  10           HA       THR  10  -2.721  16.339  -9.129
   72    HB   THR  10           HB       THR  10  -2.384  18.050  -7.131
   73    HG1  THR  10           HG1      THR  10  -1.927  15.658  -5.692
   74   1HG2  THR  10          3HG2      THR  10  -4.039  15.519  -6.843
   75   2HG2  THR  10          1HG2      THR  10  -4.180  16.955  -5.798
   76   3HG2  THR  10          2HG2      THR  10  -4.535  17.074  -7.531
   77    H    TRP  11           H        TRP  11   0.019  17.096  -7.054
   78    HA   TRP  11           HA       TRP  11   0.990  19.229  -8.615
   79   1HB   TRP  11          1HB       TRP  11   1.232  18.762  -6.134
   80   2HB   TRP  11          2HB       TRP  11   2.584  17.715  -6.538
   81    HD1  TRP  11           HD1      TRP  11   4.327  19.377  -8.435
   82    HE1  TRP  11           HE1      TRP  11   5.286  21.682  -7.864
   83    HE3  TRP  11           HE3      TRP  11   1.164  20.710  -4.612
   84    HZ2  TRP  11           HZ2      TRP  11   4.844  23.759  -5.988
   85    HZ3  TRP  11           HZ3      TRP  11   1.666  22.728  -3.290
   86    HH2  TRP  11           HH2      TRP  11   3.478  24.265  -3.974
   87    H    SER  12           H        SER  12   1.030  18.115 -10.686
   88    HA   SER  12           HA       SER  12   3.265  16.318 -11.278
   89   1HB   SER  12          1HB       SER  12   1.194  17.621 -13.093
   90   2HB   SER  12          2HB       SER  12   2.233  16.241 -13.482
   91    HG   SER  12           HG       SER  12   0.200  16.380 -11.462
   92    H    GLY  13           H        GLY  13   4.755  18.166 -10.364
   93   1HA   GLY  13          1HA       GLY  13   6.184  19.306 -12.562
   94   2HA   GLY  13          2HA       GLY  13   5.177  20.552 -11.790
   95    H    VAL  14           H        VAL  14   7.501  21.364 -11.499
   96    HA   VAL  14           HA       VAL  14   9.294  20.213  -9.658
   97    HB   VAL  14           HB       VAL  14   8.818  23.141 -10.361
   98   1HG1  VAL  14          3HG1      VAL  14  11.274  21.841  -9.107
   99   2HG1  VAL  14          1HG1      VAL  14  11.155  23.517  -9.664
  100   3HG1  VAL  14          2HG1      VAL  14  10.172  22.980  -8.302
  101   1HG2  VAL  14          2HG2      VAL  14  10.763  21.082 -11.509
  102   2HG2  VAL  14          3HG2      VAL  14   9.372  21.784 -12.359
  103   3HG2  VAL  14          1HG2      VAL  14  10.740  22.809 -11.920
  104    H    CYS  15           H        CYS  15   9.454  20.414  -7.386
  105    HA   CYS  15           HA       CYS  15   6.901  20.530  -6.121
  106   1HB   CYS  15          1HB       CYS  15   7.865  19.510  -4.370
  107   2HB   CYS  15          2HB       CYS  15   9.232  19.306  -5.462
  108    H    GLY  16           H        GLY  16   9.563  22.907  -6.129
  109   1HA   GLY  16          1HA       GLY  16   9.606  25.091  -5.402
  110   2HA   GLY  16          2HA       GLY  16   7.869  25.017  -5.101
  111    H    ASN  17           H        ASN  17   7.815  22.907  -3.147
  112    HA   ASN  17           HA       ASN  17   9.404  23.571  -0.851
  113   1HB   ASN  17          1HB       ASN  17   8.311  25.760  -0.970
  114   2HB   ASN  17          2HB       ASN  17   6.730  24.991  -1.175
  115   1HD2  ASN  17          2HD2      ASN  17   8.458  25.158   2.566
  116   2HD2  ASN  17          1HD2      ASN  17   9.440  25.426   1.140
  117    H    ASN  18           H        ASN  18   9.107  22.034   0.701
  118    HA   ASN  18           HA       ASN  18   7.616  19.748   0.446
  119   1HB   ASN  18          1HB       ASN  18   9.527  20.222   2.024
  120   2HB   ASN  18          2HB       ASN  18   8.435  21.103   3.070
  121   1HD2  ASN  18          2HD2      ASN  18   8.375  17.052   3.116
  122   2HD2  ASN  18          1HD2      ASN  18   9.626  17.947   2.250
  123    H    ASN  19           H        ASN  19   6.860  22.362   2.683
  124    HA   ASN  19           HA       ASN  19   4.448  21.327   3.649
  125   1HB   ASN  19          1HB       ASN  19   5.598  23.147   4.771
  126   2HB   ASN  19          2HB       ASN  19   5.204  24.263   3.453
  127   1HD2  ASN  19          2HD2      ASN  19   1.931  24.887   4.649
  128   2HD2  ASN  19          1HD2      ASN  19   3.184  25.302   3.494
  129    H    ALA  20           H        ALA  20   4.863  23.631   0.922
  130    HA   ALA  20           HA       ALA  20   2.084  23.854   0.327
  131   1HB   ALA  20          2HB       ALA  20   3.827  25.354  -0.606
  132   2HB   ALA  20          3HB       ALA  20   4.399  24.023  -1.642
  133   3HB   ALA  20          1HB       ALA  20   2.752  24.669  -1.835
  134    H    CYS  21           H        CYS  21   4.588  21.703  -1.135
  135    HA   CYS  21           HA       CYS  21   2.992  20.213  -2.847
  136   1HB   CYS  21          1HB       CYS  21   5.285  19.820  -3.002
  137   2HB   CYS  21          2HB       CYS  21   5.477  19.623  -1.264
  138    H    LYS  22           H        LYS  22   3.791  19.413   0.507
  139    HA   LYS  22           HA       LYS  22   2.224  17.153   0.971
  140   1HB   LYS  22          1HB       LYS  22   3.914  18.099   2.494
  141   2HB   LYS  22          2HB       LYS  22   2.919  19.514   2.793
  142   1HG   LYS  22          1HG       LYS  22   1.127  18.042   3.778
  143   2HG   LYS  22          2HG       LYS  22   2.206  16.684   3.623
  144   1HD   LYS  22          1HD       LYS  22   2.244  19.090   5.441
  145   2HD   LYS  22          2HD       LYS  22   2.479  17.403   5.876
  146   1HE   LYS  22          1HE       LYS  22   4.475  19.306   4.551
  147   2HE   LYS  22          2HE       LYS  22   4.536  18.734   6.211
  148   1HZ   LYS  22          2HZ       LYS  22   4.714  16.914   3.907
  149   2HZ   LYS  22          3HZ       LYS  22   6.020  17.669   4.538
  150   3HZ   LYS  22          1HZ       LYS  22   5.144  16.609   5.465
  151    H    ASN  23           H        ASN  23   1.352  20.539   1.784
  152    HA   ASN  23           HA       ASN  23  -1.204  19.946   2.708
  153   1HB   ASN  23          1HB       ASN  23  -0.366  22.137   3.189
  154   2HB   ASN  23          2HB       ASN  23   0.027  22.444   1.493
  155   1HD2  ASN  23          2HD2      ASN  23  -2.898  24.356   1.181
  156   2HD2  ASN  23          1HD2      ASN  23  -1.155  24.270   1.020
  157    H    GLN  24           H        GLN  24  -0.307  21.268  -0.550
  158    HA   GLN  24           HA       GLN  24  -2.943  21.175  -1.557
  159   1HB   GLN  24          1HB       GLN  24  -0.274  20.976  -2.988
  160   2HB   GLN  24          2HB       GLN  24  -1.850  21.082  -3.813
  161   1HG   GLN  24          1HG       GLN  24  -2.313  23.212  -2.574
  162   2HG   GLN  24          2HG       GLN  24  -0.687  23.129  -1.870
  163   1HE2  GLN  24          2HE2      GLN  24  -0.381  23.619  -5.908
  164   2HE2  GLN  24          1HE2      GLN  24  -1.082  22.151  -5.257
  165    H    CYS  25           H        CYS  25  -0.416  18.558  -1.646
  166    HA   CYS  25           HA       CYS  25  -2.022  16.801  -3.166
  167   1HB   CYS  25          1HB       CYS  25   0.330  16.266  -2.565
  168   2HB   CYS  25          2HB       CYS  25  -0.171  15.978  -0.901
  169    H    ILE  26           H        ILE  26  -1.759  16.865   0.456
  170    HA   ILE  26           HA       ILE  26  -3.821  14.823   0.620
  171    HB   ILE  26           HB       ILE  26  -3.474  14.840   2.951
  172   1HG1  ILE  26          1HG1      ILE  26  -2.162  17.567   2.630
  173   2HG1  ILE  26          2HG1      ILE  26  -3.637  17.163   3.524
  174   1HG2  ILE  26          3HG2      ILE  26  -1.619  13.959   1.506
  175   2HG2  ILE  26          1HG2      ILE  26  -0.762  15.495   1.709
  176   3HG2  ILE  26          2HG2      ILE  26  -1.091  14.465   3.100
  177   1HD1  ILE  26          2HD1      ILE  26  -2.238  15.708   5.047
  178   2HD1  ILE  26          3HD1      ILE  26  -0.790  16.371   4.250
  179   3HD1  ILE  26          1HD1      ILE  26  -1.883  17.446   5.127
  180    H    ASN  27           H        ASN  27  -3.905  18.234   0.397
  181    HA   ASN  27           HA       ASN  27  -6.512  18.625   1.629
  182   1HB   ASN  27          1HB       ASN  27  -4.671  20.233   1.621
  183   2HB   ASN  27          2HB       ASN  27  -4.816  20.434  -0.144
  184   1HD2  ASN  27          2HD2      ASN  27  -6.587  23.127   1.849
  185   2HD2  ASN  27          1HD2      ASN  27  -4.975  22.410   1.967
  186    H    LEU  28           H        LEU  28  -5.226  18.803  -1.786
  187    HA   LEU  28           HA       LEU  28  -7.893  18.882  -2.905
  188   1HB   LEU  28          1HB       LEU  28  -5.110  18.596  -4.075
  189   2HB   LEU  28          2HB       LEU  28  -6.551  18.341  -5.040
  190    HG   LEU  28           HG       LEU  28  -7.378  20.566  -4.641
  191   1HD1  LEU  28          3HD1      LEU  28  -4.878  21.031  -2.964
  192   2HD1  LEU  28          1HD1      LEU  28  -5.978  22.297  -3.531
  193   3HD1  LEU  28          2HD1      LEU  28  -6.562  21.086  -2.390
  194   1HD2  LEU  28          1HD2      LEU  28  -5.816  20.149  -6.514
  195   2HD2  LEU  28          2HD2      LEU  28  -5.648  21.799  -5.890
  196   3HD2  LEU  28          3HD2      LEU  28  -4.442  20.566  -5.466
  197    H    GLU  29           H        GLU  29  -5.330  16.279  -2.917
  198    HA   GLU  29           HA       GLU  29  -7.537  14.359  -3.554
  199   1HB   GLU  29          1HB       GLU  29  -5.901  12.729  -4.163
  200   2HB   GLU  29          2HB       GLU  29  -5.865  14.176  -5.160
  201   1HG   GLU  29          1HG       GLU  29  -3.807  14.926  -3.894
  202   2HG   GLU  29          2HG       GLU  29  -3.763  13.304  -3.147
  203    HE1  GLU  29           HE2      GLU  29  -3.459  11.989  -6.616
  204    H    LYS  30           H        LYS  30  -6.992  12.167  -2.299
  205    HA   LYS  30           HA       LYS  30  -7.163  13.028   0.527
  206   1HB   LYS  30          1HB       LYS  30  -8.729  10.990  -1.031
  207   2HB   LYS  30          2HB       LYS  30  -8.746  11.034   0.740
  208   1HG   LYS  30          1HG       LYS  30  -9.355  13.479  -0.981
  209   2HG   LYS  30          2HG       LYS  30 -10.579  12.376  -0.379
  210   1HD   LYS  30          1HD       LYS  30 -10.593  13.226   1.671
  211   2HD   LYS  30          2HD       LYS  30  -8.858  13.242   1.861
  212   1HE   LYS  30          1HE       LYS  30 -10.437  15.352   0.305
  213   2HE   LYS  30          2HE       LYS  30 -10.022  15.495   2.016
  214   1HZ   LYS  30          2HZ       LYS  30  -7.996  15.294  -0.127
  215   2HZ   LYS  30          3HZ       LYS  30  -8.511  16.677   0.529
  216   3HZ   LYS  30          1HZ       LYS  30  -7.674  15.600   1.426
  217    H    ALA  31           H        ALA  31  -4.766  12.133  -0.875
  218    HA   ALA  31           HA       ALA  31  -3.494   9.872   0.055
  219   1HB   ALA  31          2HB       ALA  31  -2.609  11.696  -1.401
  220   2HB   ALA  31          3HB       ALA  31  -2.581  12.782  -0.029
  221   3HB   ALA  31          1HB       ALA  31  -1.495  11.379  -0.048
  222    H    ARG  32           H        ARG  32  -1.560  10.112   1.777
  223    HA   ARG  32           HA       ARG  32  -2.718  11.100   4.390
  224   1HB   ARG  32          1HB       ARG  32  -0.746   8.850   3.870
  225   2HB   ARG  32          2HB       ARG  32  -1.224   9.429   5.475
  226   1HG   ARG  32          1HG       ARG  32  -3.168   8.293   3.449
  227   2HG   ARG  32          2HG       ARG  32  -2.364   7.319   4.683
  228   1HD   ARG  32          1HD       ARG  32  -3.421   8.396   6.484
  229   2HD   ARG  32          2HD       ARG  32  -4.010   9.742   5.525
  230    HE   ARG  32           HE       ARG  32  -5.120   7.012   5.672
  231   1HH1  ARG  32          1HH2      ARG  32  -5.083  10.052   3.768
  232   2HH1  ARG  32          2HH2      ARG  32  -6.420   9.604   2.813
  233   1HH2  ARG  32          2HH1      ARG  32  -6.835   6.440   4.456
  234   2HH2  ARG  32          1HH1      ARG  32  -7.612   7.541   3.330
  235    H    HIS  33           H        HIS  33   0.462  10.446   2.864
  236    HA   HIS  33           HA       HIS  33   1.525  12.837   4.336
  237   1HB   HIS  33          2HB       HIS  33   2.953  10.335   3.309
  238   2HB   HIS  33          1HB       HIS  33   3.758  11.775   3.921
  239    HD1  HIS  33           HD1      HIS  33   0.928   9.594   5.346
  240    HD2  HIS  33           HD2      HIS  33   4.680  11.146   6.357
  241    HE1  HIS  33           HE1      HIS  33   1.395   8.872   7.723
  242    H    GLY  34           H        GLY  34   2.986  14.141   3.157
  243   1HA   GLY  34          1HA       GLY  34   3.614  13.595   0.460
  244   2HA   GLY  34          2HA       GLY  34   2.485  14.972   0.558
  245    H    SER  35           H        SER  35   5.304  14.962  -0.282
  246    HA   SER  35           HA       SER  35   6.456  17.006   1.354
  247   1HB   SER  35          1HB       SER  35   7.303  14.121   1.820
  248   2HB   SER  35          2HB       SER  35   8.550  15.366   1.827
  249    HG   SER  35           HG       SER  35   6.192  15.292   3.375
  250    H    CYS  36           H        CYS  36   8.385  17.760   0.479
  251    HA   CYS  36           HA       CYS  36   8.637  17.291  -2.418
  252   1HB   CYS  36          1HB       CYS  36   8.586  19.566  -1.619
  253   2HB   CYS  36          2HB       CYS  36   9.934  19.258  -0.496
  254    H    ASN  37           H        ASN  37  10.246  16.104  -3.309
  255    HA   ASN  37           HA       ASN  37  12.568  15.212  -1.634
  256   1HB   ASN  37          1HB       ASN  37  11.285  13.297  -2.403
  257   2HB   ASN  37          2HB       ASN  37  11.143  13.994  -4.029
  258   1HD2  ASN  37          2HD2      ASN  37  14.874  12.570  -2.985
  259   2HD2  ASN  37          1HD2      ASN  37  13.877  13.300  -1.739
  260    H    TYR  38           H        TYR  38  14.652  15.332  -2.729
  261    HA   TYR  38           HA       TYR  38  14.726  17.363  -4.866
  262   1HB   TYR  38          1HB       TYR  38  16.341  17.746  -3.130
  263   2HB   TYR  38          2HB       TYR  38  17.013  16.133  -3.324
  264    HD1  TYR  38           HD2      TYR  38  16.084  19.015  -5.636
  265    HD2  TYR  38           HD1      TYR  38  19.115  16.169  -4.477
  266    HE1  TYR  38           HE2      TYR  38  17.282  19.425  -7.746
  267    HE2  TYR  38           HE1      TYR  38  20.273  16.550  -6.633
  268    HH   TYR  38           HH       TYR  38  18.872  18.602  -9.208
  269    H    VAL  39           H        VAL  39  17.190  14.980  -5.032
  270    HA   VAL  39           HA       VAL  39  17.858  13.626  -6.665
  271    HB   VAL  39           HB       VAL  39  14.895  12.999  -7.057
  272   1HG1  VAL  39          3HG1      VAL  39  17.349  11.583  -8.163
  273   2HG1  VAL  39          1HG1      VAL  39  15.701  10.927  -8.150
  274   3HG1  VAL  39          2HG1      VAL  39  16.055  12.365  -9.103
  275   1HG2  VAL  39          3HG2      VAL  39  15.868  12.429  -4.812
  276   2HG2  VAL  39          1HG2      VAL  39  15.412  11.003  -5.751
  277   3HG2  VAL  39          2HG2      VAL  39  17.120  11.478  -5.628
  278    H    PHE  40           H        PHE  40  18.274  13.628  -8.980
  279    HA   PHE  40           HA       PHE  40  18.143  16.217 -10.078
  280   1HB   PHE  40          1HB       PHE  40  19.188  15.286 -12.005
  281   2HB   PHE  40          2HB       PHE  40  19.792  14.381 -10.641
  282    HD1  PHE  40           HD1      PHE  40  19.056  11.982 -10.309
  283    HD2  PHE  40           HD2      PHE  40  17.791  14.304 -13.727
  284    HE1  PHE  40           HE1      PHE  40  18.144   9.942 -11.369
  285    HE2  PHE  40           HE2      PHE  40  16.899  12.253 -14.782
  286    HZ   PHE  40           HZ       PHE  40  17.056  10.072 -13.600
  287    HA   PRO  41           HA       PRO  41  18.066  17.194 -12.198
  288   1HB   PRO  41          1HB       PRO  41  16.703  18.981 -13.675
  289   2HB   PRO  41          2HB       PRO  41  17.137  17.363 -14.301
  290   1HG   PRO  41          1HG       PRO  41  14.458  18.251 -13.214
  291   2HG   PRO  41          2HG       PRO  41  14.801  17.310 -14.685
  292   1HD   PRO  41          1HD       PRO  41  14.100  16.143 -12.264
  293   2HD   PRO  41          2HD       PRO  41  15.127  15.334 -13.474
  294    H    ALA  42           H        ALA  42  14.749  18.054 -11.122
  295    HA   ALA  42           HA       ALA  42  15.813  20.182  -9.324
  296   1HB   ALA  42          1HB       ALA  42  14.841  21.165 -11.378
  297   2HB   ALA  42          2HB       ALA  42  13.327  20.283 -11.080
  298   3HB   ALA  42          3HB       ALA  42  13.867  21.540  -9.947
  299    H    HIS  43           H        HIS  43  13.942  20.806  -7.767
  300    HA   HIS  43           HA       HIS  43  13.367  18.521  -6.180
  301   1HB   HIS  43          2HB       HIS  43  12.271  21.388  -6.107
  302   2HB   HIS  43          1HB       HIS  43  11.910  20.152  -4.938
  303    HD1  HIS  43           HD1      HIS  43  13.651  19.425  -3.210
  304    HD2  HIS  43           HD2      HIS  43  15.040  22.317  -5.915
  305    HE1  HIS  43           HE1      HIS  43  15.868  20.292  -2.322
  306    H    LYS  44           H        LYS  44  11.484  17.328  -5.868
  307    HA   LYS  44           HA       LYS  44   9.240  17.758  -7.787
  308   1HB   LYS  44          1HB       LYS  44   9.313  15.353  -8.332
  309   2HB   LYS  44          2HB       LYS  44  10.739  16.254  -8.866
  310   1HG   LYS  44          1HG       LYS  44  11.941  15.410  -6.760
  311   2HG   LYS  44          2HG       LYS  44  10.531  14.419  -6.441
  312   1HD   LYS  44          1HD       LYS  44  12.275  13.113  -7.490
  313   2HD   LYS  44          2HD       LYS  44  10.843  13.182  -8.521
  314   1HE   LYS  44          1HE       LYS  44  13.013  13.346  -9.740
  315   2HE   LYS  44          2HE       LYS  44  11.930  14.695 -10.078
  316   1HZ   LYS  44          2HZ       LYS  44  14.031  14.910  -8.015
  317   2HZ   LYS  44          3HZ       LYS  44  14.368  15.160  -9.580
  318   3HZ   LYS  44          1HZ       LYS  44  13.291  16.119  -8.799
  319    H    CYS  45           H        CYS  45   7.262  17.358  -6.946
  320    HA   CYS  45           HA       CYS  45   7.049  16.999  -4.062
  321   1HB   CYS  45          1HB       CYS  45   5.581  18.563  -5.224
  322   2HB   CYS  45          2HB       CYS  45   4.981  17.267  -6.267
  323    H    ILE  46           H        ILE  46   6.741  15.062  -3.018
  324    HA   ILE  46           HA       ILE  46   5.804  12.697  -4.592
  325    HB   ILE  46           HB       ILE  46   7.485  12.781  -2.057
  326   1HG1  ILE  46          1HG1      ILE  46   8.885  13.464  -3.911
  327   2HG1  ILE  46          2HG1      ILE  46   9.321  11.851  -3.355
  328   1HG2  ILE  46          1HG2      ILE  46   6.458  10.442  -3.714
  329   2HG2  ILE  46          2HG2      ILE  46   7.692  10.311  -2.442
  330   3HG2  ILE  46          3HG2      ILE  46   6.059  10.836  -2.038
  331   1HD1  ILE  46          1HD1      ILE  46   8.084  10.865  -5.300
  332   2HD1  ILE  46          2HD1      ILE  46   7.730  12.514  -5.869
  333   3HD1  ILE  46          3HD1      ILE  46   9.401  11.948  -5.778
  334    H    CYS  47           H        CYS  47   3.990  11.667  -3.785
  335    HA   CYS  47           HA       CYS  47   3.002  12.471  -1.126
  336   1HB   CYS  47          1HB       CYS  47   1.940  13.906  -2.919
  337   2HB   CYS  47          2HB       CYS  47   1.199  12.425  -3.549
  338    H    TYR  48           H        TYR  48   1.571  10.921  -0.151
  339    HA   TYR  48           HA       TYR  48   2.088   8.172  -1.231
  340   1HB   TYR  48          1HB       TYR  48   2.151   9.129   1.630
  341   2HB   TYR  48          2HB       TYR  48   2.447   7.499   1.044
  342    HD1  TYR  48           HD1      TYR  48   3.836  10.968   1.074
  343    HD2  TYR  48           HD2      TYR  48   4.585   6.817   0.184
  344    HE1  TYR  48           HE1      TYR  48   6.247  11.449   0.900
  345    HE2  TYR  48           HE2      TYR  48   7.014   7.302   0.030
  346    HH   TYR  48           HH       TYR  48   8.351  10.577   0.505
  347    H    PHE  49           H        PHE  49   0.280   7.029  -1.616
  348    HA   PHE  49           HA       PHE  49  -2.237   7.843  -0.266
  349   1HB   PHE  49          1HB       PHE  49  -2.057   6.163  -2.748
  350   2HB   PHE  49          2HB       PHE  49  -3.392   7.103  -2.170
  351    HD1  PHE  49           HD1      PHE  49  -1.572   9.708  -1.737
  352    HD2  PHE  49           HD2      PHE  49  -2.436   7.057  -5.018
  353    HE1  PHE  49           HE1      PHE  49  -1.109  11.534  -3.333
  354    HE2  PHE  49           HE2      PHE  49  -2.063   8.917  -6.606
  355    HZ   PHE  49           HZ       PHE  49  -1.346  11.167  -5.740
  356    HA   PRO  50           HA       PRO  50  -2.257   3.632   1.428
  357   1HB   PRO  50          1HB       PRO  50  -4.941   3.197   1.696
  358   2HB   PRO  50          2HB       PRO  50  -4.000   4.291   2.757
  359   1HG   PRO  50          1HG       PRO  50  -5.661   5.046   0.340
  360   2HG   PRO  50          2HG       PRO  50  -5.703   5.785   1.966
  361   1HD   PRO  50          1HD       PRO  50  -4.234   6.842  -0.091
  362   2HD   PRO  50          2HD       PRO  50  -3.606   6.879   1.602
  363    H    CYS  51           H        CYS  51  -1.945   1.779   0.196
  364    HA   CYS  51           HA       CYS  51  -3.643   1.015  -2.031
  365   1HB   CYS  51          1HB       CYS  51  -2.681   2.512  -3.473
  366   2HB   CYS  51          2HB       CYS  51  -1.325   2.794  -2.407
   
  No H/Q in entry =         366
  Start of MODEL   13
    1    HA   PCA   1           HA       PYR   1  -2.624  -0.674   5.486
    2   1HB   PCA   1          1HB       PYR   1  -3.517   0.683   2.963
    3   2HB   PCA   1          2HB       PYR   1  -3.873  -0.976   3.514
    4   1HG   PCA   1          1HG       PYR   1  -5.699   1.153   3.662
    5   2HG   PCA   1          2HG       PYR   1  -5.720  -0.241   4.784
    6    HN   PCA   1           HN       PYR   1  -2.909   1.672   6.596
    7    H    LYS   2           H        LYS   2  -0.721  -0.980   4.154
    8    HA   LYS   2           HA       LYS   2   1.286   0.905   4.560
    9   1HB   LYS   2          1HB       LYS   2   2.608  -0.443   2.953
   10   2HB   LYS   2          2HB       LYS   2   1.858  -1.378   4.232
   11   1HG   LYS   2          1HG       LYS   2   0.524  -2.569   2.870
   12   2HG   LYS   2          2HG       LYS   2   0.135  -1.242   1.804
   13   1HD   LYS   2          1HD       LYS   2   2.670  -2.944   1.779
   14   2HD   LYS   2          2HD       LYS   2   1.347  -2.991   0.615
   15   1HE   LYS   2          1HE       LYS   2   3.444  -0.811   0.980
   16   2HE   LYS   2          2HE       LYS   2   3.126  -1.794  -0.442
   17   1HZ   LYS   2          3HZ       LYS   2   1.192   0.168   0.628
   18   2HZ   LYS   2          1HZ       LYS   2   2.282   0.530  -0.505
   19   3HZ   LYS   2          2HZ       LYS   2   1.068  -0.584  -0.776
   20    H    LEU   3           H        LEU   3   2.144   2.622   3.430
   21    HA   LEU   3           HA       LEU   3   0.487   3.854   1.486
   22   1HB   LEU   3          1HB       LEU   3   3.298   4.468   2.345
   23   2HB   LEU   3          2HB       LEU   3   2.321   5.540   1.350
   24    HG   LEU   3           HG       LEU   3   1.414   4.658   4.128
   25   1HD1  LEU   3          3HD1      LEU   3   3.596   5.795   4.327
   26   2HD1  LEU   3          1HD1      LEU   3   2.988   7.160   3.376
   27   3HD1  LEU   3          2HD1      LEU   3   2.285   6.802   4.962
   28   1HD2  LEU   3          1HD2      LEU   3   0.590   6.971   2.329
   29   2HD2  LEU   3          2HD2      LEU   3  -0.384   5.545   2.746
   30   3HD2  LEU   3          3HD2      LEU   3   0.049   6.716   3.997
   31    H    CYS   4           H        CYS   4   1.007   4.531  -0.637
   32    HA   CYS   4           HA       CYS   4   3.216   3.252  -2.141
   33   1HB   CYS   4          1HB       CYS   4   0.342   3.560  -3.123
   34   2HB   CYS   4          2HB       CYS   4   1.717   3.150  -4.131
   35    H    GLU   5           H        GLU   5   4.085   4.766  -3.591
   36    HA   GLU   5           HA       GLU   5   3.397   7.536  -2.997
   37   1HB   GLU   5          1HB       GLU   5   5.753   6.284  -4.475
   38   2HB   GLU   5          2HB       GLU   5   5.561   7.992  -4.077
   39   1HG   GLU   5          1HG       GLU   5   6.999   7.132  -2.421
   40   2HG   GLU   5          2HG       GLU   5   5.430   7.383  -1.651
   41    HE2  GLU   5           HE2      GLU   5   6.331   4.222  -0.350
   42    H    ARG   6           H        ARG   6   3.003   9.132  -4.554
   43    HA   ARG   6           HA       ARG   6   2.939   8.352  -7.399
   44   1HB   ARG   6          1HB       ARG   6   0.562   8.523  -6.454
   45   2HB   ARG   6          2HB       ARG   6   0.863  10.280  -6.299
   46   1HG   ARG   6          1HG       ARG   6   1.222  10.531  -8.648
   47   2HG   ARG   6          2HG       ARG   6   1.258   8.767  -8.868
   48   1HD   ARG   6          1HD       ARG   6  -0.810   9.115  -9.637
   49   2HD   ARG   6          2HD       ARG   6  -1.209   8.843  -7.955
   50    HE   ARG   6           HE       ARG   6  -0.969  11.508  -9.397
   51   1HH1  ARG   6          2HH2      ARG   6  -2.582   9.697  -6.751
   52   2HH1  ARG   6          1HH2      ARG   6  -3.732  10.996  -6.528
   53   1HH2  ARG   6          2HH1      ARG   6  -2.459  13.070  -9.006
   54   2HH2  ARG   6          1HH1      ARG   6  -3.707  12.841  -7.781
   55    HA   PRO   7           HA       PRO   7   5.543  12.042  -6.934
   56   1HB   PRO   7          1HB       PRO   7   6.854  12.006  -9.298
   57   2HB   PRO   7          2HB       PRO   7   6.979  10.645  -8.173
   58   1HG   PRO   7          1HG       PRO   7   5.063  10.853 -10.520
   59   2HG   PRO   7          2HG       PRO   7   6.261   9.563 -10.206
   60   1HD   PRO   7          1HD       PRO   7   3.647   9.372  -9.396
   61   2HD   PRO   7          2HD       PRO   7   4.989   8.682  -8.434
   62    H    SER   8           H        SER   8   5.875  13.603  -9.507
   63    HA   SER   8           HA       SER   8   4.211  15.608  -9.338
   64   1HB   SER   8          1HB       SER   8   5.237  14.707 -12.026
   65   2HB   SER   8          2HB       SER   8   5.218  16.330 -11.305
   66    HG   SER   8           HG       SER   8   7.303  15.456 -11.174
   67    H    GLY   9           H        GLY   9   2.703  12.741 -10.119
   68   1HA   GLY   9          1HA       GLY   9   0.969  13.586 -12.325
   69   2HA   GLY   9          2HA       GLY   9   0.818  12.140 -11.315
   70    H    THR  10           H        THR  10   0.934  15.528 -10.324
   71    HA   THR  10           HA       THR  10  -1.811  15.919 -10.032
   72    HB   THR  10           HB       THR  10  -0.620  16.298  -7.289
   73    HG1  THR  10           HG1      THR  10  -0.046  14.134  -7.820
   74   1HG2  THR  10          1HG2      THR  10  -2.888  17.030  -8.018
   75   2HG2  THR  10          2HG2      THR  10  -3.332  15.326  -8.245
   76   3HG2  THR  10          3HG2      THR  10  -2.899  15.940  -6.629
   77    H    TRP  11           H        TRP  11   1.216  16.874  -8.375
   78    HA   TRP  11           HA       TRP  11   1.007  19.664  -9.306
   79   1HB   TRP  11          1HB       TRP  11   1.723  18.950  -6.983
   80   2HB   TRP  11          2HB       TRP  11   3.198  18.314  -7.696
   81    HD1  TRP  11           HD1      TRP  11   4.178  20.618  -9.517
   82    HE1  TRP  11           HE1      TRP  11   4.916  22.874  -8.554
   83    HE3  TRP  11           HE3      TRP  11   1.731  20.441  -5.006
   84    HZ2  TRP  11           HZ2      TRP  11   4.406  24.456  -6.228
   85    HZ3  TRP  11           HZ3      TRP  11   1.845  22.372  -3.476
   86    HH2  TRP  11           HH2      TRP  11   3.259  24.307  -4.015
   87    H    SER  12           H        SER  12   1.046  18.941 -11.591
   88    HA   SER  12           HA       SER  12   3.433  17.555 -12.537
   89   1HB   SER  12          1HB       SER  12   1.149  18.798 -14.115
   90   2HB   SER  12          2HB       SER  12   2.303  17.567 -14.662
   91    HG   SER  12           HG       SER  12   1.476  16.393 -12.662
   92    H    GLY  13           H        GLY  13   4.732  19.314 -11.479
   93   1HA   GLY  13          1HA       GLY  13   6.106  20.802 -13.476
   94   2HA   GLY  13          2HA       GLY  13   5.111  21.897 -12.477
   95    H    VAL  14           H        VAL  14   7.514  22.562 -11.924
   96    HA   VAL  14           HA       VAL  14   9.000  20.871 -10.123
   97    HB   VAL  14           HB       VAL  14   9.049  23.910 -10.358
   98   1HG1  VAL  14          1HG1      VAL  14  11.100  21.903  -9.308
   99   2HG1  VAL  14          2HG1      VAL  14  11.379  23.644  -9.517
  100   3HG1  VAL  14          3HG1      VAL  14  10.193  23.082  -8.338
  101   1HG2  VAL  14          2HG2      VAL  14  10.634  21.789 -11.876
  102   2HG2  VAL  14          3HG2      VAL  14   9.495  22.956 -12.576
  103   3HG2  VAL  14          1HG2      VAL  14  11.009  23.524 -11.872
  104    H    CYS  15           H        CYS  15   8.787  20.659  -7.911
  105    HA   CYS  15           HA       CYS  15   6.165  21.099  -6.894
  106   1HB   CYS  15          1HB       CYS  15   6.764  19.804  -5.114
  107   2HB   CYS  15          2HB       CYS  15   7.870  19.233  -6.364
