*HEADER   CHITIN-BINDING                          25-OCT-95   1MMC    
*TITLE    1H NMR STUDY OF THE SOLUTION STRUCTURE OF AC-AMP2           
*COMPND   MOL_ID: 1;                                                  
*COMPND  2 MOLECULE: ANTIMICROBIAL PEPTIDE 2;                         
*COMPND  3 CHAIN: NULL;                                               
*COMPND  4 SYNONYM: AC-AMP2                                           
*SOURCE   MOL_ID: 1;                                                  
*SOURCE  2 ORGANISM_SCIENTIFIC: AMARANTHUS CAUDATUS;                  
*SOURCE  3 ORGANISM_COMMON: LOVE-LIES-BLEEDING, INCA-WHEAT, TASSEL    
*SOURCE  4 FLOWER;                                                    
*SOURCE  5 TISSUE: SEED                                               
*KEYWDS   ANTIFUNGAL ANTIMICROBIAL                                    
*EXPDTA   NMR, 26 STRUCTURES                                          
*AUTHOR   J.C.MARTINS,D.MAES,R.LORIS,H.A.M.PEPERMANS,L.WYNS,R.WILLEM, 
*AUTHOR  2 P.VERHEYDEN                                                
*REVDAT  1   08-MAR-96 1MMC    0                                      


IDENTIFYING HEADER:
SUBMITTOR: JOSE C. MARTINS
        HNMR CENTRE (ORGC)
        VRIJE UNIVERSITEIT BRUSSEL
        PLEINLAAN 2, B-1050 BRUSSEL
        BELGIUM
!BIOSYM restraint 1
!
#distance
1:VALN_1:HA         1:VALN_1:HB          1.800  2.860  40.00  40.00 1000.00
1:VALN_1:HA         1:GLY_2:HN          1.800  2.610  40.00  40.00 1000.00
1:VALN_1:HB         1:GLY_2:HN          1.800  3.820  40.00  40.00 1000.00
1:VALN_1:HG*        1:GLY_2:HN          1.800  5.930  40.00  40.00 1000.00
1:VALN_1:HG*        1:TYR_20:CG         1.800  7.000  40.00  40.00 1000.00
1:VALN_1:HG*        1:TYR_27:CZ         1.800  7.000  40.00  40.00 1000.00
1:GLY_2:HN         1:GLU_3:HN          1.800  2.940  40.00  40.00 1000.00
1:GLU_3:HN         1:GLU_3:HG*         1.800  5.950  40.00  40.00 1000.00
1:GLU_3:HN         1:CYS_4:HN          1.800  4.100  40.00  40.00 1000.00
1:GLU_3:HA         1:GLU_3:HG*         1.800  3.700  40.00  40.00 1000.00
1:GLU_3:HA         1:CYS_4:HN          1.800  2.520  40.00  40.00 1000.00
1:GLU_3:HA         1:TYR_20:CG         1.800  3.910  40.00  40.00 1000.00
1:GLU_3:HA         1:TYR_20:CZ         1.800  6.540  40.00  40.00 1000.00
1:GLU_3:HB*        1:CYS_4:HN          1.800  3.750  40.00  40.00 1000.00
1:GLU_3:HB*        1:TYR_20:HA         1.800  4.170  40.00  40.00 1000.00
1:GLU_3:HB*        1:TYR_20:CG         1.800  6.120  40.00  40.00 1000.00
1:GLU_3:HB*        1:TYR_20:CZ         1.800  5.950  40.00  40.00 1000.00
1:GLU_3:HG*        1:TYR_20:CG         1.800  8.390  40.00  40.00 1000.00
1:GLU_3:HG*        1:TYR_20:CZ         1.800  6.890  40.00  40.00 1000.00
1:CYS_4:HN         1:CYS_4:HB2         1.800  3.630  40.00  40.00 1000.00
1:CYS_4:HN         1:CYS_4:HB1         1.800  3.120  40.00  40.00 1000.00
1:CYS_4:HN         1:TYR_20:HA         1.800  2.940  40.00  40.00 1000.00
1:CYS_4:HA         1:VAL_5:HN          1.800  2.490  40.00  40.00 1000.00
1:CYS_4:HA         1:VAL_5:HG*         1.800  5.260  40.00  40.00 1000.00
1:CYS_4:HA         1:CYS_9:HA          1.800  5.000  40.00  40.00 1000.00
1:CYS_4:HB2        1:GLY_7:HN          1.800  3.860  40.00  40.00 1000.00
1:CYS_4:HB2        1:GLY_7:HA*         1.800  3.500  40.00  40.00 1000.00
1:CYS_4:HB2        1:ARG_8:HN          1.800  3.520  40.00  40.00 1000.00
1:CYS_4:HB2        1:CYS_15:HB*        1.800  5.000  40.00  40.00 1000.00
1:CYS_4:HB1        1:VAL_5:HN          1.800  3.340  40.00  40.00 1000.00
1:CYS_4:HB1        1:GLY_7:HN          1.800  3.450  40.00  40.00 1000.00
1:CYS_4:HB1        1:GLY_7:HA*         1.800  4.140  40.00  40.00 1000.00
1:CYS_4:HB1        1:ARG_8:HN          1.800  3.910  40.00  40.00 1000.00
1:CYS_4:HB1        1:CYS_15:HB*        1.800  5.000  40.00  40.00 1000.00
1:VAL_5:HN         1:VAL_5:HB          1.800  2.560  40.00  40.00 1000.00
1:VAL_5:HN         1:VAL_5:HG*         1.800  4.040  40.00  40.00 1000.00
1:VAL_5:HN         1:ARG_8:HN          1.800  3.440  40.00  40.00 1000.00
1:VAL_5:HA         1:ARG_6:HN          1.800  2.340  40.00  40.00 1000.00
1:VAL_5:HG*        1:ARG_6:HN          1.800  4.470  40.00  40.00 1000.00
1:ARG_6:HN         1:ARG_6:HA          1.800  2.400  40.00  40.00 1000.00
1:ARG_6:HN         1:ARG_6:HB*         1.800  3.860  40.00  40.00 1000.00
1:ARG_6:HN         1:ARG_6:HG*         1.800  3.760  40.00  40.00 1000.00
1:ARG_6:HN         1:GLY_7:HN          1.800  3.170  40.00  40.00 1000.00
1:ARG_6:HA         1:ARG_6:HG*         1.800  3.330  40.00  40.00 1000.00
1:ARG_6:HA         1:GLY_7:HN          1.800  2.700  40.00  40.00 1000.00
1:GLY_7:HN         1:GLY_7:HA1         1.800  2.790  40.00  40.00 1000.00
1:GLY_7:HN         1:GLY_7:HA2         1.800  2.790  40.00  40.00 1000.00
1:GLY_7:HN         1:ARG_8:HN          1.800  3.890  40.00  40.00 1000.00
1:ARG_8:HN         1:ARG_8:HG2         1.800  3.630  40.00  40.00 1000.00
1:ARG_8:HN         1:ARG_8:HG1         1.800  3.630  40.00  40.00 1000.00
1:ARG_8:HN         1:ARG_8:HG*         1.800  3.460  40.00  40.00 1000.00
1:ARG_8:HN         1:CYS_9:HN          1.800  4.020  40.00  40.00 1000.00
1:ARG_8:HA         1:ARG_8:HG2         1.800  2.940  40.00  40.00 1000.00
1:ARG_8:HA         1:ARG_8:HG1         1.800  2.940  40.00  40.00 1000.00
1:ARG_8:HA         1:ARG_8:HD*         1.800  4.230  40.00  40.00 1000.00
1:ARG_8:HA         1:CYS_9:HN          1.800  2.500  40.00  40.00 1000.00
1:ARG_8:HB*        1:CYS_9:HN          1.800  3.900  40.00  40.00 1000.00
1:CYS_9:HN         1:CYS_9:HB2         1.800  3.600  40.00  40.00 1000.00
1:CYS_9:HN         1:CYS_9:HB1         1.800  3.600  40.00  40.00 1000.00
1:CYS_9:HN         1:CYS_9:HB*         1.800  3.040  40.00  40.00 1000.00
1:CYS_9:HB2        1:PRO_10:HD1        1.800  4.300  40.00  40.00 1000.00
1:CYS_9:HB2        1:PRO_10:HD2        1.800  4.300  40.00  40.00 1000.00
1:CYS_9:HB2        1:MET_13:HA         1.800  5.000  40.00  40.00 1000.00
1:CYS_9:HB1        1:PRO_10:HD1        1.800  4.300  40.00  40.00 1000.00
1:CYS_9:HB1        1:PRO_10:HD2        1.800  4.300  40.00  40.00 1000.00
1:CYS_9:HB1        1:MET_13:HA         1.800  5.000  40.00  40.00 1000.00
1:CYS_9:HB*        1:PRO_10:HD*        1.800  3.240  40.00  40.00 1000.00
1:CYS_9:HB*        1:MET_13:HG*        1.800  5.890  40.00  40.00 1000.00
1:PRO_10:HA        1:SER_11:HN         1.800  2.410  40.00  40.00 1000.00
1:PRO_10:HB2       1:SER_11:HN         1.800  3.480  40.00  40.00 1000.00
1:PRO_10:HB1       1:SER_11:HN         1.800  3.480  40.00  40.00 1000.00
1:PRO_10:HB*       1:SER_11:HN         1.800  3.210  40.00  40.00 1000.00
1:PRO_10:HG1       1:SER_11:HN         1.800  4.950  40.00  40.00 1000.00
1:PRO_10:HG2       1:SER_11:HN         1.800  4.950  40.00  40.00 1000.00
1:PRO_10:HD*       1:MET_13:HG*        1.800  5.890  40.00  40.00 1000.00
1:SER_11:HN        1:SER_11:HA         1.800  2.490  40.00  40.00 1000.00
1:SER_11:HN        1:SER_11:HB*        1.800  3.200  40.00  40.00 1000.00
1:SER_11:HN        1:GLY_12:HN         1.800  4.050  40.00  40.00 1000.00
1:SER_11:HA        1:GLY_12:HN         1.800  2.370  40.00  40.00 1000.00
1:GLY_12:HN        1:GLY_12:HA*        1.800  2.640  40.00  40.00 1000.00
1:GLY_12:HN        1:MET_13:HN         1.800  2.870  40.00  40.00 1000.00
1:MET_13:HN        1:MET_13:HG*        1.800  4.350  40.00  40.00 1000.00
1:MET_13:HA        1:MET_13:HB*        1.800  2.690  40.00  40.00 1000.00
1:MET_13:HA        1:MET_13:HG*        1.800  3.610  40.00  40.00 1000.00
1:MET_13:HA        1:CYS_14:HN         1.800  2.830  40.00  40.00 1000.00
1:MET_13:HA        1:LYS_23:HA         1.800  2.600  40.00  40.00 1000.00
1:MET_13:HB*       1:CYS_14:HN         1.800  3.630  40.00  40.00 1000.00
1:CYS_14:HN        1:CYS_14:HB2        1.800  3.820  40.00  40.00 1000.00
1:CYS_14:HN        1:CYS_21:HB*        1.800  6.280  40.00  40.00 1000.00
1:CYS_14:HN        1:GLY_22:HN         1.800  3.050  40.00  40.00 1000.00
1:CYS_14:HA        1:CYS_14:HB2        1.800  2.740  40.00  40.00 1000.00
1:CYS_14:HA        1:CYS_15:HN         1.800  2.540  40.00  40.00 1000.00
1:CYS_14:HB2       1:TYR_27:HB2        1.800  4.500  40.00  40.00 1000.00
1:CYS_14:HB2       1:TYR_27:HB1        1.800  4.500  40.00  40.00 1000.00
1:CYS_14:HB2       1:CYS_28:HA         1.800  3.500  40.00  40.00 1000.00
1:CYS_14:HB1       1:TYR_27:HB2        1.800  4.500  40.00  40.00 1000.00
1:CYS_14:HB1       1:TYR_27:HB1        1.800  4.500  40.00  40.00 1000.00
1:CYS_14:HB1       1:CYS_28:HA         1.800  3.500  40.00  40.00 1000.00
1:CYS_15:HN        1:CYS_15:HB*        1.800  3.150  40.00  40.00 1000.00
1:CYS_15:HA        1:SER_16:HN         1.800  2.520  40.00  40.00 1000.00
1:CYS_15:HA        1:CYS_21:HA         1.800  2.600  40.00  40.00 1000.00
1:CYS_15:HB*       1:SER_16:HN         1.800  4.510  40.00  40.00 1000.00
1:SER_16:HN        1:SER_16:HB*        1.800  3.420  40.00  40.00 1000.00
1:SER_16:HN        1:CYS_21:HA         1.800  4.200  40.00  40.00 1000.00
1:SER_16:HN        1:CYS_21:HB*        1.800  5.620  40.00  40.00 1000.00
1:SER_16:HN        1:TYR_27:CG         1.800  5.200  40.00  40.00 1000.00
1:SER_16:HA        1:GLN_17:HN         1.800  2.660  40.00  40.00 1000.00
1:SER_16:HA        1:TYR_27:HA         1.800  3.500  40.00  40.00 1000.00
1:SER_16:HA        1:TYR_27:HB1        1.800  3.500  40.00  40.00 1000.00
1:SER_16:HA        1:TYR_27:CG         1.800  5.820  40.00  40.00 1000.00
1:SER_16:HB*       1:GLN_17:HN         1.800  3.750  40.00  40.00 1000.00
1:SER_16:HB*       1:PHE_18:HN         1.800  4.280  40.00  40.00 1000.00
1:SER_16:HB*       1:PHE_18:CG         1.800  6.350  40.00  40.00 1000.00
1:SER_16:HB*       1:PHE_18:CZ         1.800  7.600  40.00  40.00 1000.00
1:SER_16:HB*       1:TYR_27:HA         1.800  3.990  40.00  40.00 1000.00
1:SER_16:HB*       1:TYR_27:HB2        1.800  4.730  40.00  40.00 1000.00
1:SER_16:HB*       1:TYR_27:CG         1.800  7.680  40.00  40.00 1000.00
1:SER_16:HB*       1:TYR_27:CZ         1.800  6.700  40.00  40.00 1000.00
1:GLN_17:HN        1:GLN_17:HB1        1.800  2.880  40.00  40.00 1000.00
1:GLN_17:HN        1:GLN_17:HG*        1.800  3.340  40.00  40.00 1000.00
1:GLN_17:HN        1:PHE_18:HN         1.800  3.090  40.00  40.00 1000.00
1:GLN_17:HA        1:GLN_17:HB1        1.800  2.510  40.00  40.00 1000.00
1:GLN_17:HA        1:GLN_17:HG*        1.800  3.340  40.00  40.00 1000.00
1:GLN_17:HG*       1:PHE_18:HN         1.800  5.030  40.00  40.00 1000.00
1:GLN_17:HG*       1:PHE_18:CG         1.800  5.260  40.00  40.00 1000.00
1:GLN_17:HG*       1:PHE_18:CZ         1.800  5.950  40.00  40.00 1000.00
1:PHE_18:HN        1:PHE_18:HB2        1.800  3.540  40.00  40.00 1000.00
1:PHE_18:HN        1:PHE_18:HB1        1.800  2.940  40.00  40.00 1000.00
1:PHE_18:HN        1:GLY_19:HN         1.800  2.670  40.00  40.00 1000.00
1:PHE_18:HA        1:PHE_18:HB2        1.800  2.730  40.00  40.00 1000.00
1:PHE_18:HA        1:PHE_18:CZ         1.800  6.200  40.00  40.00 1000.00
1:PHE_18:HA        1:GLY_19:HN         1.800  3.620  40.00  40.00 1000.00
1:PHE_18:HB2       1:TYR_20:CG         1.800  5.630  40.00  40.00 1000.00
1:PHE_18:HB2       1:TYR_20:CZ         1.800  5.840  40.00  40.00 1000.00
1:PHE_18:HB2       1:TYR_27:CG         1.800  7.020  40.00  40.00 1000.00
1:PHE_18:HB2       1:TYR_27:CZ         1.800  7.640  40.00  40.00 1000.00
1:PHE_18:HB1       1:TYR_20:CZ         1.800  5.940  40.00  40.00 1000.00
1:GLY_19:HN        1:GLY_19:HA1        1.800  2.570  40.00  40.00 1000.00
1:GLY_19:HN        1:GLY_19:HA2        1.800  2.570  40.00  40.00 1000.00
1:GLY_19:HN        1:TYR_20:HN         1.800  2.840  40.00  40.00 1000.00
1:GLY_19:HA1       1:TYR_20:HN         1.800  3.550  40.00  40.00 1000.00
1:GLY_19:HA2       1:TYR_20:HN         1.800  3.550  40.00  40.00 1000.00
1:TYR_20:HN        1:TYR_20:HB2        1.800  4.180  40.00  40.00 1000.00
1:TYR_20:HA        1:CYS_21:HN         1.800  2.890  40.00  40.00 1000.00
1:TYR_20:HB2       1:TYR_27:CG         1.800  6.060  40.00  40.00 1000.00
1:TYR_20:HB2       1:TYR_27:CZ         1.800  4.810  40.00  40.00 1000.00
1:TYR_20:HB1       1:CYS_21:HN         1.800  2.940  40.00  40.00 1000.00
1:TYR_20:HB1       1:TYR_27:CG         1.800  5.820  40.00  40.00 1000.00
1:TYR_20:HB1       1:TYR_27:CZ         1.800  4.980  40.00  40.00 1000.00
1:CYS_21:HA        1:GLY_22:HN         1.800  2.410  40.00  40.00 1000.00
1:CYS_21:HA        1:TYR_27:CG         1.800  6.950  40.00  40.00 1000.00
1:CYS_21:HB*       1:GLY_22:HN         1.800  4.080  40.00  40.00 1000.00
1:GLY_22:HN        1:GLY_22:HA1        1.800  2.700  40.00  40.00 1000.00
1:GLY_22:HN        1:LYS_23:HN         1.800  3.970  40.00  40.00 1000.00
1:GLY_22:HN        1:TYR_27:HB2        1.800  3.640  40.00  40.00 1000.00
1:GLY_22:HN        1:TYR_27:HB1        1.800  4.730  40.00  40.00 1000.00
1:GLY_22:HA2       1:LYS_23:HN         1.800  3.080  40.00  40.00 1000.00
1:LYS_23:HA        1:LYS_23:HB2        1.800  2.830  40.00  40.00 1000.00
1:LYS_23:HA        1:LYS_23:HG2        1.800  3.050  40.00  40.00 1000.00
1:LYS_23:HA        1:LYS_23:HG1        1.800  3.050  40.00  40.00 1000.00
1:LYS_23:HA        1:LYS_23:HG*        1.800  2.770  40.00  40.00 1000.00
1:LYS_23:HA        1:GLY_24:HN         1.800  2.510  40.00  40.00 1000.00
1:GLY_24:HN        1:GLY_24:HA*        1.800  2.630  40.00  40.00 1000.00
1:GLY_24:HA1       1:PRO_25:HD1        1.800  3.040  40.00  40.00 1000.00
1:GLY_24:HA1       1:PRO_25:HD2        1.800  3.040  40.00  40.00 1000.00
1:GLY_24:HA2       1:PRO_25:HD1        1.800  3.040  40.00  40.00 1000.00
1:GLY_24:HA2       1:PRO_25:HD2        1.800  3.040  40.00  40.00 1000.00
1:GLY_24:HA*       1:PRO_25:HD*        1.800  2.550  40.00  40.00 1000.00
1:PRO_25:HB*       1:LYS_26:HN         1.800  4.120  40.00  40.00 1000.00
1:PRO_25:HG*       1:LYS_26:HN         1.800  5.050  40.00  40.00 1000.00
1:LYS_26:HN        1:LYS_26:HG2        1.800  4.050  40.00  40.00 1000.00
1:LYS_26:HN        1:LYS_26:HG1        1.800  4.050  40.00  40.00 1000.00
1:LYS_26:HN        1:LYS_26:HG*        1.800  3.660  40.00  40.00 1000.00
1:LYS_26:HN        1:TYR_27:HN         1.800  2.840  40.00  40.00 1000.00
1:LYS_26:HA        1:LYS_26:HG2        1.800  3.310  40.00  40.00 1000.00
1:LYS_26:HA        1:LYS_26:HG1        1.800  3.310  40.00  40.00 1000.00
1:LYS_26:HA        1:LYS_26:HG*        1.800  3.000  40.00  40.00 1000.00
1:LYS_26:HB2       1:TYR_27:CG         1.800  5.910  40.00  40.00 1000.00
1:LYS_26:HB2       1:TYR_27:CZ         1.800  5.380  40.00  40.00 1000.00
1:LYS_26:HB1       1:TYR_27:CG         1.800  5.910  40.00  40.00 1000.00
1:LYS_26:HB1       1:TYR_27:CZ         1.800  5.380  40.00  40.00 1000.00
1:LYS_26:HB*       1:TYR_27:HN         1.800  4.800  40.00  40.00 1000.00
1:LYS_26:HB*       1:TYR_27:CG         1.800  5.300  40.00  40.00 1000.00
1:LYS_26:HB*       1:TYR_27:CZ         1.800  5.160  40.00  40.00 1000.00
1:TYR_27:HN        1:TYR_27:HB2        1.800  3.400  40.00  40.00 1000.00
1:TYR_27:HN        1:CYS_28:HN         1.800  2.510  40.00  40.00 1000.00
1:TYR_27:HA        1:TYR_27:HB2        1.800  2.780  40.00  40.00 1000.00
1:TYR_27:HB2       1:CYS_28:HN         1.800  2.870  40.00  40.00 1000.00
1:TYR_27:HB1       1:CYS_28:HN         1.800  3.800  40.00  40.00 1000.00
1:CYS_28:HN        1:CYS_28:HB1        1.800  3.380  40.00  40.00 1000.00
1:CYS_28:HN        1:GLY_29:HN         1.800  3.110  40.00  40.00 1000.00
1:CYS_28:HA        1:GLY_29:HN         1.800  3.490  40.00  40.00 1000.00
1:GLY_29:HN        1:GLY_29:HA1        1.800  2.650  40.00  40.00 1000.00
1:GLY_29:HN        1:GLY_29:HA2        1.800  2.650  40.00  40.00 1000.00
1:GLY_29:HA1       1:ARGC_30:HN         1.800  3.040  40.00  40.00 1000.00
1:GLY_29:HA2       1:ARGC_30:HN         1.800  3.040  40.00  40.00 1000.00
1:ARGC_30:HN        1:ARGC_30:HG*        1.800  3.610  40.00  40.00 1000.00
1:ARGC_30:HA        1:ARGC_30:HD*        1.800  4.270  40.00  40.00 1000.00
!