  108    H    GLY  16           H        GLY  16   9.052  23.044  -6.628
  109   1HA   GLY  16          1HA       GLY  16   9.354  25.121  -5.694
  110   2HA   GLY  16          2HA       GLY  16   7.675  25.117  -5.148
  111    H    ASN  17           H        ASN  17   7.599  22.902  -3.405
  112    HA   ASN  17           HA       ASN  17   9.652  23.172  -1.369
  113   1HB   ASN  17          1HB       ASN  17   8.726  25.413  -1.116
  114   2HB   ASN  17          2HB       ASN  17   7.076  24.777  -1.161
  115   1HD2  ASN  17          2HD2      ASN  17   9.283  24.467   2.307
  116   2HD2  ASN  17          1HD2      ASN  17  10.090  24.811   0.790
  117    H    ASN  18           H        ASN  18   9.455  21.661   0.212
  118    HA   ASN  18           HA       ASN  18   7.990  19.376   0.108
  119   1HB   ASN  18          1HB       ASN  18   9.926  19.858   1.582
  120   2HB   ASN  18          2HB       ASN  18   8.900  20.802   2.642
  121   1HD2  ASN  18          2HD2      ASN  18   8.516  16.701   2.560
  122   2HD2  ASN  18          1HD2      ASN  18   9.488  17.527   1.340
  123    H    ASN  19           H        ASN  19   7.278  22.046   2.269
  124    HA   ASN  19           HA       ASN  19   4.909  20.903   3.335
  125   1HB   ASN  19          1HB       ASN  19   6.235  22.539   4.568
  126   2HB   ASN  19          2HB       ASN  19   5.759  23.815   3.433
  127   1HD2  ASN  19          2HD2      ASN  19   2.680  24.373   5.085
  128   2HD2  ASN  19          1HD2      ASN  19   3.889  24.963   3.960
  129    H    ALA  20           H        ALA  20   5.397  23.355   0.753
  130    HA   ALA  20           HA       ALA  20   2.628  23.891   0.304
  131   1HB   ALA  20          2HB       ALA  20   4.502  25.187  -0.749
  132   2HB   ALA  20          3HB       ALA  20   4.770  23.817  -1.862
  133   3HB   ALA  20          1HB       ALA  20   3.218  24.682  -1.855
  134    H    CYS  21           H        CYS  21   4.816  21.537  -1.332
  135    HA   CYS  21           HA       CYS  21   2.917  20.210  -2.893
  136   1HB   CYS  21          1HB       CYS  21   5.119  19.588  -3.316
  137   2HB   CYS  21          2HB       CYS  21   5.510  19.410  -1.604
  138    H    LYS  22           H        LYS  22   3.954  19.472   0.431
  139    HA   LYS  22           HA       LYS  22   2.370  17.264   0.990
  140   1HB   LYS  22          1HB       LYS  22   4.179  18.149   2.389
  141   2HB   LYS  22          2HB       LYS  22   3.253  19.576   2.770
  142   1HG   LYS  22          1HG       LYS  22   1.613  18.406   4.022
  143   2HG   LYS  22          2HG       LYS  22   2.322  16.841   3.687
  144   1HD   LYS  22          1HD       LYS  22   3.816  19.135   5.096
  145   2HD   LYS  22          2HD       LYS  22   2.774  18.016   5.956
  146   1HE   LYS  22          1HE       LYS  22   5.076  17.331   6.251
  147   2HE   LYS  22          2HE       LYS  22   4.164  16.099   5.364
  148   1HZ   LYS  22          3HZ       LYS  22   6.050  18.032   4.123
  149   2HZ   LYS  22          1HZ       LYS  22   6.321  16.432   4.332
  150   3HZ   LYS  22          2HZ       LYS  22   5.136  16.879   3.361
  151    H    ASN  23           H        ASN  23   1.579  20.636   1.909
  152    HA   ASN  23           HA       ASN  23  -1.034  20.110   2.805
  153   1HB   ASN  23          1HB       ASN  23  -0.037  22.258   3.283
  154   2HB   ASN  23          2HB       ASN  23   0.265  22.571   1.570
  155   1HD2  ASN  23          2HD2      ASN  23  -2.550  24.708   1.791
  156   2HD2  ASN  23          1HD2      ASN  23  -0.800  24.626   1.741
  157    H    GLN  24           H        GLN  24  -0.014  21.390  -0.427
  158    HA   GLN  24           HA       GLN  24  -2.593  21.448  -1.467
  159   1HB   GLN  24          1HB       GLN  24  -0.528  22.489  -2.425
  160   2HB   GLN  24          2HB       GLN  24  -0.009  20.905  -3.022
  161   1HG   GLN  24          1HG       GLN  24  -2.775  21.863  -3.777
  162   2HG   GLN  24          2HG       GLN  24  -1.400  22.722  -4.474
  163   1HE2  GLN  24          2HE2      GLN  24  -0.461  20.214  -6.728
  164   2HE2  GLN  24          1HE2      GLN  24   0.037  21.677  -5.882
  165    H    CYS  25           H        CYS  25  -0.249  18.702  -1.635
  166    HA   CYS  25           HA       CYS  25  -1.924  17.030  -3.158
  167   1HB   CYS  25          1HB       CYS  25   0.459  16.464  -2.570
  168   2HB   CYS  25          2HB       CYS  25  -0.076  16.084  -0.935
  169    H    ILE  26           H        ILE  26  -1.598  17.073   0.468
  170    HA   ILE  26           HA       ILE  26  -3.686  15.058   0.659
  171    HB   ILE  26           HB       ILE  26  -3.338  15.064   2.980
  172   1HG1  ILE  26          1HG1      ILE  26  -1.991  17.763   2.673
  173   2HG1  ILE  26          2HG1      ILE  26  -3.463  17.366   3.572
  174   1HG2  ILE  26          1HG2      ILE  26  -1.521  14.181   1.460
  175   2HG2  ILE  26          2HG2      ILE  26  -0.604  15.660   1.787
  176   3HG2  ILE  26          3HG2      ILE  26  -1.012  14.556   3.110
  177   1HD1  ILE  26          1HD1      ILE  26  -2.098  15.921   5.099
  178   2HD1  ILE  26          2HD1      ILE  26  -0.631  16.521   4.283
  179   3HD1  ILE  26          3HD1      ILE  26  -1.685  17.647   5.151
  180    H    ASN  27           H        ASN  27  -3.731  18.485   0.414
  181    HA   ASN  27           HA       ASN  27  -6.322  18.886   1.691
  182   1HB   ASN  27          1HB       ASN  27  -4.441  20.488   1.492
  183   2HB   ASN  27          2HB       ASN  27  -4.740  20.660  -0.239
  184   1HD2  ASN  27          2HD2      ASN  27  -6.372  23.317   1.971
  185   2HD2  ASN  27          1HD2      ASN  27  -4.757  22.593   1.984
  186    H    LEU  28           H        LEU  28  -5.044  19.026  -1.658
  187    HA   LEU  28           HA       LEU  28  -7.613  19.334  -2.830
  188   1HB   LEU  28          1HB       LEU  28  -5.107  19.974  -3.606
  189   2HB   LEU  28          2HB       LEU  28  -5.216  18.421  -4.431
  190    HG   LEU  28           HG       LEU  28  -7.472  19.405  -5.380
  191   1HD1  LEU  28          2HD1      LEU  28  -6.044  21.939  -4.394
  192   2HD1  LEU  28          3HD1      LEU  28  -7.490  21.903  -5.423
  193   3HD1  LEU  28          1HD1      LEU  28  -7.574  21.329  -3.751
  194   1HD2  LEU  28          3HD2      LEU  28  -4.763  20.603  -6.133
  195   2HD2  LEU  28          1HD2      LEU  28  -5.422  19.065  -6.722
  196   3HD2  LEU  28          2HD2      LEU  28  -6.210  20.590  -7.165
  197    H    GLU  29           H        GLU  29  -5.324  16.554  -2.769
  198    HA   GLU  29           HA       GLU  29  -7.633  14.767  -3.435
  199   1HB   GLU  29          1HB       GLU  29  -6.035  13.046  -4.079
  200   2HB   GLU  29          2HB       GLU  29  -6.023  14.463  -5.128
  201   1HG   GLU  29          1HG       GLU  29  -3.956  15.272  -3.983
  202   2HG   GLU  29          2HG       GLU  29  -3.904  13.758  -3.053
  203    HE2  GLU  29           HE2      GLU  29  -1.822  13.801  -6.136
  204    H    LYS  30           H        LYS  30  -7.063  12.555  -2.131
  205    HA   LYS  30           HA       LYS  30  -6.937  13.536   0.681
  206   1HB   LYS  30          1HB       LYS  30  -8.570  11.320  -0.522
  207   2HB   LYS  30          2HB       LYS  30  -8.570  11.766   1.189
  208   1HG   LYS  30          1HG       LYS  30  -9.240  13.858  -0.945
  209   2HG   LYS  30          2HG       LYS  30 -10.411  12.674  -0.428
  210   1HD   LYS  30          1HD       LYS  30 -10.760  14.759   0.730
  211   2HD   LYS  30          2HD       LYS  30 -10.431  13.422   1.821
  212   1HE   LYS  30          1HE       LYS  30  -9.426  15.489   2.626
  213   2HE   LYS  30          2HE       LYS  30  -8.205  14.267   2.317
  214   1HZ   LYS  30          1HZ       LYS  30  -7.734  15.454   0.210
  215   2HZ   LYS  30          2HZ       LYS  30  -8.738  16.677   0.617
  216   3HZ   LYS  30          3HZ       LYS  30  -7.427  16.314   1.514
  217    H    ALA  31           H        ALA  31  -4.733  12.454  -1.066
  218    HA   ALA  31           HA       ALA  31  -3.540  10.140  -0.052
  219   1HB   ALA  31          1HB       ALA  31  -2.621  11.777  -1.783
  220   2HB   ALA  31          2HB       ALA  31  -2.269  12.879  -0.450
  221   3HB   ALA  31          3HB       ALA  31  -1.449  11.301  -0.540
  222    H    ARG  32           H        ARG  32  -1.995   9.878   1.749
  223    HA   ARG  32           HA       ARG  32  -3.099  11.243   4.160
  224   1HB   ARG  32          1HB       ARG  32  -1.439   8.727   3.745
  225   2HB   ARG  32          2HB       ARG  32  -1.655   9.474   5.340
  226   1HG   ARG  32          1HG       ARG  32  -4.081   9.346   5.153
  227   2HG   ARG  32          2HG       ARG  32  -3.943   8.621   3.537
  228   1HD   ARG  32          1HD       ARG  32  -2.709   6.695   4.554
  229   2HD   ARG  32          2HD       ARG  32  -2.919   7.436   6.159
  230    HE   ARG  32           HE       ARG  32  -5.475   7.276   5.010
  231   1HH1  ARG  32          2HH2      ARG  32  -2.960   5.034   6.141
  232   2HH1  ARG  32          1HH2      ARG  32  -4.104   3.727   6.392
  233   1HH2  ARG  32          1HH1      ARG  32  -6.956   5.479   5.408
  234   2HH2  ARG  32          2HH1      ARG  32  -6.274   3.955   5.934
  235    H    HIS  33           H        HIS  33   0.115  10.572   2.693
  236    HA   HIS  33           HA       HIS  33   1.094  12.976   4.190
  237   1HB   HIS  33          2HB       HIS  33   2.878  10.694   3.346
  238   2HB   HIS  33          1HB       HIS  33   3.310  12.147   4.240
  239    HD1  HIS  33           HD1      HIS  33   0.370  11.531   5.949
  240    HD2  HIS  33           HD2      HIS  33   3.963   9.388   5.688
  241    HE1  HIS  33           HE1      HIS  33   0.353   9.832   7.830
  242    H    GLY  34           H        GLY  34   2.609  14.262   3.021
  243   1HA   GLY  34          1HA       GLY  34   3.120  13.703   0.260
  244   2HA   GLY  34          2HA       GLY  34   2.140  15.162   0.489
  245    H    SER  35           H        SER  35   5.091  14.701  -0.318
  246    HA   SER  35           HA       SER  35   6.380  16.629   1.412
  247   1HB   SER  35          1HB       SER  35   6.303  13.927   2.432
  248   2HB   SER  35          2HB       SER  35   7.913  14.131   1.785
  249    HG   SER  35           HG       SER  35   7.904  14.825   3.876
  250    H    CYS  36           H        CYS  36   7.070  17.642  -0.444
  251    HA   CYS  36           HA       CYS  36   8.292  16.169  -2.637
  252   1HB   CYS  36          1HB       CYS  36   7.279  18.361  -3.075
  253   2HB   CYS  36          2HB       CYS  36   8.387  19.135  -1.946
  254    H    ASN  37           H        ASN  37  10.474  15.943  -3.108
  255    HA   ASN  37           HA       ASN  37  12.508  16.830  -1.154
  256   1HB   ASN  37          1HB       ASN  37  11.948  14.575  -0.392
  257   2HB   ASN  37          2HB       ASN  37  11.983  13.957  -2.044
  258   1HD2  ASN  37          2HD2      ASN  37  15.444  13.252  -1.846
  259   2HD2  ASN  37          1HD2      ASN  37  13.861  12.780  -2.436
  260    H    TYR  38           H        TYR  38  14.694  16.518  -2.134
  261    HA   TYR  38           HA       TYR  38  14.788  17.253  -4.950
  262   1HB   TYR  38          1HB       TYR  38  16.332  18.226  -3.296
  263   2HB   TYR  38          2HB       TYR  38  16.941  16.624  -2.905
  264    HD1  TYR  38           HD2      TYR  38  16.405  18.706  -6.037
  265    HD2  TYR  38           HD1      TYR  38  19.040  16.121  -3.803
  266    HE1  TYR  38           HE2      TYR  38  18.124  18.915  -7.806
  267    HE2  TYR  38           HE1      TYR  38  20.739  16.316  -5.581
  268    HH   TYR  38           HH       TYR  38  21.306  17.314  -7.582
  269    H    VAL  39           H        VAL  39  13.432  15.107  -5.220
  270    HA   VAL  39           HA       VAL  39  15.173  12.753  -5.713
  271    HB   VAL  39           HB       VAL  39  12.286  13.317  -6.508
  272   1HG1  VAL  39          1HG1      VAL  39  13.961  10.766  -6.664
  273   2HG1  VAL  39          2HG1      VAL  39  12.232  10.895  -7.041
  274   3HG1  VAL  39          3HG1      VAL  39  13.421  11.720  -8.058
  275   1HG2  VAL  39          2HG2      VAL  39  13.494  11.640  -4.275
  276   2HG2  VAL  39          3HG2      VAL  39  12.482  13.096  -4.105
  277   3HG2  VAL  39          1HG2      VAL  39  11.786  11.607  -4.755
  278    H    PHE  40           H        PHE  40  16.694  13.394  -7.125
  279    HA   PHE  40           HA       PHE  40  16.912  15.425  -8.733
  280   1HB   PHE  40          1HB       PHE  40  18.692  13.906  -8.324
  281   2HB   PHE  40          2HB       PHE  40  17.900  12.603  -9.213
  282    HD1  PHE  40           HD2      PHE  40  17.947  12.532 -11.684
  283    HD2  PHE  40           HD1      PHE  40  20.040  15.580  -9.450
  284    HE1  PHE  40           HE2      PHE  40  19.289  13.092 -13.688
  285    HE2  PHE  40           HE1      PHE  40  21.356  16.147 -11.467
  286    HZ   PHE  40           HZ       PHE  40  20.978  14.913 -13.592
  287    HA   PRO  41           HA       PRO  41  17.640  16.347 -10.528
  288   1HB   PRO  41          1HB       PRO  41  16.595  17.932 -12.741
  289   2HB   PRO  41          2HB       PRO  41  18.133  17.055 -12.636
  290   1HG   PRO  41          1HG       PRO  41  16.033  16.303 -14.329
  291   2HG   PRO  41          2HG       PRO  41  17.312  15.218 -13.725
  292   1HD   PRO  41          1HD       PRO  41  14.509  15.546 -12.677
  293   2HD   PRO  41          2HD       PRO  41  15.476  14.062 -12.889
  294    H    ALA  42           H        ALA  42  14.506  17.579 -11.837
  295    HA   ALA  42           HA       ALA  42  14.509  19.824 -10.087
  296   1HB   ALA  42          1HB       ALA  42  13.334  19.809 -12.250
  297   2HB   ALA  42          2HB       ALA  42  12.210  18.567 -11.647
  298   3HB   ALA  42          3HB       ALA  42  12.218  20.188 -10.923
  299    H    HIS  43           H        HIS  43  13.276  20.281  -8.250
  300    HA   HIS  43           HA       HIS  43  12.693  18.165  -6.401
  301   1HB   HIS  43          2HB       HIS  43  11.799  21.077  -6.471
  302   2HB   HIS  43          1HB       HIS  43  11.626  20.013  -5.089
  303    HD1  HIS  43           HD1      HIS  43  14.232  22.066  -6.861
  304    HD2  HIS  43           HD2      HIS  43  13.941  19.408  -3.631
  305    HE1  HIS  43           HE1      HIS  43  16.398  22.225  -5.556
  306    H    LYS  44           H        LYS  44  10.889  16.951  -6.305
  307    HA   LYS  44           HA       LYS  44   8.525  17.651  -7.983
  308   1HB   LYS  44          1HB       LYS  44   8.511  15.310  -8.796
  309   2HB   LYS  44          2HB       LYS  44   9.813  16.342  -9.410
  310   1HG   LYS  44          1HG       LYS  44  11.418  15.270  -7.835
  311   2HG   LYS  44          2HG       LYS  44  10.104  14.308  -7.163
  312   1HD   LYS  44          1HD       LYS  44  11.363  12.936  -8.718
  313   2HD   LYS  44          2HD       LYS  44   9.732  13.203  -9.329
  314   1HE   LYS  44          1HE       LYS  44  11.387  13.316 -11.126
  315   2HE   LYS  44          2HE       LYS  44  10.568  14.868 -10.945
  316   1HZ   LYS  44          1HZ       LYS  44  13.263  14.212  -9.878
  317   2HZ   LYS  44          2HZ       LYS  44  12.945  15.131 -11.199
  318   3HZ   LYS  44          3HZ       LYS  44  12.522  15.636  -9.692
  319    H    CYS  45           H        CYS  45   6.592  17.025  -7.217
  320    HA   CYS  45           HA       CYS  45   6.507  16.739  -4.370
  321   1HB   CYS  45          1HB       CYS  45   4.986  18.208  -5.637
  322   2HB   CYS  45          2HB       CYS  45   4.281  16.790  -6.423
  323    H    ILE  46           H        ILE  46   7.172  14.738  -3.655
  324    HA   ILE  46           HA       ILE  46   5.922  12.278  -4.663
  325    HB   ILE  46           HB       ILE  46   7.534  12.673  -2.123
  326   1HG1  ILE  46          1HG1      ILE  46   8.959  13.490  -3.882
  327   2HG1  ILE  46          2HG1      ILE  46   9.526  11.926  -3.332
  328   1HG2  ILE  46          2HG2      ILE  46   6.917  10.201  -3.786
  329   2HG2  ILE  46          3HG2      ILE  46   7.990  10.259  -2.371
  330   3HG2  ILE  46          1HG2      ILE  46   6.266  10.598  -2.192
  331   1HD1  ILE  46          3HD1      ILE  46   8.488  10.852  -5.345
  332   2HD1  ILE  46          1HD1      ILE  46   7.921  12.451  -5.887
  333   3HD1  ILE  46          2HD1      ILE  46   9.651  12.112  -5.782
  334    H    CYS  47           H        CYS  47   3.903  11.671  -4.035
  335    HA   CYS  47           HA       CYS  47   2.979  12.511  -1.351
  336   1HB   CYS  47          1HB       CYS  47   1.965  13.865  -3.233
  337   2HB   CYS  47          2HB       CYS  47   1.148  12.372  -3.743
  338    H    TYR  48           H        TYR  48   1.567  11.085  -0.237
  339    HA   TYR  48           HA       TYR  48   2.067   8.257  -1.046
  340   1HB   TYR  48          1HB       TYR  48   2.096   9.460   1.721
  341   2HB   TYR  48          2HB       TYR  48   2.494   7.816   1.259
  342    HD1  TYR  48           HD1      TYR  48   3.647  11.376   0.817
  343    HD2  TYR  48           HD2      TYR  48   4.745   7.208   0.924
  344    HE1  TYR  48           HE1      TYR  48   6.027  11.998   0.572
  345    HE2  TYR  48           HE2      TYR  48   7.126   7.839   0.777
  346    HH   TYR  48           HH       TYR  48   8.645   9.572   0.580
  347    H    PHE  49           H        PHE  49   0.290   6.990  -1.157
  348    HA   PHE  49           HA       PHE  49  -2.185   7.752   0.289
  349   1HB   PHE  49          1HB       PHE  49  -2.101   6.184  -2.285
  350   2HB   PHE  49          2HB       PHE  49  -3.413   7.056  -1.577
  351    HD1  PHE  49           HD2      PHE  49  -0.021   7.683  -3.128
  352    HD2  PHE  49           HD1      PHE  49  -4.073   9.082  -2.624
  353    HE1  PHE  49           HE2      PHE  49   0.561   9.782  -4.230
  354    HE2  PHE  49           HE1      PHE  49  -3.588  10.962  -4.133
  355    HZ   PHE  49           HZ       PHE  49  -1.231  11.328  -4.981
  356    HA   PRO  50           HA       PRO  50  -1.740   3.485   1.866
  357   1HB   PRO  50          1HB       PRO  50  -4.332   2.900   2.477
  358   2HB   PRO  50          2HB       PRO  50  -3.360   4.067   3.419
  359   1HG   PRO  50          1HG       PRO  50  -5.345   4.656   1.199
  360   2HG   PRO  50          2HG       PRO  50  -5.266   5.427   2.802
  361   1HD   PRO  50          1HD       PRO  50  -4.120   6.533   0.557
  362   2HD   PRO  50          2HD       PRO  50  -3.342   6.698   2.176
  363    H    CYS  51           H        CYS  51  -1.481   1.642   0.529
  364    HA   CYS  51           HA       CYS  51  -3.558   0.975  -1.442
  365   1HB   CYS  51          1HB       CYS  51  -2.762   2.342  -3.031
  366   2HB   CYS  51          2HB       CYS  51  -1.345   2.738  -2.090
   
  No H/Q in entry =         366
  Start of MODEL   14
    1    HA   PCA   1           HA       PYR   1  -0.064   2.507   7.253
    2   1HB   PCA   1          1HB       PYR   1  -1.645   2.788   4.684
    3   2HB   PCA   1          2HB       PYR   1  -2.132   1.971   6.201
    4   1HG   PCA   1          1HG       PYR   1  -2.999   4.515   5.472
    5   2HG   PCA   1          2HG       PYR   1  -2.742   4.053   7.184
    6    HN   PCA   1           HN       PYR   1   0.952   4.817   6.390
    7    H    LYS   2           H        LYS   2  -0.278   0.754   4.958
    8    HA   LYS   2           HA       LYS   2   2.435   0.806   3.859
    9   1HB   LYS   2          1HB       LYS   2   1.155  -1.311   4.348
   10   2HB   LYS   2          2HB       LYS   2   0.057  -0.904   3.034
   11   1HG   LYS   2          1HG       LYS   2   2.449  -0.680   1.688
   12   2HG   LYS   2          2HG       LYS   2   2.970  -1.698   3.019
   13   1HD   LYS   2          1HD       LYS   2   2.420  -3.302   1.485
   14   2HD   LYS   2          2HD       LYS   2   0.882  -3.202   2.336
   15   1HE   LYS   2          1HE       LYS   2   1.658  -1.826  -0.305
   16   2HE   LYS   2          2HE       LYS   2   0.609  -3.243  -0.143
   17   1HZ   LYS   2          1HZ       LYS   2  -0.961  -1.833   1.052
   18   2HZ   LYS   2          2HZ       LYS   2   0.020  -0.532   0.844
   19   3HZ   LYS   2          3HZ       LYS   2  -0.682  -1.240  -0.441
   20    H    LEU   3           H        LEU   3   2.084   3.080   3.149
   21    HA   LEU   3           HA       LEU   3   0.200   3.733   1.097
   22   1HB   LEU   3          1HB       LEU   3   2.738   5.119   1.939
   23   2HB   LEU   3          2HB       LEU   3   1.467   5.843   0.950
   24    HG   LEU   3           HG       LEU   3   0.482   4.739   3.540
   25   1HD1  LEU   3          1HD1      LEU   3   2.358   7.153   3.510
   26   2HD1  LEU   3          2HD1      LEU   3   1.365   6.627   4.881
   27   3HD1  LEU   3          3HD1      LEU   3   2.685   5.598   4.297
   28   1HD2  LEU   3          2HD2      LEU   3  -0.876   6.077   1.975
   29   2HD2  LEU   3          3HD2      LEU   3  -0.799   6.704   3.621
   30   3HD2  LEU   3          1HD2      LEU   3   0.150   7.482   2.337
   31    H    CYS   4           H        CYS   4   0.823   4.606  -1.066
   32    HA   CYS   4           HA       CYS   4   3.306   3.441  -2.249
   33   1HB   CYS   4          1HB       CYS   4   0.550   3.530  -3.543
   34   2HB   CYS   4          2HB       CYS   4   2.067   3.302  -4.415
   35    H    GLU   5           H        GLU   5   4.355   4.821  -3.625
   36    HA   GLU   5           HA       GLU   5   3.865   7.664  -3.131
   37   1HB   GLU   5          1HB       GLU   5   6.137   6.087  -4.413
   38   2HB   GLU   5          2HB       GLU   5   6.125   7.842  -4.227
   39   1HG   GLU   5          1HG       GLU   5   5.847   7.593  -1.783
   40   2HG   GLU   5          2HG       GLU   5   5.950   5.830  -1.932
   41    HE1  GLU   5           HE2      GLU   5   9.427   6.129  -2.985
   42    H    ARG   6           H        ARG   6   2.496   8.692  -4.502
   43    HA   ARG   6           HA       ARG   6   2.633   8.151  -7.422
   44   1HB   ARG   6          1HB       ARG   6   0.328   8.219  -6.394
   45   2HB   ARG   6          2HB       ARG   6   0.680   9.854  -5.841
   46   1HG   ARG   6          1HG       ARG   6  -0.605  10.040  -7.841
   47   2HG   ARG   6          2HG       ARG   6   1.027  10.565  -8.219
   48   1HD   ARG   6          1HD       ARG   6   1.428   8.230  -9.204
   49   2HD   ARG   6          2HD       ARG   6  -0.299   7.909  -8.925
   50    HE   ARG   6           HE       ARG   6  -0.123  10.351 -10.313
   51   1HH1  ARG   6          1HH1      ARG   6   0.624   6.982 -11.006
   52   2HH1  ARG   6          2HH1      ARG   6   0.731   7.212 -12.728
   53   1HH2  ARG   6          2HH2      ARG   6   0.149  10.729 -12.435
   54   2HH2  ARG   6          1HH2      ARG   6   0.355   9.446 -13.609
   55    HA   PRO   7           HA       PRO   7   4.963  12.094  -7.244
   56   1HB   PRO   7          1HB       PRO   7   5.541  11.626 -10.131
   57   2HB   PRO   7          2HB       PRO   7   6.657  11.860  -8.777
   58   1HG   PRO   7          1HG       PRO   7   6.298   9.407  -9.996
   59   2HG   PRO   7          2HG       PRO   7   6.680   9.587  -8.261
   60   1HD   PRO   7          1HD       PRO   7   3.961   9.111  -9.508
   61   2HD   PRO   7          2HD       PRO   7   4.737   8.340  -8.094
   62    H    SER   8           H        SER   8   3.531  11.487 -10.568
   63    HA   SER   8           HA       SER   8   2.342  14.134 -10.459
   64   1HB   SER   8          1HB       SER   8   1.612  13.289 -12.808
   65   2HB   SER   8          2HB       SER   8   3.337  13.536 -12.484
   66    HG   SER   8           HG       SER   8   3.062  11.516 -13.438
   67    H    GLY   9           H        GLY   9   0.970  13.690  -8.628
   68   1HA   GLY   9          1HA       GLY   9  -1.618  12.311  -9.288
   69   2HA   GLY   9          2HA       GLY   9  -1.153  13.027  -7.734
   70    H    THR  10           H        THR  10  -1.487  15.230  -7.388
   71    HA   THR  10           HA       THR  10  -2.827  16.854  -9.461
   72    HB   THR  10           HB       THR  10  -2.667  18.549  -7.526
   73    HG1  THR  10           HG1      THR  10  -2.060  17.823  -5.594
   74   1HG2  THR  10          3HG2      THR  10  -4.210  15.947  -7.127
   75   2HG2  THR  10          1HG2      THR  10  -4.513  17.462  -6.248
   76   3HG2  THR  10          2HG2      THR  10  -4.751  17.388  -8.004
   77    H    TRP  11           H        TRP  11  -0.146  17.399  -7.224
   78    HA   TRP  11           HA       TRP  11   1.104  19.389  -8.816
   79   1HB   TRP  11          1HB       TRP  11   1.148  19.002  -6.293
   80   2HB   TRP  11          2HB       TRP  11   2.440  17.860  -6.575
   81    HD1  TRP  11           HD1      TRP  11   4.279  19.501  -8.579
   82    HE1  TRP  11           HE1      TRP  11   5.410  21.693  -7.898
   83    HE3  TRP  11           HE3      TRP  11   1.318  20.722  -4.602
   84    HZ2  TRP  11           HZ2      TRP  11   5.133  23.668  -5.811
   85    HZ3  TRP  11           HZ3      TRP  11   1.751  22.768  -3.307
   86    HH2  TRP  11           HH2      TRP  11   3.718  24.183  -3.833
   87    H    SER  12           H        SER  12   1.157  18.080 -10.824
   88    HA   SER  12           HA       SER  12   3.272  16.068 -11.082
   89   1HB   SER  12          1HB       SER  12   1.464  17.375 -13.161
   90   2HB   SER  12          2HB       SER  12   2.415  15.896 -13.362
   91    HG   SER  12           HG       SER  12   0.243  16.341 -11.547
   92    H    GLY  13           H        GLY  13   4.814  17.884 -10.195
   93   1HA   GLY  13          1HA       GLY  13   6.566  18.620 -12.319
   94   2HA   GLY  13          2HA       GLY  13   5.599  20.033 -11.852
   95    H    VAL  14           H        VAL  14   7.924  20.697 -11.427
   96    HA   VAL  14           HA       VAL  14   9.311  19.793  -9.085
   97    HB   VAL  14           HB       VAL  14   9.409  22.509 -10.457
   98   1HG1  VAL  14          2HG1      VAL  14  10.569  22.519  -8.274
   99   2HG1  VAL  14          3HG1      VAL  14  11.539  21.122  -8.797
  100   3HG1  VAL  14          1HG1      VAL  14  11.694  22.680  -9.620
  101   1HG2  VAL  14          3HG2      VAL  14  11.022  19.974 -11.026
  102   2HG2  VAL  14          1HG2      VAL  14   9.881  20.754 -12.142
  103   3HG2  VAL  14          2HG2      VAL  14  11.379  21.574 -11.709
  104    H    CYS  15           H        CYS  15   9.320  20.806  -7.008
  105    HA   CYS  15           HA       CYS  15   7.015  22.612  -6.391
  106   1HB   CYS  15          1HB       CYS  15   6.599  21.317  -4.369
  107   2HB   CYS  15          2HB       CYS  15   6.411  20.276  -5.755
  108    H    GLY  16           H        GLY  16  10.070  21.296  -5.082
  109   1HA   GLY  16          1HA       GLY  16  11.607  22.258  -3.586
  110   2HA   GLY  16          2HA       GLY  16  10.874  23.828  -3.898
  111    H    ASN  17           H        ASN  17   8.525  23.913  -2.957
  112    HA   ASN  17           HA       ASN  17   9.009  23.883  -0.110
  113   1HB   ASN  17          1HB       ASN  17   7.922  25.762  -1.328
  114   2HB   ASN  17          2HB       ASN  17   6.478  24.766  -1.522
  115   1HD2  ASN  17          2HD2      ASN  17   7.479  26.374   2.155
  116   2HD2  ASN  17          1HD2      ASN  17   8.624  26.396   0.831
  117    H    ASN  18           H        ASN  18   9.156  21.693   0.290
  118    HA   ASN  18           HA       ASN  18   7.590  19.548   0.227
  119   1HB   ASN  18          1HB       ASN  18   9.645  20.033   1.691
  120   2HB   ASN  18          2HB       ASN  18   8.539  20.602   2.934
  121   1HD2  ASN  18          1HD2      ASN  18   9.108  16.619   2.284
  122   2HD2  ASN  18          2HD2      ASN  18  10.086  17.881   1.570
  123    H    ASN  19           H        ASN  19   6.981  22.005   2.580
  124    HA   ASN  19           HA       ASN  19   4.561  21.274   3.766
  125   1HB   ASN  19          1HB       ASN  19   5.584  23.060   4.781
  126   2HB   ASN  19          2HB       ASN  19   5.982  23.870   3.271
  127   1HD2  ASN  19          2HD2      ASN  19   3.017  25.774   3.096
  128   2HD2  ASN  19          1HD2      ASN  19   4.468  25.241   2.246
  129    H    ALA  20           H        ALA  20   4.931  23.311   0.802
  130    HA   ALA  20           HA       ALA  20   2.078  23.624   0.512
  131   1HB   ALA  20          3HB       ALA  20   3.646  25.242  -0.474
  132   2HB   ALA  20          1HB       ALA  20   4.271  23.978  -1.563
  133   3HB   ALA  20          2HB       ALA  20   2.588  24.529  -1.699
  134    H    CYS  21           H        CYS  21   4.523  21.557  -1.088
  135    HA   CYS  21           HA       CYS  21   2.861  20.143  -2.852
  136   1HB   CYS  21          1HB       CYS  21   5.106  19.645  -3.100
  137   2HB   CYS  21          2HB       CYS  21   5.369  19.480  -1.356
  138    H    LYS  22           H        LYS  22   3.752  19.289   0.460
  139    HA   LYS  22           HA       LYS  22   2.155  17.054   0.895
  140   1HB   LYS  22          1HB       LYS  22   3.932  17.903   2.361
  141   2HB   LYS  22          2HB       LYS  22   2.988  19.326   2.771
  142   1HG   LYS  22          1HG       LYS  22   1.248  17.880   3.829
  143   2HG   LYS  22          2HG       LYS  22   2.250  16.487   3.521
  144   1HD   LYS  22          1HD       LYS  22   2.540  18.782   5.449