#NMR_dihedral
1:GLY_2:C          1:GLU_3:N           1:GLU_3:CA         1:GLU_3:C          -320.000 -35.00  40.00  40.00 1000.00 
1:GLU_3:N          1:GLU_3:CA          1:GLU_3:C          1:CYS_4:N          120.000 190.00  40.00  40.00 1000.00 
1:GLU_3:C          1:CYS_4:N           1:CYS_4:CA         1:CYS_4:C          -140.000 -35.00  40.00  40.00 1000.00 
1:CYS_4:N          1:CYS_4:CA          1:CYS_4:C          1:VAL_5:N          145.000 175.00  40.00  40.00 1000.00 
1:CYS_4:N          1:CYS_4:CA          1:CYS_4:CB         1:CYS_4:SG         -140.000 -25.00  40.00  40.00 1000.00 
1:CYS_4:C          1:VAL_5:N           1:VAL_5:CA         1:VAL_5:C          -120.000 -85.00  40.00  40.00 1000.00 
1:VAL_5:N          1:VAL_5:CA          1:VAL_5:C          1:ARG_6:N           60.000 100.00  40.00  40.00 1000.00 
1:VAL_5:N          1:VAL_5:CA          1:VAL_5:CB         1:VAL_5:CG1          50.000 200.00  40.00  40.00 1000.00 
1:VAL_5:C          1:ARG_6:N           1:ARG_6:CA         1:ARG_6:C           35.000  95.00  40.00  40.00 1000.00 
1:ARG_6:N          1:ARG_6:CA          1:ARG_6:C          1:GLY_7:N           15.000  50.00  40.00  40.00 1000.00 
1:ARG_6:N          1:ARG_6:CA          1:ARG_6:CB         1:ARG_6:CG         -120.000 -30.00  40.00  40.00 1000.00 
1:ARG_6:C          1:GLY_7:N           1:GLY_7:CA         1:GLY_7:C           50.000 140.00  40.00  40.00 1000.00 
1:GLY_7:N          1:GLY_7:CA          1:GLY_7:C          1:ARG_8:N          -10.000  70.00  40.00  40.00 1000.00 
1:GLY_7:C          1:ARG_8:N           1:ARG_8:CA         1:ARG_8:C          192.000 252.00  40.00  40.00 1000.00 
1:ARG_8:N          1:ARG_8:CA          1:ARG_8:C          1:CYS_9:N           80.000 170.00  40.00  40.00 1000.00 
1:ARG_8:N          1:ARG_8:CA          1:ARG_8:CB         1:ARG_8:CG         -90.000 -50.00  40.00  40.00 1000.00 
1:ARG_8:C          1:CYS_9:N           1:CYS_9:CA         1:CYS_9:C          -135.000 -105.00  40.00  40.00 1000.00 
1:CYS_9:N          1:CYS_9:CA          1:CYS_9:C          1:PRO_10:N         140.000 190.00  40.00  40.00 1000.00 
1:CYS_9:N          1:CYS_9:CA          1:CYS_9:CB         1:CYS_9:SG         -130.000 -55.00  40.00  40.00 1000.00 
1:PRO_10:N         1:PRO_10:CA         1:PRO_10:C         1:SER_11:N         150.000 200.00  40.00  40.00 1000.00 
1:PRO_10:C         1:SER_11:N          1:SER_11:CA        1:SER_11:C          35.000  90.00  40.00  40.00 1000.00 
1:SER_11:N         1:SER_11:CA         1:SER_11:C         1:GLY_12:N         -105.000 225.00  40.00  40.00 1000.00 
1:SER_11:N         1:SER_11:CA         1:SER_11:CB        1:SER_11:OG         60.000 220.00  40.00  40.00 1000.00 
1:GLY_12:N         1:GLY_12:CA         1:GLY_12:C         1:MET_13:N         -100.000  90.00  40.00  40.00 1000.00 
1:GLY_12:C         1:MET_13:N          1:MET_13:CA        1:MET_13:C         -140.000  70.00  40.00  40.00 1000.00 
1:MET_13:N         1:MET_13:CA         1:MET_13:C         1:CYS_14:N         135.000 210.00  40.00  40.00 1000.00 
1:MET_13:N         1:MET_13:CA         1:MET_13:CB        1:MET_13:CG        -150.000 100.00  40.00  40.00 1000.00 
1:MET_13:C         1:CYS_14:N          1:CYS_14:CA        1:CYS_14:C         -155.000 -85.00  40.00  40.00 1000.00 
1:CYS_14:N         1:CYS_14:CA         1:CYS_14:C         1:CYS_15:N         135.000 190.00  40.00  40.00 1000.00 
1:CYS_14:N         1:CYS_14:CA         1:CYS_14:CB        1:CYS_14:SG        -75.000 -45.00  40.00  40.00 1000.00 
1:CYS_14:C         1:CYS_15:N          1:CYS_15:CA        1:CYS_15:C         -160.000 -50.00  40.00  40.00 1000.00 
1:CYS_15:N         1:CYS_15:CA         1:CYS_15:C         1:SER_16:N         -10.000 225.00  40.00  40.00 1000.00 
1:CYS_15:N         1:CYS_15:CA         1:CYS_15:CB        1:CYS_15:SG        -50.000 210.00  40.00  40.00 1000.00 
1:CYS_15:C         1:SER_16:N          1:SER_16:CA        1:SER_16:C         -180.000  80.00  40.00  40.00 1000.00 
1:SER_16:N         1:SER_16:CA         1:SER_16:C         1:GLN_17:N         -220.000  10.00  40.00  40.00 1000.00 
1:SER_16:C         1:GLN_17:N          1:GLN_17:CA        1:GLN_17:C         -175.000  65.00  40.00  40.00 1000.00 
1:GLN_17:N         1:GLN_17:CA         1:GLN_17:C         1:PHE_18:N         -105.000 115.00  40.00  40.00 1000.00 
1:GLN_17:N         1:GLN_17:CA         1:GLN_17:CB        1:GLN_17:CG        -335.000  -5.00  40.00  40.00 1000.00 
1:GLN_17:C         1:PHE_18:N          1:PHE_18:CA        1:PHE_18:C         -145.000 -95.00  40.00  40.00 1000.00 
1:PHE_18:N         1:PHE_18:CA         1:PHE_18:C         1:GLY_19:N         -95.000  65.00  40.00  40.00 1000.00 
1:PHE_18:N         1:PHE_18:CA         1:PHE_18:CB        1:PHE_18:CG        -205.000 -35.00  40.00  40.00 1000.00 
1:GLY_19:C         1:TYR_20:N          1:TYR_20:CA        1:TYR_20:C         -145.000 -95.00  40.00  40.00 1000.00 
1:TYR_20:N         1:TYR_20:CA         1:TYR_20:C         1:CYS_21:N         -190.000 -145.00  40.00  40.00 1000.00 
1:TYR_20:N         1:TYR_20:CA         1:TYR_20:CB        1:TYR_20:CG        -90.000 -20.00  40.00  40.00 1000.00 
1:TYR_20:C         1:CYS_21:N          1:CYS_21:CA        1:CYS_21:C         -200.000 -80.00  40.00  40.00 1000.00 
1:CYS_21:N         1:CYS_21:CA         1:CYS_21:C         1:GLY_22:N         100.000 175.00  40.00  40.00 1000.00 
1:CYS_21:C         1:GLY_22:N          1:GLY_22:CA        1:GLY_22:C         -270.000   0.00  40.00  40.00 1000.00 
1:GLY_22:N         1:GLY_22:CA         1:GLY_22:C         1:LYS_23:N         -250.000   0.00  40.00  40.00 1000.00 
1:GLY_22:C         1:LYS_23:N          1:LYS_23:CA        1:LYS_23:C          55.000 275.00  40.00  40.00 1000.00 
1:LYS_23:N         1:LYS_23:CA         1:LYS_23:C         1:GLY_24:N         -70.000 225.00  40.00  40.00 1000.00 
1:LYS_23:N         1:LYS_23:CA         1:LYS_23:CB        1:LYS_23:CG        -210.000 -30.00  40.00  40.00 1000.00 
1:GLY_24:N         1:GLY_24:CA         1:GLY_24:C         1:PRO_25:N         130.000 220.00  40.00  40.00 1000.00 
1:PRO_25:N         1:PRO_25:CA         1:PRO_25:C         1:LYS_26:N         -90.000   0.00  40.00  40.00 1000.00 
1:PRO_25:C         1:LYS_26:N          1:LYS_26:CA        1:LYS_26:C         -70.000  10.00  40.00  40.00 1000.00 
1:LYS_26:N         1:LYS_26:CA         1:LYS_26:C         1:TYR_27:N         -90.000  95.00  40.00  40.00 1000.00 
1:LYS_26:C         1:TYR_27:N          1:TYR_27:CA        1:TYR_27:C         -145.000 -95.00  40.00  40.00 1000.00 
1:TYR_27:N         1:TYR_27:CA         1:TYR_27:C         1:CYS_28:N         -95.000 -25.00  40.00  40.00 1000.00 
1:TYR_27:N         1:TYR_27:CA         1:TYR_27:CB        1:TYR_27:CG        -205.000 -35.00  40.00  40.00 1000.00 
1:TYR_27:C         1:CYS_28:N          1:CYS_28:CA        1:CYS_28:C          35.000 295.00  40.00  40.00 1000.00 
1:CYS_28:N         1:CYS_28:CA         1:CYS_28:C         1:GLY_29:N         -105.000 125.00  40.00  40.00 1000.00 
1:CYS_28:N         1:CYS_28:CA         1:CYS_28:CB        1:CYS_28:SG        -245.000   5.00  40.00  40.00 1000.00 
1:GLY_29:N         1:GLY_29:CA         1:GLY_29:C         1:ARGC_30:N         -30.000 240.00  40.00  40.00 1000.00 
1:ARGC_30:N         1:ARGC_30:CA         1:ARGC_30:CB        1:ARGC_30:CG        -130.000 140.00  40.00  40.00 1000.00


  Entry H atom name         Orig H atom name
  Start of MODEL           1
 Raw file had  213 H/Q atoms
  Start of MODEL    1
    1   1H    VAL   1          2H        VAL   1  -2.199  -0.044  -6.292
    2   2H    VAL   1          3H        VAL   1  -2.567  -1.079  -5.056
    3   3H    VAL   1          1H        VAL   1  -2.714  -1.584  -6.614
    4    HA   VAL   1           HA       VAL   1  -4.686  -0.635  -6.943
    5    HB   VAL   1           HB       VAL   1  -6.056  -0.202  -5.027
    6   1HG1  VAL   1          2HG1      VAL   1  -5.393  -2.562  -5.415
    7   2HG1  VAL   1          1HG1      VAL   1  -4.088  -2.385  -4.223
    8   3HG1  VAL   1          3HG1      VAL   1  -5.774  -2.209  -3.719
    9   1HG2  VAL   1          2HG2      VAL   1  -3.523  -0.021  -3.363
   10   2HG2  VAL   1          1HG2      VAL   1  -4.606   1.329  -3.736
   11   3HG2  VAL   1          3HG2      VAL   1  -5.177  -0.003  -2.731
   12    H    GLY   2           H        GLY   2  -6.062   1.535  -6.371
   13   1HA   GLY   2          1HA       GLY   2  -4.654   3.593  -7.706
   14   2HA   GLY   2          2HA       GLY   2  -6.230   3.743  -6.917
   15    H    GLU   3           H        GLU   3  -5.920   3.619  -4.284
   16    HA   GLU   3           HA       GLU   3  -3.525   4.560  -3.195
   17   1HB   GLU   3          2HB       GLU   3  -4.442   6.719  -2.260
   18   2HB   GLU   3          1HB       GLU   3  -3.816   6.720  -3.907
   19   1HG   GLU   3          2HG       GLU   3  -6.066   6.696  -4.848
   20   2HG   GLU   3          1HG       GLU   3  -6.773   6.534  -3.235
   21    HE1  GLU   3           HE2      GLU   3  -4.848   8.588  -5.271
   22    H    CYS   4           H        CYS   4  -3.640   4.390  -0.914
   23    HA   CYS   4           HA       CYS   4  -5.505   2.397  -0.030
   24   1HB   CYS   4          1HB       CYS   4  -3.422   4.041   1.373
   25   2HB   CYS   4          2HB       CYS   4  -4.578   3.237   2.353
   26    H    VAL   5           H        VAL   5  -6.527   2.637   2.110
   27    HA   VAL   5           HA       VAL   5  -8.698   4.657   1.907
   28    HB   VAL   5           HB       VAL   5  -8.483   2.249   3.749
   29   1HG1  VAL   5          3HG1      VAL   5 -10.779   4.106   2.939
   30   2HG1  VAL   5          2HG1      VAL   5 -10.932   2.670   3.977
   31   3HG1  VAL   5          1HG1      VAL   5 -10.002   4.069   4.532
   32   1HG2  VAL   5          3HG2      VAL   5  -9.813   2.627   1.029
   33   2HG2  VAL   5          2HG2      VAL   5  -8.520   1.478   1.429
   34   3HG2  VAL   5          1HG2      VAL   5 -10.132   1.260   2.122
   35    H    ARG   6           H        ARG   6  -6.939   6.034   2.231
   36    HA   ARG   6           HA       ARG   6  -5.659   7.570   3.346
   37   1HB   ARG   6          2HB       ARG   6  -7.575   7.243   5.645
   38   2HB   ARG   6          1HB       ARG   6  -6.446   8.569   5.358
   39   1HG   ARG   6          2HG       ARG   6  -8.956   7.878   3.821
   40   2HG   ARG   6          1HG       ARG   6  -8.554   9.339   4.728
   41   1HD   ARG   6          2HD       ARG   6  -8.380  10.106   2.576
   42   2HD   ARG   6          1HD       ARG   6  -6.687   9.690   2.906
   43    HE   ARG   6           HE       ARG   6  -8.146   7.455   1.827
   44   1HH1  ARG   6          1HH1      ARG   6  -6.998  10.599   0.595
   45   2HH1  ARG   6          2HH1      ARG   6  -6.777   9.959  -1.030
   46   1HH2  ARG   6          1HH2      ARG   6  -7.519   6.655  -0.269
   47   2HH2  ARG   6          2HH2      ARG   6  -7.266   7.849  -1.519
   48    H    GLY   7           H        GLY   7  -4.406   5.293   3.213
   49   1HA   GLY   7          1HA       GLY   7  -2.498   4.382   4.026
   50   2HA   GLY   7          2HA       GLY   7  -2.712   5.302   5.508
   51    H    ARG   8           H        ARG   8  -5.255   3.071   4.330
   52    HA   ARG   8           HA       ARG   8  -4.391   0.877   6.022
   53   1HB   ARG   8          2HB       ARG   8  -7.179   1.989   5.942
   54   2HB   ARG   8          1HB       ARG   8  -6.642   0.450   6.666
   55   1HG   ARG   8          2HG       ARG   8  -4.802   1.909   7.834
   56   2HG   ARG   8          1HG       ARG   8  -5.763   3.265   7.331
   57   1HD   ARG   8          2HD       ARG   8  -6.417   2.752   9.579
   58   2HD   ARG   8          1HD       ARG   8  -7.731   2.270   8.487
   59    HE   ARG   8           HE       ARG   8  -7.509   0.099   9.155
   60   1HH1  ARG   8          1HH1      ARG   8  -4.528   1.782   9.969
   61   2HH1  ARG   8          2HH1      ARG   8  -3.835   0.483  10.890
   62   1HH2  ARG   8          1HH2      ARG   8  -6.622  -1.680  10.341
   63   2HH2  ARG   8          2HH2      ARG   8  -5.063  -1.546  11.086
   64    H    CYS   9           H        CYS   9  -4.742  -1.018   4.784
   65    HA   CYS   9           HA       CYS   9  -6.553  -0.945   2.442
   66   1HB   CYS   9          1HB       CYS   9  -3.672  -1.561   2.234
   67   2HB   CYS   9          2HB       CYS   9  -4.660  -2.925   1.863
   68    HA   PRO  10           HA       PRO  10  -8.107  -4.604   4.360
   69   1HB   PRO  10          2HB       PRO  10  -9.308  -5.959   2.348
   70   2HB   PRO  10          1HB       PRO  10  -9.812  -4.307   2.787
   71   1HG   PRO  10          2HG       PRO  10  -8.037  -5.175   0.504
   72   2HG   PRO  10          1HG       PRO  10  -9.339  -3.954   0.492
   73   1HD   PRO  10          2HD       PRO  10  -6.579  -3.505   0.818
   74   2HD   PRO  10          1HD       PRO  10  -7.829  -2.306   1.241
   75    H    SER  11           H        SER  11  -8.110  -7.021   4.188
   76    HA   SER  11           HA       SER  11  -6.750  -8.745   4.759
   77   1HB   SER  11          2HB       SER  11  -7.815  -9.288   2.531
   78   2HB   SER  11          1HB       SER  11  -6.385  -8.626   1.711
   79    HG   SER  11           HG       SER  11  -5.160 -10.239   2.816
   80    H    GLY  12           H        GLY  12  -5.455  -6.687   5.346
   81   1HA   GLY  12          1HA       GLY  12  -3.409  -5.754   5.896
   82   2HA   GLY  12          2HA       GLY  12  -2.861  -7.434   6.016
   83    H    MET  13           H        MET  13  -3.914  -5.521   3.145
   84    HA   MET  13           HA       MET  13  -1.323  -6.056   1.811
   85   1HB   MET  13          1HB       MET  13  -3.565  -4.317   0.781
   86   2HB   MET  13          2HB       MET  13  -2.113  -4.840  -0.054
   87   1HG   MET  13          1HG       MET  13  -3.163  -7.260   0.717
   88   2HG   MET  13          2HG       MET  13  -4.628  -6.312   0.511
   89   1HE   MET  13          2HE       MET  13  -5.266  -8.246  -1.241
   90   2HE   MET  13          1HE       MET  13  -4.319  -8.580  -2.709
   91   3HE   MET  13          3HE       MET  13  -3.653  -8.994  -1.112
   92    H    CYS  14           H        CYS  14   0.305  -4.469   1.385
   93    HA   CYS  14           HA       CYS  14   0.495  -2.691   3.735
   94   1HB   CYS  14          1HB       CYS  14   2.430  -3.282   1.460
   95   2HB   CYS  14          2HB       CYS  14   2.729  -2.171   2.792
   96    H    CYS  15           H        CYS  15   0.228  -0.482   3.599
   97    HA   CYS  15           HA       CYS  15  -0.315   0.775   1.016
   98   1HB   CYS  15          1HB       CYS  15   0.035   2.106   3.692
   99   2HB   CYS  15          2HB       CYS  15  -0.516   2.862   2.191
  100    H    SER  16           H        SER  16   1.309   1.220  -0.284
  101    HA   SER  16           HA       SER  16   4.014   0.901   0.204
  102   1HB   SER  16          2HB       SER  16   4.359   2.416  -1.791
  103   2HB   SER  16          1HB       SER  16   3.260   1.105  -2.080
  104    HG   SER  16           HG       SER  16   1.560   2.681  -1.406
  105    H    GLN  17           H        GLN  17   5.708   2.721   0.278
  106    HA   GLN  17           HA       GLN  17   5.256   4.966   1.932
  107   1HB   GLN  17          2HB       GLN  17   7.379   5.732   1.335
  108   2HB   GLN  17          1HB       GLN  17   7.448   3.959   1.403
  109   1HG   GLN  17          2HG       GLN  17   6.930   3.989  -1.088
  110   2HG   GLN  17          1HG       GLN  17   7.203   5.750  -1.013
  111   1HE2  GLN  17          2HE2      GLN  17  10.783   5.398  -0.412
  112   2HE2  GLN  17          1HE2      GLN  17   9.410   6.359   0.096
  113    H    PHE  18           H        PHE  18   4.365   4.535  -1.526
  114    HA   PHE  18           HA       PHE  18   4.052   7.247  -2.159
  115   1HB   PHE  18          2HB       PHE  18   2.996   4.942  -3.575
  116   2HB   PHE  18          1HB       PHE  18   3.788   6.369  -4.129
  117    HD1  PHE  18           HD2      PHE  18   6.380   6.619  -3.405
  118    HD2  PHE  18           HD1      PHE  18   4.210   2.980  -4.185
  119    HE1  PHE  18           HE2      PHE  18   8.519   5.423  -3.812
  120    HE2  PHE  18           HE1      PHE  18   6.353   1.766  -4.495
  121    HZ   PHE  18           HZ       PHE  18   8.512   2.980  -4.270
  122    H    GLY  19           H        GLY  19   2.206   5.296  -0.097
  123   1HA   GLY  19          1HA       GLY  19   0.116   5.363   0.625
  124   2HA   GLY  19          2HA       GLY  19  -0.060   6.816  -0.343
  125    H    TYR  20           H        TYR  20   0.899   4.165  -2.271
  126    HA   TYR  20           HA       TYR  20  -1.886   3.351  -3.042