  145   2HD   LYS  22          2HD       LYS  22   2.783  17.071   5.768
  146   1HE   LYS  22          1HE       LYS  22   4.697  19.006   4.344
  147   2HE   LYS  22          2HE       LYS  22   4.874  18.385   5.979
  148   1HZ   LYS  22          1HZ       LYS  22   4.887  16.657   3.598
  149   2HZ   LYS  22          2HZ       LYS  22   6.234  17.312   4.241
  150   3HZ   LYS  22          3HZ       LYS  22   5.328  16.243   5.123
  151    H    ASN  23           H        ASN  23   1.376  20.411   1.891
  152    HA   ASN  23           HA       ASN  23  -1.159  19.819   2.842
  153   1HB   ASN  23          1HB       ASN  23  -0.024  21.917   3.332
  154   2HB   ASN  23          2HB       ASN  23  -0.052  22.403   1.635
  155   1HD2  ASN  23          2HD2      ASN  23  -2.683  24.321   3.412
  156   2HD2  ASN  23          1HD2      ASN  23  -0.941  24.151   3.535
  157    H    GLN  24           H        GLN  24  -0.333  21.323  -0.340
  158    HA   GLN  24           HA       GLN  24  -2.926  21.358  -1.389
  159   1HB   GLN  24          1HB       GLN  24  -0.954  22.528  -2.317
  160   2HB   GLN  24          2HB       GLN  24  -0.287  20.993  -2.888
  161   1HG   GLN  24          1HG       GLN  24  -3.096  21.699  -3.731
  162   2HG   GLN  24          2HG       GLN  24  -1.796  22.672  -4.399
  163   1HE2  GLN  24          2HE2      GLN  24  -0.622  20.255  -6.659
  164   2HE2  GLN  24          1HE2      GLN  24  -0.359  21.811  -5.893
  165    H    CYS  25           H        CYS  25  -0.461  18.698  -1.653
  166    HA   CYS  25           HA       CYS  25  -2.104  17.053  -3.236
  167   1HB   CYS  25          1HB       CYS  25   0.289  16.517  -2.733
  168   2HB   CYS  25          2HB       CYS  25  -0.188  16.065  -1.095
  169    H    ILE  26           H        ILE  26  -1.752  16.912   0.379
  170    HA   ILE  26           HA       ILE  26  -3.799  14.867   0.536
  171    HB   ILE  26           HB       ILE  26  -3.507  14.925   2.884
  172   1HG1  ILE  26          1HG1      ILE  26  -2.108  17.602   2.566
  173   2HG1  ILE  26          2HG1      ILE  26  -3.642  17.286   3.375
  174   1HG2  ILE  26          2HG2      ILE  26  -1.668  13.988   1.438
  175   2HG2  ILE  26          3HG2      ILE  26  -0.762  15.486   1.686
  176   3HG2  ILE  26          1HG2      ILE  26  -1.161  14.454   3.062
  177   1HD1  ILE  26          3HD1      ILE  26  -2.432  15.830   5.021
  178   2HD1  ILE  26          1HD1      ILE  26  -0.897  16.361   4.289
  179   3HD1  ILE  26          2HD1      ILE  26  -1.967  17.543   5.056
  180    H    ASN  27           H        ASN  27  -3.945  18.288   0.340
  181    HA   ASN  27           HA       ASN  27  -6.533  18.615   1.634
  182   1HB   ASN  27          1HB       ASN  27  -4.723  20.233   1.659
  183   2HB   ASN  27          2HB       ASN  27  -4.829  20.454  -0.104
  184   1HD2  ASN  27          2HD2      ASN  27  -6.545  23.204   1.764
  185   2HD2  ASN  27          1HD2      ASN  27  -4.932  22.478   1.825
  186    H    LEU  28           H        LEU  28  -5.321  18.984  -1.759
  187    HA   LEU  28           HA       LEU  28  -7.987  19.074  -2.863
  188   1HB   LEU  28          1HB       LEU  28  -5.185  19.023  -4.014
  189   2HB   LEU  28          2HB       LEU  28  -6.577  18.720  -5.043
  190    HG   LEU  28           HG       LEU  28  -7.603  20.846  -4.453
  191   1HD1  LEU  28          3HD1      LEU  28  -5.135  21.277  -2.719
  192   2HD1  LEU  28          1HD1      LEU  28  -6.234  22.574  -3.230
  193   3HD1  LEU  28          2HD1      LEU  28  -6.833  21.273  -2.201
  194   1HD2  LEU  28          2HD2      LEU  28  -6.107  20.705  -6.386
  195   2HD2  LEU  28          3HD2      LEU  28  -5.975  22.296  -5.619
  196   3HD2  LEU  28          1HD2      LEU  28  -4.707  21.078  -5.364
  197    H    GLU  29           H        GLU  29  -5.400  16.527  -3.010
  198    HA   GLU  29           HA       GLU  29  -7.569  14.573  -3.686
  199   1HB   GLU  29          1HB       GLU  29  -5.811  12.980  -4.277
  200   2HB   GLU  29          2HB       GLU  29  -5.953  14.383  -5.327
  201   1HG   GLU  29          1HG       GLU  29  -3.948  15.388  -4.131
  202   2HG   GLU  29          2HG       GLU  29  -3.724  13.777  -3.379
  203    HE2  GLU  29           HE2      GLU  29  -2.185  15.404  -5.475
  204    H    LYS  30           H        LYS  30  -6.991  12.392  -2.335
  205    HA   LYS  30           HA       LYS  30  -7.028  13.423   0.472
  206   1HB   LYS  30          1HB       LYS  30  -8.518  11.125  -0.761
  207   2HB   LYS  30          2HB       LYS  30  -8.619  11.604   0.939
  208   1HG   LYS  30          1HG       LYS  30  -9.259  13.630  -1.268
  209   2HG   LYS  30          2HG       LYS  30 -10.408  12.408  -0.795
  210   1HD   LYS  30          1HD       LYS  30 -10.882  14.516   0.302
  211   2HD   LYS  30          2HD       LYS  30 -10.605  13.192   1.423
  212   1HE   LYS  30          1HE       LYS  30  -9.681  15.277   2.282
  213   2HE   LYS  30          2HE       LYS  30  -8.424  14.072   2.048
  214   1HZ   LYS  30          3HZ       LYS  30  -7.902  15.273  -0.073
  215   2HZ   LYS  30          1HZ       LYS  30  -8.889  16.499   0.361
  216   3HZ   LYS  30          2HZ       LYS  30  -7.597  16.093   1.261
  217    H    ALA  31           H        ALA  31  -4.758  12.287  -1.207
  218    HA   ALA  31           HA       ALA  31  -3.482  10.117  -0.102
  219   1HB   ALA  31          1HB       ALA  31  -2.626  11.730  -1.824
  220   2HB   ALA  31          2HB       ALA  31  -2.388  12.926  -0.545
  221   3HB   ALA  31          3HB       ALA  31  -1.443  11.420  -0.521
  222    H    ARG  32           H        ARG  32  -1.798  10.013   1.633
  223    HA   ARG  32           HA       ARG  32  -2.907  11.319   4.099
  224   1HB   ARG  32          1HB       ARG  32  -1.123   8.910   3.870
  225   2HB   ARG  32          2HB       ARG  32  -1.902   9.509   5.329
  226   1HG   ARG  32          1HG       ARG  32  -3.369   8.401   2.889
  227   2HG   ARG  32          2HG       ARG  32  -2.998   7.518   4.364
  228   1HD   ARG  32          1HD       ARG  32  -5.270   8.143   4.539
  229   2HD   ARG  32          2HD       ARG  32  -4.338   9.135   5.670
  230    HE   ARG  32           HE       ARG  32  -5.101  10.196   2.942
  231   1HH1  ARG  32          2HH1      ARG  32  -5.938  10.251   6.357
  232   2HH1  ARG  32          1HH1      ARG  32  -6.381  11.930   6.373
  233   1HH2  ARG  32          1HH2      ARG  32  -5.412  12.395   2.977
  234   2HH2  ARG  32          2HH2      ARG  32  -6.159  13.198   4.342
  235    H    HIS  33           H        HIS  33   0.287  10.549   2.633
  236    HA   HIS  33           HA       HIS  33   1.346  12.934   4.105
  237   1HB   HIS  33          2HB       HIS  33   3.124  10.758   3.040
  238   2HB   HIS  33          1HB       HIS  33   3.510  12.065   4.144
  239    HD1  HIS  33           HD1      HIS  33   0.677  11.064   5.836
  240    HD2  HIS  33           HD2      HIS  33   4.285   9.105   5.013
  241    HE1  HIS  33           HE1      HIS  33   0.822   9.082   7.420
  242    H    GLY  34           H        GLY  34   3.053  14.077   2.857
  243   1HA   GLY  34          1HA       GLY  34   3.465  13.522   0.127
  244   2HA   GLY  34          2HA       GLY  34   2.460  14.977   0.283
  245    H    SER  35           H        SER  35   5.292  14.737  -0.668
  246    HA   SER  35           HA       SER  35   6.696  16.554   1.163
  247   1HB   SER  35          1HB       SER  35   6.862  14.209   2.241
  248   2HB   SER  35          2HB       SER  35   7.600  13.631   0.746
  249    HG   SER  35           HG       SER  35   9.189  14.150   2.231
  250    H    CYS  36           H        CYS  36   8.323  17.572   0.086
  251    HA   CYS  36           HA       CYS  36   8.578  17.127  -2.815
  252   1HB   CYS  36          1HB       CYS  36   9.497  19.353  -0.995
  253   2HB   CYS  36          2HB       CYS  36  10.153  19.133  -2.598
  254    H    ASN  37           H        ASN  37   9.491  15.026  -2.586
  255    HA   ASN  37           HA       ASN  37  12.054  14.413  -1.474
  256   1HB   ASN  37          1HB       ASN  37  10.667  12.636  -2.380
  257   2HB   ASN  37          2HB       ASN  37  10.577  13.470  -3.950
  258   1HD2  ASN  37          2HD2      ASN  37  14.190  11.693  -3.054
  259   2HD2  ASN  37          1HD2      ASN  37  13.240  12.361  -1.739
  260    H    TYR  38           H        TYR  38  14.154  14.477  -2.463
  261    HA   TYR  38           HA       TYR  38  14.510  16.646  -4.400
  262   1HB   TYR  38          1HB       TYR  38  16.074  16.600  -2.562
  263   2HB   TYR  38          2HB       TYR  38  16.576  14.963  -2.964
  264    HD1  TYR  38           HD1      TYR  38  16.105  18.252  -4.816
  265    HD2  TYR  38           HD2      TYR  38  18.726  14.918  -4.026
  266    HE1  TYR  38           HE1      TYR  38  17.463  18.839  -6.793
  267    HE2  TYR  38           HE2      TYR  38  20.009  15.457  -6.077
  268    HH   TYR  38           HH       TYR  38  18.931  17.993  -8.357
  269    H    VAL  39           H        VAL  39  16.742  14.095  -4.830
  270    HA   VAL  39           HA       VAL  39  17.359  12.922  -6.610
  271    HB   VAL  39           HB       VAL  39  14.371  12.576  -7.145
  272   1HG1  VAL  39          1HG1      VAL  39  16.761  11.116  -8.335
  273   2HG1  VAL  39          2HG1      VAL  39  15.072  10.585  -8.448
  274   3HG1  VAL  39          3HG1      VAL  39  15.561  12.094  -9.215
  275   1HG2  VAL  39          1HG2      VAL  39  15.189  11.676  -4.956
  276   2HG2  VAL  39          2HG2      VAL  39  14.705  10.398  -6.075
  277   3HG2  VAL  39          3HG2      VAL  39  16.427  10.750  -5.823
  278    H    PHE  40           H        PHE  40  17.877  13.188  -8.856
  279    HA   PHE  40           HA       PHE  40  18.011  15.820  -9.727
  280   1HB   PHE  40          1HB       PHE  40  19.487  14.169 -10.574
  281   2HB   PHE  40          2HB       PHE  40  18.166  13.181 -11.210
  282    HD1  PHE  40           HD1      PHE  40  16.973  13.832 -13.300
  283    HD2  PHE  40           HD2      PHE  40  20.486  15.920 -11.894
  284    HE1  PHE  40           HE1      PHE  40  17.238  14.897 -15.519
  285    HE2  PHE  40           HE2      PHE  40  20.746  16.965 -14.123
  286    HZ   PHE  40           HZ       PHE  40  19.117  16.469 -15.935
  287    HA   PRO  41           HA       PRO  41  17.982  17.162 -11.437
  288   1HB   PRO  41          1HB       PRO  41  16.837  19.345 -12.562
  289   2HB   PRO  41          2HB       PRO  41  17.180  17.864 -13.496
  290   1HG   PRO  41          1HG       PRO  41  14.527  18.741 -12.342
  291   2HG   PRO  41          2HG       PRO  41  14.867  18.064 -13.953
  292   1HD   PRO  41          1HD       PRO  41  13.952  16.535 -11.814
  293   2HD   PRO  41          2HD       PRO  41  14.957  15.878 -13.131
  294    H    ALA  42           H        ALA  42  14.723  18.145 -10.326
  295    HA   ALA  42           HA       ALA  42  15.873  19.741  -8.091
  296   1HB   ALA  42          1HB       ALA  42  15.274  21.230  -9.960
  297   2HB   ALA  42          2HB       ALA  42  13.639  20.540  -9.995
  298   3HB   ALA  42          3HB       ALA  42  14.187  21.468  -8.581
  299    H    HIS  43           H        HIS  43  13.979  20.368  -6.598
  300    HA   HIS  43           HA       HIS  43  13.024  17.991  -5.429
  301   1HB   HIS  43          2HB       HIS  43  12.553  20.904  -5.040
  302   2HB   HIS  43          1HB       HIS  43  11.534  19.794  -4.150
  303    HD1  HIS  43           HD1      HIS  43  12.642  18.232  -2.322
  304    HD2  HIS  43           HD2      HIS  43  15.245  21.026  -4.078
  305    HE1  HIS  43           HE1      HIS  43  14.743  18.295  -0.919
  306    H    LYS  44           H        LYS  44  11.230  16.895  -5.611
  307    HA   LYS  44           HA       LYS  44   9.095  17.769  -7.523
  308   1HB   LYS  44          1HB       LYS  44   9.106  15.479  -8.430
  309   2HB   LYS  44          2HB       LYS  44  10.636  16.333  -8.684
  310   1HG   LYS  44          1HG       LYS  44  11.570  15.098  -6.649
  311   2HG   LYS  44          2HG       LYS  44  10.063  14.209  -6.562
  312   1HD   LYS  44          1HD       LYS  44  11.786  12.898  -7.641
  313   2HD   LYS  44          2HD       LYS  44  10.430  13.191  -8.731
  314   1HE   LYS  44          1HE       LYS  44  12.706  13.348  -9.788
  315   2HE   LYS  44          2HE       LYS  44  11.699  14.774 -10.048
  316   1HZ   LYS  44          2HZ       LYS  44  13.674  14.673  -7.856
  317   2HZ   LYS  44          3HZ       LYS  44  14.104  15.094  -9.359
  318   3HZ   LYS  44          1HZ       LYS  44  13.012  15.994  -8.520
  319    H    CYS  45           H        CYS  45   7.013  17.252  -6.926
  320    HA   CYS  45           HA       CYS  45   6.680  16.684  -4.104
  321   1HB   CYS  45          1HB       CYS  45   5.303  18.344  -5.271
  322   2HB   CYS  45          2HB       CYS  45   4.634  17.078  -6.306
  323    H    ILE  46           H        ILE  46   6.911  14.603  -3.396
  324    HA   ILE  46           HA       ILE  46   5.634  12.387  -4.959
  325    HB   ILE  46           HB       ILE  46   7.539  12.377  -2.587
  326   1HG1  ILE  46          1HG1      ILE  46   8.596  12.821  -4.799
  327   2HG1  ILE  46          2HG1      ILE  46   9.137  11.328  -4.023
  328   1HG2  ILE  46          1HG2      ILE  46   6.035  10.103  -3.931
  329   2HG2  ILE  46          2HG2      ILE  46   7.456   9.863  -2.880
  330   3HG2  ILE  46          3HG2      ILE  46   5.979  10.577  -2.233
  331   1HD1  ILE  46          2HD1      ILE  46   7.702  10.004  -5.550
  332   2HD1  ILE  46          3HD1      ILE  46   7.153  11.507  -6.329
  333   3HD1  ILE  46          1HD1      ILE  46   8.850  11.024  -6.425
  334    H    CYS  47           H        CYS  47   3.677  11.649  -4.253
  335    HA   CYS  47           HA       CYS  47   2.811  12.513  -1.542
  336   1HB   CYS  47          1HB       CYS  47   1.833  13.857  -3.420
  337   2HB   CYS  47          2HB       CYS  47   0.996  12.376  -3.933
  338    H    TYR  48           H        TYR  48   1.620  11.076  -0.321
  339    HA   TYR  48           HA       TYR  48   2.145   8.254  -1.134
  340   1HB   TYR  48          1HB       TYR  48   1.923   9.592   1.565
  341   2HB   TYR  48          2HB       TYR  48   2.212   7.887   1.294
  342    HD1  TYR  48           HD1      TYR  48   3.713  11.268   0.623
  343    HD2  TYR  48           HD2      TYR  48   4.401   7.034   1.065
  344    HE1  TYR  48           HE1      TYR  48   6.136  11.631   0.319
  345    HE2  TYR  48           HE2      TYR  48   6.832   7.416   0.831
  346    HH   TYR  48           HH       TYR  48   8.331   8.952  -0.219
  347    H    PHE  49           H        PHE  49   0.321   7.186  -1.822
  348    HA   PHE  49           HA       PHE  49  -2.289   7.978  -0.668
  349   1HB   PHE  49          1HB       PHE  49  -1.854   6.172  -3.017
  350   2HB   PHE  49          2HB       PHE  49  -3.308   6.954  -2.525
  351    HD1  PHE  49           HD2      PHE  49  -1.380   9.719  -2.145
  352    HD2  PHE  49           HD1      PHE  49  -2.803   7.080  -5.250
  353    HE1  PHE  49           HE2      PHE  49  -1.229  11.550  -3.770
  354    HE2  PHE  49           HE1      PHE  49  -2.783   8.979  -6.840
  355    HZ   PHE  49           HZ       PHE  49  -1.934  11.210  -6.097
  356    HA   PRO  50           HA       PRO  50  -2.280   4.087   1.557
  357   1HB   PRO  50          1HB       PRO  50  -4.862   3.877   2.261
  358   2HB   PRO  50          2HB       PRO  50  -3.832   5.228   2.824
  359   1HG   PRO  50          1HG       PRO  50  -5.759   5.255   0.466
  360   2HG   PRO  50          2HG       PRO  50  -5.682   6.429   1.812
  361   1HD   PRO  50          1HD       PRO  50  -4.360   6.847  -0.598
  362   2HD   PRO  50          2HD       PRO  50  -3.675   7.372   0.982
  363    H    CYS  51           H        CYS  51  -1.670   3.191  -0.568
  364    HA   CYS  51           HA       CYS  51  -3.563   1.970  -2.340
  365   1HB   CYS  51          1HB       CYS  51  -1.597   0.932  -3.373
  366   2HB   CYS  51          2HB       CYS  51  -1.353   2.616  -2.990
   
  No H/Q in entry =         366
  Start of MODEL   15
    1    HA   PCA   1           HA       PYR   1  -0.033  -2.692   3.469
    2   1HB   PCA   1          1HB       PYR   1   2.757  -3.830   3.634
    3   2HB   PCA   1          2HB       PYR   1   1.374  -4.102   4.731
    4   1HG   PCA   1          1HG       PYR   1   2.173  -5.905   2.740
    5   2HG   PCA   1          2HG       PYR   1   0.475  -5.756   3.286
    6    HN   PCA   1           HN       PYR   1   0.406  -2.749   0.870
    7    H    LYS   2           H        LYS   2   2.912  -2.290   1.508
    8    HA   LYS   2           HA       LYS   2   3.857   0.110   2.801
    9   1HB   LYS   2          1HB       LYS   2   5.208  -1.406   1.270
   10   2HB   LYS   2          2HB       LYS   2   4.243  -0.782  -0.079
   11   1HG   LYS   2          1HG       LYS   2   5.090   1.572   0.580
   12   2HG   LYS   2          2HG       LYS   2   6.088   0.780   1.786
   13   1HD   LYS   2          1HD       LYS   2   7.403   1.312  -0.192
   14   2HD   LYS   2          2HD       LYS   2   7.330  -0.429   0.071
   15   1HE   LYS   2          1HE       LYS   2   7.136   0.179  -2.323
   16   2HE   LYS   2          2HE       LYS   2   5.736  -0.722  -1.749
   17   1HZ   LYS   2          2HZ       LYS   2   4.558   1.422  -1.567
   18   2HZ   LYS   2          3HZ       LYS   2   5.840   2.217  -2.167
   19   3HZ   LYS   2          1HZ       LYS   2   5.062   1.119  -3.096
   20    H    LEU   3           H        LEU   3   3.321   2.254   2.340
   21    HA   LEU   3           HA       LEU   3   0.902   3.043   1.084
   22   1HB   LEU   3          1HB       LEU   3   3.525   4.500   1.363
   23   2HB   LEU   3          2HB       LEU   3   2.013   5.295   0.959
   24    HG   LEU   3           HG       LEU   3   2.052   3.662   3.504
   25   1HD1  LEU   3          1HD1      LEU   3   3.382   6.381   3.219
   26   2HD1  LEU   3          2HD1      LEU   3   3.013   5.567   4.753
   27   3HD1  LEU   3          3HD1      LEU   3   4.188   4.859   3.630
   28   1HD2  LEU   3          2HD2      LEU   3   0.009   4.826   2.648
   29   2HD2  LEU   3          3HD2      LEU   3   0.533   5.413   4.237
   30   3HD2  LEU   3          1HD2      LEU   3   0.872   6.376   2.785
   31    H    CYS   4           H        CYS   4   0.613   4.080  -1.007
   32    HA   CYS   4           HA       CYS   4   2.594   3.235  -3.119
   33   1HB   CYS   4          1HB       CYS   4  -0.349   3.626  -3.136
   34   2HB   CYS   4          2HB       CYS   4   0.570   4.037  -4.596
   35    H    GLU   5           H        GLU   5   4.095   4.769  -3.090
   36    HA   GLU   5           HA       GLU   5   3.590   7.538  -2.463
   37   1HB   GLU   5          1HB       GLU   5   6.017   6.189  -3.751
   38   2HB   GLU   5          2HB       GLU   5   5.921   7.817  -3.080
   39   1HG   GLU   5          1HG       GLU   5   6.898   6.663  -1.335
   40   2HG   GLU   5          2HG       GLU   5   5.189   6.685  -0.865
   41    HE2  GLU   5           HE2      GLU   5   6.517   5.001   0.411
   42    H    ARG   6           H        ARG   6   2.346   8.720  -3.881
   43    HA   ARG   6           HA       ARG   6   2.390   8.088  -6.764
   44   1HB   ARG   6          1HB       ARG   6   0.747   9.969  -5.056
   45   2HB   ARG   6          2HB       ARG   6   0.883  10.243  -6.785
   46   1HG   ARG   6          1HG       ARG   6  -1.100   9.000  -6.379
   47   2HG   ARG   6          2HG       ARG   6   0.033   7.996  -7.296
   48   1HD   ARG   6          1HD       ARG   6   0.588   6.691  -5.347
   49   2HD   ARG   6          2HD       ARG   6  -0.162   7.901  -4.280
   50    HE   ARG   6           HE       ARG   6  -2.007   6.682  -6.198
   51   1HH1  ARG   6          2HH2      ARG   6  -0.479   6.314  -3.021
   52   2HH1  ARG   6          1HH2      ARG   6  -1.866   5.562  -2.286
   53   1HH2  ARG   6          1HH1      ARG   6  -3.853   5.552  -5.200
   54   2HH2  ARG   6          2HH1      ARG   6  -3.720   5.055  -3.543
   55    HA   PRO   7           HA       PRO   7   5.415  11.450  -7.287
   56   1HB   PRO   7          1HB       PRO   7   5.562  11.512 -10.002
   57   2HB   PRO   7          2HB       PRO   7   6.204  10.121  -9.084
   58   1HG   PRO   7          1HG       PRO   7   3.488  10.353 -10.415
   59   2HG   PRO   7          2HG       PRO   7   4.676   9.029 -10.587
   60   1HD   PRO   7          1HD       PRO   7   2.575   8.943  -8.827
   61   2HD   PRO   7          2HD       PRO   7   4.147   8.167  -8.450
   62    H    SER   8           H        SER   8   5.184  13.564  -8.906
   63    HA   SER   8           HA       SER   8   2.859  14.799  -7.859
   64   1HB   SER   8          1HB       SER   8   4.678  16.007  -9.962
   65   2HB   SER   8          2HB       SER   8   3.876  16.731  -8.546
   66    HG   SER   8           HG       SER   8   5.205  15.185  -7.312
   67    H    GLY   9           H        GLY   9   1.258  13.393  -8.821
   68   1HA   GLY   9          1HA       GLY   9   0.590  13.453 -11.612
   69   2HA   GLY   9          2HA       GLY   9  -0.435  12.881 -10.286
   70    H    THR  10           H        THR  10  -0.392  15.453  -8.821
   71    HA   THR  10           HA       THR  10  -2.386  16.989 -10.352
   72    HB   THR  10           HB       THR  10  -2.271  18.297  -8.130
   73    HG1  THR  10           HG1      THR  10  -1.167  17.335  -6.490
   74   1HG2  THR  10          2HG2      THR  10  -2.930  15.323  -7.907
   75   2HG2  THR  10          3HG2      THR  10  -3.468  16.605  -6.804
   76   3HG2  THR  10          1HG2      THR  10  -4.035  16.593  -8.485
   77    H    TRP  11           H        TRP  11   0.427  17.757  -8.388
   78    HA   TRP  11           HA       TRP  11   1.068  20.183  -9.829
   79   1HB   TRP  11          1HB       TRP  11   1.280  19.685  -7.367
   80   2HB   TRP  11          2HB       TRP  11   2.699  18.715  -7.716
   81    HD1  TRP  11           HD1      TRP  11   4.123  20.877  -9.739
   82    HE1  TRP  11           HE1      TRP  11   5.218  22.942  -8.687
   83    HE3  TRP  11           HE3      TRP  11   1.617  20.951  -5.289
   84    HZ2  TRP  11           HZ2      TRP  11   4.933  24.509  -6.309
   85    HZ3  TRP  11           HZ3      TRP  11   2.042  22.755  -3.647
   86    HH2  TRP  11           HH2      TRP  11   3.793  24.440  -4.093
   87    H    SER  12           H        SER  12   1.211  18.782 -11.957
   88    HA   SER  12           HA       SER  12   3.695  17.265 -12.231
   89   1HB   SER  12          1HB       SER  12   1.702  18.126 -14.354
   90   2HB   SER  12          2HB       SER  12   2.935  16.855 -14.480
   91    HG   SER  12           HG       SER  12   1.834  15.965 -12.505
   92    H    GLY  13           H        GLY  13   4.866  19.173 -11.387
   93   1HA   GLY  13          1HA       GLY  13   6.510  20.377 -13.390
   94   2HA   GLY  13          2HA       GLY  13   5.453  21.577 -12.596
   95    H    VAL  14           H        VAL  14   7.925  22.126 -11.897
   96    HA   VAL  14           HA       VAL  14   9.092  20.454  -9.875
   97    HB   VAL  14           HB       VAL  14   9.516  23.422 -10.383
   98   1HG1  VAL  14          3HG1      VAL  14  11.188  21.336  -8.927
   99   2HG1  VAL  14          1HG1      VAL  14  11.779  22.947  -9.386
  100   3HG1  VAL  14          2HG1      VAL  14  10.450  22.798  -8.238
  101   1HG2  VAL  14          1HG2      VAL  14  10.918  20.972 -11.549
  102   2HG2  VAL  14          2HG2      VAL  14   9.972  22.171 -12.452
  103   3HG2  VAL  14          3HG2      VAL  14  11.503  22.641 -11.713
  104    H    CYS  15           H        CYS  15   8.776  20.418  -7.691
  105    HA   CYS  15           HA       CYS  15   6.293  21.469  -6.702
  106   1HB   CYS  15          1HB       CYS  15   6.572  20.154  -4.907
  107   2HB   CYS  15          2HB       CYS  15   7.694  19.328  -5.998
  108    H    GLY  16           H        GLY  16   9.650  22.486  -6.371
  109   1HA   GLY  16          1HA       GLY  16  10.600  24.367  -5.437
  110   2HA   GLY  16          2HA       GLY  16   8.995  25.033  -5.116
  111    H    ASN  17           H        ASN  17   7.754  23.586  -3.363
  112    HA   ASN  17           HA       ASN  17   9.593  23.326  -1.010
  113   1HB   ASN  17          1HB       ASN  17   8.737  25.592  -1.060
  114   2HB   ASN  17          2HB       ASN  17   7.081  24.999  -1.261
  115   1HD2  ASN  17          2HD2      ASN  17   8.855  24.835   2.455
  116   2HD2  ASN  17          1HD2      ASN  17   9.847  25.086   1.034
  117    H    ASN  18           H        ASN  18   9.186  21.850   0.451
  118    HA   ASN  18           HA       ASN  18   7.525  19.656   0.213
  119   1HB   ASN  18          1HB       ASN  18   9.556  19.973   1.670
  120   2HB   ASN  18          2HB       ASN  18   8.564  20.863   2.808
  121   1HD2  ASN  18          2HD2      ASN  18   8.171  16.814   2.553
  122   2HD2  ASN  18          1HD2      ASN  18   9.181  17.618   1.351
  123    H    ASN  19           H        ASN  19   7.044  22.224   2.541
  124    HA   ASN  19           HA       ASN  19   4.562  21.447   3.532
  125   1HB   ASN  19          1HB       ASN  19   6.127  23.314   4.352
  126   2HB   ASN  19          2HB       ASN  19   5.225  24.381   3.270
  127   1HD2  ASN  19          2HD2      ASN  19   2.150  23.486   5.381
  128   2HD2  ASN  19          1HD2      ASN  19   2.522  23.048   3.725
  129    H    ALA  20           H        ALA  20   5.162  23.634   0.747
  130    HA   ALA  20           HA       ALA  20   2.406  24.165   0.211
  131   1HB   ALA  20          3HB       ALA  20   4.290  25.442  -0.798
  132   2HB   ALA  20          1HB       ALA  20   4.687  24.027  -1.807
  133   3HB   ALA  20          2HB       ALA  20   3.115  24.842  -1.987
  134    H    CYS  21           H        CYS  21   4.653  21.781  -1.302
  135    HA   CYS  21           HA       CYS  21   2.860  20.456  -2.958
  136   1HB   CYS  21          1HB       CYS  21   5.089  19.807  -3.157
  137   2HB   CYS  21          2HB       CYS  21   5.298  19.581  -1.419
  138    H    LYS  22           H        LYS  22   3.679  19.698   0.394
  139    HA   LYS  22           HA       LYS  22   2.079  17.508   0.991
  140   1HB   LYS  22          1HB       LYS  22   3.825  18.350   2.405
  141   2HB   LYS  22          2HB       LYS  22   3.011  19.890   2.640
  142   1HG   LYS  22          1HG       LYS  22   1.184  18.800   3.889
  143   2HG   LYS  22          2HG       LYS  22   1.977  17.258   3.727
  144   1HD   LYS  22          1HD       LYS  22   2.659  19.694   5.363
  145   2HD   LYS  22          2HD       LYS  22   2.626  18.018   5.887
  146   1HE   LYS  22          1HE       LYS  22   4.800  19.415   4.239
  147   2HE   LYS  22          2HE       LYS  22   4.912  18.984   5.937
  148   1HZ   LYS  22          3HZ       LYS  22   4.570  16.991   3.803
  149   2HZ   LYS  22          1HZ       LYS  22   6.036  17.490   4.296
  150   3HZ   LYS  22          2HZ       LYS  22   5.023  16.713   5.346
  151    H    ASN  23           H        ASN  23   1.326  20.944   1.677
  152    HA   ASN  23           HA       ASN  23  -1.295  20.554   2.556
  153   1HB   ASN  23          1HB       ASN  23  -0.078  22.665   2.810
  154   2HB   ASN  23          2HB       ASN  23  -0.063  22.934   1.067
  155   1HD2  ASN  23          2HD2      ASN  23  -2.836  24.867   2.876
  156   2HD2  ASN  23          1HD2      ASN  23  -1.157  24.601   3.307
  157    H    GLN  24           H        GLN  24  -0.202  21.574  -0.717
  158    HA   GLN  24           HA       GLN  24  -2.632  21.477  -2.056
  159   1HB   GLN  24          1HB       GLN  24  -0.756  22.412  -3.097
  160   2HB   GLN  24          2HB       GLN  24   0.232  20.979  -2.921
  161   1HG   GLN  24          1HG       GLN  24  -2.268  21.118  -4.670
  162   2HG   GLN  24          2HG       GLN  24  -0.662  21.518  -5.264
  163   1HE2  GLN  24          2HE2      GLN  24   0.377  17.916  -4.650
  164   2HE2  GLN  24          1HE2      GLN  24   0.801  19.393  -3.819
  165    H    CYS  25           H        CYS  25  -0.414  18.637  -1.576
  166    HA   CYS  25           HA       CYS  25  -2.048  16.912  -3.111
  167   1HB   CYS  25          1HB       CYS  25   0.223  16.272  -2.410
  168   2HB   CYS  25          2HB       CYS  25  -0.327  16.116  -0.733
  169    H    ILE  26           H        ILE  26  -1.999  17.376   0.478
  170    HA   ILE  26           HA       ILE  26  -4.203  15.487   0.768
  171    HB   ILE  26           HB       ILE  26  -4.017  15.830   3.092
  172   1HG1  ILE  26          1HG1      ILE  26  -2.397  18.341   2.507
  173   2HG1  ILE  26          2HG1      ILE  26  -3.993  18.253   3.263
  174   1HG2  ILE  26          2HG2      ILE  26  -2.156  14.635   1.839
  175   2HG2  ILE  26          3HG2      ILE  26  -1.182  16.104   1.999
  176   3HG2  ILE  26          1HG2      ILE  26  -1.717  15.241   3.438
  177   1HD1  ILE  26          3HD1      ILE  26  -2.963  16.926   5.144
  178   2HD1  ILE  26          1HD1      ILE  26  -1.366  17.264   4.433
  179   3HD1  ILE  26          2HD1      ILE  26  -2.381  18.598   4.997
  180    H    ASN  27           H        ASN  27  -4.013  18.832   0.070
  181    HA   ASN  27           HA       ASN  27  -6.647  19.582   1.064