  127   1HB   TYR  20          1HB       TYR  20   0.751   2.582  -4.300
  128   2HB   TYR  20          2HB       TYR  20  -0.858   2.245  -4.912
  129    HD1  TYR  20           HD2      TYR  20  -1.427   5.512  -3.987
  130    HD2  TYR  20           HD1      TYR  20   0.926   3.234  -6.807
  131    HE1  TYR  20           HE2      TYR  20  -1.308   7.461  -5.460
  132    HE2  TYR  20           HE1      TYR  20   0.970   5.188  -8.319
  133    HH   TYR  20           HH       TYR  20   0.312   7.376  -8.641
  134    H    CYS  21           H        CYS  21  -1.434   0.673  -3.614
  135    HA   CYS  21           HA       CYS  21  -0.190  -0.466  -1.267
  136   1HB   CYS  21          1HB       CYS  21  -1.923  -0.475   0.152
  137   2HB   CYS  21          2HB       CYS  21  -2.907   0.399  -1.035
  138    H    GLY  22           H        GLY  22  -0.108  -2.678  -1.076
  139   1HA   GLY  22          1HA       GLY  22  -1.397  -4.576  -2.544
  140   2HA   GLY  22          2HA       GLY  22   0.047  -4.173  -3.501
  141    H    LYS  23           H        LYS  23  -0.559  -6.592  -1.912
  142    HA   LYS  23           HA       LYS  23   0.929  -6.431   0.567
  143   1HB   LYS  23          2HB       LYS  23  -1.158  -7.810  -0.011
  144   2HB   LYS  23          1HB       LYS  23  -0.090  -8.944  -0.827
  145   1HG   LYS  23          2HG       LYS  23   1.145  -9.247   1.350
  146   2HG   LYS  23          1HG       LYS  23   0.020  -8.100   2.107
  147   1HD   LYS  23          2HD       LYS  23  -1.885  -9.674   1.301
  148   2HD   LYS  23          1HD       LYS  23  -0.611 -10.805   0.837
  149   1HE   LYS  23          2HE       LYS  23  -1.371 -11.516   2.978
  150   2HE   LYS  23          1HE       LYS  23   0.205 -10.757   3.253
  151   1HZ   LYS  23          2HZ       LYS  23  -1.016  -8.749   3.953
  152   2HZ   LYS  23          1HZ       LYS  23  -2.441  -9.498   3.693
  153   3HZ   LYS  23          3HZ       LYS  23  -1.432 -10.050   4.867
  154    H    GLY  24           H        GLY  24   2.911  -5.590  -0.772
  155   1HA   GLY  24          1HA       GLY  24   4.770  -7.668  -0.411
  156   2HA   GLY  24          2HA       GLY  24   4.558  -7.425  -2.164
  157    HA   PRO  25           HA       PRO  25   7.957  -4.742  -0.039
  158   1HB   PRO  25          2HB       PRO  25   9.434  -6.163  -2.267
  159   2HB   PRO  25          1HB       PRO  25  10.071  -5.588  -0.698
  160   1HG   PRO  25          2HG       PRO  25   9.415  -8.193  -0.990
  161   2HG   PRO  25          1HG       PRO  25   8.884  -7.316   0.477
  162   1HD   PRO  25          2HD       PRO  25   7.265  -7.962  -1.997
  163   2HD   PRO  25          1HD       PRO  25   6.838  -8.098  -0.267
  164    H    LYS  26           H        LYS  26   6.933  -5.241  -3.409
  165    HA   LYS  26           HA       LYS  26   8.106  -3.029  -4.688
  166   1HB   LYS  26          2HB       LYS  26   5.325  -4.241  -5.017
  167   2HB   LYS  26          1HB       LYS  26   6.036  -3.030  -6.098
  168   1HG   LYS  26          2HG       LYS  26   7.953  -4.558  -6.547
  169   2HG   LYS  26          1HG       LYS  26   7.183  -5.808  -5.553
  170   1HD   LYS  26          2HD       LYS  26   5.209  -5.791  -7.058
  171   2HD   LYS  26          1HD       LYS  26   5.973  -4.522  -8.041
  172   1HE   LYS  26          2HE       LYS  26   7.887  -6.063  -8.527
  173   2HE   LYS  26          1HE       LYS  26   7.101  -7.334  -7.576
  174   1HZ   LYS  26          3HZ       LYS  26   6.022  -6.116 -10.036
  175   2HZ   LYS  26          2HZ       LYS  26   6.712  -7.601  -9.914
  176   3HZ   LYS  26          1HZ       LYS  26   5.287  -7.299  -9.156
  177    H    TYR  27           H        TYR  27   5.193  -3.164  -2.547
  178    HA   TYR  27           HA       TYR  27   4.966  -0.224  -2.620
  179   1HB   TYR  27          1HB       TYR  27   3.353  -2.414  -1.227
  180   2HB   TYR  27          2HB       TYR  27   3.004  -0.808  -1.178
  181    HD1  TYR  27           HD1      TYR  27   3.234  -3.757  -3.423
  182    HD2  TYR  27           HD2      TYR  27   1.653   0.244  -3.064
  183    HE1  TYR  27           HE1      TYR  27   2.007  -4.030  -5.550
  184    HE2  TYR  27           HE2      TYR  27   0.528  -0.001  -5.223
  185    HH   TYR  27           HH       TYR  27   0.564  -3.046  -7.070
  186    H    CYS  28           H        CYS  28   4.993  -2.875  -0.369
  187    HA   CYS  28           HA       CYS  28   5.191  -1.494   1.980
  188   1HB   CYS  28          1HB       CYS  28   4.692  -4.047   1.363
  189   2HB   CYS  28          2HB       CYS  28   6.364  -4.275   1.863
  190    H    GLY  29           H        GLY  29   7.929  -2.440  -0.031
  191   1HA   GLY  29          1HA       GLY  29   9.929  -2.374   1.862
  192   2HA   GLY  29          2HA       GLY  29  10.148  -2.005   0.155
  193    H    ARG  30           HN       ARG  30  11.612  -0.639   2.103
  194    HA   ARG  30           HA       ARG  30  12.298   1.318   2.841
  195   1HB   ARG  30          1HB       ARG  30  10.490   2.578   0.765
  196   2HB   ARG  30          2HB       ARG  30  11.878   3.281   1.564
  197   1HG   ARG  30          1HG       ARG  30  12.741   2.687  -0.489
  198   2HG   ARG  30          2HG       ARG  30  13.328   1.432   0.603
  199   1HD   ARG  30          1HD       ARG  30  12.597   0.738  -1.737
  200   2HD   ARG  30          2HD       ARG  30  11.966  -0.215  -0.394
  201    HE   ARG  30           HE       ARG  30  10.198   1.988  -1.197
  202   1HH1  ARG  30          2HH2      ARG  30  11.225  -1.117  -2.406
  203   2HH1  ARG  30          1HH2      ARG  30   9.626  -1.834  -2.426
  204   1HH2  ARG  30          2HH1      ARG  30   7.926   0.584  -0.986
  205   2HH2  ARG  30          1HH1      ARG  30   7.826  -0.093  -2.574
  No match found for entry  HXTARG          30
   
  No H/Q in entry =         206
  Start of MODEL           2
 Raw file had  213 H/Q atoms
  Start of MODEL    2
    1   1H    VAL   1          1H        VAL   1  -1.639  -2.241  -5.283
    2   2H    VAL   1          2H        VAL   1  -2.139  -2.870  -6.705
    3   3H    VAL   1          3H        VAL   1  -0.651  -2.084  -6.608
    4    HA   VAL   1           HA       VAL   1  -1.670  -0.052  -6.164
    5    HB   VAL   1           HB       VAL   1  -3.034   0.371  -8.173
    6   1HG1  VAL   1          3HG1      VAL   1  -0.551   0.274  -8.318
    7   2HG1  VAL   1          2HG1      VAL   1  -0.665  -1.435  -8.804
    8   3HG1  VAL   1          1HG1      VAL   1  -1.360  -0.171  -9.829
    9   1HG2  VAL   1          3HG2      VAL   1  -4.356  -1.738  -8.239
   10   2HG2  VAL   1          2HG2      VAL   1  -3.546  -1.401  -9.773
   11   3HG2  VAL   1          1HG2      VAL   1  -2.891  -2.638  -8.690
   12    H    GLY   2           H        GLY   2  -3.813   1.225  -6.041
   13   1HA   GLY   2          1HA       GLY   2  -6.297   0.232  -5.609
   14   2HA   GLY   2          2HA       GLY   2  -5.530  -0.037  -4.034
   15    H    GLU   3           H        GLU   3  -4.151   1.905  -3.371
   16    HA   GLU   3           HA       GLU   3  -3.901   4.298  -3.068
   17   1HB   GLU   3          2HB       GLU   3  -5.455   4.884  -4.760
   18   2HB   GLU   3          1HB       GLU   3  -6.769   4.677  -3.538
   19   1HG   GLU   3          2HG       GLU   3  -4.380   6.585  -3.343
   20   2HG   GLU   3          1HG       GLU   3  -5.976   7.042  -3.944
   21    HE1  GLU   3           HE2      GLU   3  -7.078   6.004  -0.498
   22    H    CYS   4           H        CYS   4  -3.663   4.548  -1.054
   23    HA   CYS   4           HA       CYS   4  -4.878   2.656   0.812
   24   1HB   CYS   4          1HB       CYS   4  -3.494   5.031   1.936
   25   2HB   CYS   4          2HB       CYS   4  -3.461   3.362   2.454
   26    H    VAL   5           H        VAL   5  -6.223   2.999   2.532
   27    HA   VAL   5           HA       VAL   5  -8.004   5.378   2.350
   28    HB   VAL   5           HB       VAL   5  -8.335   2.870   4.020
   29   1HG1  VAL   5          1HG1      VAL   5 -10.213   5.117   3.118
   30   2HG1  VAL   5          3HG1      VAL   5 -10.696   3.686   4.059
   31   3HG1  VAL   5          2HG1      VAL   5  -9.617   4.895   4.770
   32   1HG2  VAL   5          2HG2      VAL   5  -9.287   3.607   1.218
   33   2HG2  VAL   5          1HG2      VAL   5  -8.276   2.223   1.667
   34   3HG2  VAL   5          3HG2      VAL   5  -9.965   2.270   2.179
   35    H    ARG   6           H        ARG   6  -5.926   6.280   2.817
   36    HA   ARG   6           HA       ARG   6  -4.266   7.245   4.103
   37   1HB   ARG   6          2HB       ARG   6  -6.473   7.529   6.145
   38   2HB   ARG   6          1HB       ARG   6  -4.989   8.480   6.085
   39   1HG   ARG   6          2HG       ARG   6  -7.060   8.443   3.824
   40   2HG   ARG   6          1HG       ARG   6  -7.094   9.557   5.174
   41   1HD   ARG   6          2HD       ARG   6  -6.122  10.691   3.269
   42   2HD   ARG   6          1HD       ARG   6  -4.971  10.541   4.584
   43    HE   ARG   6           HE       ARG   6  -3.554   9.431   3.229
   44   1HH1  ARG   6          1HH1      ARG   6  -6.764   9.152   1.718
   45   2HH1  ARG   6          2HH1      ARG   6  -6.126   8.271   0.334
   46   1HH2  ARG   6          2HH2      ARG   6  -2.792   8.294   1.314
   47   2HH2  ARG   6          1HH2      ARG   6  -3.977   7.824   0.117
   48    H    GLY   7           H        GLY   7  -3.615   4.909   3.920
   49   1HA   GLY   7          1HA       GLY   7  -1.799   3.874   4.807
   50   2HA   GLY   7          2HA       GLY   7  -2.299   4.342   6.418
   51    H    ARG   8           H        ARG   8  -4.845   2.897   4.610
   52    HA   ARG   8           HA       ARG   8  -4.601   0.300   5.947
   53   1HB   ARG   8          2HB       ARG   8  -6.933   2.188   5.697
   54   2HB   ARG   8          1HB       ARG   8  -6.940   0.574   6.440
   55   1HG   ARG   8          2HG       ARG   8  -5.158   1.279   7.986
   56   2HG   ARG   8          1HG       ARG   8  -5.133   2.895   7.338
   57   1HD   ARG   8          2HD       ARG   8  -7.633   1.697   8.496
   58   2HD   ARG   8          1HD       ARG   8  -6.480   2.755   9.372
   59    HE   ARG   8           HE       ARG   8  -7.129   3.962   6.869
   60   1HH1  ARG   8          1HH2      ARG   8  -8.686   3.437   9.982
   61   2HH1  ARG   8          2HH2      ARG   8  -9.714   4.836   9.866
   62   1HH2  ARG   8          2HH1      ARG   8  -8.377   5.680   6.640
   63   2HH2  ARG   8          1HH1      ARG   8  -9.537   6.208   7.848
   64    H    CYS   9           H        CYS   9  -4.807  -1.235   4.315
   65    HA   CYS   9           HA       CYS   9  -6.901  -0.915   2.278
   66   1HB   CYS   9          1HB       CYS   9  -4.003  -1.448   1.763
   67   2HB   CYS   9          2HB       CYS   9  -5.133  -2.426   0.897
   68    HA   PRO  10           HA       PRO  10  -8.141  -4.629   3.940
   69   1HB   PRO  10          2HB       PRO  10  -9.410  -6.011   1.964
   70   2HB   PRO  10          1HB       PRO  10  -9.924  -4.384   2.486
   71   1HG   PRO  10          2HG       PRO  10  -8.219  -5.110   0.104
   72   2HG   PRO  10          1HG       PRO  10  -9.611  -3.991   0.161
   73   1HD   PRO  10          2HD       PRO  10  -6.978  -3.239   0.293
   74   2HD   PRO  10          1HD       PRO  10  -8.238  -2.258   1.066
   75    H    SER  11           H        SER  11  -8.228  -7.048   3.805
   76    HA   SER  11           HA       SER  11  -6.924  -8.834   4.340
   77   1HB   SER  11          2HB       SER  11  -8.132  -9.150   2.090
   78   2HB   SER  11          1HB       SER  11  -6.559  -8.880   1.310
   79    HG   SER  11           HG       SER  11  -7.062 -11.123   1.730
   80    H    GLY  12           H        GLY  12  -5.424  -7.049   5.095
   81   1HA   GLY  12          1HA       GLY  12  -3.264  -6.458   5.669
   82   2HA   GLY  12          2HA       GLY  12  -2.878  -8.153   5.334
   83    H    MET  13           H        MET  13  -3.935  -5.539   3.110
   84    HA   MET  13           HA       MET  13  -1.465  -5.791   1.465
   85   1HB   MET  13          1HB       MET  13  -3.990  -4.157   1.295
   86   2HB   MET  13          2HB       MET  13  -2.627  -3.913   0.194
   87   1HG   MET  13          1HG       MET  13  -2.831  -6.269  -0.558
   88   2HG   MET  13          2HG       MET  13  -4.181  -6.513   0.546
   89   1HE   MET  13          2HE       MET  13  -4.569  -7.403  -2.309
   90   2HE   MET  13          1HE       MET  13  -5.911  -7.334  -1.136
   91   3HE   MET  13          3HE       MET  13  -6.113  -6.643  -2.763
   92    H    CYS  14           H        CYS  14   0.216  -4.274   1.502
   93    HA   CYS  14           HA       CYS  14   0.266  -2.505   3.876
   94   1HB   CYS  14          1HB       CYS  14   2.340  -3.132   1.741
   95   2HB   CYS  14          2HB       CYS  14   2.548  -1.990   3.062
   96    H    CYS  15           H        CYS  15   0.155  -0.292   3.691
   97    HA   CYS  15           HA       CYS  15  -0.705   0.964   1.207
   98   1HB   CYS  15          1HB       CYS  15  -1.473   1.847   3.330
   99   2HB   CYS  15          2HB       CYS  15   0.189   2.048   3.911
  100    H    SER  16           H        SER  16   0.650   1.379  -0.418
  101    HA   SER  16           HA       SER  16   3.374   0.869  -0.418
  102   1HB   SER  16          2HB       SER  16   1.941   2.778  -2.284
  103   2HB   SER  16          1HB       SER  16   3.362   1.788  -2.636
  104    HG   SER  16           HG       SER  16   1.802  -0.026  -2.100
  105    H    GLN  17           H        GLN  17   5.190   2.249  -0.351
  106    HA   GLN  17           HA       GLN  17   5.280   4.693   0.934
  107   1HB   GLN  17          2HB       GLN  17   7.354   5.102  -0.587
  108   2HB   GLN  17          1HB       GLN  17   7.333   3.903   0.718
  109   1HG   GLN  17          2HG       GLN  17   7.015   2.097  -0.694
  110   2HG   GLN  17          1HG       GLN  17   6.625   3.144  -2.090
  111   1HE2  GLN  17          2HE2      GLN  17  10.132   1.786  -2.411
  112   2HE2  GLN  17          1HE2      GLN  17   8.510   1.095  -2.372
  113    H    PHE  18           H        PHE  18   4.246   4.102  -2.461
  114    HA   PHE  18           HA       PHE  18   4.243   6.757  -3.340
  115   1HB   PHE  18          2HB       PHE  18   3.014   4.398  -4.520
  116   2HB   PHE  18          1HB       PHE  18   3.872   5.709  -5.241
  117    HD1  PHE  18           HD1      PHE  18   6.479   5.888  -4.254
  118    HD2  PHE  18           HD2      PHE  18   4.137   2.336  -4.987
  119    HE1  PHE  18           HE1      PHE  18   8.557   4.558  -4.487
  120    HE2  PHE  18           HE2      PHE  18   6.226   1.003  -5.148
  121    HZ   PHE  18           HZ       PHE  18   8.431   2.115  -4.927
  122    H    GLY  19           H        GLY  19   2.197   5.379  -1.129
  123   1HA   GLY  19          1HA       GLY  19   0.178   5.970  -0.390
  124   2HA   GLY  19          2HA       GLY  19   0.141   7.131  -1.701
  125    H    TYR  20           H        TYR  20   0.635   4.170  -3.094
  126    HA   TYR  20           HA       TYR  20  -2.218   3.380  -3.408
  127   1HB   TYR  20          1HB       TYR  20   0.276   2.457  -4.836
  128   2HB   TYR  20          2HB       TYR  20  -1.341   1.864  -5.140
  129    HD1  TYR  20           HD1      TYR  20  -3.198   3.495  -5.854
  130    HD2  TYR  20           HD2      TYR  20   0.989   4.530  -5.907
  131    HE1  TYR  20           HE1      TYR  20  -3.692   5.415  -7.324
  132    HE2  TYR  20           HE2      TYR  20   0.487   6.460  -7.374
  133    HH   TYR  20           HH       TYR  20  -2.826   7.227  -8.470
  134    H    CYS  21           H        CYS  21  -1.664   0.529  -3.663
  135    HA   CYS  21           HA       CYS  21  -0.401  -0.173  -1.152
  136   1HB   CYS  21          1HB       CYS  21  -2.266  -0.876   0.104
  137   2HB   CYS  21          2HB       CYS  21  -2.599   0.784  -0.374
  138    H    GLY  22           H        GLY  22  -0.441  -2.518  -0.698
  139   1HA   GLY  22          1HA       GLY  22  -1.773  -4.467  -2.016
  140   2HA   GLY  22          2HA       GLY  22  -0.358  -4.171  -3.038
  141    H    LYS  23           H        LYS  23  -0.708  -6.493  -1.628
  142    HA   LYS  23           HA       LYS  23   0.972  -6.497   0.794
  143   1HB   LYS  23          2HB       LYS  23  -1.013  -7.973   0.513
  144   2HB   LYS  23          1HB       LYS  23  -0.181  -8.815  -0.802
  145   1HG   LYS  23          2HG       LYS  23   1.701  -9.296   0.905
  146   2HG   LYS  23          1HG       LYS  23   0.606  -8.704   2.149
  147   1HD   LYS  23          2HD       LYS  23   0.244 -11.061   0.229
  148   2HD   LYS  23          1HD       LYS  23   0.527 -11.170   1.964
  149   1HE   LYS  23          2HE       LYS  23  -1.985 -10.101   0.572
  150   2HE   LYS  23          1HE       LYS  23  -1.831 -11.635   1.427
  151   1HZ   LYS  23          2HZ       LYS  23  -1.525  -8.989   2.701
  152   2HZ   LYS  23          1HZ       LYS  23  -2.892  -9.871   2.716
  153   3HZ   LYS  23          3HZ       LYS  23  -1.539 -10.444   3.469
  154    H    GLY  24           H        GLY  24   2.896  -5.453  -0.440
  155   1HA   GLY  24          1HA       GLY  24   4.672  -7.596  -1.055
  156   2HA   GLY  24          2HA       GLY  24   4.318  -6.656  -2.518
  157    HA   PRO  25           HA       PRO  25   7.711  -5.064   0.399
  158   1HB   PRO  25          2HB       PRO  25   9.981  -5.576  -1.058
  159   2HB   PRO  25          1HB       PRO  25   9.163  -6.786  -0.032
  160   1HG   PRO  25          2HG       PRO  25   8.911  -6.434  -3.024
  161   2HG   PRO  25          1HG       PRO  25   9.152  -7.947  -2.109
  162   1HD   PRO  25          2HD       PRO  25   6.685  -7.120  -2.972
  163   2HD   PRO  25          1HD       PRO  25   6.874  -8.003  -1.438
  164    H    LYS  26           H        LYS  26   7.632  -4.610  -3.150
  165    HA   LYS  26           HA       LYS  26   8.942  -2.150  -3.405
  166   1HB   LYS  26          2HB       LYS  26   6.577  -3.402  -4.871
  167   2HB   LYS  26          1HB       LYS  26   7.220  -1.833  -5.348
  168   1HG   LYS  26          2HG       LYS  26   9.506  -2.840  -5.558
  169   2HG   LYS  26          1HG       LYS  26   8.835  -4.429  -5.157
  170   1HD   LYS  26          2HD       LYS  26   7.394  -4.326  -7.177
  171   2HD   LYS  26          1HD       LYS  26   8.044  -2.714  -7.555
  172   1HE   LYS  26          2HE       LYS  26  10.352  -3.692  -7.696
  173   2HE   LYS  26          1HE       LYS  26   9.686  -5.299  -7.364
  174   1HZ   LYS  26          2HZ       LYS  26   8.445  -5.132  -9.418
  175   2HZ   LYS  26          1HZ       LYS  26   9.069  -3.638  -9.720
  176   3HZ   LYS  26          3HZ       LYS  26  10.054  -4.951  -9.692
  177    H    TYR  27           H        TYR  27   5.749  -2.807  -2.097
  178    HA   TYR  27           HA       TYR  27   5.020   0.051  -1.941
  179   1HB   TYR  27          1HB       TYR  27   3.704  -2.610  -1.259
  180   2HB   TYR  27          2HB       TYR  27   2.933  -1.152  -1.000
  181    HD1  TYR  27           HD1      TYR  27   4.264  -0.089  -3.950
  182    HD2  TYR  27           HD2      TYR  27   1.970  -3.501  -2.662
  183    HE1  TYR  27           HE1      TYR  27   3.092  -0.096  -6.097
  184    HE2  TYR  27           HE2      TYR  27   0.829  -3.540  -4.871
  185    HH   TYR  27           HH       TYR  27   1.468  -1.128  -7.380
  186    H    CYS  28           H        CYS  28   5.134  -2.784   0.157
  187    HA   CYS  28           HA       CYS  28   4.736  -1.396   2.524
  188   1HB   CYS  28          1HB       CYS  28   4.700  -3.993   1.944
  189   2HB   CYS  28          2HB       CYS  28   6.331  -3.957   2.618
  190    H    GLY  29           H        GLY  29   7.824  -2.185   1.008
  191   1HA   GLY  29          1HA       GLY  29   9.573  -1.816   3.059
  192   2HA   GLY  29          2HA       GLY  29   9.939  -1.487   1.363
  193    H    ARG  30           HN       ARG  30  10.782  -0.055   3.900
  194    HA   ARG  30           HA       ARG  30  10.369   2.683   2.836
  195   1HB   ARG  30          1HB       ARG  30  10.317   1.819   5.767
  196   2HB   ARG  30          2HB       ARG  30  10.345   3.493   5.205
  197   1HG   ARG  30          1HG       ARG  30   8.118   1.501   4.564
  198   2HG   ARG  30          2HG       ARG  30   8.105   2.625   5.916
  199   1HD   ARG  30          1HD       ARG  30   8.307   4.553   4.396
  200   2HD   ARG  30          2HD       ARG  30   8.297   3.511   2.985
  201    HE   ARG  30           HE       ARG  30   6.087   4.365   4.647
  202   1HH1  ARG  30          1HH1      ARG  30   7.223   1.823   2.496
  203   2HH1  ARG  30          2HH1      ARG  30   5.720   1.328   1.872
  204   1HH2  ARG  30          1HH2      ARG  30   3.853   3.754   3.829
  205   2HH2  ARG  30          2HH2      ARG  30   3.704   2.378   2.835
  No match found for entry  HXTARG          30
   
  No H/Q in entry =         206
  Start of MODEL           3
 Raw file had  213 H/Q atoms
  Start of MODEL    3
    1   1H    VAL   1          2H        VAL   1  -1.974  -2.489  -5.261
    2   2H    VAL   1          3H        VAL   1  -2.625  -3.212  -6.561
    3   3H    VAL   1          1H        VAL   1  -1.116  -2.476  -6.670
    4    HA   VAL   1           HA       VAL   1  -2.099  -0.361  -6.274
    5    HB   VAL   1           HB       VAL   1  -2.019  -1.083  -8.580
    6   1HG1  VAL   1          1HG1      VAL   1  -3.363  -3.154  -8.517
    7   2HG1  VAL   1          3HG1      VAL   1  -4.833  -2.205  -8.199
    8   3HG1  VAL   1          2HG1      VAL   1  -3.982  -2.046  -9.744
    9   1HG2  VAL   1          1HG2      VAL   1  -3.046   1.118  -8.080
   10   2HG2  VAL   1          3HG2      VAL   1  -3.581   0.391  -9.599
   11   3HG2  VAL   1          2HG2      VAL   1  -4.657   0.361  -8.200
   12    H    GLY   2           H        GLY   2  -4.224   0.877  -6.090
   13   1HA   GLY   2          1HA       GLY   2  -6.684  -0.002  -5.478
   14   2HA   GLY   2          2HA       GLY   2  -5.845  -0.381  -3.964
   15    H    GLU   3           H        GLU   3  -4.160   1.605  -3.594
   16    HA   GLU   3           HA       GLU   3  -3.882   3.842  -2.921
   17   1HB   GLU   3          2HB       GLU   3  -6.641   4.520  -3.715
   18   2HB   GLU   3          1HB       GLU   3  -5.343   5.541  -3.055
   19   1HG   GLU   3          2HG       GLU   3  -3.916   5.085  -4.953
   20   2HG   GLU   3          1HG       GLU   3  -5.173   4.092  -5.728
   21    HE1  GLU   3           HE2      GLU   3  -7.068   7.365  -5.843
   22    H    CYS   4           H        CYS   4  -3.637   3.816  -0.760
   23    HA   CYS   4           HA       CYS   4  -5.591   2.338   0.865
   24   1HB   CYS   4          1HB       CYS   4  -3.178   3.947   1.640
   25   2HB   CYS   4          2HB       CYS   4  -4.254   3.295   2.807
   26    H    VAL   5           H        VAL   5  -6.425   3.269   2.752
   27    HA   VAL   5           HA       VAL   5  -7.884   5.840   2.185
   28    HB   VAL   5           HB       VAL   5  -8.888   3.323   3.555
   29   1HG1  VAL   5          2HG1      VAL   5 -10.267   5.935   2.716
   30   2HG1  VAL   5          1HG1      VAL   5 -11.098   4.511   3.378
   31   3HG1  VAL   5          3HG1      VAL   5  -9.981   5.434   4.388
   32   1HG2  VAL   5          3HG2      VAL   5  -9.374   4.491   0.778
   33   2HG2  VAL   5          2HG2      VAL   5  -8.602   2.938   1.154
   34   3HG2  VAL   5          1HG2      VAL   5 -10.322   3.167   1.492
   35    H    ARG   6           H        ARG   6  -6.199   6.844   3.218
   36    HA   ARG   6           HA       ARG   6  -4.946   7.733   4.928
   37   1HB   ARG   6          2HB       ARG   6  -7.306   7.032   6.725
   38   2HB   ARG   6          1HB       ARG   6  -5.947   8.088   7.115
   39   1HG   ARG   6          2HG       ARG   6  -6.584   9.562   5.167
   40   2HG   ARG   6          1HG       ARG   6  -7.979   8.513   4.875
   41   1HD   ARG   6          2HD       ARG   6  -8.717  10.435   6.099
   42   2HD   ARG   6          1HD       ARG   6  -8.830   9.009   7.158
   43    HE   ARG   6           HE       ARG   6  -6.295  10.253   7.542
   44   1HH1  ARG   6          2HH1      ARG   6  -9.701  10.924   8.133
   45   2HH1  ARG   6          1HH1      ARG   6  -9.439  11.955   9.505
   46   1HH2  ARG   6          1HH2      ARG   6  -5.891  11.616   9.374
   47   2HH2  ARG   6          2HH2      ARG   6  -7.208  12.354  10.221
   48    H    GLY   7           H        GLY   7  -3.976   5.514   4.126
   49   1HA   GLY   7          1HA       GLY   7  -2.262   4.185   4.700
   50   2HA   GLY   7          2HA       GLY   7  -2.453   4.723   6.363
   51    H    ARG   8           H        ARG   8  -5.110   2.994   4.707
   52    HA   ARG   8           HA       ARG   8  -4.400   0.409   5.840
   53   1HB   ARG   8          2HB       ARG   8  -7.093   1.742   5.968
   54   2HB   ARG   8          1HB       ARG   8  -6.691   0.090   6.492
   55   1HG   ARG   8          2HG       ARG   8  -4.902   1.047   7.944
   56   2HG   ARG   8          1HG       ARG   8  -5.428   2.638   7.599
   57   1HD   ARG   8          2HD       ARG   8  -6.992   0.480   9.023
   58   2HD   ARG   8          1HD       ARG   8  -6.444   2.017   9.714
   59    HE   ARG   8           HE       ARG   8  -8.928   1.519   8.451
   60   1HH1  ARG   8          1HH1      ARG   8  -6.519   4.120   8.463
   61   2HH1  ARG   8          2HH1      ARG   8  -7.218   4.919   7.093
   62   1HH2  ARG   8          1HH2      ARG   8 -10.023   2.835   6.813
   63   2HH2  ARG   8          2HH2      ARG   8  -9.172   4.251   6.233
   64    H    CYS   9           H        CYS   9  -4.896  -1.105   4.255
   65    HA   CYS   9           HA       CYS   9  -6.778  -0.471   2.050
   66   1HB   CYS   9          1HB       CYS   9  -3.982  -1.450   1.716
   67   2HB   CYS   9          2HB       CYS   9  -5.182  -2.493   0.993
   68    HA   PRO  10           HA       PRO  10  -8.737  -4.247   3.279
   69   1HB   PRO  10          2HB       PRO  10  -8.506  -5.326   0.478
   70   2HB   PRO  10          1HB       PRO  10  -9.968  -5.167   1.494
   71   1HG   PRO  10          2HG       PRO  10  -9.508  -3.457  -0.545
   72   2HG   PRO  10          1HG       PRO  10 -10.109  -2.824   1.019
   73   1HD   PRO  10          2HD       PRO  10  -7.243  -2.875   0.016
   74   2HD   PRO  10          1HD       PRO  10  -8.155  -1.515   0.729
   75    H    SER  11           H        SER  11  -8.533  -6.637   3.165
   76    HA   SER  11           HA       SER  11  -7.215  -8.335   3.984
   77   1HB   SER  11          2HB       SER  11  -8.194  -8.653   1.601
   78   2HB   SER  11          1HB       SER  11  -6.534  -8.425   1.009
   79    HG   SER  11           HG       SER  11  -7.128 -10.650   1.390
   80    H    GLY  12           H        GLY  12  -5.817  -6.437   4.752
   81   1HA   GLY  12          1HA       GLY  12  -3.733  -5.797   5.528
   82   2HA   GLY  12          2HA       GLY  12  -3.356  -7.526   5.473
   83    H    MET  13           H        MET  13  -4.005  -5.170   2.825
   84    HA   MET  13           HA       MET  13  -1.443  -5.825   1.480
   85   1HB   MET  13          1HB       MET  13  -3.298  -3.510   1.014
   86   2HB   MET  13          2HB       MET  13  -1.947  -3.977  -0.001
   87   1HG   MET  13          1HG       MET  13  -4.481  -5.597   0.430
   88   2HG   MET  13          2HG       MET  13  -4.045  -4.668  -0.998
   89   1HE   MET  13          3HE       MET  13  -5.147  -7.485  -1.310
   90   2HE   MET  13          2HE       MET  13  -4.492  -6.546  -2.676
   91   3HE   MET  13          1HE       MET  13  -3.981  -8.232  -2.428
   92    H    CYS  14           H        CYS  14   0.446  -4.370   1.384
   93    HA   CYS  14           HA       CYS  14   0.700  -2.613   3.786
   94   1HB   CYS  14          1HB       CYS  14   2.630  -3.282   1.528
   95   2HB   CYS  14          2HB       CYS  14   2.875  -2.013   2.711
   96    H    CYS  15           H        CYS  15   0.484  -0.404   3.536
   97    HA   CYS  15           HA       CYS  15  -0.299   0.725   0.961
   98   1HB   CYS  15          1HB       CYS  15   0.535   2.170   3.491
   99   2HB   CYS  15          2HB       CYS  15  -0.285   2.861   2.084
  100    H    SER  16           H        SER  16   1.211   1.214  -0.560
  101    HA   SER  16           HA       SER  16   4.002   1.008  -0.200
  102   1HB   SER  16          2HB       SER  16   4.169   2.495  -2.247
  103   2HB   SER  16          1HB       SER  16   3.199   1.071  -2.476
  104    HG   SER  16           HG       SER  16   1.404   2.639  -1.721
  105    H    GLN  17           H        GLN  17   5.552   2.924   0.025
  106    HA   GLN  17           HA       GLN  17   4.699   5.118   1.631
  107   1HB   GLN  17          2HB       GLN  17   6.817   5.992   1.475
  108   2HB   GLN  17          1HB       GLN  17   6.970   4.220   1.508
  109   1HG   GLN  17          2HG       GLN  17   6.904   4.400  -1.070
  110   2HG   GLN  17          1HG       GLN  17   7.213   6.136  -0.809
  111   1HE2  GLN  17          2HE2      GLN  17  10.406   4.760   1.038
  112   2HE2  GLN  17          1HE2      GLN  17   8.938   5.504   1.628
  113    H    PHE  18           H        PHE  18   4.195   4.614  -1.830
  114    HA   PHE  18           HA       PHE  18   3.809   7.287  -2.578
  115   1HB   PHE  18          2HB       PHE  18   3.007   4.812  -3.885
  116   2HB   PHE  18          1HB       PHE  18   3.615   6.284  -4.538
  117    HD1  PHE  18           HD2      PHE  18   6.155   6.830  -3.319
  118    HD2  PHE  18           HD1      PHE  18   4.487   3.089  -4.675
  119    HE1  PHE  18           HE2      PHE  18   8.439   5.930  -3.663
  120    HE2  PHE  18           HE1      PHE  18   6.773   2.183  -4.974
  121    HZ   PHE  18           HZ       PHE  18   8.750   3.623  -4.528
  122    H    GLY  19           H        GLY  19   1.923   5.309  -0.565
  123   1HA   GLY  19          1HA       GLY  19  -0.154   5.533   0.141
  124   2HA   GLY  19          2HA       GLY  19  -0.339   6.813  -1.037
  125    H    TYR  20           H        TYR  20   0.624   4.077  -2.744
  126    HA   TYR  20           HA       TYR  20  -2.154   3.080  -3.251
  127   1HB   TYR  20          1HB       TYR  20   0.454   2.426  -4.652
  128   2HB   TYR  20          2HB       TYR  20  -1.104   1.752  -5.051
  129    HD1  TYR  20           HD2      TYR  20   0.748   5.004  -4.991
  130    HD2  TYR  20           HD1      TYR  20  -2.658   2.818  -6.473
  131    HE1  TYR  20           HE2      TYR  20  -0.038   7.029  -6.186
  132    HE2  TYR  20           HE1      TYR  20  -3.351   4.798  -7.783
  133    HH   TYR  20           HH       TYR  20  -3.291   7.186  -7.458
  134    H    CYS  21           H        CYS  21  -1.459   0.331  -3.681
  135    HA   CYS  21           HA       CYS  21  -0.142  -0.507  -1.253
  136   1HB   CYS  21          1HB       CYS  21  -2.001  -1.174   0.049
  137   2HB   CYS  21          2HB       CYS  21  -2.427   0.433  -0.540
  138    H    GLY  22           H        GLY  22   0.041  -2.745  -0.903
  139   1HA   GLY  22          1HA       GLY  22  -1.164  -4.746  -2.340
  140   2HA   GLY  22          2HA       GLY  22   0.362  -4.362  -3.178
  141    H    LYS  23           H        LYS  23  -0.270  -6.732  -1.581
  142    HA   LYS  23           HA       LYS  23   1.070  -6.452   1.006
  143   1HB   LYS  23          2HB       LYS  23  -0.873  -7.951   0.632
  144   2HB   LYS  23          1HB       LYS  23   0.125  -8.962  -0.424
  145   1HG   LYS  23          2HG       LYS  23   1.704  -9.223   1.614
  146   2HG   LYS  23          1HG       LYS  23   0.452  -8.446   2.575
  147   1HD   LYS  23          2HD       LYS  23   0.280 -11.033   0.943
  148   2HD   LYS  23          1HD       LYS  23   0.344 -10.928   2.700
  149   1HE   LYS  23          2HE       LYS  23  -1.944  -9.972   0.897
  150   2HE   LYS  23          1HE       LYS  23  -1.945 -11.416   1.907
  151   1HZ   LYS  23          3HZ       LYS  23  -1.712  -8.665   2.957
  152   2HZ   LYS  23          2HZ       LYS  23  -3.094  -9.514   2.884
  153   3HZ   LYS  23          1HZ       LYS  23  -1.862 -10.038   3.847
  154    H    GLY  24           H        GLY  24   3.103  -5.541  -0.190
  155   1HA   GLY  24          1HA       GLY  24   5.000  -7.469   0.295
  156   2HA   GLY  24          2HA       GLY  24   4.847  -7.449  -1.479
  157    HA   PRO  25           HA       PRO  25   8.117  -4.420   0.362
  158   1HB   PRO  25          2HB       PRO  25   9.626  -6.057  -1.690
  159   2HB   PRO  25          1HB       PRO  25  10.253  -5.273  -0.210
  160   1HG   PRO  25          2HG       PRO  25   9.671  -7.912  -0.164
  161   2HG   PRO  25          1HG       PRO  25   9.118  -6.872   1.183
  162   1HD   PRO  25          2HD       PRO  25   7.514  -7.876  -1.178
  163   2HD   PRO  25          1HD       PRO  25   7.087  -7.794   0.555
  164    H    LYS  26           H        LYS  26   7.237  -5.408  -2.945
  165    HA   LYS  26           HA       LYS  26   8.321  -3.359  -4.497
  166   1HB   LYS  26          2HB       LYS  26   5.600  -4.720  -4.688
  167   2HB   LYS  26          1HB       LYS  26   6.279  -3.664  -5.937
  168   1HG   LYS  26          2HG       LYS  26   8.216  -5.164  -6.200