  182   1HB   ASN  27          1HB       ASN  27  -4.716  21.048   1.023
  183   2HB   ASN  27          2HB       ASN  27  -4.637  20.976  -0.754
  184   1HD2  ASN  27          2HD2      ASN  27  -6.252  24.139   0.359
  185   2HD2  ASN  27          1HD2      ASN  27  -4.712  23.329   0.683
  186    H    LEU  28           H        LEU  28  -5.140  19.226  -2.204
  187    HA   LEU  28           HA       LEU  28  -7.671  19.370  -3.594
  188   1HB   LEU  28          1HB       LEU  28  -4.804  18.758  -4.386
  189   2HB   LEU  28          2HB       LEU  28  -6.126  18.376  -5.476
  190    HG   LEU  28           HG       LEU  28  -6.926  20.688  -5.457
  191   1HD1  LEU  28          2HD1      LEU  28  -4.489  21.254  -3.716
  192   2HD1  LEU  28          3HD1      LEU  28  -5.456  22.490  -4.542
  193   3HD1  LEU  28          1HD1      LEU  28  -6.192  21.507  -3.276
  194   1HD2  LEU  28          3HD2      LEU  28  -5.354  19.924  -7.176
  195   2HD2  LEU  28          1HD2      LEU  28  -5.056  21.625  -6.777
  196   3HD2  LEU  28          2HD2      LEU  28  -3.978  20.362  -6.146
  197    H    GLU  29           H        GLU  29  -5.375  16.584  -3.128
  198    HA   GLU  29           HA       GLU  29  -7.712  14.764  -3.579
  199   1HB   GLU  29          1HB       GLU  29  -6.068  12.955  -3.841
  200   2HB   GLU  29          2HB       GLU  29  -6.036  14.197  -5.086
  201   1HG   GLU  29          1HG       GLU  29  -4.015  15.213  -3.974
  202   2HG   GLU  29          2HG       GLU  29  -3.971  13.786  -2.904
  203    HE2  GLU  29           HE2      GLU  29  -1.934  13.453  -6.048
  204    H    LYS  30           H        LYS  30  -7.219  12.697  -1.945
  205    HA   LYS  30           HA       LYS  30  -7.346  14.055   0.720
  206   1HB   LYS  30          1HB       LYS  30  -8.965  11.795  -0.453
  207   2HB   LYS  30          2HB       LYS  30  -8.984  12.193   1.271
  208   1HG   LYS  30          1HG       LYS  30  -9.575  14.248  -0.908
  209   2HG   LYS  30          2HG       LYS  30 -10.811  13.275  -0.130
  210   1HD   LYS  30          1HD       LYS  30 -10.852  14.481   1.738
  211   2HD   LYS  30          2HD       LYS  30  -9.115  14.570   1.917
  212   1HE   LYS  30          1HE       LYS  30 -10.721  16.306  -0.026
  213   2HE   LYS  30          2HE       LYS  30 -10.322  16.788   1.627
  214   1HZ   LYS  30          3HZ       LYS  30  -8.283  16.196  -0.431
  215   2HZ   LYS  30          1HZ       LYS  30  -8.787  17.678  -0.018
  216   3HZ   LYS  30          2HZ       LYS  30  -7.971  16.750   1.052
  217    H    ALA  31           H        ALA  31  -5.061  12.603  -0.739
  218    HA   ALA  31           HA       ALA  31  -4.073  10.489   0.747
  219   1HB   ALA  31          3HB       ALA  31  -2.912  11.630  -1.151
  220   2HB   ALA  31          1HB       ALA  31  -2.649  13.039  -0.099
  221   3HB   ALA  31          2HB       ALA  31  -1.849  11.502   0.277
  222    H    ARG  32           H        ARG  32  -2.609  10.440   2.609
  223    HA   ARG  32           HA       ARG  32  -3.658  12.208   4.747
  224   1HB   ARG  32          1HB       ARG  32  -2.064   9.642   4.914
  225   2HB   ARG  32          2HB       ARG  32  -2.801  10.515   6.263
  226   1HG   ARG  32          1HG       ARG  32  -4.324   9.209   3.939
  227   2HG   ARG  32          2HG       ARG  32  -4.085   8.538   5.546
  228   1HD   ARG  32          1HD       ARG  32  -6.283   9.406   5.541
  229   2HD   ARG  32          2HD       ARG  32  -5.288  10.480   6.535
  230    HE   ARG  32           HE       ARG  32  -5.869  11.144   3.645
  231   1HH1  ARG  32          1HH2      ARG  32  -6.845  11.837   6.945
  232   2HH1  ARG  32          2HH2      ARG  32  -7.066  13.540   6.683
  233   1HH2  ARG  32          2HH1      ARG  32  -5.846  13.365   3.339
  234   2HH2  ARG  32          1HH1      ARG  32  -6.589  14.438   4.503
  235    H    HIS  33           H        HIS  33  -0.405  11.039   3.704
  236    HA   HIS  33           HA       HIS  33   0.603  13.667   4.649
  237   1HB   HIS  33          2HB       HIS  33   2.844  12.629   4.904
  238   2HB   HIS  33          1HB       HIS  33   1.641  12.281   6.140
  239    HD1  HIS  33           HD1      HIS  33   0.241   9.841   5.477
  240    HD2  HIS  33           HD2      HIS  33   4.310  10.336   4.629
  241    HE1  HIS  33           HE1      HIS  33   1.237   7.529   5.246
  242    H    GLY  34           H        GLY  34   1.827  14.822   3.305
  243   1HA   GLY  34          1HA       GLY  34   2.623  13.721   0.704
  244   2HA   GLY  34          2HA       GLY  34   1.727  15.255   0.731
  245    H    SER  35           H        SER  35   4.608  14.857  -0.050
  246    HA   SER  35           HA       SER  35   5.905  16.845   1.568
  247   1HB   SER  35          1HB       SER  35   5.901  14.209   2.773
  248   2HB   SER  35          2HB       SER  35   7.499  14.434   2.082
  249    HG   SER  35           HG       SER  35   7.442  15.247   4.152
  250    H    CYS  36           H        CYS  36   6.913  17.744  -0.117
  251    HA   CYS  36           HA       CYS  36   7.697  16.229  -2.425
  252   1HB   CYS  36          1HB       CYS  36   7.104  18.597  -2.671
  253   2HB   CYS  36          2HB       CYS  36   8.392  19.058  -1.549
  254    H    ASN  37           H        ASN  37   9.709  15.686  -3.128
  255    HA   ASN  37           HA       ASN  37  11.898  15.534  -1.087
  256   1HB   ASN  37          1HB       ASN  37  10.693  13.392  -1.454
  257   2HB   ASN  37          2HB       ASN  37  11.021  13.506  -3.194
  258   1HD2  ASN  37          2HD2      ASN  37  14.389  12.387  -2.868
  259   2HD2  ASN  37          1HD2      ASN  37  13.334  13.297  -3.936
  260    H    TYR  38           H        TYR  38  14.012  15.690  -1.985
  261    HA   TYR  38           HA       TYR  38  14.142  17.006  -4.612
  262   1HB   TYR  38          1HB       TYR  38  15.485  17.983  -2.819
  263   2HB   TYR  38          2HB       TYR  38  16.411  16.491  -2.670
  264    HD1  TYR  38           HD2      TYR  38  15.226  18.736  -5.497
  265    HD2  TYR  38           HD1      TYR  38  18.587  16.726  -3.702
  266    HE1  TYR  38           HE2      TYR  38  16.450  18.868  -7.638
  267    HE2  TYR  38           HE1      TYR  38  19.789  16.826  -5.868
  268    HH   TYR  38           HH       TYR  38  18.190  17.982  -8.859
  269    H    VAL  39           H        VAL  39  16.947  15.221  -4.285
  270    HA   VAL  39           HA       VAL  39  17.867  13.611  -5.533
  271    HB   VAL  39           HB       VAL  39  15.077  12.352  -5.585
  272   1HG1  VAL  39          3HG1      VAL  39  17.695  11.215  -6.593
  273   2HG1  VAL  39          1HG1      VAL  39  16.209  10.294  -6.289
  274   3HG1  VAL  39          2HG1      VAL  39  16.219  11.531  -7.544
  275   1HG2  VAL  39          3HG2      VAL  39  16.309  12.523  -3.359
  276   2HG2  VAL  39          1HG2      VAL  39  15.988  10.870  -3.913
  277   3HG2  VAL  39          2HG2      VAL  39  17.609  11.572  -4.087
  278    H    PHE  40           H        PHE  40  18.155  13.085  -7.870
  279    HA   PHE  40           HA       PHE  40  17.699  15.393  -9.388
  280   1HB   PHE  40          1HB       PHE  40  18.760  14.246 -11.186
  281   2HB   PHE  40          2HB       PHE  40  19.500  13.647  -9.724
  282    HD1  PHE  40           HD1      PHE  40  19.017  11.285  -8.955
  283    HD2  PHE  40           HD2      PHE  40  17.413  12.857 -12.647
  284    HE1  PHE  40           HE1      PHE  40  18.287   9.015  -9.616
  285    HE2  PHE  40           HE2      PHE  40  16.703  10.580 -13.300
  286    HZ   PHE  40           HZ       PHE  40  17.121   8.660 -11.782
  287    HA   PRO  41           HA       PRO  41  17.456  15.993 -11.610
  288   1HB   PRO  41          1HB       PRO  41  15.887  17.353 -13.325
  289   2HB   PRO  41          2HB       PRO  41  16.502  15.713 -13.678
  290   1HG   PRO  41          1HG       PRO  41  13.733  16.470 -12.747
  291   2HG   PRO  41          2HG       PRO  41  14.210  15.293 -13.992
  292   1HD   PRO  41          1HD       PRO  41  13.612  14.603 -11.351
  293   2HD   PRO  41          2HD       PRO  41  14.677  13.647 -12.411
  294    H    ALA  42           H        ALA  42  14.062  16.851 -10.797
  295    HA   ALA  42           HA       ALA  42  14.985  19.294  -9.351
  296   1HB   ALA  42          2HB       ALA  42  13.946  19.738 -11.563
  297   2HB   ALA  42          3HB       ALA  42  12.473  18.907 -11.016
  298   3HB   ALA  42          1HB       ALA  42  13.010  20.402 -10.218
  299    H    HIS  43           H        HIS  43  13.008  20.132  -8.028
  300    HA   HIS  43           HA       HIS  43  12.584  18.305  -5.874
  301   1HB   HIS  43          2HB       HIS  43  11.102  20.889  -6.424
  302   2HB   HIS  43          1HB       HIS  43  11.324  20.084  -4.876
  303    HD1  HIS  43           HD1      HIS  43  12.093  22.393  -3.927
  304    HD2  HIS  43           HD2      HIS  43  14.682  20.713  -6.789
  305    HE1  HIS  43           HE1      HIS  43  14.311  23.576  -3.748
  306    H    LYS  44           H        LYS  44  11.084  16.703  -5.831
  307    HA   LYS  44           HA       LYS  44   8.817  16.687  -7.806
  308   1HB   LYS  44          1HB       LYS  44  10.323  14.525  -6.325
  309   2HB   LYS  44          2HB       LYS  44   8.820  14.213  -7.190
  310   1HG   LYS  44          1HG       LYS  44   9.685  14.686  -9.292
  311   2HG   LYS  44          2HG       LYS  44  11.114  15.497  -8.680
  312   1HD   LYS  44          1HD       LYS  44  10.455  12.527  -8.243
  313   2HD   LYS  44          2HD       LYS  44  11.477  13.101  -9.560
  314   1HE   LYS  44          1HE       LYS  44  12.071  13.328  -6.564
  315   2HE   LYS  44          2HE       LYS  44  12.866  12.272  -7.719
  316   1HZ   LYS  44          1HZ       LYS  44  12.980  15.222  -7.992
  317   2HZ   LYS  44          2HZ       LYS  44  14.041  14.373  -7.128
  318   3HZ   LYS  44          3HZ       LYS  44  13.918  14.063  -8.716
  319    H    CYS  45           H        CYS  45   6.788  16.920  -6.991
  320    HA   CYS  45           HA       CYS  45   6.358  16.916  -4.099
  321   1HB   CYS  45          1HB       CYS  45   5.131  18.544  -5.447
  322   2HB   CYS  45          2HB       CYS  45   4.398  17.256  -6.392
  323    H    ILE  46           H        ILE  46   7.087  14.730  -3.734
  324    HA   ILE  46           HA       ILE  46   5.444  12.523  -4.750
  325    HB   ILE  46           HB       ILE  46   7.435  12.592  -2.460
  326   1HG1  ILE  46          1HG1      ILE  46   8.728  13.159  -4.393
  327   2HG1  ILE  46          2HG1      ILE  46   9.015  11.470  -4.019
  328   1HG2  ILE  46          3HG2      ILE  46   6.204  10.254  -3.986
  329   2HG2  ILE  46          1HG2      ILE  46   7.530  10.118  -2.813
  330   3HG2  ILE  46          2HG2      ILE  46   5.937  10.665  -2.290
  331   1HD1  ILE  46          3HD1      ILE  46   7.394  10.813  -5.829
  332   2HD1  ILE  46          1HD1      ILE  46   7.221  12.539  -6.236
  333   3HD1  ILE  46          2HD1      ILE  46   8.787  11.733  -6.412
  334    H    CYS  47           H        CYS  47   3.713  11.579  -3.706
  335    HA   CYS  47           HA       CYS  47   2.981  12.644  -1.035
  336   1HB   CYS  47          1HB       CYS  47   1.749  13.900  -2.773
  337   2HB   CYS  47          2HB       CYS  47   1.034  12.413  -3.344
  338    H    TYR  48           H        TYR  48   1.969  11.189   0.394
  339    HA   TYR  48           HA       TYR  48   2.474   8.356  -0.418
  340   1HB   TYR  48          1HB       TYR  48   2.790   9.558   2.308
  341   2HB   TYR  48          2HB       TYR  48   3.441   8.037   1.708
  342    HD1  TYR  48           HD1      TYR  48   3.717  11.755   1.595
  343    HD2  TYR  48           HD2      TYR  48   5.726   8.029   0.849
  344    HE1  TYR  48           HE1      TYR  48   5.670  12.978   0.717
  345    HE2  TYR  48           HE2      TYR  48   7.755   9.276   0.132
  346    HH   TYR  48           HH       TYR  48   7.752  12.854  -0.198
  347    H    PHE  49           H        PHE  49   0.551   7.207  -0.508
  348    HA   PHE  49           HA       PHE  49  -1.241   7.330   1.768
  349   1HB   PHE  49          1HB       PHE  49  -3.243   7.821   0.283
  350   2HB   PHE  49          2HB       PHE  49  -2.194   9.151   0.729
  351    HD1  PHE  49           HD2      PHE  49  -0.393   9.919  -0.994
  352    HD2  PHE  49           HD1      PHE  49  -4.043   7.827  -1.946
  353    HE1  PHE  49           HE2      PHE  49  -0.345  10.860  -3.231
  354    HE2  PHE  49           HE1      PHE  49  -4.093   8.998  -4.134
  355    HZ   PHE  49           HZ       PHE  49  -2.202  10.561  -4.756
  356    HA   PRO  50           HA       PRO  50  -1.985   3.134   0.788
  357   1HB   PRO  50          1HB       PRO  50  -4.949   3.745   0.735
  358   2HB   PRO  50          2HB       PRO  50  -4.110   2.390   1.546
  359   1HG   PRO  50          1HG       PRO  50  -4.878   4.522   3.013
  360   2HG   PRO  50          2HG       PRO  50  -3.219   3.886   3.225
  361   1HD   PRO  50          1HD       PRO  50  -4.118   6.221   1.529
  362   2HD   PRO  50          2HD       PRO  50  -2.783   6.167   2.710
  363    H    CYS  51           H        CYS  51  -2.569   1.690  -0.985
  364    HA   CYS  51           HA       CYS  51  -2.448   3.097  -3.494
  365   1HB   CYS  51          1HB       CYS  51  -1.506   0.677  -2.678
  366   2HB   CYS  51          2HB       CYS  51  -2.907   0.173  -3.623
   
  No H/Q in entry =         366
  Start of MODEL   16
    1    HA   PCA   1           HA       PYR   1  -2.001  -0.002   4.976
    2   1HB   PCA   1          1HB       PYR   1   0.095  -1.274   6.335
    3   2HB   PCA   1          2HB       PYR   1  -1.531  -1.962   6.105
    4   1HG   PCA   1          1HG       PYR   1   0.968  -2.767   4.709
    5   2HG   PCA   1          2HG       PYR   1  -0.584  -3.636   4.880
    6    HN   PCA   1           HN       PYR   1  -1.588  -0.593   2.547
    7    H    LYS   2           H        LYS   2   1.437  -0.797   4.475
    8    HA   LYS   2           HA       LYS   2   2.611   1.703   4.727
    9   1HB   LYS   2          1HB       LYS   2   4.468   0.768   3.350
   10   2HB   LYS   2          2HB       LYS   2   3.898  -0.320   4.612
   11   1HG   LYS   2          1HG       LYS   2   4.159  -1.778   2.868
   12   2HG   LYS   2          2HG       LYS   2   2.447  -1.429   2.768
   13   1HD   LYS   2          1HD       LYS   2   3.535   0.487   1.028
   14   2HD   LYS   2          2HD       LYS   2   4.721  -0.788   0.922
   15   1HE   LYS   2          1HE       LYS   2   2.973  -0.946  -0.821
   16   2HE   LYS   2          2HE       LYS   2   3.022  -2.406   0.179
   17   1HZ   LYS   2          1HZ       LYS   2   1.178  -0.247   0.869
   18   2HZ   LYS   2          2HZ       LYS   2   0.748  -1.244  -0.344
   19   3HZ   LYS   2          3HZ       LYS   2   1.002  -1.859   1.141
   20    H    LEU   3           H        LEU   3   3.038   3.424   3.319
   21    HA   LEU   3           HA       LEU   3   0.906   3.705   1.396
   22   1HB   LEU   3          1HB       LEU   3   2.956   5.769   2.209
   23   2HB   LEU   3          2HB       LEU   3   1.447   6.039   1.342
   24    HG   LEU   3           HG       LEU   3   0.476   4.824   3.605
   25   1HD1  LEU   3          3HD1      LEU   3   2.869   6.497   4.507
   26   2HD1  LEU   3          1HD1      LEU   3   1.595   5.851   5.558
   27   3HD1  LEU   3          2HD1      LEU   3   2.698   4.746   4.733
   28   1HD2  LEU   3          2HD2      LEU   3  -0.292   6.975   2.586
   29   2HD2  LEU   3          3HD2      LEU   3  -0.196   7.035   4.352
   30   3HD2  LEU   3          1HD2      LEU   3   1.066   7.805   3.377
   31    H    CYS   4           H        CYS   4   1.127   4.484  -0.757
   32    HA   CYS   4           HA       CYS   4   3.624   3.597  -2.134
   33   1HB   CYS   4          1HB       CYS   4   0.749   3.842  -3.064
   34   2HB   CYS   4          2HB       CYS   4   2.116   3.867  -4.195
   35    H    GLU   5           H        GLU   5   4.959   5.083  -2.764
   36    HA   GLU   5           HA       GLU   5   4.451   7.904  -2.350
   37   1HB   GLU   5          1HB       GLU   5   6.877   6.302  -3.322
   38   2HB   GLU   5          2HB       GLU   5   6.874   8.029  -2.990
   39   1HG   GLU   5          1HG       GLU   5   7.766   6.962  -1.049
   40   2HG   GLU   5          2HG       GLU   5   6.149   7.563  -0.652
   41    HE2  GLU   5           HE2      GLU   5   5.431   4.485   0.652
   42    H    ARG   6           H        ARG   6   2.931   8.446  -3.926
   43    HA   ARG   6           HA       ARG   6   3.193   7.947  -6.751
   44   1HB   ARG   6          1HB       ARG   6   1.076   8.473  -5.771
   45   2HB   ARG   6          2HB       ARG   6   1.655  10.023  -5.170
   46   1HG   ARG   6          1HG       ARG   6   2.109   9.907  -8.051
   47   2HG   ARG   6          2HG       ARG   6   0.467   9.426  -7.691
   48   1HD   ARG   6          1HD       ARG   6   0.404  11.736  -8.034
   49   2HD   ARG   6          2HD       ARG   6   0.175  11.510  -6.302
   50    HE   ARG   6           HE       ARG   6   2.970  11.974  -6.781
   51   1HH1  ARG   6          2HH2      ARG   6  -0.122  13.678  -6.732
   52   2HH1  ARG   6          1HH2      ARG   6   0.532  15.259  -6.919
   53   1HH2  ARG   6          1HH1      ARG   6   3.936  14.059  -6.829
   54   2HH2  ARG   6          2HH1      ARG   6   3.002  15.471  -7.133
   55    HA   PRO   7           HA       PRO   7   6.449  11.104  -6.905
   56   1HB   PRO   7          1HB       PRO   7   7.515  10.560  -9.379
   57   2HB   PRO   7          2HB       PRO   7   7.712   9.484  -7.982
   58   1HG   PRO   7          1HG       PRO   7   5.730   9.164 -10.251
   59   2HG   PRO   7          2HG       PRO   7   6.781   7.944  -9.497
   60   1HD   PRO   7          1HD       PRO   7   4.119   8.382  -8.822
   61   2HD   PRO   7          2HD       PRO   7   5.331   7.657  -7.732
   62    H    SER   8           H        SER   8   5.569  11.099 -10.363
   63    HA   SER   8           HA       SER   8   4.542  13.830 -10.196
   64   1HB   SER   8          1HB       SER   8   4.620  11.791 -12.458
   65   2HB   SER   8          2HB       SER   8   4.091  13.461 -12.630
   66    HG   SER   8           HG       SER   8   6.268  13.142 -13.233
   67    H    GLY   9           H        GLY   9   2.365  14.368 -11.091
   68   1HA   GLY   9          1HA       GLY   9   0.311  12.731 -11.725
   69   2HA   GLY   9          2HA       GLY   9   0.182  12.765  -9.959
   70    H    THR  10           H        THR  10  -0.065  14.856  -8.890
   71    HA   THR  10           HA       THR  10  -1.351  16.974 -10.523
   72    HB   THR  10           HB       THR  10  -1.480  18.105  -8.238
   73    HG1  THR  10           HG1      THR  10  -1.321  16.448  -6.494
   74   1HG2  THR  10          1HG2      THR  10  -3.399  16.913  -9.160
   75   2HG2  THR  10          2HG2      THR  10  -2.850  15.412  -8.359
   76   3HG2  THR  10          3HG2      THR  10  -3.321  16.836  -7.395
   77    H    TRP  11           H        TRP  11   0.694  17.634  -7.805
   78    HA   TRP  11           HA       TRP  11   2.379  19.432  -9.284
   79   1HB   TRP  11          1HB       TRP  11   1.689  19.520  -6.854
   80   2HB   TRP  11          2HB       TRP  11   2.891  18.288  -6.517
   81    HD1  TRP  11           HD1      TRP  11   4.959  19.928  -8.773
   82    HE1  TRP  11           HE1      TRP  11   6.071  22.097  -7.945
   83    HE3  TRP  11           HE3      TRP  11   2.065  20.796  -4.684
   84    HZ2  TRP  11           HZ2      TRP  11   5.685  24.001  -5.833
   85    HZ3  TRP  11           HZ3      TRP  11   2.453  22.795  -3.268
   86    HH2  TRP  11           HH2      TRP  11   4.371  24.266  -3.716
   87    H    SER  12           H        SER  12   3.503  18.467 -10.828
   88    HA   SER  12           HA       SER  12   5.138  16.036 -10.298
   89   1HB   SER  12          1HB       SER  12   4.158  17.250 -12.918
   90   2HB   SER  12          2HB       SER  12   4.951  15.684 -12.693
   91    HG   SER  12           HG       SER  12   2.396  16.541 -11.726
   92    H    GLY  13           H        GLY  13   5.360  19.420 -11.210
   93   1HA   GLY  13          1HA       GLY  13   8.087  19.268 -12.238
   94   2HA   GLY  13          2HA       GLY  13   7.087  20.704 -11.991
   95    H    VAL  14           H        VAL  14   8.995  21.708 -11.108
   96    HA   VAL  14           HA       VAL  14  10.486  20.848  -8.902
   97    HB   VAL  14           HB       VAL  14   9.739  23.639  -9.747
   98   1HG1  VAL  14          2HG1      VAL  14  11.924  22.718  -7.853
   99   2HG1  VAL  14          3HG1      VAL  14  11.843  24.336  -8.575
  100   3HG1  VAL  14          1HG1      VAL  14  10.561  23.797  -7.492
  101   1HG2  VAL  14          1HG2      VAL  14  10.955  22.361 -11.527
  102   2HG2  VAL  14          2HG2      VAL  14  11.969  23.643 -10.861
  103   3HG2  VAL  14          3HG2      VAL  14  12.227  21.964 -10.351
  104    H    CYS  15           H        CYS  15   9.985  20.670  -6.836
  105    HA   CYS  15           HA       CYS  15   7.280  21.060  -5.900
  106   1HB   CYS  15          1HB       CYS  15   7.804  19.810  -4.083
  107   2HB   CYS  15          2HB       CYS  15   9.045  19.259  -5.205
  108    H    GLY  16           H        GLY  16  10.330  22.810  -5.379
  109   1HA   GLY  16          1HA       GLY  16  10.751  24.866  -4.463
  110   2HA   GLY  16          2HA       GLY  16   9.015  25.176  -4.422
  111    H    ASN  17           H        ASN  17   8.350  22.910  -2.617
  112    HA   ASN  17           HA       ASN  17   9.660  23.419  -0.083
  113   1HB   ASN  17          1HB       ASN  17   8.613  25.625  -0.353
  114   2HB   ASN  17          2HB       ASN  17   7.062  24.864  -0.738
  115   1HD2  ASN  17          2HD2      ASN  17   8.375  24.982   3.174
  116   2HD2  ASN  17          1HD2      ASN  17   9.512  25.242   1.865
  117    H    ASN  18           H        ASN  18   9.218  21.788   1.257
  118    HA   ASN  18           HA       ASN  18   7.723  19.556   0.775
  119   1HB   ASN  18          1HB       ASN  18   9.473  19.916   2.544
  120   2HB   ASN  18          2HB       ASN  18   8.320  20.822   3.503
  121   1HD2  ASN  18          2HD2      ASN  18   7.995  16.758   3.313
  122   2HD2  ASN  18          1HD2      ASN  18   9.318  17.592   2.507
  123    H    ASN  19           H        ASN  19   6.806  22.145   2.949
  124    HA   ASN  19           HA       ASN  19   4.315  21.095   3.721
  125   1HB   ASN  19          1HB       ASN  19   5.438  22.787   5.038
  126   2HB   ASN  19          2HB       ASN  19   5.175  24.009   3.784
  127   1HD2  ASN  19          2HD2      ASN  19   1.859  24.691   4.813
  128   2HD2  ASN  19          1HD2      ASN  19   3.193  25.119   3.757
  129    H    ALA  20           H        ALA  20   4.918  23.602   1.176
  130    HA   ALA  20           HA       ALA  20   2.166  23.885   0.429
  131   1HB   ALA  20          3HB       ALA  20   3.913  25.402  -0.452
  132   2HB   ALA  20          1HB       ALA  20   4.611  24.050  -1.384
  133   3HB   ALA  20          2HB       ALA  20   2.977  24.640  -1.748
  134    H    CYS  21           H        CYS  21   4.758  21.697  -0.808
  135    HA   CYS  21           HA       CYS  21   3.246  20.274  -2.644
  136   1HB   CYS  21          1HB       CYS  21   5.490  19.709  -2.669
  137   2HB   CYS  21          2HB       CYS  21   5.602  19.542  -0.925
  138    H    LYS  22           H        LYS  22   3.691  19.564   0.810
  139    HA   LYS  22           HA       LYS  22   2.153  17.275   1.138
  140   1HB   LYS  22          1HB       LYS  22   3.672  18.302   2.769
  141   2HB   LYS  22          2HB       LYS  22   2.572  19.625   3.044
  142   1HG   LYS  22          1HG       LYS  22   0.907  18.338   4.031
  143   2HG   LYS  22          2HG       LYS  22   1.643  16.809   3.610
  144   1HD   LYS  22          1HD       LYS  22   2.968  18.916   5.427
  145   2HD   LYS  22          2HD       LYS  22   1.843  17.714   6.039
  146   1HE   LYS  22          1HE       LYS  22   4.092  16.978   6.512
  147   2HE   LYS  22          2HE       LYS  22   3.311  15.869   5.376
  148   1HZ   LYS  22          3HZ       LYS  22   5.307  17.938   4.607
  149   2HZ   LYS  22          1HZ       LYS  22   5.571  16.316   4.661
  150   3HZ   LYS  22          2HZ       LYS  22   4.517  16.880   3.618
  151    H    ASN  23           H        ASN  23   1.138  20.665   1.616
  152    HA   ASN  23           HA       ASN  23  -1.552  20.100   2.173
  153   1HB   ASN  23          1HB       ASN  23  -0.507  22.290   2.554
  154   2HB   ASN  23          2HB       ASN  23  -0.311  22.559   0.822
  155   1HD2  ASN  23          2HD2      ASN  23  -3.440  24.234   2.329
  156   2HD2  ASN  23          1HD2      ASN  23  -1.823  24.065   2.988
  157    H    GLN  24           H        GLN  24  -0.148  21.222  -0.983
  158    HA   GLN  24           HA       GLN  24  -2.550  20.986  -2.409
  159   1HB   GLN  24          1HB       GLN  24   0.322  20.830  -3.326
  160   2HB   GLN  24          2HB       GLN  24  -1.075  20.775  -4.430
  161   1HG   GLN  24          1HG       GLN  24  -1.886  22.948  -3.512
  162   2HG   GLN  24          2HG       GLN  24  -0.474  23.027  -2.449
  163   1HE2  GLN  24          2HE2      GLN  24   0.682  23.220  -6.373
  164   2HE2  GLN  24          1HE2      GLN  24  -0.108  21.776  -5.763
  165    H    CYS  25           H        CYS  25  -0.042  18.503  -1.875
  166    HA   CYS  25           HA       CYS  25  -1.052  16.418  -3.446
  167   1HB   CYS  25          1HB       CYS  25   0.989  16.030  -2.457
  168   2HB   CYS  25          2HB       CYS  25   0.447  16.524  -0.861
  169    H    ILE  26           H        ILE  26  -1.742  16.858   0.090
  170    HA   ILE  26           HA       ILE  26  -3.843  14.852  -0.089
  171    HB   ILE  26           HB       ILE  26  -4.055  15.056   2.254
  172   1HG1  ILE  26          1HG1      ILE  26  -2.578  17.701   2.043
  173   2HG1  ILE  26          2HG1      ILE  26  -4.229  17.413   2.608
  174   1HG2  ILE  26          1HG2      ILE  26  -1.971  14.014   1.282
  175   2HG2  ILE  26          2HG2      ILE  26  -1.106  15.520   1.648
  176   3HG2  ILE  26          3HG2      ILE  26  -1.819  14.563   2.953
  177   1HD1  ILE  26          3HD1      ILE  26  -3.281  16.063   4.514
  178   2HD1  ILE  26          1HD1      ILE  26  -1.657  16.593   4.007
  179   3HD1  ILE  26          2HD1      ILE  26  -2.851  17.787   4.530
  180    H    ASN  27           H        ASN  27  -3.796  18.179  -0.654
  181    HA   ASN  27           HA       ASN  27  -6.591  18.718  -0.009
  182   1HB   ASN  27          1HB       ASN  27  -4.781  20.303   0.293
  183   2HB   ASN  27          2HB       ASN  27  -4.471  20.334  -1.460
  184   1HD2  ASN  27          2HD2      ASN  27  -6.440  23.329  -0.549
  185   2HD2  ASN  27          1HD2      ASN  27  -4.876  22.638  -0.092
  186    H    LEU  28           H        LEU  28  -4.666  18.735  -3.111
  187    HA   LEU  28           HA       LEU  28  -7.041  18.865  -4.725
  188   1HB   LEU  28          1HB       LEU  28  -4.105  18.381  -5.327
  189   2HB   LEU  28          2HB       LEU  28  -5.350  18.180  -6.546
  190    HG   LEU  28           HG       LEU  28  -6.097  20.464  -6.356
  191   1HD1  LEU  28          2HD1      LEU  28  -3.901  20.830  -4.280
  192   2HD1  LEU  28          3HD1      LEU  28  -4.804  22.143  -5.054
  193   3HD1  LEU  28          1HD1      LEU  28  -5.651  21.005  -4.004
  194   1HD2  LEU  28          1HD2      LEU  28  -4.263  19.883  -7.910
  195   2HD2  LEU  28          2HD2      LEU  28  -4.093  21.540  -7.305
  196   3HD2  LEU  28          3HD2      LEU  28  -3.069  20.247  -6.644
  197    H    GLU  29           H        GLU  29  -4.875  16.158  -3.769
  198    HA   GLU  29           HA       GLU  29  -6.986  14.306  -4.812
  199   1HB   GLU  29          1HB       GLU  29  -5.469  12.515  -4.967
  200   2HB   GLU  29          2HB       GLU  29  -5.029  13.789  -6.084
  201   1HG   GLU  29          1HG       GLU  29  -3.543  13.653  -3.452
  202   2HG   GLU  29          2HG       GLU  29  -3.287  12.395  -4.648
  203    HE1  GLU  29           HE2      GLU  29  -3.056  15.835  -4.303
  204    H    LYS  30           H        LYS  30  -6.861  12.242  -3.216
  205    HA   LYS  30           HA       LYS  30  -7.251  13.484  -0.534
  206   1HB   LYS  30          1HB       LYS  30  -8.627  11.199  -1.943
  207   2HB   LYS  30          2HB       LYS  30  -8.812  11.487  -0.207
  208   1HG   LYS  30          1HG       LYS  30  -9.343  13.629  -2.318
  209   2HG   LYS  30          2HG       LYS  30 -10.574  12.562  -1.662
  210   1HD   LYS  30          1HD       LYS  30 -10.857  13.779   0.159
  211   2HD   LYS  30          2HD       LYS  30  -9.166  13.739   0.603
  212   1HE   LYS  30          1HE       LYS  30 -10.378  15.687  -1.427
  213   2HE   LYS  30          2HE       LYS  30 -10.200  16.045   0.292
  214   1HZ   LYS  30          2HZ       LYS  30  -7.898  15.460  -1.475
  215   2HZ   LYS  30          3HZ       LYS  30  -8.419  16.938  -1.098
  216   3HZ   LYS  30          1HZ       LYS  30  -7.798  15.962   0.056
  217    H    ALA  31           H        ALA  31  -4.776  12.230  -1.796
  218    HA   ALA  31           HA       ALA  31  -3.683  10.135  -0.434