  169   2HG   LYS  26          1HG       LYS  26   7.563  -6.255  -4.960
  170   1HD   LYS  26          2HD       LYS  26   5.495  -6.549  -6.312
  171   2HD   LYS  26          1HD       LYS  26   6.167  -5.542  -7.593
  172   1HE   LYS  26          2HE       LYS  26   7.371  -8.181  -6.585
  173   2HE   LYS  26          1HE       LYS  26   6.314  -8.029  -7.992
  174   1HZ   LYS  26          3HZ       LYS  26   7.958  -6.625  -9.029
  175   2HZ   LYS  26          2HZ       LYS  26   8.963  -6.773  -7.733
  176   3HZ   LYS  26          1HZ       LYS  26   8.595  -8.089  -8.643
  177    H    TYR  27           H        TYR  27   5.406  -3.286  -2.389
  178    HA   TYR  27           HA       TYR  27   5.029  -0.393  -2.884
  179   1HB   TYR  27          1HB       TYR  27   3.496  -2.462  -1.247
  180   2HB   TYR  27          2HB       TYR  27   3.121  -0.850  -1.344
  181    HD1  TYR  27           HD2      TYR  27   3.504  -3.914  -3.459
  182    HD2  TYR  27           HD1      TYR  27   1.569  -0.075  -3.123
  183    HE1  TYR  27           HE2      TYR  27   2.316  -4.313  -5.586
  184    HE2  TYR  27           HE1      TYR  27   0.461  -0.437  -5.282
  185    HH   TYR  27           HH       TYR  27   1.031  -3.317  -7.256
  186    H    CYS  28           H        CYS  28   5.184  -2.714  -0.281
  187    HA   CYS  28           HA       CYS  28   5.270  -1.035   1.861
  188   1HB   CYS  28          1HB       CYS  28   5.017  -3.683   1.546
  189   2HB   CYS  28          2HB       CYS  28   6.683  -3.693   2.103
  190    H    GLY  29           H        GLY  29   8.123  -2.067   0.066
  191   1HA   GLY  29          1HA       GLY  29   9.961  -1.786   2.118
  192   2HA   GLY  29          2HA       GLY  29  10.322  -1.930   0.403
  193    H    ARG  30           HN       ARG  30  12.097  -0.505   1.488
  194    HA   ARG  30           HA       ARG  30  13.323   1.328   0.941
  195   1HB   ARG  30          1HB       ARG  30  10.927   2.525  -0.317
  196   2HB   ARG  30          2HB       ARG  30  12.604   3.018  -0.503
  197   1HG   ARG  30          1HG       ARG  30  13.230   0.886  -1.529
  198   2HG   ARG  30          2HG       ARG  30  11.593   0.237  -1.326
  199   1HD   ARG  30          1HD       ARG  30  12.373   2.661  -2.931
  200   2HD   ARG  30          2HD       ARG  30  11.914   1.063  -3.576
  201    HE   ARG  30           HE       ARG  30  10.184   3.105  -2.233
  202   1HH1  ARG  30          2HH1      ARG  30   8.788   1.607  -0.742
  203   2HH1  ARG  30          1HH1      ARG  30   7.610   0.775  -1.623
  204   1HH2  ARG  30          1HH2      ARG  30   9.883   0.525  -4.451
  205   2HH2  ARG  30          2HH2      ARG  30   8.418  -0.167  -3.820
  No match found for entry  HXTARG          30
   
  No H/Q in entry =         206
  Start of MODEL           4
 Raw file had  213 H/Q atoms
  Start of MODEL    4
    1   1H    VAL   1          2H        VAL   1  -3.759   0.412  -6.474
    2   2H    VAL   1          3H        VAL   1  -4.550  -0.968  -5.959
    3   3H    VAL   1          1H        VAL   1  -4.849  -0.302  -7.455
    4    HA   VAL   1           HA       VAL   1  -6.617   0.532  -6.287
    5    HB   VAL   1           HB       VAL   1  -6.361   1.485  -4.019
    6   1HG1  VAL   1          1HG1      VAL   1  -7.025  -0.907  -4.353
    7   2HG1  VAL   1          3HG1      VAL   1  -5.332  -1.385  -4.095
    8   3HG1  VAL   1          2HG1      VAL   1  -6.238  -0.584  -2.803
    9   1HG2  VAL   1          1HG2      VAL   1  -3.912   2.068  -4.127
   10   2HG2  VAL   1          3HG2      VAL   1  -4.357   1.152  -2.690
   11   3HG2  VAL   1          2HG2      VAL   1  -3.534   0.335  -4.031
   12    H    GLY   2           H        GLY   2  -7.106   2.979  -5.888
   13   1HA   GLY   2          1HA       GLY   2  -5.402   4.669  -7.530
   14   2HA   GLY   2          2HA       GLY   2  -6.806   5.159  -6.566
   15    H    GLU   3           H        GLU   3  -5.988   4.190  -3.994
   16    HA   GLU   3           HA       GLU   3  -3.416   5.079  -3.237
   17   1HB   GLU   3          2HB       GLU   3  -4.327   6.804  -1.653
   18   2HB   GLU   3          1HB       GLU   3  -4.220   7.298  -3.344
   19   1HG   GLU   3          2HG       GLU   3  -6.550   7.172  -3.693
   20   2HG   GLU   3          1HG       GLU   3  -6.832   6.166  -2.266
   21    HE1  GLU   3           HE2      GLU   3  -6.454   7.114  -0.237
   22    H    CYS   4           H        CYS   4  -3.425   4.697  -0.745
   23    HA   CYS   4           HA       CYS   4  -5.217   2.512   0.079
   24   1HB   CYS   4          1HB       CYS   4  -3.216   4.136   1.582
   25   2HB   CYS   4          2HB       CYS   4  -4.514   3.537   2.509
   26    H    VAL   5           H        VAL   5  -6.433   2.869   2.118
   27    HA   VAL   5           HA       VAL   5  -8.447   5.070   1.743
   28    HB   VAL   5           HB       VAL   5  -8.824   2.251   2.840
   29   1HG1  VAL   5          1HG1      VAL   5 -10.820   4.518   2.375
   30   2HG1  VAL   5          3HG1      VAL   5 -11.234   2.858   2.851
   31   3HG1  VAL   5          2HG1      VAL   5 -10.313   3.885   3.957
   32   1HG2  VAL   5          1HG2      VAL   5  -9.752   3.536   0.233
   33   2HG2  VAL   5          3HG2      VAL   5  -8.566   2.223   0.394
   34   3HG2  VAL   5          2HG2      VAL   5 -10.255   1.940   0.829
   35    H    ARG   6           H        ARG   6  -7.613   6.575   3.146
   36    HA   ARG   6           HA       ARG   6  -6.829   7.542   5.064
   37   1HB   ARG   6          2HB       ARG   6  -8.595   5.445   6.388
   38   2HB   ARG   6          1HB       ARG   6  -7.999   6.930   7.138
   39   1HG   ARG   6          2HG       ARG   6  -9.210   8.315   5.527
   40   2HG   ARG   6          1HG       ARG   6  -9.807   6.889   4.667
   41   1HD   ARG   6          2HD       ARG   6 -10.404   7.543   7.580
   42   2HD   ARG   6          1HD       ARG   6 -11.475   7.882   6.198
   43    HE   ARG   6           HE       ARG   6 -10.758   5.131   6.142
   44   1HH1  ARG   6          2HH1      ARG   6 -12.699   7.361   8.052
   45   2HH1  ARG   6          1HH1      ARG   6 -13.874   6.186   8.556
   46   1HH2  ARG   6          1HH2      ARG   6 -12.299   3.520   6.780
   47   2HH2  ARG   6          2HH2      ARG   6 -13.626   3.938   7.812
   48    H    GLY   7           H        GLY   7  -5.012   5.869   3.965
   49   1HA   GLY   7          1HA       GLY   7  -3.031   4.824   4.375
   50   2HA   GLY   7          2HA       GLY   7  -3.172   5.410   6.036
   51    H    ARG   8           H        ARG   8  -5.576   3.122   4.566
   52    HA   ARG   8           HA       ARG   8  -4.298   0.824   5.740
   53   1HB   ARG   8          2HB       ARG   8  -7.210   1.577   6.152
   54   2HB   ARG   8          1HB       ARG   8  -6.429   0.038   6.599
   55   1HG   ARG   8          2HG       ARG   8  -4.696   1.463   7.813
   56   2HG   ARG   8          1HG       ARG   8  -5.753   2.814   7.573
   57   1HD   ARG   8          2HD       ARG   8  -7.583   1.642   8.797
   58   2HD   ARG   8          1HD       ARG   8  -6.512   0.281   9.127
   59    HE   ARG   8           HE       ARG   8  -6.641   2.850  10.471
   60   1HH1  ARG   8          2HH1      ARG   8  -4.383   0.300   9.600
   61   2HH1  ARG   8          1HH1      ARG   8  -3.254   0.613  10.883
   62   1HH2  ARG   8          1HH2      ARG   8  -5.166   3.330  12.188
   63   2HH2  ARG   8          2HH2      ARG   8  -3.721   2.394  12.388
   64    H    CYS   9           H        CYS   9  -4.825  -0.972   4.504
   65    HA   CYS   9           HA       CYS   9  -6.835  -0.873   2.360
   66   1HB   CYS   9          1HB       CYS   9  -3.913  -1.507   1.989
   67   2HB   CYS   9          2HB       CYS   9  -5.055  -2.586   1.282
   68    HA   PRO  10           HA       PRO  10  -7.987  -4.481   4.432
   69   1HB   PRO  10          2HB       PRO  10  -9.322  -5.995   2.615
   70   2HB   PRO  10          1HB       PRO  10  -9.817  -4.326   3.009
   71   1HG   PRO  10          2HG       PRO  10  -8.188  -5.267   0.648
   72   2HG   PRO  10          1HG       PRO  10  -9.569  -4.134   0.653
   73   1HD   PRO  10          2HD       PRO  10  -6.908  -3.408   0.658
   74   2HD   PRO  10          1HD       PRO  10  -8.153  -2.342   1.334
   75    H    SER  11           H        SER  11  -8.028  -6.902   4.464
   76    HA   SER  11           HA       SER  11  -6.683  -8.663   5.002
   77   1HB   SER  11          2HB       SER  11  -8.091  -9.075   2.890
   78   2HB   SER  11          1HB       SER  11  -6.592  -8.868   1.959
   79    HG   SER  11           HG       SER  11  -7.073 -11.078   2.536
   80    H    GLY  12           H        GLY  12  -5.089  -6.886   5.544
   81   1HA   GLY  12          1HA       GLY  12  -2.873  -6.321   5.896
   82   2HA   GLY  12          2HA       GLY  12  -2.560  -8.041   5.613
   83    H    MET  13           H        MET  13  -3.746  -5.522   3.357
   84    HA   MET  13           HA       MET  13  -1.381  -5.875   1.553
   85   1HB   MET  13          1HB       MET  13  -3.910  -4.278   1.407
   86   2HB   MET  13          2HB       MET  13  -2.703  -4.298   0.116
   87   1HG   MET  13          1HG       MET  13  -3.931  -6.907   1.069
   88   2HG   MET  13          2HG       MET  13  -4.911  -5.822   0.103
   89   1HE   MET  13          2HE       MET  13  -3.895  -4.725  -2.146
   90   2HE   MET  13          1HE       MET  13  -3.584  -5.963  -3.390
   91   3HE   MET  13          3HE       MET  13  -5.082  -6.018  -2.433
   92    H    CYS  14           H        CYS  14   0.268  -4.319   1.450
   93    HA   CYS  14           HA       CYS  14   0.392  -2.595   3.839
   94   1HB   CYS  14          1HB       CYS  14   2.348  -3.084   1.557
   95   2HB   CYS  14          2HB       CYS  14   2.648  -2.041   2.928
   96    H    CYS  15           H        CYS  15   0.099  -0.354   3.759
   97    HA   CYS  15           HA       CYS  15  -0.518   0.955   1.236
   98   1HB   CYS  15          1HB       CYS  15   0.194   2.264   3.859
   99   2HB   CYS  15          2HB       CYS  15  -0.457   3.051   2.414
  100    H    SER  16           H        SER  16   0.876   1.516  -0.178
  101    HA   SER  16           HA       SER  16   3.553   0.680  -0.014
  102   1HB   SER  16          2HB       SER  16   3.704   1.589  -2.286
  103   2HB   SER  16          1HB       SER  16   2.131   0.763  -2.063
  104    HG   SER  16           HG       SER  16   1.328   2.883  -1.478
  105    H    GLN  17           H        GLN  17   5.483   2.033  -0.357
  106    HA   GLN  17           HA       GLN  17   5.850   4.442   0.945
  107   1HB   GLN  17          2HB       GLN  17   7.805   4.816  -0.419
  108   2HB   GLN  17          1HB       GLN  17   7.708   3.165   0.226
  109   1HG   GLN  17          2HG       GLN  17   6.838   2.322  -1.855
  110   2HG   GLN  17          1HG       GLN  17   6.730   3.972  -2.504
  111   1HE2  GLN  17          2HE2      GLN  17  10.341   4.311  -2.952
  112   2HE2  GLN  17          1HE2      GLN  17   8.986   5.205  -2.301
  113    H    PHE  18           H        PHE  18   4.204   4.030  -2.257
  114    HA   PHE  18           HA       PHE  18   4.362   6.713  -3.055
  115   1HB   PHE  18          2HB       PHE  18   2.843   4.401  -3.993
  116   2HB   PHE  18          1HB       PHE  18   3.398   5.760  -4.875
  117    HD1  PHE  18           HD2      PHE  18   6.093   6.112  -4.877
  118    HD2  PHE  18           HD1      PHE  18   3.980   2.379  -4.497
  119    HE1  PHE  18           HE2      PHE  18   8.129   4.882  -5.585
  120    HE2  PHE  18           HE1      PHE  18   6.057   1.141  -5.085
  121    HZ   PHE  18           HZ       PHE  18   8.121   2.395  -5.659
  122    H    GLY  19           H        GLY  19   2.394   5.235  -0.670
  123   1HA   GLY  19          1HA       GLY  19   0.420   5.726   0.215
  124   2HA   GLY  19          2HA       GLY  19   0.348   7.078  -0.897
  125    H    TYR  20           H        TYR  20   0.825   4.213  -2.617
  126    HA   TYR  20           HA       TYR  20  -2.060   3.549  -3.113
  127   1HB   TYR  20          1HB       TYR  20   0.534   2.738  -4.510
  128   2HB   TYR  20          2HB       TYR  20  -1.037   2.069  -4.862
  129    HD1  TYR  20           HD1      TYR  20  -0.022   5.730  -4.506
  130    HD2  TYR  20           HD2      TYR  20  -1.552   2.579  -7.032
  131    HE1  TYR  20           HE1      TYR  20  -0.703   7.391  -6.158
  132    HE2  TYR  20           HE2      TYR  20  -2.230   4.270  -8.699
  133    HH   TYR  20           HH       TYR  20  -1.848   7.770  -8.127
  134    H    CYS  21           H        CYS  21  -1.439   0.721  -3.555
  135    HA   CYS  21           HA       CYS  21  -0.212  -0.149  -1.107
  136   1HB   CYS  21          1HB       CYS  21  -2.014  -0.585   0.255
  137   2HB   CYS  21          2HB       CYS  21  -2.702   0.774  -0.638
  138    H    GLY  22           H        GLY  22  -0.197  -2.450  -0.742
  139   1HA   GLY  22          1HA       GLY  22  -1.567  -4.371  -2.052
  140   2HA   GLY  22          2HA       GLY  22  -0.173  -4.094  -3.100
  141    H    LYS  23           H        LYS  23  -0.636  -6.406  -1.603
  142    HA   LYS  23           HA       LYS  23   1.070  -6.450   0.776
  143   1HB   LYS  23          2HB       LYS  23  -0.963  -7.866   0.520
  144   2HB   LYS  23          1HB       LYS  23  -0.179  -8.730  -0.806
  145   1HG   LYS  23          2HG       LYS  23   1.696  -9.296   0.898
  146   2HG   LYS  23          1HG       LYS  23   0.619  -8.681   2.143
  147   1HD   LYS  23          2HD       LYS  23   0.152 -10.978   0.167
  148   2HD   LYS  23          1HD       LYS  23   0.479 -11.155   1.888
  149   1HE   LYS  23          2HE       LYS  23  -2.032  -9.935   0.623
  150   2HE   LYS  23          1HE       LYS  23  -1.910 -11.519   1.387
  151   1HZ   LYS  23          2HZ       LYS  23  -1.471  -8.960   2.788
  152   2HZ   LYS  23          1HZ       LYS  23  -2.858  -9.810   2.823
  153   3HZ   LYS  23          3HZ       LYS  23  -1.490 -10.452   3.479
  154    H    GLY  24           H        GLY  24   3.039  -5.509  -0.493
  155   1HA   GLY  24          1HA       GLY  24   4.717  -7.715  -0.731
  156   2HA   GLY  24          2HA       GLY  24   4.441  -7.127  -2.384
  157    HA   PRO  25           HA       PRO  25   8.014  -5.078   0.161
  158   1HB   PRO  25          2HB       PRO  25   9.541  -6.252  -2.175
  159   2HB   PRO  25          1HB       PRO  25  10.095  -5.987  -0.496
  160   1HG   PRO  25          2HG       PRO  25   9.310  -8.458  -1.267
  161   2HG   PRO  25          1HG       PRO  25   8.737  -7.803   0.297
  162   1HD   PRO  25          2HD       PRO  25   7.253  -7.883  -2.344
  163   2HD   PRO  25          1HD       PRO  25   6.702  -8.327  -0.707
  164    H    LYS  26           H        LYS  26   7.390  -5.191  -3.354
  165    HA   LYS  26           HA       LYS  26   8.664  -2.926  -4.329
  166   1HB   LYS  26          2HB       LYS  26   5.860  -3.984  -4.911
  167   2HB   LYS  26          1HB       LYS  26   6.660  -2.731  -5.867
  168   1HG   LYS  26          2HG       LYS  26   8.463  -4.264  -6.475
  169   2HG   LYS  26          1HG       LYS  26   7.746  -5.557  -5.491
  170   1HD   LYS  26          2HD       LYS  26   5.668  -5.460  -6.826
  171   2HD   LYS  26          1HD       LYS  26   6.342  -4.194  -7.849
  172   1HE   LYS  26          2HE       LYS  26   7.486  -7.026  -7.553
  173   2HE   LYS  26          1HE       LYS  26   6.386  -6.515  -8.839
  174   1HZ   LYS  26          1HZ       LYS  26   8.032  -4.932  -9.566
  175   2HZ   LYS  26          3HZ       LYS  26   9.077  -5.412  -8.388
  176   3HZ   LYS  26          2HZ       LYS  26   8.640  -6.457  -9.577
  177    H    TYR  27           H        TYR  27   5.582  -3.136  -2.549
  178    HA   TYR  27           HA       TYR  27   5.148  -0.227  -2.638
  179   1HB   TYR  27          1HB       TYR  27   3.653  -2.624  -1.445
  180   2HB   TYR  27          2HB       TYR  27   3.122  -1.058  -1.315
  181    HD1  TYR  27           HD1      TYR  27   3.299   0.177  -4.007
  182    HD2  TYR  27           HD2      TYR  27   2.544  -3.956  -3.052
  183    HE1  TYR  27           HE1      TYR  27   1.782   0.028  -5.928
  184    HE2  TYR  27           HE2      TYR  27   1.168  -4.151  -5.112
  185    HH   TYR  27           HH       TYR  27   0.438  -1.349  -7.197
  186    H    CYS  28           H        CYS  28   5.360  -2.824  -0.380
  187    HA   CYS  28           HA       CYS  28   5.145  -1.429   2.051
  188   1HB   CYS  28          1HB       CYS  28   4.549  -3.880   1.371
  189   2HB   CYS  28          2HB       CYS  28   6.207  -4.260   1.824
  190    H    GLY  29           H        GLY  29   7.312  -0.415   0.659
  191   1HA   GLY  29          1HA       GLY  29   9.262   0.646   1.169
  192   2HA   GLY  29          2HA       GLY  29   8.979   0.049   2.807
  193    H    ARG  30           HN       ARG  30  11.390  -0.145   2.907
  194    HA   ARG  30           HA       ARG  30  12.539  -2.477   1.402
  195   1HB   ARG  30          1HB       ARG  30  13.960   0.033   2.367
  196   2HB   ARG  30          2HB       ARG  30  14.679  -1.330   1.513
  197   1HG   ARG  30          1HG       ARG  30  12.697   0.695   0.375
  198   2HG   ARG  30          2HG       ARG  30  14.421   0.552   0.045
  199   1HD   ARG  30          1HD       ARG  30  13.687  -0.558  -1.819
  200   2HD   ARG  30          2HD       ARG  30  13.769  -1.916  -0.721
  201    HE   ARG  30           HE       ARG  30  11.429  -1.977  -0.499
  202   1HH1  ARG  30          2HH1      ARG  30  12.379   0.844  -2.370
  203   2HH1  ARG  30          1HH1      ARG  30  10.739   1.291  -2.793
  204   1HH2  ARG  30          1HH2      ARG  30   9.284  -1.568  -1.274
  205   2HH2  ARG  30          2HH2      ARG  30   8.972  -0.332  -2.424
  No match found for entry  HXTARG          30
   
  No H/Q in entry =         206
  Start of MODEL           5
 Raw file had  213 H/Q atoms
  Start of MODEL    5
    1   1H    VAL   1          2H        VAL   1  -4.296   0.703  -9.553
    2   2H    VAL   1          3H        VAL   1  -3.869  -0.899  -9.321
    3   3H    VAL   1          1H        VAL   1  -5.463  -0.424  -9.384
    4    HA   VAL   1           HA       VAL   1  -5.108  -0.612  -7.128
    5    HB   VAL   1           HB       VAL   1  -3.142   0.583  -6.075
    6   1HG1  VAL   1          3HG1      VAL   1  -3.203  -1.867  -6.327
    7   2HG1  VAL   1          2HG1      VAL   1  -2.446  -1.736  -7.929
    8   3HG1  VAL   1          1HG1      VAL   1  -1.560  -1.229  -6.480
    9   1HG2  VAL   1          1HG2      VAL   1  -2.516   2.008  -8.067
   10   2HG2  VAL   1          3HG2      VAL   1  -1.166   1.071  -7.410
   11   3HG2  VAL   1          2HG2      VAL   1  -1.959   0.543  -8.897
   12    H    GLY   2           H        GLY   2  -5.694   1.129  -5.535
   13   1HA   GLY   2          1HA       GLY   2  -6.857   3.466  -6.979
   14   2HA   GLY   2          2HA       GLY   2  -7.400   2.775  -5.450
   15    H    GLU   3           H        GLU   3  -6.178   3.196  -3.494
   16    HA   GLU   3           HA       GLU   3  -3.854   4.767  -3.326
   17   1HB   GLU   3          2HB       GLU   3  -5.167   6.636  -2.067
   18   2HB   GLU   3          1HB       GLU   3  -4.725   6.719  -3.768
   19   1HG   GLU   3          2HG       GLU   3  -6.971   7.519  -3.389
   20   2HG   GLU   3          1HG       GLU   3  -6.939   6.165  -4.508
   21    HE2  GLU   3           HE2      GLU   3  -8.863   4.117  -2.408
   22    H    CYS   4           H        CYS   4  -3.321   4.764  -0.924
   23    HA   CYS   4           HA       CYS   4  -4.565   2.698   0.597
   24   1HB   CYS   4          1HB       CYS   4  -3.369   5.036   2.024
   25   2HB   CYS   4          2HB       CYS   4  -3.400   3.356   2.474
   26    H    VAL   5           H        VAL   5  -6.014   2.834   2.319
   27    HA   VAL   5           HA       VAL   5  -8.155   4.812   1.810
   28    HB   VAL   5           HB       VAL   5  -8.265   2.269   3.457
   29   1HG1  VAL   5          1HG1      VAL   5 -10.386   4.062   2.147
   30   2HG1  VAL   5          3HG1      VAL   5 -10.718   2.537   2.998
   31   3HG1  VAL   5          2HG1      VAL   5 -10.108   3.935   3.889
   32   1HG2  VAL   5          2HG2      VAL   5  -8.806   2.828   0.508
   33   2HG2  VAL   5          1HG2      VAL   5  -7.620   1.690   1.179
   34   3HG2  VAL   5          3HG2      VAL   5  -9.347   1.361   1.358
   35    H    ARG   6           H        ARG   6  -6.536   6.173   2.692
   36    HA   ARG   6           HA       ARG   6  -5.677   7.664   4.244
   37   1HB   ARG   6          2HB       ARG   6  -7.859   6.802   6.146
   38   2HB   ARG   6          1HB       ARG   6  -6.845   8.238   6.240
   39   1HG   ARG   6          2HG       ARG   6  -8.915   7.614   4.089
   40   2HG   ARG   6          1HG       ARG   6  -9.018   8.808   5.388
   41   1HD   ARG   6          2HD       ARG   6  -8.467  10.180   3.593
   42   2HD   ARG   6          1HD       ARG   6  -6.907   9.890   4.327
   43    HE   ARG   6           HE       ARG   6  -6.215   8.718   2.465
   44   1HH1  ARG   6          1HH1      ARG   6  -9.679   9.331   2.148
   45   2HH1  ARG   6          2HH1      ARG   6  -9.815   8.565   0.593
   46   1HH2  ARG   6          1HH2      ARG   6  -6.502   7.332   0.588
   47   2HH2  ARG   6          2HH2      ARG   6  -7.934   7.497  -0.341
   48    H    GLY   7           H        GLY   7  -4.217   5.649   3.828
   49   1HA   GLY   7          1HA       GLY   7  -2.318   4.734   4.623
   50   2HA   GLY   7          2HA       GLY   7  -2.708   5.390   6.211
   51    H    ARG   8           H        ARG   8  -4.917   3.159   4.509
   52    HA   ARG   8           HA       ARG   8  -4.299   0.911   6.234
   53   1HB   ARG   8          2HB       ARG   8  -6.976   2.136   5.548
   54   2HB   ARG   8          1HB       ARG   8  -6.697   0.636   6.462
   55   1HG   ARG   8          2HG       ARG   8  -5.266   1.895   8.050
   56   2HG   ARG   8          1HG       ARG   8  -5.630   3.397   7.261
   57   1HD   ARG   8          2HD       ARG   8  -7.782   1.631   8.412
   58   2HD   ARG   8          1HD       ARG   8  -7.074   3.072   9.211
   59    HE   ARG   8           HE       ARG   8  -7.761   3.864   6.611
   60   1HH1  ARG   8          2HH1      ARG   8  -9.560   2.885   9.473
   61   2HH1  ARG   8          1HH1      ARG   8 -11.032   3.682   8.999
   62   1HH2  ARG   8          1HH2      ARG   8  -9.546   4.811   5.927
   63   2HH2  ARG   8          2HH2      ARG   8 -11.030   4.886   6.865
   64    H    CYS   9           H        CYS   9  -5.042  -0.960   5.161
   65    HA   CYS   9           HA       CYS   9  -5.782  -0.943   2.294
   66   1HB   CYS   9          1HB       CYS   9  -3.490  -2.328   3.662
   67   2HB   CYS   9          2HB       CYS   9  -4.248  -3.119   2.344
   68    HA   PRO  10           HA       PRO  10  -8.172  -4.492   3.961
   69   1HB   PRO  10          2HB       PRO  10  -8.957  -5.736   1.689
   70   2HB   PRO  10          1HB       PRO  10  -9.491  -4.080   2.067
   71   1HG   PRO  10          2HG       PRO  10  -7.363  -4.962   0.125
   72   2HG   PRO  10          1HG       PRO  10  -8.527  -3.618  -0.023
   73   1HD   PRO  10          2HD       PRO  10  -5.822  -3.542   0.901
   74   2HD   PRO  10          1HD       PRO  10  -6.951  -2.178   0.978
   75    H    SER  11           H        SER  11  -8.182  -6.898   3.682
   76    HA   SER  11           HA       SER  11  -6.964  -8.770   4.266
   77   1HB   SER  11          2HB       SER  11  -8.056  -8.822   1.930
   78   2HB   SER  11          1HB       SER  11  -6.419  -8.623   1.269
   79    HG   SER  11           HG       SER  11  -7.129 -10.843   1.489
   80    H    GLY  12           H        GLY  12  -5.410  -7.090   5.176
   81   1HA   GLY  12          1HA       GLY  12  -3.256  -6.550   5.833
   82   2HA   GLY  12          2HA       GLY  12  -2.950  -8.284   5.640
   83    H    MET  13           H        MET  13  -3.718  -5.799   3.180
   84    HA   MET  13           HA       MET  13  -1.158  -6.352   1.755
   85   1HB   MET  13          1HB       MET  13  -3.408  -4.485   0.943
   86   2HB   MET  13          2HB       MET  13  -2.009  -4.973  -0.003
   87   1HG   MET  13          1HG       MET  13  -2.979  -7.412   0.433
   88   2HG   MET  13          2HG       MET  13  -4.469  -6.545   0.738
   89   1HE   MET  13          3HE       MET  13  -4.008  -8.797  -1.500
   90   2HE   MET  13          2HE       MET  13  -5.580  -8.018  -1.176
   91   3HE   MET  13          1HE       MET  13  -4.947  -8.092  -2.837
   92    H    CYS  14           H        CYS  14   0.116  -4.260   1.049
   93    HA   CYS  14           HA       CYS  14   0.467  -2.719   3.589
   94   1HB   CYS  14          1HB       CYS  14   2.396  -3.218   1.308
   95   2HB   CYS  14          2HB       CYS  14   2.661  -2.188   2.712
   96    H    CYS  15           H        CYS  15   0.096  -0.600   3.591
   97    HA   CYS  15           HA       CYS  15  -0.875   0.891   1.298
   98   1HB   CYS  15          1HB       CYS  15  -1.576   1.607   3.476
   99   2HB   CYS  15          2HB       CYS  15   0.089   1.658   4.077
  100    H    SER  16           H        SER  16   0.497   1.237  -0.393
  101    HA   SER  16           HA       SER  16   3.200   0.622  -0.333
  102   1HB   SER  16          2HB       SER  16   1.934   2.541  -2.297
  103   2HB   SER  16          1HB       SER  16   3.213   1.362  -2.598
  104    HG   SER  16           HG       SER  16   1.474  -0.222  -1.934
  105    H    GLN  17           H        GLN  17   5.116   1.919  -0.223
  106    HA   GLN  17           HA       GLN  17   5.192   4.355   1.101
  107   1HB   GLN  17          2HB       GLN  17   7.413   4.673   0.323
  108   2HB   GLN  17          1HB       GLN  17   7.124   3.004   0.856
  109   1HG   GLN  17          2HG       GLN  17   6.744   2.330  -1.475
  110   2HG   GLN  17          1HG       GLN  17   7.049   4.014  -1.977
  111   1HE2  GLN  17          2HE2      GLN  17  10.213   1.615  -1.822
  112   2HE2  GLN  17          1HE2      GLN  17   8.559   1.086  -2.094
  113    H    PHE  18           H        PHE  18   4.338   3.867  -2.339
  114    HA   PHE  18           HA       PHE  18   4.451   6.546  -3.149
  115   1HB   PHE  18          2HB       PHE  18   3.304   4.099  -4.263
  116   2HB   PHE  18          1HB       PHE  18   3.887   5.482  -5.101
  117    HD1  PHE  18           HD2      PHE  18   6.518   6.075  -4.469
  118    HD2  PHE  18           HD1      PHE  18   4.680   2.170  -4.576
  119    HE1  PHE  18           HE2      PHE  18   8.752   5.020  -4.665
  120    HE2  PHE  18           HE1      PHE  18   6.924   1.127  -4.738
  121    HZ   PHE  18           HZ       PHE  18   8.959   2.545  -4.771
  122    H    GLY  19           H        GLY  19   2.328   5.165  -1.016
  123   1HA   GLY  19          1HA       GLY  19   0.355   5.782  -0.253
  124   2HA   GLY  19          2HA       GLY  19   0.353   7.004  -1.508
  125    H    TYR  20           H        TYR  20   0.675   3.944  -2.880
  126    HA   TYR  20           HA       TYR  20  -2.228   3.503  -3.371
  127   1HB   TYR  20          1HB       TYR  20   0.246   2.278  -4.638
  128   2HB   TYR  20          2HB       TYR  20  -1.406   1.898  -5.083
  129    HD1  TYR  20           HD1      TYR  20  -2.903   3.551  -6.132
  130    HD2  TYR  20           HD2      TYR  20   1.260   4.385  -5.442
  131    HE1  TYR  20           HE1      TYR  20  -3.066   5.542  -7.593
  132    HE2  TYR  20           HE2      TYR  20   1.098   6.393  -6.886
  133    HH   TYR  20           HH       TYR  20  -1.965   7.380  -8.441
  134    H    CYS  21           H        CYS  21  -2.031   0.628  -3.706
  135    HA   CYS  21           HA       CYS  21  -1.271  -0.286  -0.989
  136   1HB   CYS  21          1HB       CYS  21  -3.597   0.436  -0.726
  137   2HB   CYS  21          2HB       CYS  21  -4.059  -0.520  -2.158
  138    H    GLY  22           H        GLY  22  -0.493  -2.420  -1.022
  139   1HA   GLY  22          1HA       GLY  22  -1.644  -4.394  -2.500
  140   2HA   GLY  22          2HA       GLY  22  -0.253  -3.890  -3.471
  141    H    LYS  23           H        LYS  23  -0.516  -6.308  -2.309
  142    HA   LYS  23           HA       LYS  23   0.896  -6.525   0.242
  143   1HB   LYS  23          2HB       LYS  23  -1.172  -7.805  -0.681
  144   2HB   LYS  23          1HB       LYS  23  -0.039  -8.799  -1.567
  145   1HG   LYS  23          2HG       LYS  23   1.018  -9.466   0.606
  146   2HG   LYS  23          1HG       LYS  23  -0.131  -8.418   1.463
  147   1HD   LYS  23          2HD       LYS  23  -2.010  -9.776   0.260
  148   2HD   LYS  23          1HD       LYS  23  -0.728 -10.873  -0.247
  149   1HE   LYS  23          2HE       LYS  23  -1.747 -11.851   1.668
  150   2HE   LYS  23          1HE       LYS  23  -0.170 -11.248   2.202
  151   1HZ   LYS  23          1HZ       LYS  23  -2.774  -9.866   2.621
  152   2HZ   LYS  23          3HZ       LYS  23  -1.946 -10.719   3.748
  153   3HZ   LYS  23          2HZ       LYS  23  -1.319  -9.332   3.145
  154    H    GLY  24           H        GLY  24   2.956  -5.482  -0.810
  155   1HA   GLY  24          1HA       GLY  24   4.719  -7.691  -1.135
  156   2HA   GLY  24          2HA       GLY  24   4.538  -6.824  -2.677
  157    HA   PRO  25           HA       PRO  25   7.913  -5.316   0.433
  158   1HB   PRO  25          2HB       PRO  25   9.627  -5.998  -1.971
  159   2HB   PRO  25          1HB       PRO  25  10.050  -6.074  -0.237
  160   1HG   PRO  25          2HG       PRO  25   9.347  -8.337  -1.542
  161   2HG   PRO  25          1HG       PRO  25   8.660  -8.004   0.076
  162   1HD   PRO  25          2HD       PRO  25   7.358  -7.565  -2.623
  163   2HD   PRO  25          1HD       PRO  25   6.709  -8.307  -1.137
  164    H    LYS  26           H        LYS  26   7.816  -4.713  -3.106
  165    HA   LYS  26           HA       LYS  26   9.150  -2.279  -3.284
  166   1HB   LYS  26          2HB       LYS  26   6.699  -3.321  -4.779
  167   2HB   LYS  26          1HB       LYS  26   7.530  -1.826  -5.217
  168   1HG   LYS  26          2HG       LYS  26   9.645  -3.058  -5.544
  169   2HG   LYS  26          1HG       LYS  26   8.825  -4.585  -5.146
  170   1HD   LYS  26          2HD       LYS  26   7.299  -4.285  -7.088
  171   2HD   LYS  26          1HD       LYS  26   7.978  -2.687  -7.391
  172   1HE   LYS  26          2HE       LYS  26   8.892  -4.223  -9.008
  173   2HE   LYS  26          1HE       LYS  26  10.179  -3.649  -7.941
  174   1HZ   LYS  26          3HZ       LYS  26   8.812  -6.257  -7.728
  175   2HZ   LYS  26          2HZ       LYS  26  10.310  -6.005  -8.351
  176   3HZ   LYS  26          1HZ       LYS  26  10.037  -5.735  -6.755
  177    H    TYR  27           H        TYR  27   5.897  -2.885  -2.099
  178    HA   TYR  27           HA       TYR  27   5.193   0.005  -1.947
  179   1HB   TYR  27          1HB       TYR  27   3.819  -2.685  -1.617
  180   2HB   TYR  27          2HB       TYR  27   3.021  -1.303  -1.139
  181    HD1  TYR  27           HD2      TYR  27   4.983  -0.375  -4.082
  182    HD2  TYR  27           HD1      TYR  27   1.549  -2.663  -2.893
  183    HE1  TYR  27           HE2      TYR  27   4.019  -0.065  -6.311
  184    HE2  TYR  27           HE1      TYR  27   0.552  -2.337  -5.155
  185    HH   TYR  27           HH       TYR  27   0.848  -1.416  -7.239
  186    H    CYS  28           H        CYS  28   5.254  -2.907   0.036
  187    HA   CYS  28           HA       CYS  28   4.865  -1.608   2.475
  188   1HB   CYS  28          1HB       CYS  28   5.124  -4.242   1.756
  189   2HB   CYS  28          2HB       CYS  28   6.601  -4.019   2.691
  190    H    GLY  29           H        GLY  29   8.025  -2.757   1.335
  191   1HA   GLY  29          1HA       GLY  29  10.174  -2.304   2.095
  192   2HA   GLY  29          2HA       GLY  29   9.644  -0.667   1.671
  193    H    ARG  30           HN       ARG  30  10.936   0.312   3.299
  194    HA   ARG  30           HA       ARG  30  11.227   1.389   5.260
  195   1HB   ARG  30          1HB       ARG  30   8.339   0.615   5.580
  196   2HB   ARG  30          2HB       ARG  30   9.212   1.656   6.711
  197   1HG   ARG  30          1HG       ARG  30   9.713   3.296   5.107
  198   2HG   ARG  30          2HG       ARG  30   9.348   2.258   3.724
  199   1HD   ARG  30          1HD       ARG  30   7.285   3.124   5.756
  200   2HD   ARG  30          2HD       ARG  30   7.656   3.997   4.236
  201    HE   ARG  30           HE       ARG  30   7.137   1.183   3.749
  202   1HH1  ARG  30          1HH1      ARG  30   5.432   4.086   4.624
  203   2HH1  ARG  30          2HH1      ARG  30   3.988   3.775   3.707
  204   1HH2  ARG  30          2HH2      ARG  30   5.386   0.817   2.215
  205   2HH2  ARG  30          1HH2      ARG  30   3.880   1.586   2.564
  No match found for entry  HXTARG          30
   
  No H/Q in entry =         206
  Start of MODEL           6
 Raw file had  213 H/Q atoms
  Start of MODEL    6
    1   1H    VAL   1          1H        VAL   1  -2.490  -0.220  -6.373
    2   2H    VAL   1          2H        VAL   1  -2.703  -1.111  -5.008
    3   3H    VAL   1          3H        VAL   1  -2.939  -1.823  -6.474