  219   1HB   ALA  31          2HB       ALA  31  -2.592  11.643  -2.075
  220   2HB   ALA  31          3HB       ALA  31  -2.552  12.923  -0.853
  221   3HB   ALA  31          1HB       ALA  31  -1.576  11.455  -0.621
  222    H    ARG  32           H        ARG  32  -2.227  10.074   1.430
  223    HA   ARG  32           HA       ARG  32  -3.566  11.325   3.804
  224   1HB   ARG  32          1HB       ARG  32  -2.105   8.751   3.247
  225   2HB   ARG  32          2HB       ARG  32  -1.976   9.453   4.849
  226   1HG   ARG  32          1HG       ARG  32  -3.717   7.758   4.700
  227   2HG   ARG  32          2HG       ARG  32  -4.263   9.310   5.314
  228   1HD   ARG  32          1HD       ARG  32  -4.762   8.271   2.482
  229   2HD   ARG  32          2HD       ARG  32  -5.906   8.101   3.805
  230    HE   ARG  32           HE       ARG  32  -5.620  10.306   2.067
  231   1HH1  ARG  32          1HH1      ARG  32  -6.499   9.641   5.388
  232   2HH1  ARG  32          2HH1      ARG  32  -7.044  11.258   5.725
  233   1HH2  ARG  32          2HH2      ARG  32  -5.921  12.435   2.542
  234   2HH2  ARG  32          1HH2      ARG  32  -6.794  12.929   3.980
  235    H    HIS  33           H        HIS  33  -0.267  10.644   2.555
  236    HA   HIS  33           HA       HIS  33   0.561  13.146   3.975
  237   1HB   HIS  33          2HB       HIS  33   2.268  10.667   3.567
  238   2HB   HIS  33          1HB       HIS  33   2.878  12.257   4.016
  239    HD1  HIS  33           HD1      HIS  33  -0.268  11.942   5.763
  240    HD2  HIS  33           HD2      HIS  33   3.642  10.524   6.322
  241    HE1  HIS  33           HE1      HIS  33  -0.106  11.121   8.156
  242    H    GLY  34           H        GLY  34   2.341  14.241   2.895
  243   1HA   GLY  34          1HA       GLY  34   3.031  13.660   0.207
  244   2HA   GLY  34          2HA       GLY  34   2.026  15.100   0.276
  245    H    SER  35           H        SER  35   5.010  14.799  -0.229
  246    HA   SER  35           HA       SER  35   6.104  16.788   1.567
  247   1HB   SER  35          1HB       SER  35   6.414  13.868   2.240
  248   2HB   SER  35          2HB       SER  35   7.938  14.726   2.086
  249    HG   SER  35           HG       SER  35   7.099  14.753   4.200
  250    H    CYS  36           H        CYS  36   8.157  17.429   0.748
  251    HA   CYS  36           HA       CYS  36   8.521  16.674  -2.076
  252   1HB   CYS  36          1HB       CYS  36   8.464  19.018  -1.536
  253   2HB   CYS  36          2HB       CYS  36   9.810  18.836  -0.390
  254    H    ASN  37           H        ASN  37  10.339  15.655  -2.898
  255    HA   ASN  37           HA       ASN  37  12.639  15.071  -1.092
  256   1HB   ASN  37          1HB       ASN  37  11.424  12.959  -1.107
  257   2HB   ASN  37          2HB       ASN  37  11.157  13.081  -2.859
  258   1HD2  ASN  37          2HD2      ASN  37  14.179  11.467  -3.632
  259   2HD2  ASN  37          1HD2      ASN  37  12.469  11.657  -3.975
  260    H    TYR  38           H        TYR  38  14.646  14.720  -2.398
  261    HA   TYR  38           HA       TYR  38  14.587  16.340  -4.861
  262   1HB   TYR  38          1HB       TYR  38  16.471  16.564  -3.279
  263   2HB   TYR  38          2HB       TYR  38  16.953  14.907  -3.653
  264    HD1  TYR  38           HD1      TYR  38  16.515  18.339  -5.014
  265    HD2  TYR  38           HD2      TYR  38  17.915  14.356  -5.874
  266    HE1  TYR  38           HE1      TYR  38  17.314  19.105  -7.219
  267    HE2  TYR  38           HE2      TYR  38  18.664  15.113  -8.114
  268    HH   TYR  38           HH       TYR  38  18.188  18.455  -9.277
  269    H    VAL  39           H        VAL  39  13.711  15.378  -6.582
  270    HA   VAL  39           HA       VAL  39  15.105  13.290  -7.861
  271    HB   VAL  39           HB       VAL  39  13.817  11.819  -6.447
  272   1HG1  VAL  39          2HG1      VAL  39  11.939  13.265  -5.813
  273   2HG1  VAL  39          3HG1      VAL  39  11.322  13.163  -7.476
  274   3HG1  VAL  39          1HG1      VAL  39  11.375  11.713  -6.460
  275   1HG2  VAL  39          1HG2      VAL  39  14.144  11.175  -8.859
  276   2HG2  VAL  39          2HG2      VAL  39  12.841  10.358  -7.982
  277   3HG2  VAL  39          3HG2      VAL  39  12.439  11.640  -9.124
  278    H    PHE  40           H        PHE  40  13.650  12.945 -10.081
  279    HA   PHE  40           HA       PHE  40  14.066  15.314 -11.291
  280   1HB   PHE  40          1HB       PHE  40  13.450  14.378 -13.269
  281   2HB   PHE  40          2HB       PHE  40  13.751  12.951 -12.311
  282    HD1  PHE  40           HD1      PHE  40  11.736  11.626 -11.420
  283    HD2  PHE  40           HD2      PHE  40  11.308  14.905 -14.196
  284    HE1  PHE  40           HE1      PHE  40   9.480  10.815 -12.043
  285    HE2  PHE  40           HE2      PHE  40   9.065  14.083 -14.822
  286    HZ   PHE  40           HZ       PHE  40   8.173  11.994 -13.791
  287    HA   PRO  41           HA       PRO  41  13.503  16.780 -12.958
  288   1HB   PRO  41          1HB       PRO  41  13.133  19.440 -13.223
  289   2HB   PRO  41          2HB       PRO  41  12.026  18.226 -13.940
  290   1HG   PRO  41          1HG       PRO  41  11.623  19.758 -11.356
  291   2HG   PRO  41          2HG       PRO  41  10.477  19.539 -12.702
  292   1HD   PRO  41          1HD       PRO  41  10.467  17.921 -10.459
  293   2HD   PRO  41          2HD       PRO  41  10.020  17.312 -12.075
  294    H    ALA  42           H        ALA  42  12.852  18.760 -10.028
  295    HA   ALA  42           HA       ALA  42  15.451  18.329  -8.924
  296   1HB   ALA  42          2HB       ALA  42  14.900  21.080 -10.143
  297   2HB   ALA  42          3HB       ALA  42  16.199  20.723  -8.987
  298   3HB   ALA  42          1HB       ALA  42  16.210  19.969 -10.591
  299    H    HIS  43           H        HIS  43  14.379  17.837  -7.081
  300    HA   HIS  43           HA       HIS  43  13.225  18.058  -5.123
  301   1HB   HIS  43          2HB       HIS  43  12.479  20.920  -5.738
  302   2HB   HIS  43          1HB       HIS  43  12.484  20.106  -4.203
  303    HD1  HIS  43           HD1      HIS  43  14.684  19.766  -2.904
  304    HD2  HIS  43           HD2      HIS  43  15.120  21.846  -6.521
  305    HE1  HIS  43           HE1      HIS  43  17.011  20.781  -2.921
  306    H    LYS  44           H        LYS  44  11.391  16.867  -5.211
  307    HA   LYS  44           HA       LYS  44   9.245  17.602  -7.155
  308   1HB   LYS  44          1HB       LYS  44  10.857  15.726  -7.877
  309   2HB   LYS  44          2HB       LYS  44  10.061  14.818  -6.574
  310   1HG   LYS  44          1HG       LYS  44   7.817  15.463  -7.723
  311   2HG   LYS  44          2HG       LYS  44   8.833  16.056  -9.052
  312   1HD   LYS  44          1HD       LYS  44   9.872  13.651  -9.043
  313   2HD   LYS  44          2HD       LYS  44   8.594  13.229  -7.904
  314   1HE   LYS  44          1HE       LYS  44   7.912  12.600 -10.146
  315   2HE   LYS  44          2HE       LYS  44   6.894  13.953  -9.610
  316   1HZ   LYS  44          1HZ       LYS  44   9.292  14.264 -11.305
  317   2HZ   LYS  44          2HZ       LYS  44   7.720  14.048 -11.867
  318   3HZ   LYS  44          3HZ       LYS  44   8.135  15.387 -11.001
  319    H    CYS  45           H        CYS  45   7.224  17.406  -6.391
  320    HA   CYS  45           HA       CYS  45   6.804  16.900  -3.586
  321   1HB   CYS  45          1HB       CYS  45   5.500  18.585  -4.825
  322   2HB   CYS  45          2HB       CYS  45   4.859  17.320  -5.884
  323    H    ILE  46           H        ILE  46   6.840  14.832  -2.797
  324    HA   ILE  46           HA       ILE  46   5.780  12.589  -4.429
  325    HB   ILE  46           HB       ILE  46   6.989  12.590  -1.637
  326   1HG1  ILE  46          1HG1      ILE  46   8.729  13.323  -3.126
  327   2HG1  ILE  46          2HG1      ILE  46   9.018  11.650  -2.654
  328   1HG2  ILE  46          1HG2      ILE  46   6.331  10.327  -3.558
  329   2HG2  ILE  46          2HG2      ILE  46   7.234  10.165  -2.030
  330   3HG2  ILE  46          3HG2      ILE  46   5.544  10.673  -2.013
  331   1HD1  ILE  46          2HD1      ILE  46   8.118  10.884  -4.862
  332   2HD1  ILE  46          3HD1      ILE  46   7.890  12.586  -5.333
  333   3HD1  ILE  46          1HD1      ILE  46   9.511  11.963  -5.013
  334    H    CYS  47           H        CYS  47   3.816  11.701  -3.950
  335    HA   CYS  47           HA       CYS  47   2.256  12.859  -1.662
  336   1HB   CYS  47          1HB       CYS  47   1.662  13.728  -3.971
  337   2HB   CYS  47          2HB       CYS  47   1.176  12.081  -4.346
  338    H    TYR  48           H        TYR  48   1.117  11.273  -0.418
  339    HA   TYR  48           HA       TYR  48   1.968   8.456  -1.017
  340   1HB   TYR  48          1HB       TYR  48   1.731   9.882   1.622
  341   2HB   TYR  48          2HB       TYR  48   2.165   8.201   1.387
  342    HD1  TYR  48           HD2      TYR  48   3.339  11.607   0.336
  343    HD2  TYR  48           HD1      TYR  48   4.424   7.670   1.666
  344    HE1  TYR  48           HE2      TYR  48   5.697  12.325   0.488
  345    HE2  TYR  48           HE1      TYR  48   6.762   8.407   1.923
  346    HH   TYR  48           HH       TYR  48   8.272  10.143   1.653
  347    H    PHE  49           H        PHE  49   0.212   7.157  -1.405
  348    HA   PHE  49           HA       PHE  49  -2.278   7.646   0.138
  349   1HB   PHE  49          1HB       PHE  49  -2.388   5.663  -2.015
  350   2HB   PHE  49          2HB       PHE  49  -3.482   6.946  -1.585
  351    HD1  PHE  49           HD1      PHE  49  -2.011   9.414  -1.951
  352    HD2  PHE  49           HD2      PHE  49  -2.029   5.848  -4.361
  353    HE1  PHE  49           HE1      PHE  49  -1.532  10.773  -3.978
  354    HE2  PHE  49           HE2      PHE  49  -1.626   7.215  -6.382
  355    HZ   PHE  49           HZ       PHE  49  -1.405   9.695  -6.189
  356    HA   PRO  50           HA       PRO  50  -1.147   3.865   2.346
  357   1HB   PRO  50          1HB       PRO  50  -3.440   3.271   3.612
  358   2HB   PRO  50          2HB       PRO  50  -2.479   4.730   3.994
  359   1HG   PRO  50          1HG       PRO  50  -4.884   4.559   2.135
  360   2HG   PRO  50          2HG       PRO  50  -4.656   5.685   3.505
  361   1HD   PRO  50          1HD       PRO  50  -4.022   6.428   0.956
  362   2HD   PRO  50          2HD       PRO  50  -2.965   6.889   2.325
  363    H    CYS  51           H        CYS  51  -0.883   3.040   0.156
  364    HA   CYS  51           HA       CYS  51  -2.918   1.542  -1.205
  365   1HB   CYS  51          1HB       CYS  51  -1.109   1.012  -2.760
  366   2HB   CYS  51          2HB       CYS  51  -0.989   2.665  -2.227
   
  No H/Q in entry =         366
  Start of MODEL   17
    1    HA   PCA   1           HA       PYR   1  -2.992  -1.532   3.419
    2   1HB   PCA   1          1HB       PYR   1  -1.007  -3.309   4.313
    3   2HB   PCA   1          2HB       PYR   1  -2.709  -3.737   4.008
    4   1HG   PCA   1          1HG       PYR   1  -0.351  -4.403   2.322
    5   2HG   PCA   1          2HG       PYR   1  -1.978  -5.142   2.357
    6    HN   PCA   1           HN       PYR   1  -2.676  -1.492   0.919
    7    H    LYS   2           H        LYS   2   0.365  -2.398   2.430
    8    HA   LYS   2           HA       LYS   2   1.616  -0.226   3.650
    9   1HB   LYS   2          1HB       LYS   2   3.554  -0.746   2.514
   10   2HB   LYS   2          2HB       LYS   2   2.760  -2.299   2.726
   11   1HG   LYS   2          1HG       LYS   2   2.716  -0.667   0.119
   12   2HG   LYS   2          2HG       LYS   2   3.960  -1.806   0.538
   13   1HD   LYS   2          1HD       LYS   2   2.841  -3.570  -0.122
   14   2HD   LYS   2          2HD       LYS   2   1.410  -3.181   0.815
   15   1HE   LYS   2          1HE       LYS   2   2.074  -1.837  -1.857
   16   2HE   LYS   2          2HE       LYS   2   1.134  -3.332  -1.741
   17   1HZ   LYS   2          3HZ       LYS   2   0.329  -0.866  -0.345
   18   2HZ   LYS   2          1HZ       LYS   2  -0.260  -1.288  -1.811
   19   3HZ   LYS   2          2HZ       LYS   2  -0.534  -2.259  -0.560
   20    H    LEU   3           H        LEU   3   2.417   1.773   2.882
   21    HA   LEU   3           HA       LEU   3   0.607   3.267   1.306
   22   1HB   LEU   3          1HB       LEU   3   3.427   3.818   2.197
   23   2HB   LEU   3          2HB       LEU   3   2.409   5.053   1.468
   24    HG   LEU   3           HG       LEU   3   1.487   3.618   3.987
   25   1HD1  LEU   3          1HD1      LEU   3   3.776   4.510   4.397
   26   2HD1  LEU   3          2HD1      LEU   3   3.259   6.094   3.791
   27   3HD1  LEU   3          3HD1      LEU   3   2.552   5.430   5.281
   28   1HD2  LEU   3          3HD2      LEU   3   0.890   6.344   2.765
   29   2HD2  LEU   3          1HD2      LEU   3  -0.190   4.943   2.842
   30   3HD2  LEU   3          2HD2      LEU   3   0.288   5.763   4.330
   31    H    CYS   4           H        CYS   4   1.073   4.467  -0.648
   32    HA   CYS   4           HA       CYS   4   3.267   3.407  -2.403
   33   1HB   CYS   4          1HB       CYS   4   0.423   4.148  -3.175
   34   2HB   CYS   4          2HB       CYS   4   1.780   4.269  -4.306
   35    H    GLU   5           H        GLU   5   4.724   4.928  -2.780
   36    HA   GLU   5           HA       GLU   5   4.304   7.738  -2.084
   37   1HB   GLU   5          1HB       GLU   5   6.651   6.293  -3.431
   38   2HB   GLU   5          2HB       GLU   5   6.640   7.955  -2.833
   39   1HG   GLU   5          1HG       GLU   5   6.079   7.014  -0.541
   40   2HG   GLU   5          2HG       GLU   5   6.422   5.403  -1.179
   41    HE1  GLU   5           HE2      GLU   5   9.889   6.026  -1.485
   42    H    ARG   6           H        ARG   6   2.493   8.051  -3.577
   43    HA   ARG   6           HA       ARG   6   2.903   7.641  -6.457
   44   1HB   ARG   6          1HB       ARG   6   0.665   7.958  -4.782
   45   2HB   ARG   6          2HB       ARG   6   0.695   9.434  -5.725
   46   1HG   ARG   6          1HG       ARG   6   0.827   6.662  -6.983
   47   2HG   ARG   6          2HG       ARG   6  -0.680   7.393  -6.466
   48   1HD   ARG   6          1HD       ARG   6   1.161   8.374  -8.663
   49   2HD   ARG   6          2HD       ARG   6  -0.490   7.824  -8.828
   50    HE   ARG   6           HE       ARG   6   0.488  10.464  -8.144
   51   1HH1  ARG   6          1HH1      ARG   6  -2.245   8.320  -7.519
   52   2HH1  ARG   6          2HH1      ARG   6  -3.343   9.598  -7.084
   53   1HH2  ARG   6          2HH2      ARG   6  -0.953  12.172  -7.644
   54   2HH2  ARG   6          1HH2      ARG   6  -2.547  11.835  -7.055
   55    HA   PRO   7           HA       PRO   7   4.779  11.807  -6.642
   56   1HB   PRO   7          1HB       PRO   7   4.770  12.170  -9.370
   57   2HB   PRO   7          2HB       PRO   7   5.991  11.199  -8.499
   58   1HG   PRO   7          1HG       PRO   7   3.511  10.210  -9.916
   59   2HG   PRO   7          2HG       PRO   7   5.172   9.559 -10.034
   60   1HD   PRO   7          1HD       PRO   7   3.308   8.436  -8.434
   61   2HD   PRO   7          2HD       PRO   7   4.985   8.524  -7.870
   62    H    SER   8           H        SER   8   3.883  13.864  -7.017
   63    HA   SER   8           HA       SER   8   1.533  14.606  -6.232
   64   1HB   SER   8          1HB       SER   8   1.617  16.530  -7.868
   65   2HB   SER   8          2HB       SER   8   3.116  16.203  -6.993
   66    HG   SER   8           HG       SER   8   3.412  16.522  -9.292
   67    H    GLY   9           H        GLY   9   1.823  14.376  -9.742
   68   1HA   GLY   9          1HA       GLY   9   0.270  13.582 -11.363
   69   2HA   GLY   9          2HA       GLY   9  -0.914  13.228 -10.093
   70    H    THR  10           H        THR  10  -1.044  15.614  -8.676
   71    HA   THR  10           HA       THR  10  -2.669  17.274 -10.399
   72    HB   THR  10           HB       THR  10  -2.797  18.511  -8.115
   73    HG1  THR  10           HG1      THR  10  -1.818  17.529  -6.425
   74   1HG2  THR  10          2HG2      THR  10  -3.424  15.526  -8.060
   75   2HG2  THR  10          3HG2      THR  10  -4.083  16.768  -6.973
   76   3HG2  THR  10          1HG2      THR  10  -4.487  16.806  -8.701
   77    H    TRP  11           H        TRP  11   0.000  17.923  -8.167
   78    HA   TRP  11           HA       TRP  11   0.890  20.348  -9.493
   79   1HB   TRP  11          1HB       TRP  11   1.140  19.679  -7.062
   80   2HB   TRP  11          2HB       TRP  11   2.485  18.652  -7.529
   81    HD1  TRP  11           HD1      TRP  11   4.130  20.546  -9.408
   82    HE1  TRP  11           HE1      TRP  11   5.252  22.654  -8.504
   83    HE3  TRP  11           HE3      TRP  11   1.294  21.224  -5.214
   84    HZ2  TRP  11           HZ2      TRP  11   4.932  24.437  -6.259
   85    HZ3  TRP  11           HZ3      TRP  11   1.802  23.057  -3.642
   86    HH2  TRP  11           HH2      TRP  11   3.707  24.569  -4.093
   87    H    SER  12           H        SER  12   0.871  19.245 -11.704
   88    HA   SER  12           HA       SER  12   2.882  17.260 -12.207
   89   1HB   SER  12          1HB       SER  12   1.475  18.861 -14.363
   90   2HB   SER  12          2HB       SER  12   1.860  17.136 -14.331
   91    HG   SER  12           HG       SER  12   0.120  16.937 -12.768
   92    H    GLY  13           H        GLY  13   4.523  18.971 -11.160
   93   1HA   GLY  13          1HA       GLY  13   6.281  19.960 -13.221
   94   2HA   GLY  13          2HA       GLY  13   5.373  21.279 -12.451
   95    H    VAL  14           H        VAL  14   7.821  21.698 -11.978
   96    HA   VAL  14           HA       VAL  14   9.199  20.261  -9.955
   97    HB   VAL  14           HB       VAL  14   9.278  23.241 -10.612
   98   1HG1  VAL  14          2HG1      VAL  14  11.287  21.469  -9.151
   99   2HG1  VAL  14          3HG1      VAL  14  11.581  23.142  -9.666
  100   3HG1  VAL  14          1HG1      VAL  14  10.352  22.806  -8.447
  101   1HG2  VAL  14          3HG2      VAL  14  10.941  20.904 -11.666
  102   2HG2  VAL  14          1HG2      VAL  14   9.808  21.891 -12.612
  103   3HG2  VAL  14          2HG2      VAL  14  11.284  22.618 -11.974
  104    H    CYS  15           H        CYS  15   9.081  20.364  -7.725
  105    HA   CYS  15           HA       CYS  15   6.461  20.851  -6.736
  106   1HB   CYS  15          1HB       CYS  15   7.158  19.836  -4.781
  107   2HB   CYS  15          2HB       CYS  15   8.286  19.152  -5.962
  108    H    GLY  16           H        GLY  16   9.329  22.902  -6.618
  109   1HA   GLY  16          1HA       GLY  16   9.597  25.047  -5.837
  110   2HA   GLY  16          2HA       GLY  16   7.877  25.110  -5.451
  111    H    ASN  17           H        ASN  17   7.640  23.053  -3.510
  112    HA   ASN  17           HA       ASN  17   9.466  23.549  -1.314
  113   1HB   ASN  17          1HB       ASN  17   8.464  25.776  -1.365
  114   2HB   ASN  17          2HB       ASN  17   6.842  25.081  -1.497
  115   1HD2  ASN  17          2HD2      ASN  17   8.729  25.173   2.163
  116   2HD2  ASN  17          1HD2      ASN  17   9.650  25.447   0.698
  117    H    ASN  18           H        ASN  18   9.178  22.066   0.263
  118    HA   ASN  18           HA       ASN  18   7.628  19.809   0.001
  119   1HB   ASN  18          1HB       ASN  18   9.675  20.216   1.450
  120   2HB   ASN  18          2HB       ASN  18   8.655  21.038   2.609
  121   1HD2  ASN  18          1HD2      ASN  18   8.552  16.979   2.446
  122   2HD2  ASN  18          2HD2      ASN  18   9.600  17.825   1.313
  123    H    ASN  19           H        ASN  19   7.058  22.363   2.335
  124    HA   ASN  19           HA       ASN  19   4.638  21.421   3.407
  125   1HB   ASN  19          1HB       ASN  19   5.888  23.190   4.481
  126   2HB   ASN  19          2HB       ASN  19   5.521  24.313   3.164
  127   1HD2  ASN  19          2HD2      ASN  19   2.352  25.157   4.471
  128   2HD2  ASN  19          1HD2      ASN  19   3.612  25.508   3.304
  129    H    ALA  20           H        ALA  20   5.040  23.705   0.658
  130    HA   ALA  20           HA       ALA  20   2.244  24.011   0.174
  131   1HB   ALA  20          3HB       ALA  20   3.992  25.460  -0.842
  132   2HB   ALA  20          1HB       ALA  20   4.488  24.098  -1.882
  133   3HB   ALA  20          2HB       ALA  20   2.850  24.784  -2.020
  134    H    CYS  21           H        CYS  21   4.643  21.819  -1.409
  135    HA   CYS  21           HA       CYS  21   2.934  20.477  -3.116
  136   1HB   CYS  21          1HB       CYS  21   5.182  19.919  -3.384
  137   2HB   CYS  21          2HB       CYS  21   5.451  19.722  -1.652
  138    H    LYS  22           H        LYS  22   3.848  19.557   0.183
  139    HA   LYS  22           HA       LYS  22   2.297  17.307   0.729
  140   1HB   LYS  22          1HB       LYS  22   4.053  18.163   2.158
  141   2HB   LYS  22          2HB       LYS  22   3.184  19.667   2.442
  142   1HG   LYS  22          1HG       LYS  22   1.387  18.410   3.643
  143   2HG   LYS  22          2HG       LYS  22   2.331  16.953   3.486
  144   1HD   LYS  22          1HD       LYS  22   2.748  19.444   5.127
  145   2HD   LYS  22          2HD       LYS  22   2.871  17.772   5.655
  146   1HE   LYS  22          1HE       LYS  22   4.919  19.363   4.019
  147   2HE   LYS  22          2HE       LYS  22   5.044  18.980   5.728
  148   1HZ   LYS  22          2HZ       LYS  22   4.976  16.939   3.609
  149   2HZ   LYS  22          3HZ       LYS  22   6.349  17.594   4.164
  150   3HZ   LYS  22          1HZ       LYS  22   5.380  16.707   5.173
  151    H    ASN  23           H        ASN  23   1.470  20.707   1.572
  152    HA   ASN  23           HA       ASN  23  -1.084  20.168   2.551
  153   1HB   ASN  23          1HB       ASN  23   0.078  22.298   2.880
  154   2HB   ASN  23          2HB       ASN  23  -0.034  22.689   1.163
  155   1HD2  ASN  23          2HD2      ASN  23  -2.754  24.360   3.294
  156   2HD2  ASN  23          1HD2      ASN  23  -1.041  24.129   3.593
  157    H    GLN  24           H        GLN  24  -0.217  21.453  -0.698
  158    HA   GLN  24           HA       GLN  24  -2.743  21.392  -1.866
  159   1HB   GLN  24          1HB       GLN  24  -0.897  22.454  -2.945
  160   2HB   GLN  24          2HB       GLN  24   0.055  20.981  -3.000
  161   1HG   GLN  24          1HG       GLN  24  -2.575  21.368  -4.505
  162   2HG   GLN  24          2HG       GLN  24  -1.007  21.766  -5.198
  163   1HE2  GLN  24          2HE2      GLN  24  -0.035  18.122  -5.051
  164   2HE2  GLN  24          1HE2      GLN  24   0.560  19.559  -4.253
  165    H    CYS  25           H        CYS  25  -0.356  18.668  -1.785
  166    HA   CYS  25           HA       CYS  25  -1.975  16.916  -3.280
  167   1HB   CYS  25          1HB       CYS  25   0.335  16.311  -2.714
  168   2HB   CYS  25          2HB       CYS  25  -0.091  16.186  -1.004
  169    H    ILE  26           H        ILE  26  -1.727  17.080   0.330
  170    HA   ILE  26           HA       ILE  26  -3.828  15.101   0.584
  171    HB   ILE  26           HB       ILE  26  -3.553  15.322   2.934
  172   1HG1  ILE  26          1HG1      ILE  26  -2.065  17.929   2.418
  173   2HG1  ILE  26          2HG1      ILE  26  -3.633  17.743   3.209
  174   1HG2  ILE  26          1HG2      ILE  26  -1.740  14.227   1.606
  175   2HG2  ILE  26          2HG2      ILE  26  -0.813  15.736   1.645
  176   3HG2  ILE  26          3HG2      ILE  26  -1.169  14.885   3.141
  177   1HD1  ILE  26          2HD1      ILE  26  -2.509  16.378   5.001
  178   2HD1  ILE  26          3HD1      ILE  26  -0.943  16.823   4.275
  179   3HD1  ILE  26          1HD1      ILE  26  -2.010  18.080   4.915
  180    H    ASN  27           H        ASN  27  -3.875  18.504   0.125
  181    HA   ASN  27           HA       ASN  27  -6.477  19.003   1.328
  182   1HB   ASN  27          1HB       ASN  27  -4.631  20.576   1.262
  183   2HB   ASN  27          2HB       ASN  27  -4.676  20.635  -0.515
  184   1HD2  ASN  27          2HD2      ASN  27  -6.361  23.610   0.951
  185   2HD2  ASN  27          1HD2      ASN  27  -4.764  22.863   1.107
  186    H    LEU  28           H        LEU  28  -5.210  19.100  -2.065
  187    HA   LEU  28           HA       LEU  28  -7.859  19.182  -3.209
  188   1HB   LEU  28          1HB       LEU  28  -5.046  18.912  -4.324
  189   2HB   LEU  28          2HB       LEU  28  -6.459  18.641  -5.334
  190    HG   LEU  28           HG       LEU  28  -7.337  20.876  -4.848
  191   1HD1  LEU  28          1HD1      LEU  28  -4.743  21.272  -3.298
  192   2HD1  LEU  28          2HD1      LEU  28  -5.821  22.582  -3.816
  193   3HD1  LEU  28          3HD1      LEU  28  -6.398  21.385  -2.657
  194   1HD2  LEU  28          1HD2      LEU  28  -5.934  20.474  -6.822
  195   2HD2  LEU  28          2HD2      LEU  28  -5.659  22.105  -6.186
  196   3HD2  LEU  28          3HD2      LEU  28  -4.471  20.820  -5.880
  197    H    GLU  29           H        GLU  29  -5.325  16.597  -3.140
  198    HA   GLU  29           HA       GLU  29  -7.466  14.619  -3.831
  199   1HB   GLU  29          1HB       GLU  29  -5.619  13.014  -4.229
  200   2HB   GLU  29          2HB       GLU  29  -5.739  14.349  -5.375
  201   1HG   GLU  29          1HG       GLU  29  -3.893  15.525  -4.168
  202   2HG   GLU  29          2HG       GLU  29  -3.695  14.071  -3.157
  203    HE2  GLU  29           HE2      GLU  29  -1.508  14.352  -6.259
  204    H    LYS  30           H        LYS  30  -7.013  12.510  -2.386
  205    HA   LYS  30           HA       LYS  30  -7.106  13.619   0.384
  206   1HB   LYS  30          1HB       LYS  30  -8.641  11.346  -0.833
  207   2HB   LYS  30          2HB       LYS  30  -8.773  11.874   0.850
  208   1HG   LYS  30          1HG       LYS  30  -9.269  13.859  -1.429
  209   2HG   LYS  30          2HG       LYS  30 -10.479  12.700  -0.949
  210   1HD   LYS  30          1HD       LYS  30 -10.904  14.850   0.068
  211   2HD   LYS  30          2HD       LYS  30 -10.691  13.563   1.242
  212   1HE   LYS  30          1HE       LYS  30  -9.727  15.651   2.045
  213   2HE   LYS  30          2HE       LYS  30  -8.500  14.404   1.886
  214   1HZ   LYS  30          2HZ       LYS  30  -7.894  15.510  -0.261
  215   2HZ   LYS  30          3HZ       LYS  30  -8.860  16.777   0.097
  216   3HZ   LYS  30          1HZ       LYS  30  -7.601  16.379   1.046
  217    H    ALA  31           H        ALA  31  -4.785  12.372  -1.162
  218    HA   ALA  31           HA       ALA  31  -3.693  10.176   0.164
  219   1HB   ALA  31          1HB       ALA  31  -2.641  11.640  -1.654
  220   2HB   ALA  31          2HB       ALA  31  -2.363  12.839  -0.383
  221   3HB   ALA  31          3HB       ALA  31  -1.556  11.252  -0.301
  222    H    ARG  32           H        ARG  32  -2.075  10.211   2.017
  223    HA   ARG  32           HA       ARG  32  -3.442  11.647   4.255
  224   1HB   ARG  32          1HB       ARG  32  -1.622   9.239   4.282
  225   2HB   ARG  32          2HB       ARG  32  -2.458   9.935   5.677
  226   1HG   ARG  32          1HG       ARG  32  -3.831   8.736   3.206
  227   2HG   ARG  32          2HG       ARG  32  -3.574   7.932   4.749
  228   1HD   ARG  32          1HD       ARG  32  -5.827   8.625   4.761
  229   2HD   ARG  32          2HD       ARG  32  -4.943   9.677   5.876
  230    HE   ARG  32           HE       ARG  32  -5.522  10.555   3.041
  231   1HH1  ARG  32          1HH2      ARG  32  -6.599  10.871   6.365
  232   2HH1  ARG  32          2HH2      ARG  32  -6.925  12.574   6.261
  233   1HH2  ARG  32          1HH1      ARG  32  -5.639  12.793   2.946
  234   2HH2  ARG  32          2HH1      ARG  32  -6.447  13.709   4.197
  235    H    HIS  33           H        HIS  33  -0.043  10.881   3.431
  236    HA   HIS  33           HA       HIS  33   0.626  13.597   4.463
  237   1HB   HIS  33          2HB       HIS  33   2.960  12.712   4.868
  238   2HB   HIS  33          1HB       HIS  33   1.707  12.354   6.050
  239    HD1  HIS  33           HD1      HIS  33   0.535   9.863   5.735
  240    HD2  HIS  33           HD2      HIS  33   4.461  10.451   4.399
  241    HE1  HIS  33           HE1      HIS  33   1.624   7.580   5.582
  242    H    GLY  34           H        GLY  34   2.478  14.553   3.324
  243   1HA   GLY  34          1HA       GLY  34   3.144  13.530   0.726
  244   2HA   GLY  34          2HA       GLY  34   2.164  15.010   0.657
  245    H    SER  35           H        SER  35   4.871  14.906  -0.277
  246    HA   SER  35           HA       SER  35   6.150  16.974   1.262
  247   1HB   SER  35          1HB       SER  35   6.753  14.136   1.971
  248   2HB   SER  35          2HB       SER  35   8.179  15.019   1.453
  249    HG   SER  35           HG       SER  35   7.704  15.167   3.724
  250    H    CYS  36           H        CYS  36   7.781  17.856   0.099
  251    HA   CYS  36           HA       CYS  36   8.273  16.808  -2.622
  252   1HB   CYS  36          1HB       CYS  36   7.914  19.230  -2.394
  253   2HB   CYS  36          2HB       CYS  36   9.319  19.329  -1.296
  254    H    ASN  37           H        ASN  37  10.145  15.874  -3.180
  255    HA   ASN  37           HA       ASN  37  12.376  15.625  -1.197