    4    HA   VAL   1           HA       VAL   1  -4.939  -0.907  -6.835
    5    HB   VAL   1           HB       VAL   1  -6.272  -0.671  -4.881
    6   1HG1  VAL   1          2HG1      VAL   1  -5.333  -2.950  -5.283
    7   2HG1  VAL   1          1HG1      VAL   1  -4.046  -2.610  -4.106
    8   3HG1  VAL   1          3HG1      VAL   1  -5.734  -2.638  -3.585
    9   1HG2  VAL   1          2HG2      VAL   1  -3.725  -0.165  -3.298
   10   2HG2  VAL   1          1HG2      VAL   1  -4.997   1.016  -3.628
   11   3HG2  VAL   1          3HG2      VAL   1  -5.352  -0.374  -2.613
   12    H    GLY   2           H        GLY   2  -6.425   1.163  -6.181
   13   1HA   GLY   2          1HA       GLY   2  -5.198   3.306  -7.537
   14   2HA   GLY   2          2HA       GLY   2  -6.733   3.370  -6.661
   15    H    GLU   3           H        GLU   3  -6.001   3.038  -3.972
   16    HA   GLU   3           HA       GLU   3  -3.846   4.734  -3.173
   17   1HB   GLU   3          2HB       GLU   3  -5.292   6.399  -2.104
   18   2HB   GLU   3          1HB       GLU   3  -5.145   6.551  -3.859
   19   1HG   GLU   3          2HG       GLU   3  -7.349   5.599  -4.219
   20   2HG   GLU   3          1HG       GLU   3  -7.512   5.176  -2.505
   21    HE2  GLU   3           HE2      GLU   3  -8.632   8.756  -3.698
   22    H    CYS   4           H        CYS   4  -3.721   4.498  -0.810
   23    HA   CYS   4           HA       CYS   4  -5.335   2.303   0.347
   24   1HB   CYS   4          1HB       CYS   4  -3.203   4.058   1.477
   25   2HB   CYS   4          2HB       CYS   4  -4.318   3.377   2.584
   26    H    VAL   5           H        VAL   5  -6.344   2.733   2.373
   27    HA   VAL   5           HA       VAL   5  -8.470   4.798   2.041
   28    HB   VAL   5           HB       VAL   5  -8.391   2.408   3.918
   29   1HG1  VAL   5          2HG1      VAL   5 -10.600   4.360   3.073
   30   2HG1  VAL   5          1HG1      VAL   5 -10.838   2.927   4.097
   31   3HG1  VAL   5          3HG1      VAL   5  -9.866   4.282   4.683
   32   1HG2  VAL   5          3HG2      VAL   5  -9.688   2.837   1.189
   33   2HG2  VAL   5          2HG2      VAL   5  -8.433   1.647   1.591
   34   3HG2  VAL   5          1HG2      VAL   5 -10.056   1.478   2.276
   35    H    ARG   6           H        ARG   6  -6.733   6.181   2.410
   36    HA   ARG   6           HA       ARG   6  -5.396   7.642   3.651
   37   1HB   ARG   6          2HB       ARG   6  -7.541   7.287   5.746
   38   2HB   ARG   6          1HB       ARG   6  -6.409   8.635   5.631
   39   1HG   ARG   6          2HG       ARG   6  -8.495   7.931   3.505
   40   2HG   ARG   6          1HG       ARG   6  -8.727   9.077   4.818
   41   1HD   ARG   6          2HD       ARG   6  -8.222  10.392   2.898
   42   2HD   ARG   6          1HD       ARG   6  -6.861  10.474   4.001
   43    HE   ARG   6           HE       ARG   6  -5.513   9.600   2.399
   44   1HH1  ARG   6          1HH2      ARG   6  -8.851   8.803   1.462
   45   2HH1  ARG   6          2HH2      ARG   6  -8.351   8.114  -0.076
   46   1HH2  ARG   6          2HH1      ARG   6  -4.923   8.571   0.364
   47   2HH2  ARG   6          1HH1      ARG   6  -6.221   7.954  -0.634
   48    H    GLY   7           H        GLY   7  -4.230   5.389   3.542
   49   1HA   GLY   7          1HA       GLY   7  -2.314   4.564   4.361
   50   2HA   GLY   7          2HA       GLY   7  -2.617   5.386   5.889
   51    H    ARG   8           H        ARG   8  -5.050   3.118   4.612
   52    HA   ARG   8           HA       ARG   8  -4.148   0.850   6.186
   53   1HB   ARG   8          2HB       ARG   8  -6.921   2.112   6.121
   54   2HB   ARG   8          1HB       ARG   8  -6.477   0.565   6.891
   55   1HG   ARG   8          2HG       ARG   8  -4.698   1.788   8.138
   56   2HG   ARG   8          1HG       ARG   8  -5.268   3.290   7.522
   57   1HD   ARG   8          2HD       ARG   8  -6.977   1.399   9.164
   58   2HD   ARG   8          1HD       ARG   8  -6.151   2.810   9.830
   59    HE   ARG   8           HE       ARG   8  -8.665   2.768   8.453
   60   1HH1  ARG   8          2HH2      ARG   8  -5.816   4.764   8.855
   61   2HH1  ARG   8          1HH2      ARG   8  -6.302   5.995   7.751
   62   1HH2  ARG   8          2HH1      ARG   8  -9.616   4.640   7.455
   63   2HH2  ARG   8          1HH1      ARG   8  -8.710   6.117   7.357
   64    H    CYS   9           H        CYS   9  -4.548  -0.979   4.920
   65    HA   CYS   9           HA       CYS   9  -6.440  -0.828   2.654
   66   1HB   CYS   9          1HB       CYS   9  -3.556  -1.400   2.311
   67   2HB   CYS   9          2HB       CYS   9  -4.546  -2.746   1.920
   68    HA   PRO  10           HA       PRO  10  -7.908  -4.529   4.488
   69   1HB   PRO  10          2HB       PRO  10  -9.259  -5.769   2.501
   70   2HB   PRO  10          1HB       PRO  10  -9.663  -4.104   2.991
   71   1HG   PRO  10          2HG       PRO  10  -7.984  -5.002   0.639
   72   2HG   PRO  10          1HG       PRO  10  -9.262  -3.755   0.665
   73   1HD   PRO  10          2HD       PRO  10  -6.502  -3.332   0.915
   74   2HD   PRO  10          1HD       PRO  10  -7.730  -2.150   1.444
   75    H    SER  11           H        SER  11  -8.030  -6.930   4.249
   76    HA   SER  11           HA       SER  11  -6.752  -8.797   4.577
   77   1HB   SER  11          2HB       SER  11  -8.210  -8.905   2.455
   78   2HB   SER  11          1HB       SER  11  -6.714  -8.667   1.527
   79    HG   SER  11           HG       SER  11  -7.308 -10.904   1.867
   80    H    GLY  12           H        GLY  12  -5.098  -7.100   5.228
   81   1HA   GLY  12          1HA       GLY  12  -2.869  -6.595   5.572
   82   2HA   GLY  12          2HA       GLY  12  -2.585  -8.299   5.184
   83    H    MET  13           H        MET  13  -3.777  -5.628   3.089
   84    HA   MET  13           HA       MET  13  -1.374  -5.905   1.324
   85   1HB   MET  13          1HB       MET  13  -3.976  -4.430   0.925
   86   2HB   MET  13          2HB       MET  13  -2.589  -4.384  -0.171
   87   1HG   MET  13          1HG       MET  13  -2.834  -6.816  -0.519
   88   2HG   MET  13          2HG       MET  13  -4.192  -6.845   0.620
   89   1HE   MET  13          3HE       MET  13  -5.682  -8.086  -1.118
   90   2HE   MET  13          2HE       MET  13  -5.928  -7.533  -2.790
   91   3HE   MET  13          1HE       MET  13  -4.323  -8.099  -2.271
   92    H    CYS  14           H        CYS  14   0.212  -4.347   1.215
   93    HA   CYS  14           HA       CYS  14   0.288  -2.653   3.640
   94   1HB   CYS  14          1HB       CYS  14   2.401  -3.302   1.549
   95   2HB   CYS  14          2HB       CYS  14   2.619  -2.302   2.979
   96    H    CYS  15           H        CYS  15   0.335  -0.408   3.532
   97    HA   CYS  15           HA       CYS  15  -0.297   0.905   1.038
   98   1HB   CYS  15          1HB       CYS  15   0.493   2.195   3.635
   99   2HB   CYS  15          2HB       CYS  15  -0.203   2.987   2.213
  100    H    SER  16           H        SER  16   1.016   1.352  -0.466
  101    HA   SER  16           HA       SER  16   3.763   0.871  -0.571
  102   1HB   SER  16          2HB       SER  16   3.644   2.056  -2.727
  103   2HB   SER  16          1HB       SER  16   2.192   1.057  -2.500
  104    HG   SER  16           HG       SER  16   1.219   2.962  -1.583
  105    H    GLN  17           H        GLN  17   5.346   2.643  -1.271
  106    HA   GLN  17           HA       GLN  17   5.693   4.788   0.636
  107   1HB   GLN  17          2HB       GLN  17   7.503   5.497  -0.541
  108   2HB   GLN  17          1HB       GLN  17   7.589   3.768  -0.164
  109   1HG   GLN  17          2HG       GLN  17   6.445   4.742  -2.738
  110   2HG   GLN  17          1HG       GLN  17   8.209   4.685  -2.475
  111   1HE2  GLN  17          2HE2      GLN  17   8.342   1.068  -2.646
  112   2HE2  GLN  17          1HE2      GLN  17   9.254   2.533  -2.270
  113    H    PHE  18           H        PHE  18   3.878   4.503  -2.450
  114    HA   PHE  18           HA       PHE  18   3.739   7.254  -3.011
  115   1HB   PHE  18          2HB       PHE  18   2.546   4.803  -4.075
  116   2HB   PHE  18          1HB       PHE  18   2.723   6.304  -4.876
  117    HD1  PHE  18           HD2      PHE  18   5.391   7.194  -4.779
  118    HD2  PHE  18           HD1      PHE  18   3.970   3.124  -4.994
  119    HE1  PHE  18           HE2      PHE  18   7.584   6.469  -5.672
  120    HE2  PHE  18           HE1      PHE  18   6.169   2.407  -5.874
  121    HZ   PHE  18           HZ       PHE  18   7.983   4.076  -6.213
  122    H    GLY  19           H        GLY  19   2.135   5.532  -0.645
  123   1HA   GLY  19          1HA       GLY  19   0.140   5.635   0.351
  124   2HA   GLY  19          2HA       GLY  19  -0.138   7.073  -0.618
  125    H    TYR  20           H        TYR  20   0.571   4.348  -2.536
  126    HA   TYR  20           HA       TYR  20  -2.255   3.503  -3.035
  127   1HB   TYR  20          1HB       TYR  20   0.340   2.920  -4.509
  128   2HB   TYR  20          2HB       TYR  20  -1.215   2.227  -4.881
  129    HD1  TYR  20           HD2      TYR  20  -1.120   5.915  -4.133
  130    HD2  TYR  20           HD1      TYR  20  -1.066   2.835  -7.175
  131    HE1  TYR  20           HE2      TYR  20  -1.795   7.549  -5.803
  132    HE2  TYR  20           HE1      TYR  20  -1.814   4.496  -8.835
  133    HH   TYR  20           HH       TYR  20  -2.471   6.676  -9.198
  134    H    CYS  21           H        CYS  21  -1.533   0.759  -3.629
  135    HA   CYS  21           HA       CYS  21  -0.187  -0.248  -1.300
  136   1HB   CYS  21          1HB       CYS  21  -1.846  -0.392   0.218
  137   2HB   CYS  21          2HB       CYS  21  -2.860   0.583  -0.852
  138    H    GLY  22           H        GLY  22  -0.223  -2.578  -1.006
  139   1HA   GLY  22          1HA       GLY  22  -1.690  -4.399  -2.387
  140   2HA   GLY  22          2HA       GLY  22  -0.228  -4.156  -3.369
  141    H    LYS  23           H        LYS  23  -0.718  -6.506  -2.027
  142    HA   LYS  23           HA       LYS  23   0.952  -6.647   0.415
  143   1HB   LYS  23          2HB       LYS  23  -1.075  -8.041   0.154
  144   2HB   LYS  23          1HB       LYS  23  -0.331  -8.860  -1.230
  145   1HG   LYS  23          2HG       LYS  23   1.571  -9.515   0.390
  146   2HG   LYS  23          1HG       LYS  23   0.561  -8.903   1.695
  147   1HD   LYS  23          2HD       LYS  23  -0.025 -11.160  -0.290
  148   2HD   LYS  23          1HD       LYS  23   0.337 -11.357   1.422
  149   1HE   LYS  23          2HE       LYS  23  -2.176 -10.084   0.212
  150   2HE   LYS  23          1HE       LYS  23  -2.068 -11.668   0.978
  151   1HZ   LYS  23          1HZ       LYS  23  -1.548  -9.118   2.370
  152   2HZ   LYS  23          3HZ       LYS  23  -2.961  -9.926   2.419
  153   3HZ   LYS  23          2HZ       LYS  23  -1.604 -10.610   3.060
  154    H    GLY  24           H        GLY  24   2.898  -5.654  -0.745
  155   1HA   GLY  24          1HA       GLY  24   4.595  -7.851  -1.268
  156   2HA   GLY  24          2HA       GLY  24   4.383  -6.928  -2.767
  157    HA   PRO  25           HA       PRO  25   7.583  -5.407   0.420
  158   1HB   PRO  25          2HB       PRO  25   9.942  -5.998  -0.852
  159   2HB   PRO  25          1HB       PRO  25   9.017  -7.173   0.123
  160   1HG   PRO  25          2HG       PRO  25   9.002  -6.853  -2.882
  161   2HG   PRO  25          1HG       PRO  25   9.132  -8.361  -1.936
  162   1HD   PRO  25          2HD       PRO  25   6.765  -7.477  -2.998
  163   2HD   PRO  25          1HD       PRO  25   6.797  -8.347  -1.449
  164    H    LYS  26           H        LYS  26   7.585  -4.991  -3.095
  165    HA   LYS  26           HA       LYS  26   8.999  -2.651  -3.540
  166   1HB   LYS  26          2HB       LYS  26   6.301  -3.566  -4.648
  167   2HB   LYS  26          1HB       LYS  26   7.197  -2.184  -5.282
  168   1HG   LYS  26          2HG       LYS  26   9.114  -3.638  -5.862
  169   2HG   LYS  26          1HG       LYS  26   8.329  -5.018  -5.113
  170   1HD   LYS  26          2HD       LYS  26   8.069  -5.158  -7.529
  171   2HD   LYS  26          1HD       LYS  26   6.516  -5.020  -6.715
  172   1HE   LYS  26          2HE       LYS  26   6.580  -3.677  -8.772
  173   2HE   LYS  26          1HE       LYS  26   6.291  -2.671  -7.354
  174   1HZ   LYS  26          1HZ       LYS  26   8.892  -3.001  -8.715
  175   2HZ   LYS  26          3HZ       LYS  26   7.895  -1.701  -8.848
  176   3HZ   LYS  26          2HZ       LYS  26   8.608  -2.038  -7.408
  177    H    TYR  27           H        TYR  27   5.763  -3.020  -2.148
  178    HA   TYR  27           HA       TYR  27   5.373  -0.108  -1.817
  179   1HB   TYR  27          1HB       TYR  27   3.730  -2.637  -1.395
  180   2HB   TYR  27          2HB       TYR  27   3.132  -1.138  -0.972
  181    HD1  TYR  27           HD1      TYR  27   4.596   0.076  -3.815
  182    HD2  TYR  27           HD2      TYR  27   1.893  -3.136  -2.851
  183    HE1  TYR  27           HE1      TYR  27   3.397   0.468  -5.911
  184    HE2  TYR  27           HE2      TYR  27   0.700  -2.755  -5.008
  185    HH   TYR  27           HH       TYR  27   1.591  -0.115  -7.229
  186    H    CYS  28           H        CYS  28   5.181  -3.096   0.015
  187    HA   CYS  28           HA       CYS  28   4.733  -1.934   2.462
  188   1HB   CYS  28          1HB       CYS  28   4.727  -4.489   1.729
  189   2HB   CYS  28          2HB       CYS  28   6.332  -4.489   2.474
  190    H    GLY  29           H        GLY  29   7.916  -2.677   1.096
  191   1HA   GLY  29          1HA       GLY  29  10.038  -1.879   1.722
  192   2HA   GLY  29          2HA       GLY  29   9.086  -0.437   2.003
  193    H    ARG  30           HN       ARG  30   9.488   0.332   3.871
  194    HA   ARG  30           HA       ARG  30  10.727  -0.423   6.168
  195   1HB   ARG  30          1HB       ARG  30   9.294   1.214   7.333
  196   2HB   ARG  30          2HB       ARG  30  10.014   1.826   5.853
  197   1HG   ARG  30          1HG       ARG  30   7.208   0.704   5.644
  198   2HG   ARG  30          2HG       ARG  30   7.440   2.191   6.557
  199   1HD   ARG  30          1HD       ARG  30   8.588   3.213   4.601
  200   2HD   ARG  30          2HD       ARG  30   8.205   1.800   3.626
  201    HE   ARG  30           HE       ARG  30   6.423   3.909   4.626
  202   1HH1  ARG  30          1HH1      ARG  30   6.383   0.559   3.494
  203   2HH1  ARG  30          2HH1      ARG  30   5.308   0.809   2.180
  204   1HH2  ARG  30          2HH2      ARG  30   4.438   4.162   3.116
  205   2HH2  ARG  30          1HH2      ARG  30   3.795   2.711   2.486
  No match found for entry  HXTARG          30
   
  No H/Q in entry =         206
  Start of MODEL           7
 Raw file had  213 H/Q atoms
  Start of MODEL    7
    1   1H    VAL   1          2H        VAL   1  -4.376  -0.101  -3.622
    2   2H    VAL   1          3H        VAL   1  -4.996  -1.086  -4.768
    3   3H    VAL   1          1H        VAL   1  -3.480  -1.398  -4.123
    4    HA   VAL   1           HA       VAL   1  -2.513   0.409  -5.112
    5    HB   VAL   1           HB       VAL   1  -2.897   0.075  -7.509
    6   1HG1  VAL   1          1HG1      VAL   1  -1.510  -1.529  -6.220
    7   2HG1  VAL   1          3HG1      VAL   1  -2.931  -2.571  -5.992
    8   3HG1  VAL   1          2HG1      VAL   1  -2.297  -2.274  -7.620
    9   1HG2  VAL   1          2HG2      VAL   1  -5.380  -0.162  -7.512
   10   2HG2  VAL   1          1HG2      VAL   1  -4.566  -1.485  -8.356
   11   3HG2  VAL   1          3HG2      VAL   1  -5.221  -1.753  -6.735
   12    H    GLY   2           H        GLY   2  -2.738   2.405  -6.486
   13   1HA   GLY   2          1HA       GLY   2  -3.918   4.130  -7.504
   14   2HA   GLY   2          2HA       GLY   2  -5.432   3.565  -6.778
   15    H    GLU   3           H        GLU   3  -4.614   3.244  -4.202
   16    HA   GLU   3           HA       GLU   3  -3.322   5.330  -2.819
   17   1HB   GLU   3          2HB       GLU   3  -5.139   6.638  -1.968
   18   2HB   GLU   3          1HB       GLU   3  -4.741   6.906  -3.654
   19   1HG   GLU   3          2HG       GLU   3  -6.979   6.867  -3.867
   20   2HG   GLU   3          1HG       GLU   3  -6.721   5.138  -4.087
   21    HE2  GLU   3           HE2      GLU   3  -7.305   3.790  -2.289
   22    H    CYS   4           H        CYS   4  -3.379   4.692  -0.539
   23    HA   CYS   4           HA       CYS   4  -5.014   2.329   0.169