  256   1HB   ASN  37          1HB       ASN  37  11.422  13.420  -1.494
  257   2HB   ASN  37          2HB       ASN  37  11.246  13.668  -3.239
  258   1HD2  ASN  37          2HD2      ASN  37  15.096  13.075  -1.861
  259   2HD2  ASN  37          1HD2      ASN  37  13.961  13.919  -0.820
  260    H    TYR  38           H        TYR  38  14.517  15.720  -2.254
  261    HA   TYR  38           HA       TYR  38  14.428  17.315  -4.722
  262   1HB   TYR  38          1HB       TYR  38  15.838  18.242  -3.029
  263   2HB   TYR  38          2HB       TYR  38  16.766  16.750  -2.904
  264    HD1  TYR  38           HD2      TYR  38  15.555  18.952  -5.766
  265    HD2  TYR  38           HD1      TYR  38  18.927  17.002  -3.912
  266    HE1  TYR  38           HE2      TYR  38  16.829  19.162  -7.856
  267    HE2  TYR  38           HE1      TYR  38  20.165  17.148  -6.053
  268    HH   TYR  38           HH       TYR  38  18.615  18.348  -9.053
  269    H    VAL  39           H        VAL  39  17.224  15.428  -4.426
  270    HA   VAL  39           HA       VAL  39  18.305  14.199  -5.861
  271    HB   VAL  39           HB       VAL  39  17.637  12.077  -6.454
  272   1HG1  VAL  39          3HG1      VAL  39  17.954  12.480  -4.040
  273   2HG1  VAL  39          1HG1      VAL  39  16.201  12.697  -3.848
  274   3HG1  VAL  39          2HG1      VAL  39  16.850  11.131  -4.363
  275   1HG2  VAL  39          2HG2      VAL  39  15.445  12.498  -7.535
  276   2HG2  VAL  39          3HG2      VAL  39  15.469  11.106  -6.450
  277   3HG2  VAL  39          1HG2      VAL  39  14.704  12.598  -5.917
  278    H    PHE  40           H        PHE  40  18.543  13.450  -8.203
  279    HA   PHE  40           HA       PHE  40  18.145  15.778  -9.701
  280   1HB   PHE  40          1HB       PHE  40  19.244  14.674 -11.480
  281   2HB   PHE  40          2HB       PHE  40  19.928  13.999 -10.024
  282    HD1  PHE  40           HD1      PHE  40  19.290  11.626  -9.332
  283    HD2  PHE  40           HD2      PHE  40  17.977  13.369 -13.063
  284    HE1  PHE  40           HE1      PHE  40  18.549   9.402 -10.122
  285    HE2  PHE  40           HE2      PHE  40  17.250  11.137 -13.841
  286    HZ   PHE  40           HZ       PHE  40  17.521   9.153 -12.370
  287    HA   PRO  41           HA       PRO  41  17.928  16.460 -11.889
  288   1HB   PRO  41          1HB       PRO  41  16.377  17.897 -13.562
  289   2HB   PRO  41          2HB       PRO  41  16.999  16.274 -13.980
  290   1HG   PRO  41          1HG       PRO  41  14.220  16.988 -13.044
  291   2HG   PRO  41          2HG       PRO  41  14.709  15.869 -14.337
  292   1HD   PRO  41          1HD       PRO  41  14.084  15.055 -11.741
  293   2HD   PRO  41          2HD       PRO  41  15.170  14.154 -12.827
  294    H    ALA  42           H        ALA  42  14.524  17.270 -11.062
  295    HA   ALA  42           HA       ALA  42  15.414  19.689  -9.557
  296   1HB   ALA  42          2HB       ALA  42  14.326  20.188 -11.720
  297   2HB   ALA  42          3HB       ALA  42  12.897  19.263 -11.206
  298   3HB   ALA  42          1HB       ALA  42  13.362  20.746 -10.344
  299    H    HIS  43           H        HIS  43  13.589  20.434  -8.083
  300    HA   HIS  43           HA       HIS  43  13.109  18.475  -6.066
  301   1HB   HIS  43          2HB       HIS  43  11.907  21.236  -6.474
  302   2HB   HIS  43          1HB       HIS  43  11.876  20.325  -4.972
  303    HD1  HIS  43           HD1      HIS  43  13.866  20.326  -3.429
  304    HD2  HIS  43           HD2      HIS  43  14.604  22.234  -7.090
  305    HE1  HIS  43           HE1      HIS  43  16.125  21.473  -3.245
  306    H    LYS  44           H        LYS  44  11.434  17.100  -5.803
  307    HA   LYS  44           HA       LYS  44   9.197  17.191  -7.786
  308   1HB   LYS  44          1HB       LYS  44   9.430  14.755  -8.000
  309   2HB   LYS  44          2HB       LYS  44  10.834  15.669  -8.571
  310   1HG   LYS  44          1HG       LYS  44  12.003  15.151  -6.386
  311   2HG   LYS  44          2HG       LYS  44  10.611  14.193  -5.909
  312   1HD   LYS  44          1HD       LYS  44  12.358  12.752  -6.717
  313   2HD   LYS  44          2HD       LYS  44  10.958  12.653  -7.784
  314   1HE   LYS  44          1HE       LYS  44  13.167  12.680  -8.964
  315   2HE   LYS  44          2HE       LYS  44  12.074  13.949  -9.514
  316   1HZ   LYS  44          1HZ       LYS  44  14.136  14.465  -7.466
  317   2HZ   LYS  44          2HZ       LYS  44  14.470  14.552  -9.046
  318   3HZ   LYS  44          3HZ       LYS  44  13.360  15.563  -8.375
  319    H    CYS  45           H        CYS  45   7.219  16.812  -7.068
  320    HA   CYS  45           HA       CYS  45   6.785  16.779  -4.185
  321   1HB   CYS  45          1HB       CYS  45   5.633  18.413  -5.550
  322   2HB   CYS  45          2HB       CYS  45   4.963  17.158  -6.564
  323    H    ILE  46           H        ILE  46   6.671  14.826  -3.134
  324    HA   ILE  46           HA       ILE  46   5.493  12.462  -4.526
  325    HB   ILE  46           HB       ILE  46   7.334  12.700  -2.112
  326   1HG1  ILE  46          1HG1      ILE  46   8.576  13.138  -4.152
  327   2HG1  ILE  46          2HG1      ILE  46   9.021  11.578  -3.468
  328   1HG2  ILE  46          3HG2      ILE  46   6.088  10.237  -3.378
  329   2HG2  ILE  46          1HG2      ILE  46   7.476  10.199  -2.265
  330   3HG2  ILE  46          2HG2      ILE  46   5.924  10.810  -1.712
  331   1HD1  ILE  46          1HD1      ILE  46   7.542  10.444  -5.163
  332   2HD1  ILE  46          2HD1      ILE  46   7.223  12.037  -5.891
  333   3HD1  ILE  46          3HD1      ILE  46   8.863  11.382  -5.874
  334    H    CYS  47           H        CYS  47   3.797  11.309  -3.487
  335    HA   CYS  47           HA       CYS  47   2.892  12.397  -0.927
  336   1HB   CYS  47          1HB       CYS  47   1.854  13.669  -2.870
  337   2HB   CYS  47          2HB       CYS  47   0.950  12.196  -3.225
  338    H    TYR  48           H        TYR  48   1.536  11.078   0.323
  339    HA   TYR  48           HA       TYR  48   2.108   8.210  -0.256
  340   1HB   TYR  48          1HB       TYR  48   1.940   9.752   2.341
  341   2HB   TYR  48          2HB       TYR  48   2.258   8.032   2.188
  342    HD1  TYR  48           HD1      TYR  48   3.644  11.408   1.341
  343    HD2  TYR  48           HD2      TYR  48   4.474   7.232   1.977
  344    HE1  TYR  48           HE1      TYR  48   6.052  11.824   0.917
  345    HE2  TYR  48           HE2      TYR  48   6.891   7.691   1.761
  346    HH   TYR  48           HH       TYR  48   8.356   9.153   0.632
  347    H    PHE  49           H        PHE  49   0.337   6.939  -0.548
  348    HA   PHE  49           HA       PHE  49  -2.175   7.562   0.856
  349   1HB   PHE  49          1HB       PHE  49  -2.127   6.191  -1.811
  350   2HB   PHE  49          2HB       PHE  49  -3.392   7.031  -1.001
  351    HD1  PHE  49           HD2      PHE  49   0.052   8.049  -2.302
  352    HD2  PHE  49           HD1      PHE  49  -4.218   8.707  -2.426
  353    HE1  PHE  49           HE2      PHE  49   0.399  10.063  -3.613
  354    HE2  PHE  49           HE1      PHE  49  -3.848  10.448  -4.151
  355    HZ   PHE  49           HZ       PHE  49  -1.491  11.072  -4.792
  356    HA   PRO  50           HA       PRO  50  -1.577   3.232   2.107
  357   1HB   PRO  50          1HB       PRO  50  -3.978   2.685   3.160
  358   2HB   PRO  50          2HB       PRO  50  -2.891   3.915   3.869
  359   1HG   PRO  50          1HG       PRO  50  -5.211   4.408   1.961
  360   2HG   PRO  50          2HG       PRO  50  -4.917   5.205   3.533
  361   1HD   PRO  50          1HD       PRO  50  -4.067   6.313   1.137
  362   2HD   PRO  50          2HD       PRO  50  -3.092   6.446   2.660
  363    H    CYS  51           H        CYS  51  -1.316   2.872  -0.222
  364    HA   CYS  51           HA       CYS  51  -3.520   2.041  -1.890
  365   1HB   CYS  51          1HB       CYS  51  -1.788   1.604  -3.545
  366   2HB   CYS  51          2HB       CYS  51  -1.439   3.067  -2.666
   
  No H/Q in entry =         366
  Start of MODEL   18
    1    HA   PCA   1           HA       PYR   1  -3.672   0.398   3.362
    2   1HB   PCA   1          1HB       PYR   1  -2.559  -0.822   5.655
    3   2HB   PCA   1          2HB       PYR   1  -4.174  -1.147   4.968
    4   1HG   PCA   1          1HG       PYR   1  -1.703  -2.814   4.725
    5   2HG   PCA   1          2HG       PYR   1  -3.421  -3.304   4.613
    6    HN   PCA   1           HN       PYR   1  -2.613  -0.898   1.465
    7    H    LYS   2           H        LYS   2  -0.425  -1.089   3.569
    8    HA   LYS   2           HA       LYS   2   0.993   1.123   4.608
    9   1HB   LYS   2          1HB       LYS   2   2.990   0.045   3.750
   10   2HB   LYS   2          2HB       LYS   2   1.900  -1.119   4.474
   11   1HG   LYS   2          1HG       LYS   2   2.587  -2.278   2.619
   12   2HG   LYS   2          2HG       LYS   2   1.046  -1.620   2.079
   13   1HD   LYS   2          1HD       LYS   2   2.611  -1.497   0.296
   14   2HD   LYS   2          2HD       LYS   2   2.280   0.147   0.806
   15   1HE   LYS   2          1HE       LYS   2   4.448   0.117   2.131
   16   2HE   LYS   2          2HE       LYS   2   4.773  -1.488   1.449
   17   1HZ   LYS   2          3HZ       LYS   2   4.683  -0.422  -0.743
   18   2HZ   LYS   2          1HZ       LYS   2   4.387   1.032  -0.027
   19   3HZ   LYS   2          2HZ       LYS   2   5.827   0.283   0.216
   20    H    LEU   3           H        LEU   3   2.308   2.744   3.519
   21    HA   LEU   3           HA       LEU   3   0.809   3.845   1.314
   22   1HB   LEU   3          1HB       LEU   3   3.262   4.817   2.759
   23   2HB   LEU   3          2HB       LEU   3   2.420   5.760   1.534
   24    HG   LEU   3           HG       LEU   3   0.986   4.780   4.041
   25   1HD1  LEU   3          2HD1      LEU   3   2.933   6.189   4.703
   26   2HD1  LEU   3          3HD1      LEU   3   2.389   7.460   3.593
   27   3HD1  LEU   3          1HD1      LEU   3   1.393   7.016   4.990
   28   1HD2  LEU   3          3HD2      LEU   3   0.387   7.000   2.056
   29   2HD2  LEU   3          1HD2      LEU   3  -0.485   5.457   2.216
   30   3HD2  LEU   3          2HD2      LEU   3  -0.534   6.635   3.528
   31    H    CYS   4           H        CYS   4   1.689   4.638  -0.658
   32    HA   CYS   4           HA       CYS   4   4.332   3.702  -1.564
   33   1HB   CYS   4          1HB       CYS   4   1.698   3.035  -2.895
   34   2HB   CYS   4          2HB       CYS   4   3.134   3.330  -3.871
   35    H    GLU   5           H        GLU   5   5.258   5.147  -2.945
   36    HA   GLU   5           HA       GLU   5   4.263   7.867  -2.786
   37   1HB   GLU   5          1HB       GLU   5   6.831   6.657  -3.927
   38   2HB   GLU   5          2HB       GLU   5   6.482   8.372  -3.754
   39   1HG   GLU   5          1HG       GLU   5   7.810   7.890  -1.899
   40   2HG   GLU   5          2HG       GLU   5   6.167   7.983  -1.262
   41    HE2  GLU   5           HE2      GLU   5   7.617   5.116   0.334
   42    H    ARG   6           H        ARG   6   3.540   9.119  -4.459
   43    HA   ARG   6           HA       ARG   6   3.987   8.280  -7.275
   44   1HB   ARG   6          1HB       ARG   6   1.450   8.134  -6.007
   45   2HB   ARG   6          2HB       ARG   6   1.467   9.723  -6.777
   46   1HG   ARG   6          1HG       ARG   6   2.241   8.109  -8.874
   47   2HG   ARG   6          2HG       ARG   6   1.242   7.025  -7.915
   48   1HD   ARG   6          1HD       ARG   6  -0.108   8.120  -9.574
   49   2HD   ARG   6          2HD       ARG   6  -0.600   8.679  -7.959
   50    HE   ARG   6           HE       ARG   6   1.269  10.575  -8.829
   51   1HH1  ARG   6          2HH2      ARG   6  -1.889   9.432  -9.913
   52   2HH1  ARG   6          1HH2      ARG   6  -2.342  10.963 -10.614
   53   1HH2  ARG   6          1HH1      ARG   6   0.729  12.563  -9.830
   54   2HH2  ARG   6          2HH1      ARG   6  -0.898  12.823 -10.374
   55    HA   PRO   7           HA       PRO   7   4.989  12.746  -7.145
   56   1HB   PRO   7          1HB       PRO   7   4.491  13.479  -9.751
   57   2HB   PRO   7          2HB       PRO   7   5.970  12.632  -9.236
   58   1HG   PRO   7          1HG       PRO   7   3.482  11.444 -10.468
   59   2HG   PRO   7          2HG       PRO   7   5.185  11.116 -10.902
   60   1HD   PRO   7          1HD       PRO   7   3.755   9.482  -9.288
   61   2HD   PRO   7          2HD       PRO   7   5.480   9.733  -8.959
   62    H    SER   8           H        SER   8   3.457  14.244  -6.390
   63    HA   SER   8           HA       SER   8   1.114  13.270  -5.550
   64   1HB   SER   8          1HB       SER   8   0.397  15.403  -4.856
   65   2HB   SER   8          2HB       SER   8   2.173  15.407  -4.788
   66    HG   SER   8           HG       SER   8   2.130  16.542  -6.785
   67    H    GLY   9           H        GLY   9  -1.006  13.228  -5.907
   68   1HA   GLY   9          1HA       GLY   9  -2.128  12.270  -8.122
   69   2HA   GLY   9          2HA       GLY   9  -3.013  13.304  -7.015
   70    H    THR  10           H        THR  10  -2.320  15.741  -7.299
   71    HA   THR  10           HA       THR  10  -3.078  16.553 -10.025
   72    HB   THR  10           HB       THR  10  -3.105  18.806  -8.787
   73    HG1  THR  10           HG1      THR  10  -2.810  18.779  -6.647
   74   1HG2  THR  10          3HG2      THR  10  -4.803  16.546  -7.625
   75   2HG2  THR  10          1HG2      THR  10  -5.136  18.283  -7.468
   76   3HG2  THR  10          2HG2      THR  10  -5.181  17.511  -9.068
   77    H    TRP  11           H        TRP  11  -0.766  17.832  -7.675
   78    HA   TRP  11           HA       TRP  11   0.813  19.113  -9.731
   79   1HB   TRP  11          1HB       TRP  11   0.271  20.126  -7.583
   80   2HB   TRP  11          2HB       TRP  11   1.172  18.896  -6.725
   81    HD1  TRP  11           HD1      TRP  11   3.411  19.864  -9.444
   82    HE1  TRP  11           HE1      TRP  11   5.149  21.608  -8.584
   83    HE3  TRP  11           HE3      TRP  11   1.108  21.354  -5.127
   84    HZ2  TRP  11           HZ2      TRP  11   5.442  23.398  -6.417
   85    HZ3  TRP  11           HZ3      TRP  11   2.145  23.040  -3.670
   86    HH2  TRP  11           HH2      TRP  11   4.353  24.029  -4.269
   87    H    SER  12           H        SER  12   1.209  16.902 -10.787
   88    HA   SER  12           HA       SER  12   3.533  15.457  -9.635
   89   1HB   SER  12          1HB       SER  12   1.988  15.186 -12.249
   90   2HB   SER  12          2HB       SER  12   3.382  14.183 -11.821
   91    HG   SER  12           HG       SER  12   1.263  14.492  -9.992
   92    H    GLY  13           H        GLY  13   4.669  17.590  -9.488
   93   1HA   GLY  13          1HA       GLY  13   6.456  17.969 -11.778
   94   2HA   GLY  13          2HA       GLY  13   5.332  19.311 -11.486
   95    H    VAL  14           H        VAL  14   7.393  20.456 -11.200
   96    HA   VAL  14           HA       VAL  14   9.246  19.834  -9.185
   97    HB   VAL  14           HB       VAL  14   8.653  22.515 -10.479
   98   1HG1  VAL  14          2HG1      VAL  14  10.108  22.748  -8.471
   99   2HG1  VAL  14          3HG1      VAL  14  11.231  21.560  -9.169
  100   3HG1  VAL  14          1HG1      VAL  14  10.964  23.115  -9.970
  101   1HG2  VAL  14          1HG2      VAL  14  10.590  20.293 -11.289
  102   2HG2  VAL  14          2HG2      VAL  14   9.163  20.818 -12.207
  103   3HG2  VAL  14          3HG2      VAL  14  10.538  21.909 -12.021
  104    H    CYS  15           H        CYS  15   9.303  20.381  -7.029
  105    HA   CYS  15           HA       CYS  15   6.834  21.585  -5.857
  106   1HB   CYS  15          1HB       CYS  15   7.561  20.630  -3.721
  107   2HB   CYS  15          2HB       CYS  15   7.259  19.458  -4.989
  108    H    GLY  16           H        GLY  16  10.401  21.719  -5.325
  109   1HA   GLY  16          1HA       GLY  16  11.695  23.438  -4.480
  110   2HA   GLY  16          2HA       GLY  16  10.329  24.550  -4.623
  111    H    ASN  17           H        ASN  17   8.421  23.292  -3.010
  112    HA   ASN  17           HA       ASN  17   9.629  23.458  -0.274
  113   1HB   ASN  17          1HB       ASN  17   8.685  25.615  -0.916
  114   2HB   ASN  17          2HB       ASN  17   7.153  24.840  -1.353
  115   1HD2  ASN  17          2HD2      ASN  17   8.132  25.324   2.636
  116   2HD2  ASN  17          1HD2      ASN  17   9.386  25.420   1.415
  117    H    ASN  18           H        ASN  18   9.136  21.813   1.022
  118    HA   ASN  18           HA       ASN  18   7.514  19.636   0.743
  119   1HB   ASN  18          1HB       ASN  18   9.185  19.918   2.482
  120   2HB   ASN  18          2HB       ASN  18   8.365  21.305   3.157
  121   1HD2  ASN  18          2HD2      ASN  18   6.857  17.599   3.978
  122   2HD2  ASN  18          1HD2      ASN  18   8.059  17.700   2.727
  123    H    ASN  19           H        ASN  19   6.748  22.444   2.687
  124    HA   ASN  19           HA       ASN  19   4.301  21.545   3.559
  125   1HB   ASN  19          1HB       ASN  19   5.506  23.417   4.610
  126   2HB   ASN  19          2HB       ASN  19   5.024  24.481   3.275
  127   1HD2  ASN  19          2HD2      ASN  19   1.967  25.213   4.911
  128   2HD2  ASN  19          1HD2      ASN  19   3.295  25.771   3.915
  129    H    ALA  20           H        ALA  20   4.814  23.728   0.786
  130    HA   ALA  20           HA       ALA  20   2.070  24.089   0.102
  131   1HB   ALA  20          2HB       ALA  20   3.888  25.419  -0.917
  132   2HB   ALA  20          3HB       ALA  20   4.468  23.970  -1.781
  133   3HB   ALA  20          1HB       ALA  20   2.864  24.642  -2.140
  134    H    CYS  21           H        CYS  21   4.478  21.784  -1.243
  135    HA   CYS  21           HA       CYS  21   2.809  20.348  -2.963
  136   1HB   CYS  21          1HB       CYS  21   5.159  19.986  -3.054
  137   2HB   CYS  21          2HB       CYS  21   5.246  19.547  -1.343
  138    H    LYS  22           H        LYS  22   3.639  19.577   0.412
  139    HA   LYS  22           HA       LYS  22   2.017  17.357   0.866
  140   1HB   LYS  22          1HB       LYS  22   3.743  18.164   2.410
  141   2HB   LYS  22          2HB       LYS  22   2.833  19.636   2.710
  142   1HG   LYS  22          1HG       LYS  22   1.021  18.351   3.808
  143   2HG   LYS  22          2HG       LYS  22   1.799  16.844   3.348
  144   1HD   LYS  22          1HD       LYS  22   2.182  17.448   5.738
  145   2HD   LYS  22          2HD       LYS  22   3.660  17.211   4.807
  146   1HE   LYS  22          1HE       LYS  22   3.768  19.170   6.366
  147   2HE   LYS  22          2HE       LYS  22   4.119  19.553   4.684
  148   1HZ   LYS  22          1HZ       LYS  22   1.868  20.398   4.470
  149   2HZ   LYS  22          2HZ       LYS  22   1.550  20.061   6.053
  150   3HZ   LYS  22          3HZ       LYS  22   2.668  21.195   5.641
  151    H    ASN  23           H        ASN  23   1.228  20.767   1.646
  152    HA   ASN  23           HA       ASN  23  -1.397  20.272   2.596
  153   1HB   ASN  23          1HB       ASN  23  -0.357  22.401   3.081
  154   2HB   ASN  23          2HB       ASN  23  -0.056  22.716   1.367
  155   1HD2  ASN  23          2HD2      ASN  23  -2.882  24.823   1.461
  156   2HD2  ASN  23          1HD2      ASN  23  -1.140  24.721   1.312
  157    H    GLN  24           H        GLN  24  -0.434  21.658  -0.577
  158    HA   GLN  24           HA       GLN  24  -2.973  21.604  -1.787
  159   1HB   GLN  24          1HB       GLN  24  -0.943  22.776  -2.591
  160   2HB   GLN  24          2HB       GLN  24  -0.167  21.247  -2.971
  161   1HG   GLN  24          1HG       GLN  24  -2.729  22.323  -4.253
  162   2HG   GLN  24          2HG       GLN  24  -1.113  22.500  -4.939
  163   1HE2  GLN  24          2HE2      GLN  24  -0.932  18.755  -5.401
  164   2HE2  GLN  24          1HE2      GLN  24  -0.043  19.898  -4.414
  165    H    CYS  25           H        CYS  25  -0.505  18.945  -1.759
  166    HA   CYS  25           HA       CYS  25  -2.013  17.223  -3.364
  167   1HB   CYS  25          1HB       CYS  25   0.247  16.596  -2.723
  168   2HB   CYS  25          2HB       CYS  25  -0.226  16.444  -1.030
  169    H    ILE  26           H        ILE  26  -1.975  17.220   0.281
  170    HA   ILE  26           HA       ILE  26  -4.104  15.223   0.219
  171    HB   ILE  26           HB       ILE  26  -3.898  15.103   2.551
  172   1HG1  ILE  26          1HG1      ILE  26  -2.424  17.767   2.469
  173   2HG1  ILE  26          2HG1      ILE  26  -3.983  17.418   3.231
  174   1HG2  ILE  26          3HG2      ILE  26  -1.990  14.308   1.040
  175   2HG2  ILE  26          1HG2      ILE  26  -1.080  15.724   1.588
  176   3HG2  ILE  26          2HG2      ILE  26  -1.607  14.502   2.755
  177   1HD1  ILE  26          3HD1      ILE  26  -2.826  15.822   4.781
  178   2HD1  ILE  26          1HD1      ILE  26  -1.270  16.366   4.112
  179   3HD1  ILE  26          2HD1      ILE  26  -2.319  17.514   4.953
  180    H    ASN  27           H        ASN  27  -4.040  18.649   0.143
  181    HA   ASN  27           HA       ASN  27  -6.600  19.131   1.430
  182   1HB   ASN  27          1HB       ASN  27  -4.715  20.669   1.396
  183   2HB   ASN  27          2HB       ASN  27  -4.870  20.890  -0.365
  184   1HD2  ASN  27          2HD2      ASN  27  -6.564  23.598   1.733
  185   2HD2  ASN  27          1HD2      ASN  27  -4.985  22.811   1.871
  186    H    LEU  28           H        LEU  28  -5.357  19.198  -1.985
  187    HA   LEU  28           HA       LEU  28  -8.077  19.202  -3.057
  188   1HB   LEU  28          1HB       LEU  28  -5.295  19.117  -4.248
  189   2HB   LEU  28          2HB       LEU  28  -6.696  18.627  -5.199
  190    HG   LEU  28           HG       LEU  28  -7.806  20.830  -4.610
  191   1HD1  LEU  28          1HD1      LEU  28  -4.988  21.493  -3.647
  192   2HD1  LEU  28          2HD1      LEU  28  -6.252  22.692  -3.985
  193   3HD1  LEU  28          3HD1      LEU  28  -6.476  21.530  -2.675
  194   1HD2  LEU  28          1HD2      LEU  28  -6.800  20.389  -6.802
  195   2HD2  LEU  28          2HD2      LEU  28  -6.578  22.078  -6.317
  196   3HD2  LEU  28          3HD2      LEU  28  -5.224  20.940  -6.205
  197    H    GLU  29           H        GLU  29  -5.423  16.697  -3.397
  198    HA   GLU  29           HA       GLU  29  -7.628  14.724  -3.782
  199   1HB   GLU  29          1HB       GLU  29  -5.955  13.179  -4.501
  200   2HB   GLU  29          2HB       GLU  29  -5.920  14.640  -5.470
  201   1HG   GLU  29          1HG       GLU  29  -3.959  14.322  -3.174
  202   2HG   GLU  29          2HG       GLU  29  -3.726  13.436  -4.671
  203    HE1  GLU  29           HE2      GLU  29  -3.685  17.296  -5.572
  204    H    LYS  30           H        LYS  30  -6.778  12.442  -2.599
  205    HA   LYS  30           HA       LYS  30  -6.751  13.290   0.263
  206   1HB   LYS  30          1HB       LYS  30  -8.406  11.175  -1.111
  207   2HB   LYS  30          2HB       LYS  30  -8.347  11.409   0.644
  208   1HG   LYS  30          1HG       LYS  30  -9.119  13.627  -1.315
  209   2HG   LYS  30          2HG       LYS  30 -10.275  12.564  -0.541
  210   1HD   LYS  30          1HD       LYS  30 -10.120  13.520   1.492
  211   2HD   LYS  30          2HD       LYS  30  -8.418  13.894   1.403
  212   1HE   LYS  30          1HE       LYS  30 -10.608  15.475  -0.027
  213   2HE   LYS  30          2HE       LYS  30  -9.866  15.889   1.523
  214   1HZ   LYS  30          1HZ       LYS  30  -7.679  15.984   0.267
  215   2HZ   LYS  30          2HZ       LYS  30  -8.555  15.952  -1.113
  216   3HZ   LYS  30          3HZ       LYS  30  -8.772  17.156  -0.066
  217    H    ALA  31           H        ALA  31  -4.509  12.280  -1.485
  218    HA   ALA  31           HA       ALA  31  -3.341   9.963  -0.366
  219   1HB   ALA  31          3HB       ALA  31  -2.362  11.393  -2.197
  220   2HB   ALA  31          1HB       ALA  31  -2.186  12.677  -0.985
  221   3HB   ALA  31          2HB       ALA  31  -1.214  11.193  -0.851
  222    H    ARG  32           H        ARG  32  -1.618   9.963   1.420
  223    HA   ARG  32           HA       ARG  32  -2.894  11.271   3.782
  224   1HB   ARG  32          1HB       ARG  32  -0.980   8.938   3.654
  225   2HB   ARG  32          2HB       ARG  32  -1.843   9.514   5.083
  226   1HG   ARG  32          1HG       ARG  32  -3.142   8.311   2.589
  227   2HG   ARG  32          2HG       ARG  32  -2.808   7.478   4.104
  228   1HD   ARG  32          1HD       ARG  32  -5.123   8.011   4.124
  229   2HD   ARG  32          2HD       ARG  32  -4.293   9.024   5.316
  230    HE   ARG  32           HE       ARG  32  -4.950  10.073   2.555
  231   1HH1  ARG  32          1HH2      ARG  32  -5.988  10.091   5.905
  232   2HH1  ARG  32          2HH2      ARG  32  -6.426  11.771   5.922
  233   1HH2  ARG  32          2HH1      ARG  32  -5.224  12.300   2.610
  234   2HH2  ARG  32          1HH1      ARG  32  -6.080  13.068   3.927
  235    H    HIS  33           H        HIS  33   0.452  10.669   2.611
  236    HA   HIS  33           HA       HIS  33   1.233  13.115   4.180
  237   1HB   HIS  33          2HB       HIS  33   3.201  11.063   3.179
  238   2HB   HIS  33          1HB       HIS  33   3.464  12.392   4.291
  239    HD1  HIS  33           HD1      HIS  33   0.557  10.963   5.710
  240    HD2  HIS  33           HD2      HIS  33   4.544   9.739   5.367
  241    HE1  HIS  33           HE1      HIS  33   0.868   9.030   7.323
  242    H    GLY  34           H        GLY  34   2.862  14.436   2.995
  243   1HA   GLY  34          1HA       GLY  34   3.428  13.825   0.278
  244   2HA   GLY  34          2HA       GLY  34   2.374  15.249   0.404
  245    H    SER  35           H        SER  35   5.169  15.155  -0.527
  246    HA   SER  35           HA       SER  35   6.354  17.129   1.160
  247   1HB   SER  35          1HB       SER  35   6.867  15.088   2.585
  248   2HB   SER  35          2HB       SER  35   7.706  14.375   1.204
  249    HG   SER  35           HG       SER  35   9.176  15.485   2.537
  250    H    CYS  36           H        CYS  36   8.724  17.348   0.448
  251    HA   CYS  36           HA       CYS  36   8.575  17.591  -2.531
  252   1HB   CYS  36          1HB       CYS  36   8.249  19.681  -1.412
  253   2HB   CYS  36          2HB       CYS  36   9.692  19.443  -0.392
  254    H    ASN  37           H        ASN  37   9.809  15.875  -3.185
  255    HA   ASN  37           HA       ASN  37  12.170  15.047  -1.573
  256   1HB   ASN  37          1HB       ASN  37  10.501  13.393  -2.367
  257   2HB   ASN  37          2HB       ASN  37  10.873  13.845  -4.049
  258   1HD2  ASN  37          2HD2      ASN  37  13.870  11.936  -4.161
  259   2HD2  ASN  37          1HD2      ASN  37  13.055  13.283  -4.935
  260    H    TYR  38           H        TYR  38  14.302  14.923  -2.575
  261    HA   TYR  38           HA       TYR  38  14.616  16.759  -4.878
  262   1HB   TYR  38          1HB       TYR  38  16.203  17.074  -3.082
  263   2HB   TYR  38          2HB       TYR  38  16.774  15.418  -3.251
  264    HD1  TYR  38           HD1      TYR  38  16.042  18.330  -5.603
  265    HD2  TYR  38           HD2      TYR  38  18.903  15.344  -4.370
  266    HE1  TYR  38           HE1      TYR  38  17.270  18.631  -7.711
  267    HE2  TYR  38           HE2      TYR  38  20.082  15.606  -6.534
  268    HH   TYR  38           HH       TYR  38  18.773  17.665  -9.158
  269    H    VAL  39           H        VAL  39  16.939  14.325  -4.999
  270    HA   VAL  39           HA       VAL  39  17.529  12.893  -6.596
  271    HB   VAL  39           HB       VAL  39  14.554  12.232  -6.762
  272   1HG1  VAL  39          1HG1      VAL  39  16.907  10.841  -8.090
  273   2HG1  VAL  39          2HG1      VAL  39  15.275  10.169  -7.920
  274   3HG1  VAL  39          3HG1      VAL  39  15.522  11.609  -8.907
  275   1HG2  VAL  39          3HG2      VAL  39  15.813  11.700  -4.613
  276   2HG2  VAL  39          1HG2      VAL  39  15.207  10.273  -5.475
  277   3HG2  VAL  39          2HG2      VAL  39  16.922  10.717  -5.577
  278    H    PHE  40           H        PHE  40  17.799  12.809  -8.952
  279    HA   PHE  40           HA       PHE  40  17.764  15.385 -10.031
  280   1HB   PHE  40          1HB       PHE  40  18.641  14.414 -12.018
  281   2HB   PHE  40          2HB       PHE  40  19.235  13.435 -10.702
  282    HD1  PHE  40           HD1      PHE  40  18.312  11.099 -10.368
  283    HD2  PHE  40           HD2      PHE  40  17.103  13.580 -13.694
  284    HE1  PHE  40           HE1      PHE  40  17.194   9.160 -11.422
  285    HE2  PHE  40           HE2      PHE  40  16.005  11.628 -14.741
  286    HZ   PHE  40           HZ       PHE  40  16.031   9.421 -13.601
  287    HA   PRO  41           HA       PRO  41  17.665  16.410 -12.120
  288   1HB   PRO  41          1HB       PRO  41  16.377  18.326 -13.507
  289   2HB   PRO  41          2HB       PRO  41  16.680  16.695 -14.176
  290   1HG   PRO  41          1HG       PRO  41  14.100  17.749 -13.012
  291   2HG   PRO  41          2HG       PRO  41  14.345  16.781 -14.485
  292   1HD   PRO  41          1HD       PRO  41  13.633  15.683 -12.023
  293   2HD   PRO  41          2HD       PRO  41  14.529  14.792 -13.277
  294    H    ALA  42           H        ALA  42  14.474  17.627 -11.007
  295    HA   ALA  42           HA       ALA  42  15.792  19.571  -9.164
  296   1HB   ALA  42          3HB       ALA  42  14.797  20.654 -11.151
  297   2HB   ALA  42          1HB       ALA  42  13.235  19.892 -10.780
  298   3HB   ALA  42          2HB       ALA  42  13.932  21.087  -9.667
  299    H    HIS  43           H        HIS  43  14.101  20.331  -7.506
  300    HA   HIS  43           HA       HIS  43  13.268  18.116  -5.917
  301   1HB   HIS  43          2HB       HIS  43  12.641  21.088  -5.795
  302   2HB   HIS  43          1HB       HIS  43  12.137  19.955  -4.564
  303    HD1  HIS  43           HD1      HIS  43  15.169  21.847  -5.642
  304    HD2  HIS  43           HD2      HIS  43  14.148  18.787  -2.960
  305    HE1  HIS  43           HE1      HIS  43  17.139  21.522  -4.080
  306    H    LYS  44           H        LYS  44  11.357  17.054  -5.878
  307    HA   LYS  44           HA       LYS  44   9.205  17.863  -7.790
  308   1HB   LYS  44          1HB       LYS  44   9.021  15.511  -8.449
  309   2HB   LYS  44          2HB       LYS  44  10.600  16.217  -8.821
  310   1HG   LYS  44          1HG       LYS  44  11.501  15.122  -6.688
  311   2HG   LYS  44          2HG       LYS  44   9.929  14.363  -6.492
  312   1HD   LYS  44          1HD       LYS  44  11.491  12.806  -7.485
  313   2HD   LYS  44          2HD       LYS  44  10.172  13.152  -8.603
  314   1HE   LYS  44          1HE       LYS  44  12.470  13.011  -9.636
  315   2HE   LYS  44          2HE       LYS  44  11.594  14.492 -10.024
  316   1HZ   LYS  44          1HZ       LYS  44  13.543  14.401  -7.805
  317   2HZ   LYS  44          2HZ       LYS  44  14.010  14.666  -9.327
  318   3HZ   LYS  44          3HZ       LYS  44  12.993  15.716  -8.590
  319    H    CYS  45           H        CYS  45   7.114  17.570  -7.173
  320    HA   CYS  45           HA       CYS  45   6.651  17.305  -4.325
  321   1HB   CYS  45          1HB       CYS  45   5.343  18.936  -5.687
  322   2HB   CYS  45          2HB       CYS  45   4.740  17.618  -6.660
  323    H    ILE  46           H        ILE  46   6.792  15.289  -3.432
  324    HA   ILE  46           HA       ILE  46   5.586  12.952  -4.847
  325    HB   ILE  46           HB       ILE  46   7.374  13.157  -2.397
  326   1HG1  ILE  46          1HG1      ILE  46   8.616  13.539  -4.440
  327   2HG1  ILE  46          2HG1      ILE  46   9.035  11.974  -3.738
  328   1HG2  ILE  46          1HG2      ILE  46   6.059  10.718  -3.653
  329   2HG2  ILE  46          2HG2      ILE  46   7.438  10.634  -2.534
  330   3HG2  ILE  46          3HG2      ILE  46   5.905  11.302  -1.993
  331   1HD1  ILE  46          2HD1      ILE  46   7.538  10.864  -5.437
  332   2HD1  ILE  46          3HD1      ILE  46   7.294  12.460  -6.191
  333   3HD1  ILE  46          1HD1      ILE  46   8.907  11.746  -6.127
  334    H    CYS  47           H        CYS  47   3.864  11.854  -3.974
  335    HA   CYS  47           HA       CYS  47   2.926  12.698  -1.336
  336   1HB   CYS  47          1HB       CYS  47   1.702  13.903  -3.274
  337   2HB   CYS  47          2HB       CYS  47   0.829  12.365  -3.438
  338    H    TYR  48           H        TYR  48   1.730  11.156  -0.222
  339    HA   TYR  48           HA       TYR  48   2.573   8.402  -1.008
  340   1HB   TYR  48          1HB       TYR  48   2.230   9.669   1.721
  341   2HB   TYR  48          2HB       TYR  48   2.720   8.019   1.387
  342    HD1  TYR  48           HD1      TYR  48   3.815  11.565   0.650
  343    HD2  TYR  48           HD2      TYR  48   5.007   7.507   1.491
  344    HE1  TYR  48           HE1      TYR  48   6.172  12.271   0.675
  345    HE2  TYR  48           HE2      TYR  48   7.363   8.238   1.600
  346    HH   TYR  48           HH       TYR  48   8.844  10.000   1.341
  347    H    PHE  49           H        PHE  49   0.895   7.077  -1.468
  348    HA   PHE  49           HA       PHE  49  -1.818   7.705  -0.412
  349   1HB   PHE  49          1HB       PHE  49  -1.066   6.274  -2.972
  350   2HB   PHE  49          2HB       PHE  49  -2.638   6.781  -2.504
  351    HD1  PHE  49           HD1      PHE  49   0.747   8.375  -3.206
  352    HD2  PHE  49           HD2      PHE  49  -3.544   8.551  -3.730
  353    HE1  PHE  49           HE1      PHE  49   0.998  10.296  -4.686
  354    HE2  PHE  49           HE2      PHE  49  -3.220  10.207  -5.535
  355    HZ   PHE  49           HZ       PHE  49  -0.897  10.905  -6.169
  356    HA   PRO  50           HA       PRO  50  -1.661   3.441   1.171
  357   1HB   PRO  50          1HB       PRO  50  -4.236   2.579   0.699
  358   2HB   PRO  50          2HB       PRO  50  -3.779   3.684   2.026
  359   1HG   PRO  50          1HG       PRO  50  -4.883   4.420  -0.698
  360   2HG   PRO  50          2HG       PRO  50  -5.427   5.014   0.899
  361   1HD   PRO  50          1HD       PRO  50  -3.707   6.451  -0.651
  362   2HD   PRO  50          2HD       PRO  50  -3.462   6.379   1.136
  363    H    CYS  51           H        CYS  51  -0.779   1.734   0.112
  364    HA   CYS  51           HA       CYS  51  -0.539   1.910  -2.737
  365   1HB   CYS  51          1HB       CYS  51   1.207   1.310  -1.013
  366   2HB   CYS  51          2HB       CYS  51   0.514  -0.314  -0.963
   
  No H/Q in entry =         366
  Start of MODEL   19
    1    HA   PCA   1           HA       PYR   1  -1.611   0.670   6.560
    2   1HB   PCA   1          1HB       PYR   1  -2.535   0.590   3.684
    3   2HB   PCA   1          2HB       PYR   1  -2.652  -0.698   4.920
    4   1HG   PCA   1          1HG       PYR   1  -4.793   0.944   4.220
    5   2HG   PCA   1          2HG       PYR   1  -4.582   0.315   5.883
    6    HN   PCA   1           HN       PYR   1  -2.115   3.265   6.209
    7    H    LYS   2           H        LYS   2  -0.058  -0.387   4.651
    8    HA   LYS   2           HA       LYS   2   2.239   1.217   4.597
    9   1HB   LYS   2          1HB       LYS   2   2.211  -1.257   4.305
   10   2HB   LYS   2          2HB       LYS   2   1.467  -1.044   2.723
   11   1HG   LYS   2          1HG       LYS   2   3.705   0.559   2.401
   12   2HG   LYS   2          2HG       LYS   2   4.280  -0.494   3.671
   13   1HD   LYS   2          1HD       LYS   2   4.920  -1.241   1.416
   14   2HD   LYS   2          2HD       LYS   2   3.985  -2.462   2.277
   15   1HE   LYS   2          1HE       LYS   2   3.472  -2.033  -0.239
   16   2HE   LYS   2          2HE       LYS   2   2.120  -2.232   0.874
   17   1HZ   LYS   2          3HZ       LYS   2   3.085   0.429  -0.050
   18   2HZ   LYS   2          1HZ       LYS   2   1.740  -0.401  -0.575
   19   3HZ   LYS   2          2HZ       LYS   2   1.805   0.117   0.917
   20    H    LEU   3           H        LEU   3   2.660   3.036   3.456
   21    HA   LEU   3           HA       LEU   3   0.999   4.025   1.412
   22   1HB   LEU   3          1HB       LEU   3   3.827   4.784   2.093
   23   2HB   LEU   3          2HB       LEU   3   2.719   5.744   1.120
   24    HG   LEU   3           HG       LEU   3   2.206   5.031   4.047
   25   1HD1  LEU   3          1HD1      LEU   3   4.214   6.438   3.802
   26   2HD1  LEU   3          2HD1      LEU   3   3.292   7.602   2.831
   27   3HD1  LEU   3          3HD1      LEU   3   2.873   7.330   4.536
   28   1HD2  LEU   3          3HD2      LEU   3   0.859   6.997   2.135
   29   2HD2  LEU   3          1HD2      LEU   3   0.127   5.544   2.858
   30   3HD2  LEU   3          2HD2      LEU   3   0.566   6.912   3.882
   31    H    CYS   4           H        CYS   4   1.464   4.540  -0.749
   32    HA   CYS   4           HA       CYS   4   3.717   3.274  -2.195
   33   1HB   CYS   4          1HB       CYS   4   0.808   3.382  -3.127
   34   2HB   CYS   4          2HB       CYS   4   2.179   2.975  -4.143
   35    H    GLU   5           H        GLU   5   4.490   4.770  -3.766
   36    HA   GLU   5           HA       GLU   5   3.662   7.558  -3.418
   37   1HB   GLU   5          1HB       GLU   5   5.744   6.227  -5.209
   38   2HB   GLU   5          2HB       GLU   5   5.459   7.970  -5.101
   39   1HG   GLU   5          1HG       GLU   5   6.002   7.956  -2.719
   40   2HG   GLU   5          2HG       GLU   5   6.315   6.208  -2.761
   41    HE2  GLU   5           HE2      GLU   5   9.587   7.507  -3.074
   42    H    ARG   6           H        ARG   6   2.718   8.835  -5.025
   43    HA   ARG   6           HA       ARG   6   2.098   7.577  -7.658
   44   1HB   ARG   6          1HB       ARG   6   0.074   7.826  -5.930
   45   2HB   ARG   6          2HB       ARG   6   0.070   9.486  -6.576
   46   1HG   ARG   6          1HG       ARG   6   0.063   8.428  -8.893
   47   2HG   ARG   6          2HG       ARG   6  -0.250   6.885  -8.049
   48   1HD   ARG   6          1HD       ARG   6  -2.392   7.627  -8.628
   49   2HD   ARG   6          2HD       ARG   6  -2.214   8.111  -6.927
   50    HE   ARG   6           HE       ARG   6  -1.387  10.099  -8.972
   51   1HH1  ARG   6          1HH2      ARG   6  -4.100   9.076  -6.899
   52   2HH1  ARG   6          2HH2      ARG   6  -4.713  10.723  -6.811
   53   1HH2  ARG   6          1HH1      ARG   6  -2.387  12.121  -9.011
   54   2HH2  ARG   6          2HH1      ARG   6  -3.809  12.382  -8.035
   55    HA   PRO   7           HA       PRO   7   4.827  11.289  -7.872
   56   1HB   PRO   7          1HB       PRO   7   4.989  10.112 -10.666
   57   2HB   PRO   7          2HB       PRO   7   6.280  10.899  -9.710
   58   1HG   PRO   7          1HG       PRO   7   6.159   8.197  -9.796
   59   2HG   PRO   7          2HG       PRO   7   6.403   9.006  -8.219
   60   1HD   PRO   7          1HD       PRO   7   3.831   7.895  -9.365
   61   2HD   PRO   7          2HD       PRO   7   4.501   7.731  -7.716
   62    H    SER   8           H        SER   8   2.559  10.288 -10.541
   63    HA   SER   8           HA       SER   8   1.835  13.016 -11.148
   64   1HB   SER   8          1HB       SER   8   0.245  10.478 -11.689
   65   2HB   SER   8          2HB       SER   8   0.180  12.020 -12.562
   66    HG   SER   8           HG       SER   8   2.427  11.609 -13.108
   67    H    GLY   9           H        GLY   9   1.528  13.773  -8.911
   68   1HA   GLY   9          1HA       GLY   9  -0.731  12.739  -7.357
   69   2HA   GLY   9          2HA       GLY   9   0.302  14.122  -6.972
   70    H    THR  10           H        THR  10  -0.381  16.110  -7.451
   71    HA   THR  10           HA       THR  10  -2.631  16.609  -9.374
   72    HB   THR  10           HB       THR  10  -2.851  18.770  -7.947
   73    HG1  THR  10           HG1      THR  10  -2.191  18.436  -5.741
   74   1HG2  THR  10          1HG2      THR  10  -3.651  16.145  -6.649
   75   2HG2  THR  10          2HG2      THR  10  -4.320  17.749  -6.269
   76   3HG2  THR  10          3HG2      THR  10  -4.580  17.043  -7.875
   77    H    TRP  11           H        TRP  11  -0.375  18.491  -7.571
   78    HA   TRP  11           HA       TRP  11   0.903  19.963  -9.675
   79   1HB   TRP  11          1HB       TRP  11   0.544  20.659  -7.336
   80   2HB   TRP  11          2HB       TRP  11   1.559  19.339  -6.768
   81    HD1  TRP  11           HD1      TRP  11   3.519  20.744  -9.507
   82    HE1  TRP  11           HE1      TRP  11   5.273  22.394  -8.569
   83    HE3  TRP  11           HE3      TRP  11   1.588  21.412  -4.831
   84    HZ2  TRP  11           HZ2      TRP  11   5.578  24.029  -6.228
   85    HZ3  TRP  11           HZ3      TRP  11   2.643  22.988  -3.258
   86    HH2  TRP  11           HH2      TRP  11   4.734  24.137  -3.857
   87    H    SER  12           H        SER  12   1.279  17.922 -10.969
   88    HA   SER  12           HA       SER  12   3.244  16.013  -9.984
   89   1HB   SER  12          1HB       SER  12   2.001  16.345 -12.749
   90   2HB   SER  12          2HB       SER  12   2.801  14.908 -12.100
   91    HG   SER  12           HG       SER  12   0.394  16.141 -11.134
   92    H    GLY  13           H        GLY  13   4.750  18.042  -9.659
   93   1HA   GLY  13          1HA       GLY  13   6.729  18.159 -11.821
   94   2HA   GLY  13          2HA       GLY  13   5.731  19.610 -11.661
   95    H    VAL  14           H        VAL  14   7.809  20.605 -11.310
   96    HA   VAL  14           HA       VAL  14   9.490  20.064  -9.099
   97    HB   VAL  14           HB       VAL  14   9.091  22.656 -10.633
   98   1HG1  VAL  14          3HG1      VAL  14  11.429  21.724  -8.913
   99   2HG1  VAL  14          1HG1      VAL  14  11.399  23.191  -9.909
  100   3HG1  VAL  14          2HG1      VAL  14  10.310  23.048  -8.526
  101   1HG2  VAL  14          3HG2      VAL  14  11.047  20.346 -11.067
  102   2HG2  VAL  14          1HG2      VAL  14   9.733  20.821 -12.165
  103   3HG2  VAL  14          2HG2      VAL  14  11.106  21.903 -11.920
  104    H    CYS  15           H        CYS  15   9.367  20.740  -7.016
  105    HA   CYS  15           HA       CYS  15   6.733  21.763  -6.171
  106   1HB   CYS  15          1HB       CYS  15   7.005  20.625  -4.219
  107   2HB   CYS  15          2HB       CYS  15   7.806  19.578  -5.396
  108    H    GLY  16           H        GLY  16  10.203  22.563  -5.689
  109   1HA   GLY  16          1HA       GLY  16  11.164  24.439  -4.719
  110   2HA   GLY  16          2HA       GLY  16   9.576  25.201  -4.591
  111    H    ASN  17           H        ASN  17   8.170  23.350  -2.977
  112    HA   ASN  17           HA       ASN  17   9.686  23.250  -0.424
  113   1HB   ASN  17          1HB       ASN  17   8.730  25.499  -0.578
  114   2HB   ASN  17          2HB       ASN  17   7.133  24.816  -0.924
  115   1HD2  ASN  17          2HD2      ASN  17   8.592  24.769   2.927
  116   2HD2  ASN  17          1HD2      ASN  17   9.653  25.164   1.590
  117    H    ASN  18           H        ASN  18   9.239  21.549   0.761
  118    HA   ASN  18           HA       ASN  18   7.582  19.425   0.121
  119   1HB   ASN  18          1HB       ASN  18   9.566  19.518   1.691
  120   2HB   ASN  18          2HB       ASN  18   8.545  20.276   2.896
  121   1HD2  ASN  18          2HD2      ASN  18   8.163  16.292   2.227
  122   2HD2  ASN  18          1HD2      ASN  18   9.256  17.183   1.172
  123    H    ASN  19           H        ASN  19   7.038  21.698   2.709
  124    HA   ASN  19           HA       ASN  19   4.559  20.818   3.591
  125   1HB   ASN  19          1HB       ASN  19   6.076  22.623   4.598
  126   2HB   ASN  19          2HB       ASN  19   5.192  23.775   3.592
  127   1HD2  ASN  19          2HD2      ASN  19   2.075  22.733   5.555
  128   2HD2  ASN  19          1HD2      ASN  19   2.476  22.440   3.877
  129    H    ALA  20           H        ALA  20   5.134  23.262   1.018
  130    HA   ALA  20           HA       ALA  20   2.369  23.804   0.515
  131   1HB   ALA  20          3HB       ALA  20   4.177  25.225  -0.379
  132   2HB   ALA  20          1HB       ALA  20   4.687  23.904  -1.459
  133   3HB   ALA  20          2HB       ALA  20   3.090  24.657  -1.658
  134    H    CYS  21           H        CYS  21   4.654  21.575  -1.144
  135    HA   CYS  21           HA       CYS  21   2.898  20.391  -2.936
  136   1HB   CYS  21          1HB       CYS  21   5.169  19.875  -3.149
  137   2HB   CYS  21          2HB       CYS  21   5.326  19.352  -1.471
  138    H    LYS  22           H        LYS  22   3.725  19.308   0.327
  139    HA   LYS  22           HA       LYS  22   2.106  17.089   0.730
  140   1HB   LYS  22          1HB       LYS  22   3.864  17.833   2.223
  141   2HB   LYS  22          2HB       LYS  22   3.010  19.318   2.602
  142   1HG   LYS  22          1HG       LYS  22   1.194  18.067   3.718
  143   2HG   LYS  22          2HG       LYS  22   2.027  16.567   3.420
  144   1HD   LYS  22          1HD       LYS  22   2.657  18.860   5.278
  145   2HD   LYS  22          2HD       LYS  22   2.615  17.143   5.654
  146   1HE   LYS  22          1HE       LYS  22   4.802  18.693   4.179
  147   2HE   LYS  22          2HE       LYS  22   4.907  18.051   5.810
  148   1HZ   LYS  22          3HZ       LYS  22   4.541  16.326   3.455
  149   2HZ   LYS  22          1HZ       LYS  22   6.013  16.762   3.983
  150   3HZ   LYS  22          2HZ       LYS  22   5.015  15.871   4.952
  151    H    ASN  23           H        ASN  23   1.346  20.425   1.746
  152    HA   ASN  23           HA       ASN  23  -1.282  19.902   2.582
  153   1HB   ASN  23          1HB       ASN  23  -0.288  22.023   3.163
  154   2HB   ASN  23          2HB       ASN  23   0.105  22.379   1.477
  155   1HD2  ASN  23          2HD2      ASN  23  -2.677  24.537   1.474
  156   2HD2  ASN  23          1HD2      ASN  23  -0.931  24.397   1.414
  157    H    GLN  24           H        GLN  24  -0.220  21.301  -0.586
  158    HA   GLN  24           HA       GLN  24  -2.797  21.362  -1.678
  159   1HB   GLN  24          1HB       GLN  24  -0.078  21.061  -3.024
  160   2HB   GLN  24          2HB       GLN  24  -1.606  21.292  -3.904
  161   1HG   GLN  24          1HG       GLN  24  -2.019  23.411  -2.720
  162   2HG   GLN  24          2HG       GLN  24  -0.550  23.199  -1.758
  163   1HE2  GLN  24          2HE2      GLN  24   0.243  23.807  -5.745
  164   2HE2  GLN  24          1HE2      GLN  24  -0.835  22.504  -5.270
  165    H    CYS  25           H        CYS  25  -0.440  18.615  -1.824
  166    HA   CYS  25           HA       CYS  25  -2.074  17.022  -3.491
  167   1HB   CYS  25          1HB       CYS  25   0.259  16.375  -2.869
  168   2HB   CYS  25          2HB       CYS  25  -0.314  15.965  -1.253
  169    H    ILE  26           H        ILE  26  -1.912  16.942   0.149
  170    HA   ILE  26           HA       ILE  26  -4.068  14.965   0.128
  171    HB   ILE  26           HB       ILE  26  -3.778  14.745   2.427
  172   1HG1  ILE  26          1HG1      ILE  26  -2.339  17.408   2.435
  173   2HG1  ILE  26          2HG1      ILE  26  -3.871  16.978   3.227
  174   1HG2  ILE  26          3HG2      ILE  26  -1.898  14.001   0.868
  175   2HG2  ILE  26          1HG2      ILE  26  -0.983  15.412   1.427
  176   3HG2  ILE  26          2HG2      ILE  26  -1.474  14.154   2.576
  177   1HD1  ILE  26          1HD1      ILE  26  -2.631  15.349   4.664
  178   2HD1  ILE  26          2HD1      ILE  26  -1.105  15.968   3.980
  179   3HD1  ILE  26          3HD1      ILE  26  -2.162  17.045   4.905
  180    H    ASN  27           H        ASN  27  -3.956  18.375   0.100
  181    HA   ASN  27           HA       ASN  27  -6.552  18.837   1.336
  182   1HB   ASN  27          1HB       ASN  27  -4.639  20.347   1.427
  183   2HB   ASN  27          2HB       ASN  27  -4.750  20.647  -0.324
  184   1HD2  ASN  27          2HD2      ASN  27  -6.444  23.326   1.750
  185   2HD2  ASN  27          1HD2      ASN  27  -4.861  22.543   1.848
  186    H    LEU  28           H        LEU  28  -5.225  19.145  -2.053
  187    HA   LEU  28           HA       LEU  28  -7.863  19.508  -3.165
  188   1HB   LEU  28          1HB       LEU  28  -5.106  19.076  -4.343
  189   2HB   LEU  28          2HB       LEU  28  -6.551  18.996  -5.335
  190    HG   LEU  28           HG       LEU  28  -7.208  21.247  -4.803
  191   1HD1  LEU  28          2HD1      LEU  28  -4.715  21.405  -3.062
  192   2HD1  LEU  28          3HD1      LEU  28  -5.707  22.787  -3.555
  193   3HD1  LEU  28          1HD1      LEU  28  -6.401  21.547  -2.510
  194   1HD2  LEU  28          3HD2      LEU  28  -5.645  20.836  -6.677
  195   2HD2  LEU  28          1HD2      LEU  28  -5.367  22.424  -5.941
  196   3HD2  LEU  28          2HD2      LEU  28  -4.265  21.079  -5.582
  197    H    GLU  29           H        GLU  29  -5.541  16.710  -3.372
  198    HA   GLU  29           HA       GLU  29  -7.927  14.993  -3.974
  199   1HB   GLU  29          1HB       GLU  29  -6.487  13.251  -4.684
  200   2HB   GLU  29          2HB       GLU  29  -6.258  14.703  -5.649
  201   1HG   GLU  29          1HG       GLU  29  -4.161  15.193  -4.433
  202   2HG   GLU  29          2HG       GLU  29  -4.340  13.690  -3.501
  203    HE2  GLU  29           HE2      GLU  29  -2.272  14.435  -5.281
  204    H    LYS  30           H        LYS  30  -7.213  12.685  -2.768
  205    HA   LYS  30           HA       LYS  30  -7.197  13.513   0.097
  206   1HB   LYS  30          1HB       LYS  30  -8.906  11.518  -1.396
  207   2HB   LYS  30          2HB       LYS  30  -8.793  11.535   0.370
  208   1HG   LYS  30          1HG       LYS  30  -9.542  14.005  -1.252
  209   2HG   LYS  30          2HG       LYS  30 -10.720  12.864  -0.625
  210   1HD   LYS  30          1HD       LYS  30 -10.607  13.604   1.475
  211   2HD   LYS  30          2HD       LYS  30  -8.862  13.712   1.522
  212   1HE   LYS  30          1HE       LYS  30 -10.660  15.779   0.160
  213   2HE   LYS  30          2HE       LYS  30 -10.115  15.899   1.838
  214   1HZ   LYS  30          1HZ       LYS  30  -8.263  15.806  -0.462
  215   2HZ   LYS  30          2HZ       LYS  30  -8.728  17.167   0.270
  216   3HZ   LYS  30          3HZ       LYS  30  -7.828  16.054   1.068
  217    H    ALA  31           H        ALA  31  -4.971  12.500  -1.707
  218    HA   ALA  31           HA       ALA  31  -3.929  10.074  -0.770
  219   1HB   ALA  31          2HB       ALA  31  -2.859  11.705  -2.431
  220   2HB   ALA  31          3HB       ALA  31  -2.407  12.676  -1.019
  221   3HB   ALA  31          1HB       ALA  31  -1.758  11.030  -1.205
  222    H    ARG  32           H        ARG  32  -2.321   9.710   0.917
  223    HA   ARG  32           HA       ARG  32  -3.496  10.773   3.388
  224   1HB   ARG  32          1HB       ARG  32  -3.456   8.399   2.938
  225   2HB   ARG  32          2HB       ARG  32  -1.692   8.424   2.717
  226   1HG   ARG  32          1HG       ARG  32  -2.431   7.325   4.747
  227   2HG   ARG  32          2HG       ARG  32  -1.315   8.658   5.051
  228   1HD   ARG  32          1HD       ARG  32  -4.358   8.785   5.335
  229   2HD   ARG  32          2HD       ARG  32  -3.244   8.492   6.688
  230    HE   ARG  32           HE       ARG  32  -2.233  10.782   5.634
  231   1HH1  ARG  32          2HH2      ARG  32  -5.450  10.063   6.856
  232   2HH1  ARG  32          1HH2      ARG  32  -6.013  11.703   6.741
  233   1HH2  ARG  32          1HH1      ARG  32  -2.930  12.804   5.281
  234   2HH2  ARG  32          2HH1      ARG  32  -4.461  13.383   5.903
  235    H    HIS  33           H        HIS  33  -0.212  10.290   2.002
  236    HA   HIS  33           HA       HIS  33   0.700  12.602   3.668
  237   1HB   HIS  33          2HB       HIS  33   2.301  10.159   2.844
  238   2HB   HIS  33          1HB       HIS  33   3.017  11.681   3.375
  239    HD1  HIS  33           HD1      HIS  33   0.098  11.318   5.412
  240    HD2  HIS  33           HD2      HIS  33   3.925   9.610   5.369
  241    HE1  HIS  33           HE1      HIS  33   0.510  10.332   7.730
  242    H    GLY  34           H        GLY  34   2.111  14.004   2.627
  243   1HA   GLY  34          1HA       GLY  34   2.604  13.661  -0.198
  244   2HA   GLY  34          2HA       GLY  34   1.665  15.098   0.213
  245    H    SER  35           H        SER  35   4.608  14.762  -0.684
  246    HA   SER  35           HA       SER  35   5.962  16.436   1.186
  247   1HB   SER  35          1HB       SER  35   5.808  13.695   2.118
  248   2HB   SER  35          2HB       SER  35   7.425  13.903   1.471
  249    HG   SER  35           HG       SER  35   7.405  14.522   3.597
  250    H    CYS  36           H        CYS  36   7.191  17.412  -0.243
  251    HA   CYS  36           HA       CYS  36   7.907  16.245  -2.778
  252   1HB   CYS  36          1HB       CYS  36   7.527  18.673  -2.484
  253   2HB   CYS  36          2HB       CYS  36   8.896  18.739  -1.344
  254    H    ASN  37           H        ASN  37   9.876  15.508  -3.444
  255    HA   ASN  37           HA       ASN  37  11.973  14.945  -1.372
  256   1HB   ASN  37          1HB       ASN  37  10.857  12.864  -1.954
  257   2HB   ASN  37          2HB       ASN  37  10.929  13.262  -3.681
  258   1HD2  ASN  37          2HD2      ASN  37  14.029  11.654  -4.042
  259   2HD2  ASN  37          1HD2      ASN  37  12.449  12.022  -4.709
  260    H    TYR  38           H        TYR  38  14.168  14.741  -2.386
  261    HA   TYR  38           HA       TYR  38  14.449  16.792  -4.479
  262   1HB   TYR  38          1HB       TYR  38  15.855  17.087  -2.539
  263   2HB   TYR  38          2HB       TYR  38  16.581  15.503  -2.773
  264    HD1  TYR  38           HD1      TYR  38  15.825  18.505  -4.991
  265    HD2  TYR  38           HD2      TYR  38  18.810  15.698  -3.639
  266    HE1  TYR  38           HE1      TYR  38  17.240  19.072  -6.919
  267    HE2  TYR  38           HE2      TYR  38  20.175  16.211  -5.643
  268    HH   TYR  38           HH       TYR  38  18.955  18.336  -8.258
  269    H    VAL  39           H        VAL  39  16.971  14.583  -4.578
  270    HA   VAL  39           HA       VAL  39  17.964  13.601  -6.249
  271    HB   VAL  39           HB       VAL  39  17.022  11.802  -7.432
  272   1HG1  VAL  39          3HG1      VAL  39  17.628  11.453  -5.099
  273   2HG1  VAL  39          1HG1      VAL  39  15.988  11.869  -4.574
  274   3HG1  VAL  39          2HG1      VAL  39  16.266  10.415  -5.552
  275   1HG2  VAL  39          1HG2      VAL  39  14.794  12.733  -8.063
  276   2HG2  VAL  39          2HG2      VAL  39  14.777  11.073  -7.464
  277   3HG2  VAL  39          3HG2      VAL  39  14.230  12.372  -6.409
  278    H    PHE  40           H        PHE  40  18.228  13.436  -8.690
  279    HA   PHE  40           HA       PHE  40  18.160  16.087  -9.538
  280   1HB   PHE  40          1HB       PHE  40  19.197  15.354 -11.534
  281   2HB   PHE  40          2HB       PHE  40  19.728  14.240 -10.299
  282    HD1  PHE  40           HD1      PHE  40  18.776  11.873 -10.265
  283    HD2  PHE  40           HD2      PHE  40  17.853  14.679 -13.420
  284    HE1  PHE  40           HE1      PHE  40  17.813  10.045 -11.625
  285    HE2  PHE  40           HE2      PHE  40  16.902  12.839 -14.770
  286    HZ   PHE  40           HZ       PHE  40  16.867  10.523 -13.872
  287    HA   PRO  41           HA       PRO  41  18.138  17.341 -11.471
  288   1HB   PRO  41          1HB       PRO  41  16.863  19.352 -12.737
  289   2HB   PRO  41          2HB       PRO  41  17.300  17.824 -13.553
  290   1HG   PRO  41          1HG       PRO  41  14.586  18.637 -12.513
  291   2HG   PRO  41          2HG       PRO  41  15.000  17.828 -14.041
  292   1HD   PRO  41          1HD       PRO  41  14.147  16.474 -11.751
  293   2HD   PRO  41          2HD       PRO  41  15.159  15.740 -13.019
  294    H    ALA  42           H        ALA  42  14.829  18.375 -10.526
  295    HA   ALA  42           HA       ALA  42  15.925  20.137  -8.380
  296   1HB   ALA  42          3HB       ALA  42  15.037  21.379 -10.318
  297   2HB   ALA  42          1HB       ALA  42  13.483  20.534 -10.145
  298   3HB   ALA  42          2HB       ALA  42  14.050  21.630  -8.867
  299    H    HIS  43           H        HIS  43  14.076  20.664  -6.791
  300    HA   HIS  43           HA       HIS  43  13.227  18.280  -5.468
  301   1HB   HIS  43          2HB       HIS  43  12.403  21.187  -5.158
  302   2HB   HIS  43          1HB       HIS  43  11.991  19.930  -4.007
  303    HD1  HIS  43           HD1      HIS  43  13.770  19.029  -2.396
  304    HD2  HIS  43           HD2      HIS  43  15.197  21.951  -5.046
  305    HE1  HIS  43           HE1      HIS  43  16.079  19.721  -1.592
  306    H    LYS  44           H        LYS  44  11.383  17.122  -5.686
  307    HA   LYS  44           HA       LYS  44   9.356  18.039  -7.688
  308   1HB   LYS  44          1HB       LYS  44   9.344  15.773  -8.603
  309   2HB   LYS  44          2HB       LYS  44  10.905  16.589  -8.767
  310   1HG   LYS  44          1HG       LYS  44  11.715  15.296  -6.716
  311   2HG   LYS  44          2HG       LYS  44  10.173  14.456  -6.710
  312   1HD   LYS  44          1HD       LYS  44  11.859  13.082  -7.763
  313   2HD   LYS  44          2HD       LYS  44  10.597  13.503  -8.922
  314   1HE   LYS  44          1HE       LYS  44  12.957  13.573  -9.811
  315   2HE   LYS  44          2HE       LYS  44  12.044  15.057 -10.081
  316   1HZ   LYS  44          2HZ       LYS  44  13.845  14.769  -7.759
  317   2HZ   LYS  44          3HZ       LYS  44  14.401  15.231  -9.202
  318   3HZ   LYS  44          1HZ       LYS  44  13.291  16.149  -8.418
  319    H    CYS  45           H        CYS  45   7.259  17.717  -7.242
  320    HA   CYS  45           HA       CYS  45   6.656  17.169  -4.476
  321   1HB   CYS  45          1HB       CYS  45   5.531  18.973  -5.624
  322   2HB   CYS  45          2HB       CYS  45   4.882  17.851  -6.815
  323    H    ILE  46           H        ILE  46   7.229  14.945  -4.225
  324    HA   ILE  46           HA       ILE  46   5.571  12.891  -5.509
  325    HB   ILE  46           HB       ILE  46   7.414  12.723  -3.102
  326   1HG1  ILE  46          1HG1      ILE  46   8.758  13.414  -4.958
  327   2HG1  ILE  46          2HG1      ILE  46   9.067  11.715  -4.626
  328   1HG2  ILE  46          3HG2      ILE  46   6.195  10.524  -4.824
  329   2HG2  ILE  46          1HG2      ILE  46   7.471  10.290  -3.610
  330   3HG2  ILE  46          2HG2      ILE  46   5.873  10.839  -3.114
  331   1HD1  ILE  46          2HD1      ILE  46   7.586  11.090  -6.556
  332   2HD1  ILE  46          3HD1      ILE  46   7.375  12.822  -6.913
  333   3HD1  ILE  46          1HD1      ILE  46   8.975  12.081  -7.021
  334    H    CYS  47           H        CYS  47   3.872  11.758  -4.561
  335    HA   CYS  47           HA       CYS  47   2.933  12.628  -1.931
  336   1HB   CYS  47          1HB       CYS  47   1.737  13.963  -3.702
  337   2HB   CYS  47          2HB       CYS  47   1.040  12.442  -4.296
  338    H    TYR  48           H        TYR  48   1.590  11.045  -0.812
  339    HA   TYR  48           HA       TYR  48   2.129   8.298  -1.801
  340   1HB   TYR  48          1HB       TYR  48   2.539   9.026   1.063
  341   2HB   TYR  48          2HB       TYR  48   3.175   7.677   0.148
  342    HD1  TYR  48           HD2      TYR  48   3.426  11.421   0.448
  343    HD2  TYR  48           HD1      TYR  48   5.500   7.730  -0.313
  344    HE1  TYR  48           HE2      TYR  48   5.469  12.681  -0.105
  345    HE2  TYR  48           HE1      TYR  48   7.614   8.999  -0.614
  346    HH   TYR  48           HH       TYR  48   7.643  12.582  -0.815
  347    H    PHE  49           H        PHE  49   0.548   6.796  -1.392
  348    HA   PHE  49           HA       PHE  49  -1.751   7.579   0.296
  349   1HB   PHE  49          1HB       PHE  49  -1.980   5.996  -2.257
  350   2HB   PHE  49          2HB       PHE  49  -3.198   6.806  -1.359
  351    HD1  PHE  49           HD1      PHE  49  -0.013   7.908  -3.174
  352    HD2  PHE  49           HD2      PHE  49  -4.278   8.389  -2.710
  353    HE1  PHE  49           HE1      PHE  49   0.082  10.007  -4.430
  354    HE2  PHE  49           HE2      PHE  49  -4.222  10.166  -4.420
  355    HZ   PHE  49           HZ       PHE  49  -2.015  10.886  -5.407
  356    HA   PRO  50           HA       PRO  50  -1.063   3.358   1.876
  357   1HB   PRO  50          1HB       PRO  50  -3.598   2.692   2.650
  358   2HB   PRO  50          2HB       PRO  50  -2.569   3.861   3.535
  359   1HG   PRO  50          1HG       PRO  50  -4.724   4.478   1.496
  360   2HG   PRO  50          2HG       PRO  50  -4.515   5.195   3.122
  361   1HD   PRO  50          1HD       PRO  50  -3.546   6.450   0.890
  362   2HD   PRO  50          2HD       PRO  50  -2.596   6.435   2.393
  363    H    CYS  51           H        CYS  51  -0.808   1.536   0.576
  364    HA   CYS  51           HA       CYS  51  -2.945   0.721  -1.275
  365   1HB   CYS  51          1HB       CYS  51  -2.239   1.997  -2.985
  366   2HB   CYS  51          2HB       CYS  51  -0.858   2.549  -2.079
   
  No H/Q in entry =         366
  Start of MODEL   20
    1    HA   PCA   1           HA       PYR   1  -3.247  -0.283   4.448
    2   1HB   PCA   1          1HB       PYR   1  -3.613   0.386   1.526
    3   2HB   PCA   1          2HB       PYR   1  -4.010  -1.139   2.372
    4   1HG   PCA   1          1HG       PYR   1  -5.914   0.792   1.719
    5   2HG   PCA   1          2HG       PYR   1  -6.058  -0.234   3.180
    6    HN   PCA   1           HN       PYR   1  -3.606   2.347   4.678
    7    H    LYS   2           H        LYS   2  -1.379  -0.948   2.622
    8    HA   LYS   2           HA       LYS   2   0.858   0.591   3.386
    9   1HB   LYS   2          1HB       LYS   2   2.165  -0.865   2.053
   10   2HB   LYS   2          2HB       LYS   2   0.840  -1.808   2.716
   11   1HG   LYS   2          1HG       LYS   2   0.648  -2.579   0.595
   12   2HG   LYS   2          2HG       LYS   2  -0.309  -1.125   0.352
   13   1HD   LYS   2          1HD       LYS   2   2.268  -0.159  -0.130
   14   2HD   LYS   2          2HD       LYS   2   2.475  -1.858  -0.537
   15   1HE   LYS   2          1HE       LYS   2   1.893  -0.819  -2.585
   16   2HE   LYS   2          2HE       LYS   2   0.387  -1.589  -2.057
   17   1HZ   LYS   2          1HZ       LYS   2  -0.202   0.627  -1.108
   18   2HZ   LYS   2          2HZ       LYS   2   1.142   1.255  -1.764
   19   3HZ   LYS   2          3HZ       LYS   2  -0.071   0.661  -2.730
   20    H    LEU   3           H        LEU   3   1.927   2.300   2.458
   21    HA   LEU   3           HA       LEU   3   0.318   4.014   0.839
   22   1HB   LEU   3          1HB       LEU   3   3.149   4.239   1.832
   23   2HB   LEU   3          2HB       LEU   3   2.260   5.585   1.118
   24    HG   LEU   3           HG       LEU   3   1.285   4.115   3.609
   25   1HD1  LEU   3          3HD1      LEU   3   3.504   5.131   4.008
   26   2HD1  LEU   3          1HD1      LEU   3   2.897   6.688   3.410
   27   3HD1  LEU   3          2HD1      LEU   3   2.214   5.968   4.884
   28   1HD2  LEU   3          2HD2      LEU   3   0.557   6.798   2.341
   29   2HD2  LEU   3          3HD2      LEU   3  -0.489   5.366   2.432
   30   3HD2  LEU   3          1HD2      LEU   3  -0.027   6.218   3.909
   31    H    CYS   4           H        CYS   4   1.282   5.334  -0.936
   32    HA   CYS   4           HA       CYS   4   3.331   4.039  -2.656
   33   1HB   CYS   4          1HB       CYS   4   0.681   5.246  -3.623
   34   2HB   CYS   4          2HB       CYS   4   2.084   4.886  -4.621
   35    H    GLU   5           H        GLU   5   4.935   5.498  -2.200
   36    HA   GLU   5           HA       GLU   5   4.489   8.322  -1.684
   37   1HB   GLU   5          1HB       GLU   5   6.946   8.394  -1.663
   38   2HB   GLU   5          2HB       GLU   5   6.294   7.143  -0.611
   39   1HG   GLU   5          1HG       GLU   5   7.406   5.505  -1.626
   40   2HG   GLU   5          2HG       GLU   5   6.879   5.982  -3.239
   41    HE1  GLU   5           HE2      GLU   5   7.929   7.963  -4.021
   42    H    ARG   6           H        ARG   6   3.175   8.694  -3.627
   43    HA   ARG   6           HA       ARG   6   4.524   8.340  -6.238
   44   1HB   ARG   6          1HB       ARG   6   1.733   8.504  -5.247
   45   2HB   ARG   6          2HB       ARG   6   2.041   9.133  -6.872
   46   1HG   ARG   6          1HG       ARG   6   3.010   7.052  -7.594
   47   2HG   ARG   6          2HG       ARG   6   2.981   6.415  -5.941
   48   1HD   ARG   6          1HD       ARG   6   1.179   5.455  -7.257
   49   2HD   ARG   6          2HD       ARG   6   0.506   6.472  -5.956
   50    HE   ARG   6           HE       ARG   6   0.704   8.186  -8.150
   51   1HH1  ARG   6          1HH1      ARG   6  -0.916   5.131  -7.518
   52   2HH1  ARG   6          2HH1      ARG   6  -2.282   5.458  -8.549
   53   1HH2  ARG   6          2HH2      ARG   6  -1.071   8.721  -9.351
   54   2HH2  ARG   6          1HH2      ARG   6  -2.370   7.596  -9.681
   55    HA   PRO   7           HA       PRO   7   4.789  12.864  -6.709
   56   1HB   PRO   7          1HB       PRO   7   5.834  12.210  -9.406
   57   2HB   PRO   7          2HB       PRO   7   6.609  13.160  -8.112
   58   1HG   PRO   7          1HG       PRO   7   7.471  10.624  -8.864
   59   2HG   PRO   7          2HG       PRO   7   7.633  11.270  -7.211
   60   1HD   PRO   7          1HD       PRO   7   5.572   9.345  -8.260
   61   2HD   PRO   7          2HD       PRO   7   6.421   9.391  -6.686
   62    H    SER   8           H        SER   8   3.747  10.217  -8.896
   63    HA   SER   8           HA       SER   8   2.059  11.697 -10.663
   64   1HB   SER   8          1HB       SER   8   1.338   9.247 -11.091
   65   2HB   SER   8          2HB       SER   8   3.000   9.737 -11.459
   66    HG   SER   8           HG       SER   8   3.013   7.812 -10.257
   67    H    GLY   9           H        GLY   9   0.899  12.940  -9.016
   68   1HA   GLY   9          1HA       GLY   9  -1.699  11.611  -8.461
   69   2HA   GLY   9          2HA       GLY   9  -0.904  12.525  -7.158
   70    H    THR  10           H        THR  10  -1.191  14.773  -7.194
   71    HA   THR  10           HA       THR  10  -2.293  16.056  -9.655
   72    HB   THR  10           HB       THR  10  -2.356  18.073  -8.162
   73    HG1  THR  10           HG1      THR  10  -1.762  17.928  -6.126
   74   1HG2  THR  10          2HG2      THR  10  -3.864  15.596  -7.219
   75   2HG2  THR  10          3HG2      THR  10  -4.276  17.282  -6.836
   76   3HG2  THR  10          1HG2      THR  10  -4.351  16.714  -8.510
   77    H    TRP  11           H        TRP  11   0.162  16.943  -7.282
   78    HA   TRP  11           HA       TRP  11   1.468  18.656  -9.176
   79   1HB   TRP  11          1HB       TRP  11   1.083  18.979  -6.699
   80   2HB   TRP  11          2HB       TRP  11   2.459  17.923  -6.416
   81    HD1  TRP  11           HD1      TRP  11   3.966  19.542  -9.105
   82    HE1  TRP  11           HE1      TRP  11   5.094  21.788  -8.529
   83    HE3  TRP  11           HE3      TRP  11   1.644  20.518  -4.658
   84    HZ2  TRP  11           HZ2      TRP  11   4.891  23.793  -6.512
   85    HZ3  TRP  11           HZ3      TRP  11   2.216  22.560  -3.386
   86    HH2  TRP  11           HH2      TRP  11   3.921  24.119  -4.222
   87    H    SER  12           H        SER  12   1.823  16.602 -10.618
   88    HA   SER  12           HA       SER  12   4.278  15.122  -9.993
   89   1HB   SER  12          1HB       SER  12   2.630  15.213 -12.557
   90   2HB   SER  12          2HB       SER  12   3.764  13.949 -12.034
   91    HG   SER  12           HG       SER  12   2.327  13.935 -10.062
   92    H    GLY  13           H        GLY  13   5.280  17.438  -9.736
   93   1HA   GLY  13          1HA       GLY  13   6.999  17.979 -12.021
   94   2HA   GLY  13          2HA       GLY  13   5.748  19.218 -11.779
   95    H    VAL  14           H        VAL  14   7.819  20.498 -11.486
   96    HA   VAL  14           HA       VAL  14   9.485  20.128  -9.217
   97    HB   VAL  14           HB       VAL  14   8.918  22.685 -10.764
   98   1HG1  VAL  14          3HG1      VAL  14  11.277  21.879  -9.004
   99   2HG1  VAL  14          1HG1      VAL  14  11.184  23.352  -9.991
  100   3HG1  VAL  14          2HG1      VAL  14  10.074  23.135  -8.634
  101   1HG2  VAL  14          1HG2      VAL  14  11.019  20.510 -11.199
  102   2HG2  VAL  14          2HG2      VAL  14   9.702  20.933 -12.313
  103   3HG2  VAL  14          3HG2      VAL  14  11.006  22.084 -12.018
  104    H    CYS  15           H        CYS  15   9.264  20.815  -7.143
  105    HA   CYS  15           HA       CYS  15   6.532  21.469  -6.326
  106   1HB   CYS  15          1HB       CYS  15   7.075  20.604  -4.267
  107   2HB   CYS  15          2HB       CYS  15   8.025  19.629  -5.393
  108    H    GLY  16           H        GLY  16   9.739  23.040  -6.094
  109   1HA   GLY  16          1HA       GLY  16  10.307  25.144  -5.318
  110   2HA   GLY  16          2HA       GLY  16   8.597  25.557  -5.179
  111    H    ASN  17           H        ASN  17   7.778  23.476  -3.301
  112    HA   ASN  17           HA       ASN  17   9.373  23.929  -0.878
  113   1HB   ASN  17          1HB       ASN  17   8.243  26.087  -1.158
  114   2HB   ASN  17          2HB       ASN  17   6.683  25.267  -1.330
  115   1HD2  ASN  17          2HD2      ASN  17   8.407  25.647   2.398
  116   2HD2  ASN  17          1HD2      ASN  17   9.361  25.937   0.957
  117    H    ASN  18           H        ASN  18   9.071  22.444   0.605
  118    HA   ASN  18           HA       ASN  18   7.675  20.067   0.270
  119   1HB   ASN  18          1HB       ASN  18   9.693  20.609   1.705
  120   2HB   ASN  18          2HB       ASN  18   8.629  21.370   2.871
  121   1HD2  ASN  18          2HD2      ASN  18   8.975  17.383   2.884
  122   2HD2  ASN  18          1HD2      ASN  18   9.863  18.263   1.653
  123    H    ASN  19           H        ASN  19   6.966  22.592   2.569
  124    HA   ASN  19           HA       ASN  19   4.560  21.612   3.626
  125   1HB   ASN  19          1HB       ASN  19   5.693  23.467   4.664
  126   2HB   ASN  19          2HB       ASN  19   5.301  24.532   3.308
  127   1HD2  ASN  19          2HD2      ASN  19   2.058  25.238   4.512
  128   2HD2  ASN  19          1HD2      ASN  19   3.330  25.630   3.370
  129    H    ALA  20           H        ALA  20   4.882  23.900   0.866
  130    HA   ALA  20           HA       ALA  20   2.108  24.022   0.234
  131   1HB   ALA  20          3HB       ALA  20   3.780  25.516  -0.820
  132   2HB   ALA  20          1HB       ALA  20   4.447  24.132  -1.723
  133   3HB   ALA  20          2HB       ALA  20   2.784  24.674  -2.019
  134    H    CYS  21           H        CYS  21   4.679  21.837  -1.054
  135    HA   CYS  21           HA       CYS  21   3.101  20.243  -2.676
  136   1HB   CYS  21          1HB       CYS  21   5.389  19.849  -2.784
  137   2HB   CYS  21          2HB       CYS  21   5.556  19.631  -1.047
  138    H    LYS  22           H        LYS  22   3.763  19.648   0.835
  139    HA   LYS  22           HA       LYS  22   2.158  17.319   0.888
  140   1HB   LYS  22          1HB       LYS  22   2.530  17.125   3.101
  141   2HB   LYS  22          2HB       LYS  22   3.944  18.049   2.516
  142   1HG   LYS  22          1HG       LYS  22   2.877  20.095   3.483
  143   2HG   LYS  22          2HG       LYS  22   1.520  19.116   4.035
  144   1HD   LYS  22          1HD       LYS  22   3.005  19.540   5.857
  145   2HD   LYS  22          2HD       LYS  22   2.995  17.810   5.523
  146   1HE   LYS  22          1HE       LYS  22   5.110  19.611   4.282
  147   2HE   LYS  22          2HE       LYS  22   5.270  19.159   5.978
  148   1HZ   LYS  22          1HZ       LYS  22   4.989  17.113   3.871
  149   2HZ   LYS  22          2HZ       LYS  22   6.426  17.776   4.294
  150   3HZ   LYS  22          3HZ       LYS  22   5.542  16.941   5.402
  151    H    ASN  23           H        ASN  23   1.347  20.722   1.621
  152    HA   ASN  23           HA       ASN  23  -1.331  20.283   2.489
  153   1HB   ASN  23          1HB       ASN  23  -0.182  22.453   2.638
  154   2HB   ASN  23          2HB       ASN  23  -0.185  22.620   0.883
  155   1HD2  ASN  23          2HD2      ASN  23  -3.191  24.281   2.717
  156   2HD2  ASN  23          1HD2      ASN  23  -1.534  24.113   3.267
  157    H    GLN  24           H        GLN  24  -0.199  21.199  -0.822
  158    HA   GLN  24           HA       GLN  24  -2.723  20.866  -2.010
  159   1HB   GLN  24          1HB       GLN  24   0.069  20.721  -3.159
  160   2HB   GLN  24          2HB       GLN  24  -1.409  20.672  -4.155
  161   1HG   GLN  24          1HG       GLN  24  -2.139  22.839  -3.193
  162   2HG   GLN  24          2HG       GLN  24  -0.686  22.896  -2.180
  163   1HE2  GLN  24          2HE2      GLN  24   0.202  23.263  -6.166
  164   2HE2  GLN  24          1HE2      GLN  24  -0.707  21.868  -5.616
  165    H    CYS  25           H        CYS  25  -0.117  18.459  -1.624
  166    HA   CYS  25           HA       CYS  25  -1.222  16.246  -2.928
  167   1HB   CYS  25          1HB       CYS  25   0.930  16.051  -2.042
  168   2HB   CYS  25          2HB       CYS  25   0.433  16.569  -0.442
  169    H    ILE  26           H        ILE  26  -1.655  16.909   0.633
  170    HA   ILE  26           HA       ILE  26  -3.652  14.768   0.667
  171    HB   ILE  26           HB       ILE  26  -3.610  14.935   3.003
  172   1HG1  ILE  26          1HG1      ILE  26  -2.468  17.716   2.663
  173   2HG1  ILE  26          2HG1      ILE  26  -3.988  17.215   3.433
  174   1HG2  ILE  26          3HG2      ILE  26  -1.582  14.025   1.928
  175   2HG2  ILE  26          1HG2      ILE  26  -0.797  15.613   2.014
  176   3HG2  ILE  26          2HG2      ILE  26  -1.220  14.769   3.485
  177   1HD1  ILE  26          3HD1      ILE  26  -2.637  16.031   5.193
  178   2HD1  ILE  26          1HD1      ILE  26  -1.178  16.787   4.499
  179   3HD1  ILE  26          2HD1      ILE  26  -2.462  17.799   5.168
  180    H    ASN  27           H        ASN  27  -3.728  18.126   0.153
  181    HA   ASN  27           HA       ASN  27  -6.441  18.650   1.042
  182   1HB   ASN  27          1HB       ASN  27  -4.643  20.290   1.038
  183   2HB   ASN  27          2HB       ASN  27  -4.530  20.207  -0.738
  184   1HD2  ASN  27          2HD2      ASN  27  -6.425  23.238   0.142
  185   2HD2  ASN  27          1HD2      ASN  27  -4.803  22.603   0.445
  186    H    LEU  28           H        LEU  28  -4.868  18.455  -2.262
  187    HA   LEU  28           HA       LEU  28  -7.477  18.395  -3.538
  188   1HB   LEU  28          1HB       LEU  28  -4.636  18.122  -4.553
  189   2HB   LEU  28          2HB       LEU  28  -6.053  17.789  -5.545
  190    HG   LEU  28           HG       LEU  28  -6.922  20.036  -5.249
  191   1HD1  LEU  28          3HD1      LEU  28  -4.382  20.581  -3.657
  192   2HD1  LEU  28          1HD1      LEU  28  -5.476  21.828  -4.282
  193   3HD1  LEU  28          2HD1      LEU  28  -6.058  20.700  -3.060
  194   1HD2  LEU  28          1HD2      LEU  28  -5.421  19.526  -7.136
  195   2HD2  LEU  28          2HD2      LEU  28  -5.215  21.201  -6.598
  196   3HD2  LEU  28          3HD2      LEU  28  -4.010  19.974  -6.150
  197    H    GLU  29           H        GLU  29  -4.795  15.876  -3.367
  198    HA   GLU  29           HA       GLU  29  -6.955  13.856  -3.826
  199   1HB   GLU  29          1HB       GLU  29  -5.263  12.209  -4.092
  200   2HB   GLU  29          2HB       GLU  29  -5.129  13.490  -5.279
  201   1HG   GLU  29          1HG       GLU  29  -3.307  13.469  -2.853
  202   2HG   GLU  29          2HG       GLU  29  -3.017  12.404  -4.230
  203    HE1  GLU  29           HE2      GLU  29  -2.693  16.273  -5.180
  204    H    LYS  30           H        LYS  30  -6.540  11.824  -2.273
  205    HA   LYS  30           HA       LYS  30  -6.898  13.051   0.413
  206   1HB   LYS  30          1HB       LYS  30  -8.188  10.685  -0.933
  207   2HB   LYS  30          2HB       LYS  30  -8.357  10.997   0.801
  208   1HG   LYS  30          1HG       LYS  30  -9.013  13.080  -1.333
  209   2HG   LYS  30          2HG       LYS  30 -10.187  11.974  -0.640
  210   1HD   LYS  30          1HD       LYS  30 -10.474  13.183   1.188
  211   2HD   LYS  30          2HD       LYS  30  -8.771  13.271   1.570
  212   1HE   LYS  30          1HE       LYS  30 -10.184  15.084  -0.455
  213   2HE   LYS  30          2HE       LYS  30  -9.971  15.488   1.249
  214   1HZ   LYS  30          2HZ       LYS  30  -7.708  15.051  -0.610
  215   2HZ   LYS  30          3HZ       LYS  30  -8.321  16.487  -0.186
  216   3HZ   LYS  30          1HZ       LYS  30  -7.572  15.557   0.921
  217    H    ALA  31           H        ALA  31  -4.361  11.981  -0.807
  218    HA   ALA  31           HA       ALA  31  -3.174   9.932   0.633
  219   1HB   ALA  31          2HB       ALA  31  -2.238  12.733  -0.081
  220   2HB   ALA  31          3HB       ALA  31  -1.122  11.436   0.372
  221   3HB   ALA  31          1HB       ALA  31  -2.094  11.299  -1.112
  222    H    ARG  32           H        ARG  32  -1.660  10.025   2.425
  223    HA   ARG  32           HA       ARG  32  -3.015  11.251   4.773
  224   1HB   ARG  32          1HB       ARG  32  -0.671   9.287   4.596
  225   2HB   ARG  32          2HB       ARG  32  -1.483   9.767   6.084
  226   1HG   ARG  32          1HG       ARG  32  -2.860   8.266   3.810
  227   2HG   ARG  32          2HG       ARG  32  -1.980   7.476   5.102
  228   1HD   ARG  32          1HD       ARG  32  -4.361   7.443   5.651
  229   2HD   ARG  32          2HD       ARG  32  -3.422   8.351   6.826
  230    HE   ARG  32           HE       ARG  32  -4.659  10.196   6.391
  231   1HH1  ARG  32          2HH2      ARG  32  -5.064   8.021   3.625
  232   2HH1  ARG  32          1HH2      ARG  32  -5.788   9.268   2.614
  233   1HH2  ARG  32          2HH1      ARG  32  -5.692  11.799   5.020
  234   2HH2  ARG  32          1HH1      ARG  32  -6.046  11.347   3.374
  235    H    HIS  33           H        HIS  33   0.386  10.938   3.737
  236    HA   HIS  33           HA       HIS  33   0.765  13.763   4.570
  237   1HB   HIS  33          2HB       HIS  33   3.159  13.237   4.977
  238   2HB   HIS  33          1HB       HIS  33   2.016  12.587   6.142
  239    HD1  HIS  33           HD1      HIS  33   1.601  10.007   6.186
  240    HD2  HIS  33           HD2      HIS  33   4.759  11.285   3.746
  241    HE1  HIS  33           HE1      HIS  33   3.053   7.985   5.715
  242    H    GLY  34           H        GLY  34   2.675  14.688   3.396
  243   1HA   GLY  34          1HA       GLY  34   3.362  13.640   0.817
  244   2HA   GLY  34          2HA       GLY  34   2.453  15.138   0.707
  245    H    SER  35           H        SER  35   5.158  15.096  -0.037
  246    HA   SER  35           HA       SER  35   6.352  17.151   1.576
  247   1HB   SER  35          1HB       SER  35   7.355  14.270   1.876
  248   2HB   SER  35          2HB       SER  35   8.475  15.617   1.991
  249    HG   SER  35           HG       SER  35   6.175  15.154   3.565
  250    H    CYS  36           H        CYS  36   8.071  18.030   0.434
  251    HA   CYS  36           HA       CYS  36   8.548  16.919  -2.292
  252   1HB   CYS  36          1HB       CYS  36   7.886  19.297  -2.206
  253   2HB   CYS  36          2HB       CYS  36   9.274  19.633  -1.138
  254    H    ASN  37           H        ASN  37  10.545  16.182  -2.812
  255    HA   ASN  37           HA       ASN  37  12.814  16.695  -0.961
  256   1HB   ASN  37          1HB       ASN  37  11.763  14.371  -0.579
  257   2HB   ASN  37          2HB       ASN  37  12.298  13.953  -2.209
  258   1HD2  ASN  37          2HD2      ASN  37  15.752  13.688  -1.171
  259   2HD2  ASN  37          1HD2      ASN  37  14.753  13.850  -2.595
  260    H    TYR  38           H        TYR  38  14.922  16.300  -2.196
  261    HA   TYR  38           HA       TYR  38  14.740  17.256  -4.955
  262   1HB   TYR  38          1HB       TYR  38  16.705  17.770  -3.558
  263   2HB   TYR  38          2HB       TYR  38  17.085  16.048  -3.464
  264    HD1  TYR  38           HD1      TYR  38  17.881  14.816  -5.480
  265    HD2  TYR  38           HD2      TYR  38  17.012  19.038  -5.647
  266    HE1  TYR  38           HE1      TYR  38  18.713  14.903  -7.814
  267    HE2  TYR  38           HE2      TYR  38  17.963  19.135  -7.932
  268    HH   TYR  38           HH       TYR  38  18.457  17.849  -9.803
  269    H    VAL  39           H        VAL  39  14.147  15.946  -6.608
  270    HA   VAL  39           HA       VAL  39  15.204  13.214  -6.717
  271    HB   VAL  39           HB       VAL  39  12.229  13.751  -7.185
  272   1HG1  VAL  39          2HG1      VAL  39  13.266  12.084  -8.747
  273   2HG1  VAL  39          3HG1      VAL  39  13.870  11.182  -7.347
  274   3HG1  VAL  39          1HG1      VAL  39  12.124  11.328  -7.627
  275   1HG2  VAL  39          2HG2      VAL  39  13.596  12.156  -4.982
  276   2HG2  VAL  39          3HG2      VAL  39  12.593  13.615  -4.782
  277   3HG2  VAL  39          1HG2      VAL  39  11.862  12.109  -5.345
  278    H    PHE  40           H        PHE  40  16.264  13.335  -8.601
  279    HA   PHE  40           HA       PHE  40  16.627  15.465 -10.022
  280   1HB   PHE  40          1HB       PHE  40  17.769  14.248 -11.640
  281   2HB   PHE  40          2HB       PHE  40  17.788  13.194 -10.247
  282    HD1  PHE  40           HD1      PHE  40  16.002  11.278 -10.169
  283    HD2  PHE  40           HD2      PHE  40  16.863  13.573 -13.726
  284    HE1  PHE  40           HE1      PHE  40  14.795   9.611 -11.550
  285    HE2  PHE  40           HE2      PHE  40  15.648  11.908 -15.090
  286    HZ   PHE  40           HZ       PHE  40  14.597   9.935 -14.006
  287    HA   PRO  41           HA       PRO  41  17.077  16.450 -11.978
  288   1HB   PRO  41          1HB       PRO  41  16.492  18.645 -13.390
  289   2HB   PRO  41          2HB       PRO  41  16.384  17.012 -14.119
  290   1HG   PRO  41          1HG       PRO  41  14.103  18.629 -12.926
  291   2HG   PRO  41          2HG       PRO  41  14.182  17.901 -14.559
  292   1HD   PRO  41          1HD       PRO  41  13.011  16.605 -12.435
  293   2HD   PRO  41          2HD       PRO  41  13.915  15.714 -13.691
  294    H    ALA  42           H        ALA  42  14.338  17.422 -10.070
  295    HA   ALA  42           HA       ALA  42  15.888  19.597  -8.774
  296   1HB   ALA  42          1HB       ALA  42  14.671  20.576 -10.731
  297   2HB   ALA  42          2HB       ALA  42  13.146  20.027 -10.006
  298   3HB   ALA  42          3HB       ALA  42  14.151  21.242  -9.184
  299    H    HIS  43           H        HIS  43  13.887  20.693  -7.280
  300    HA   HIS  43           HA       HIS  43  13.215  18.712  -5.257
  301   1HB   HIS  43          2HB       HIS  43  12.312  21.548  -5.681
  302   2HB   HIS  43          1HB       HIS  43  12.111  20.656  -4.187
  303    HD1  HIS  43           HD1      HIS  43  14.559  19.618  -3.205
  304    HD2  HIS  43           HD2      HIS  43  14.645  23.068  -5.590
  305    HE1  HIS  43           HE1      HIS  43  16.795  20.755  -2.811
  306    H    LYS  44           H        LYS  44  11.589  17.332  -5.521
  307    HA   LYS  44           HA       LYS  44   9.334  17.982  -7.378
  308   1HB   LYS  44          1HB       LYS  44  11.016  16.382  -8.312
  309   2HB   LYS  44          2HB       LYS  44  10.504  15.279  -7.015
  310   1HG   LYS  44          1HG       LYS  44   8.138  15.466  -7.849
  311   2HG   LYS  44          2HG       LYS  44   8.706  16.483  -9.173
  312   1HD   LYS  44          1HD       LYS  44   9.434  13.550  -8.684
  313   2HD   LYS  44          2HD       LYS  44   8.244  14.175  -9.818
  314   1HE   LYS  44          1HE       LYS  44   9.972  13.831 -11.263
  315   2HE   LYS  44          2HE       LYS  44  10.223  15.538 -10.881
  316   1HZ   LYS  44          3HZ       LYS  44  11.635  13.263  -9.617
  317   2HZ   LYS  44          1HZ       LYS  44  12.257  14.176 -10.815
  318   3HZ   LYS  44          2HZ       LYS  44  11.998  14.847  -9.368
  319    H    CYS  45           H        CYS  45   7.315  17.575  -6.642
  320    HA   CYS  45           HA       CYS  45   6.970  17.175  -3.804
  321   1HB   CYS  45          1HB       CYS  45   5.552  18.730  -5.034
  322   2HB   CYS  45          2HB       CYS  45   4.982  17.425  -6.077
  323    H    ILE  46           H        ILE  46   6.484  15.281  -2.732
  324    HA   ILE  46           HA       ILE  46   5.704  12.866  -4.300
  325    HB   ILE  46           HB       ILE  46   7.221  12.995  -1.661
  326   1HG1  ILE  46          1HG1      ILE  46   8.715  13.904  -3.353
  327   2HG1  ILE  46          2HG1      ILE  46   9.239  12.313  -2.818
  328   1HG2  ILE  46          3HG2      ILE  46   6.625  10.688  -3.542
  329   2HG2  ILE  46          1HG2      ILE  46   7.658  10.617  -2.094
  330   3HG2  ILE  46          2HG2      ILE  46   5.928  10.955  -1.938
  331   1HD1  ILE  46          2HD1      ILE  46   7.726  12.839  -5.415
  332   2HD1  ILE  46          3HD1      ILE  46   9.470  12.615  -5.261
  333   3HD1  ILE  46          1HD1      ILE  46   8.379  11.277  -4.871
  334    H    CYS  47           H        CYS  47   3.773  11.961  -3.674
  335    HA   CYS  47           HA       CYS  47   2.434  13.065  -1.246
  336   1HB   CYS  47          1HB       CYS  47   1.638  14.017  -3.408
  337   2HB   CYS  47          2HB       CYS  47   1.318  12.425  -3.999
  338    H    TYR  48           H        TYR  48   1.582  11.505   0.168
  339    HA   TYR  48           HA       TYR  48   2.197   8.675  -0.585
  340   1HB   TYR  48          1HB       TYR  48   2.213  10.080   2.087
  341   2HB   TYR  48          2HB       TYR  48   2.415   8.358   1.836
  342    HD1  TYR  48           HD2      TYR  48   3.915  11.604   0.633
  343    HD2  TYR  48           HD1      TYR  48   4.603   7.526   1.823
  344    HE1  TYR  48           HE2      TYR  48   6.350  12.004   0.569
  345    HE2  TYR  48           HE1      TYR  48   7.034   7.939   1.813
  346    HH   TYR  48           HH       TYR  48   8.722   9.461   1.380
  347    H    PHE  49           H        PHE  49   0.314   7.832  -1.333
  348    HA   PHE  49           HA       PHE  49  -2.072   7.940   0.446
  349   1HB   PHE  49          1HB       PHE  49  -3.318   7.481  -1.808
  350   2HB   PHE  49          2HB       PHE  49  -2.917   9.109  -1.345
  351    HD1  PHE  49           HD2      PHE  49  -0.481   9.978  -2.179
  352    HD2  PHE  49           HD1      PHE  49  -3.164   7.223  -4.144
  353    HE1  PHE  49           HE2      PHE  49   0.494  10.553  -4.358
  354    HE2  PHE  49           HE1      PHE  49  -2.459   8.152  -6.324
  355    HZ   PHE  49           HZ       PHE  49  -0.592   9.879  -6.398
  356    HA   PRO  50           HA       PRO  50  -1.787   3.501   0.397
  357   1HB   PRO  50          1HB       PRO  50  -4.251   2.755   1.125
  358   2HB   PRO  50          2HB       PRO  50  -3.145   3.638   2.224
  359   1HG   PRO  50          1HG       PRO  50  -5.371   4.811   0.520
  360   2HG   PRO  50          2HG       PRO  50  -5.106   5.053   2.271
  361   1HD   PRO  50          1HD       PRO  50  -4.179   6.835   0.427
  362   2HD   PRO  50          2HD       PRO  50  -3.214   6.432   1.878
  363    H    CYS  51           H        CYS  51  -1.456   3.998  -1.937
  364    HA   CYS  51           HA       CYS  51  -3.711   3.666  -3.750
  365   1HB   CYS  51          1HB       CYS  51  -2.369   4.744  -5.203
  366   2HB   CYS  51          2HB       CYS  51  -1.326   4.972  -3.883
   
  No H/Q in entry =         366