   24   1HB   CYS   4          1HB       CYS   4  -3.043   3.938   1.639
   25   2HB   CYS   4          2HB       CYS   4  -4.353   3.459   2.620
   26    H    VAL   5           H        VAL   5  -6.282   2.587   2.152
   27    HA   VAL   5           HA       VAL   5  -8.460   4.573   1.652
   28    HB   VAL   5           HB       VAL   5  -8.532   2.071   3.362
   29   1HG1  VAL   5          3HG1      VAL   5 -10.687   3.987   2.321
   30   2HG1  VAL   5          2HG1      VAL   5 -11.001   2.486   3.219
   31   3HG1  VAL   5          1HG1      VAL   5 -10.184   3.837   4.012
   32   1HG2  VAL   5          2HG2      VAL   5  -9.438   2.623   0.502
   33   2HG2  VAL   5          1HG2      VAL   5  -8.212   1.447   1.020
   34   3HG2  VAL   5          3HG2      VAL   5  -9.910   1.189   1.445
   35    H    ARG   6           H        ARG   6  -6.758   5.902   2.323
   36    HA   ARG   6           HA       ARG   6  -5.699   7.379   3.790
   37   1HB   ARG   6          2HB       ARG   6  -8.064   6.846   5.606
   38   2HB   ARG   6          1HB       ARG   6  -6.997   8.253   5.648
   39   1HG   ARG   6          2HG       ARG   6  -8.771   7.466   3.297
   40   2HG   ARG   6          1HG       ARG   6  -9.220   8.620   4.539
   41   1HD   ARG   6          2HD       ARG   6  -7.844  10.283   3.793
   42   2HD   ARG   6          1HD       ARG   6  -6.648   9.230   3.080
   43    HE   ARG   6           HE       ARG   6  -9.038  10.312   1.831
   44   1HH1  ARG   6          2HH1      ARG   6  -6.619   7.760   1.648
   45   2HH1  ARG   6          1HH1      ARG   6  -7.184   7.097   0.134
   46   1HH2  ARG   6          1HH2      ARG   6  -9.672   9.576  -0.339
   47   2HH2  ARG   6          2HH2      ARG   6  -8.810   8.209  -1.014
   48    H    GLY   7           H        GLY   7  -4.412   5.208   3.733
   49   1HA   GLY   7          1HA       GLY   7  -2.555   4.492   4.753
   50   2HA   GLY   7          2HA       GLY   7  -3.156   5.097   6.291
   51    H    ARG   8           H        ARG   8  -5.304   2.821   4.642
   52    HA   ARG   8           HA       ARG   8  -4.300   0.441   5.947
   53   1HB   ARG   8          2HB       ARG   8  -7.124   1.536   6.097
   54   2HB   ARG   8          1HB       ARG   8  -6.551  -0.030   6.719
   55   1HG   ARG   8          2HG       ARG   8  -4.850   1.161   8.043
   56   2HG   ARG   8          1HG       ARG   8  -5.459   2.683   7.579
   57   1HD   ARG   8          2HD       ARG   8  -7.722   1.190   8.593
   58   2HD   ARG   8          1HD       ARG   8  -6.385   1.086   9.740
   59    HE   ARG   8           HE       ARG   8  -6.772   3.262  10.340
   60   1HH1  ARG   8          2HH2      ARG   8  -8.216   2.860   7.209
   61   2HH1  ARG   8          1HH2      ARG   8  -7.889   4.434   6.582
   62   1HH2  ARG   8          2HH1      ARG   8  -6.500   5.530   9.729
   63   2HH2  ARG   8          1HH1      ARG   8  -6.718   5.928   8.049
   64    H    CYS   9           H        CYS   9  -4.937  -1.310   4.543
   65    HA   CYS   9           HA       CYS   9  -6.940  -0.853   2.442
   66   1HB   CYS   9          1HB       CYS   9  -4.079  -1.558   1.934
   67   2HB   CYS   9          2HB       CYS   9  -5.262  -2.630   1.205
   68    HA   PRO  10           HA       PRO  10  -8.499  -4.676   3.830
   69   1HB   PRO  10          2HB       PRO  10  -8.347  -5.861   1.062
   70   2HB   PRO  10          1HB       PRO  10  -9.752  -5.784   2.164
   71   1HG   PRO  10          2HG       PRO  10  -9.569  -4.097   0.072
   72   2HG   PRO  10          1HG       PRO  10 -10.083  -3.458   1.665
   73   1HD   PRO  10          2HD       PRO  10  -7.313  -3.358   0.427
   74   2HD   PRO  10          1HD       PRO  10  -8.250  -2.041   1.187
   75    H    SER  11           H        SER  11  -8.234  -7.019   3.880
   76    HA   SER  11           HA       SER  11  -6.816  -8.660   4.737
   77   1HB   SER  11          2HB       SER  11  -6.354 -10.115   2.722
   78   2HB   SER  11          1HB       SER  11  -7.965  -9.383   2.669
   79    HG   SER  11           HG       SER  11  -5.664  -8.305   1.403
   80    H    GLY  12           H        GLY  12  -5.366  -6.762   5.370
   81   1HA   GLY  12          1HA       GLY  12  -3.217  -6.116   5.944
   82   2HA   GLY  12          2HA       GLY  12  -2.808  -7.828   5.759
   83    H    MET  13           H        MET  13  -3.828  -5.385   3.318
   84    HA   MET  13           HA       MET  13  -1.403  -5.823   1.671
   85   1HB   MET  13          1HB       MET  13  -3.681  -3.899   1.559
   86   2HB   MET  13          2HB       MET  13  -2.350  -3.862   0.397
   87   1HG   MET  13          1HG       MET  13  -2.908  -6.153  -0.330
   88   2HG   MET  13          2HG       MET  13  -4.211  -6.232   0.853
   89   1HE   MET  13          2HE       MET  13  -4.990  -7.114  -1.840
   90   2HE   MET  13          1HE       MET  13  -6.235  -6.744  -0.618
   91   3HE   MET  13          3HE       MET  13  -6.400  -6.118  -2.273
   92    H    CYS  14           H        CYS  14   0.349  -4.302   1.485
   93    HA   CYS  14           HA       CYS  14   0.691  -2.527   3.854
   94   1HB   CYS  14          1HB       CYS  14   2.546  -3.285   1.560
   95   2HB   CYS  14          2HB       CYS  14   2.888  -2.065   2.777
   96    H    CYS  15           H        CYS  15   0.446  -0.292   3.611
   97    HA   CYS  15           HA       CYS  15  -0.432   0.768   1.070
   98   1HB   CYS  15          1HB       CYS  15   0.563   2.324   3.460
   99   2HB   CYS  15          2HB       CYS  15  -0.310   2.966   2.063
  100    H    SER  16           H        SER  16   0.906   1.828  -0.479
  101    HA   SER  16           HA       SER  16   3.562   0.828  -0.586
  102   1HB   SER  16          2HB       SER  16   2.467   2.990  -2.389
  103   2HB   SER  16          1HB       SER  16   3.591   1.691  -2.781
  104    HG   SER  16           HG       SER  16   1.842   0.218  -2.377
  105    H    GLN  17           H        GLN  17   5.257   2.596  -1.595
  106    HA   GLN  17           HA       GLN  17   5.967   4.573   0.409
  107   1HB   GLN  17          2HB       GLN  17   7.754   5.173  -0.811
  108   2HB   GLN  17          1HB       GLN  17   7.673   3.419  -0.569
  109   1HG   GLN  17          2HG       GLN  17   6.516   4.672  -3.002
  110   2HG   GLN  17          1HG       GLN  17   8.281   4.461  -2.835
  111   1HE2  GLN  17          1HE2      GLN  17   8.153   0.881  -3.256
  112   2HE2  GLN  17          2HE2      GLN  17   9.174   2.273  -2.877
  113    H    PHE  18           H        PHE  18   4.122   4.661  -2.682
  114    HA   PHE  18           HA       PHE  18   3.882   7.447  -2.854
  115   1HB   PHE  18          2HB       PHE  18   2.475   5.256  -4.182
  116   2HB   PHE  18          1HB       PHE  18   2.906   6.808  -4.778
  117    HD1  PHE  18           HD2      PHE  18   5.575   7.323  -4.799
  118    HD2  PHE  18           HD1      PHE  18   3.711   3.443  -5.163
  119    HE1  PHE  18           HE2      PHE  18   7.629   6.425  -5.857
  120    HE2  PHE  18           HE1      PHE  18   5.774   2.555  -6.195
  121    HZ   PHE  18           HZ       PHE  18   7.736   4.039  -6.548
  122    H    GLY  19           H        GLY  19   2.589   5.519  -0.565
  123   1HA   GLY  19          1HA       GLY  19   0.679   5.300   0.593
  124   2HA   GLY  19          2HA       GLY  19   0.301   6.891  -0.060
  125    H    TYR  20           H        TYR  20   0.854   4.150  -2.123
  126    HA   TYR  20           HA       TYR  20  -2.023   3.714  -2.875
  127   1HB   TYR  20          1HB       TYR  20   0.602   2.866  -4.141
  128   2HB   TYR  20          2HB       TYR  20  -0.983   2.299  -4.643
  129    HD1  TYR  20           HD1      TYR  20  -0.985   5.885  -3.782
  130    HD2  TYR  20           HD2      TYR  20  -0.244   2.972  -6.896
  131    HE1  TYR  20           HE1      TYR  20  -1.126   7.643  -5.463
  132    HE2  TYR  20           HE2      TYR  20  -0.538   4.745  -8.589
  133    HH   TYR  20           HH       TYR  20  -0.930   6.989  -8.970
  134    H    CYS  21           H        CYS  21  -1.443   0.862  -3.436
  135    HA   CYS  21           HA       CYS  21  -0.416  -0.193  -1.014
  136   1HB   CYS  21          1HB       CYS  21  -2.229  -0.687   0.298
  137   2HB   CYS  21          2HB       CYS  21  -2.886   0.752  -0.497
  138    H    GLY  22           H        GLY  22  -0.229  -2.466  -0.824
  139   1HA   GLY  22          1HA       GLY  22  -1.779  -4.318  -2.074
  140   2HA   GLY  22          2HA       GLY  22  -0.373  -4.099  -3.139
  141    H    LYS  23           H        LYS  23  -0.832  -6.416  -1.688
  142    HA   LYS  23           HA       LYS  23   0.928  -6.475   0.687
  143   1HB   LYS  23          2HB       LYS  23  -1.129  -7.863   0.546
  144   2HB   LYS  23          1HB       LYS  23  -0.411  -8.765  -0.795
  145   1HG   LYS  23          2HG       LYS  23   1.542  -9.315   0.782
  146   2HG   LYS  23          1HG       LYS  23   0.605  -8.602   2.089
  147   1HD   LYS  23          2HD       LYS  23  -0.152 -10.968   0.292
  148   2HD   LYS  23          1HD       LYS  23   0.422 -11.099   1.951
  149   1HE   LYS  23          2HE       LYS  23  -2.216  -9.833   1.041
  150   2HE   LYS  23          1HE       LYS  23  -2.024 -11.408   1.809
  151   1HZ   LYS  23          2HZ       LYS  23  -1.339  -8.831   3.085
  152   2HZ   LYS  23          1HZ       LYS  23  -2.706  -9.672   3.324
  153   3HZ   LYS  23          3HZ       LYS  23  -1.260 -10.316   3.795
  154    H    GLY  24           H        GLY  24   2.850  -5.562  -0.592
  155   1HA   GLY  24          1HA       GLY  24   4.500  -7.803  -1.043
  156   2HA   GLY  24          2HA       GLY  24   4.222  -6.994  -2.597
  157    HA   PRO  25           HA       PRO  25   7.619  -5.267   0.248
  158   1HB   PRO  25          2HB       PRO  25   9.889  -6.041  -1.079
  159   2HB   PRO  25          1HB       PRO  25   8.990  -7.101   0.040
  160   1HG   PRO  25          2HG       PRO  25   8.821  -7.041  -2.978
  161   2HG   PRO  25          1HG       PRO  25   8.974  -8.465  -1.912
  162   1HD   PRO  25          2HD       PRO  25   6.567  -7.620  -2.916
  163   2HD   PRO  25          1HD       PRO  25   6.676  -8.353  -1.300
  164    H    LYS  26           H        LYS  26   7.431  -5.205  -3.289
  165    HA   LYS  26           HA       LYS  26   8.855  -2.939  -4.028
  166   1HB   LYS  26          2HB       LYS  26   6.110  -3.918  -4.932
  167   2HB   LYS  26          1HB       LYS  26   7.022  -2.653  -5.761
  168   1HG   LYS  26          2HG       LYS  26   8.863  -4.209  -6.213
  169   2HG   LYS  26          1HG       LYS  26   8.011  -5.514  -5.360
  170   1HD   LYS  26          2HD       LYS  26   6.089  -5.286  -6.926
  171   2HD   LYS  26          1HD       LYS  26   6.956  -4.054  -7.838
  172   1HE   LYS  26          2HE       LYS  26   7.868  -6.957  -7.438
  173   2HE   LYS  26          1HE       LYS  26   7.009  -6.351  -8.859
  174   1HZ   LYS  26          3HZ       LYS  26   8.855  -4.883  -9.297
  175   2HZ   LYS  26          2HZ       LYS  26   9.676  -5.457  -7.990
  176   3HZ   LYS  26          1HZ       LYS  26   9.346  -6.450  -9.256
  177    H    TYR  27           H        TYR  27   5.694  -3.128  -2.426
  178    HA   TYR  27           HA       TYR  27   5.344  -0.185  -2.376
  179   1HB   TYR  27          1HB       TYR  27   3.710  -2.635  -1.624
  180   2HB   TYR  27          2HB       TYR  27   3.154  -1.114  -1.265
  181    HD1  TYR  27           HD2      TYR  27   4.392  -0.041  -4.251
  182    HD2  TYR  27           HD1      TYR  27   1.755  -3.185  -2.916
  183    HE1  TYR  27           HE2      TYR  27   3.199   0.077  -6.367
  184    HE2  TYR  27           HE1      TYR  27   0.523  -3.034  -5.080
  185    HH   TYR  27           HH       TYR  27   1.488  -0.772  -7.662
  186    H    CYS  28           H        CYS  28   5.266  -2.951  -0.189
  187    HA   CYS  28           HA       CYS  28   5.062  -1.475   2.120
  188   1HB   CYS  28          1HB       CYS  28   5.073  -4.110   1.703
  189   2HB   CYS  28          2HB       CYS  28   6.715  -3.981   2.337
  190    H    GLY  29           H        GLY  29   8.127  -2.656   0.747
  191   1HA   GLY  29          1HA       GLY  29   9.907  -1.378   2.441
  192   2HA   GLY  29          2HA       GLY  29  10.244  -1.786   0.762
  193    H    ARG  30           HN       ARG  30  10.634   0.765   2.461
  194    HA   ARG  30           HA       ARG  30   8.835   2.744   1.293
  195   1HB   ARG  30          1HB       ARG  30  11.348   3.084   2.957
  196   2HB   ARG  30          2HB       ARG  30  10.193   4.355   2.558
  197   1HG   ARG  30          1HG       ARG  30   9.583   1.871   4.255
  198   2HG   ARG  30          2HG       ARG  30   9.901   3.504   4.824
  199   1HD   ARG  30          1HD       ARG  30   7.600   3.421   4.909
  200   2HD   ARG  30          2HD       ARG  30   7.920   4.272   3.386
  201    HE   ARG  30           HE       ARG  30   7.526   1.317   3.199
  202   1HH1  ARG  30          1HH1      ARG  30   5.786   4.415   3.384
  203   2HH1  ARG  30          2HH1      ARG  30   4.497   3.877   2.319
  204   1HH2  ARG  30          1HH2      ARG  30   5.807   0.751   1.670
  205   2HH2  ARG  30          2HH2      ARG  30   4.288   1.460   2.084
  No match found for entry  HXTARG          30
   
  No H/Q in entry =         206
  Start of MODEL           8
 Raw file had  213 H/Q atoms
  Start of MODEL    8
    1   1H    VAL   1          2H        VAL   1  -4.146   0.388  -7.676
    2   2H    VAL   1          3H        VAL   1  -4.741  -1.168  -7.499
    3   3H    VAL   1          1H        VAL   1  -5.408  -0.100  -8.587
    4    HA   VAL   1           HA       VAL   1  -6.870   0.044  -6.847
    5    HB   VAL   1           HB       VAL   1  -5.640  -1.226  -5.253
    6   1HG1  VAL   1          3HG1      VAL   1  -3.323  -0.408  -5.626
    7   2HG1  VAL   1          2HG1      VAL   1  -3.758   1.157  -4.898
    8   3HG1  VAL   1          1HG1      VAL   1  -3.770  -0.321  -3.923
    9   1HG2  VAL   1          2HG2      VAL   1  -7.384   0.297  -4.364
   10   2HG2  VAL   1          1HG2      VAL   1  -6.125  -0.129  -3.195
   11   3HG2  VAL   1          3HG2      VAL   1  -6.103   1.466  -3.951
   12    H    GLY   2           H        GLY   2  -7.550   2.098  -5.837
   13   1HA   GLY   2          1HA       GLY   2  -6.695   4.368  -7.390
   14   2HA   GLY   2          2HA       GLY   2  -7.811   4.394  -6.012
   15    H    GLU   3           H        GLU   3  -6.513   3.712  -3.832
   16    HA   GLU   3           HA       GLU   3  -3.825   4.341  -3.483
   17   1HB   GLU   3          2HB       GLU   3  -4.244   6.342  -1.971
   18   2HB   GLU   3          1HB       GLU   3  -4.308   6.686  -3.697
   19   1HG   GLU   3          2HG       GLU   3  -6.650   6.905  -3.722
   20   2HG   GLU   3          1HG       GLU   3  -6.869   6.044  -2.191
   21    HE1  GLU   3           HE2      GLU   3  -6.090   7.049  -0.312
   22    H    CYS   4           H        CYS   4  -3.539   4.252  -0.977
   23    HA   CYS   4           HA       CYS   4  -5.399   2.378   0.293
   24   1HB   CYS   4          1HB       CYS   4  -3.137   4.032   1.390
   25   2HB   CYS   4          2HB       CYS   4  -4.277   3.385   2.485
   26    H    VAL   5           H        VAL   5  -6.308   3.004   2.381
   27    HA   VAL   5           HA       VAL   5  -8.060   5.431   2.164
   28    HB   VAL   5           HB       VAL   5  -8.708   2.646   3.226
   29   1HG1  VAL   5          2HG1      VAL   5 -10.425   5.166   3.039
   30   2HG1  VAL   5          1HG1      VAL   5 -11.012   3.550   3.485
   31   3HG1  VAL   5          3HG1      VAL   5  -9.864   4.388   4.537
   32   1HG2  VAL   5          2HG2      VAL   5  -9.709   4.149   0.765
   33   2HG2  VAL   5          1HG2      VAL   5  -8.686   2.697   0.764
   34   3HG2  VAL   5          3HG2      VAL   5 -10.348   2.601   1.357
   35    H    ARG   6           H        ARG   6  -6.946   6.784   3.534
   36    HA   ARG   6           HA       ARG   6  -5.910   7.584   5.410
   37   1HB   ARG   6          2HB       ARG   6  -7.825   5.659   6.794
   38   2HB   ARG   6          1HB       ARG   6  -6.966   7.000   7.564
   39   1HG   ARG   6          2HG       ARG   6  -8.089   8.631   6.134
   40   2HG   ARG   6          1HG       ARG   6  -8.939   7.351   5.257
   41   1HD   ARG   6          2HD       ARG   6  -9.191   7.886   8.250
   42   2HD   ARG   6          1HD       ARG   6 -10.322   8.500   7.061
   43    HE   ARG   6           HE       ARG   6 -10.119   5.801   8.137
   44   1HH1  ARG   6          2HH1      ARG   6 -11.224   7.643   5.346
   45   2HH1  ARG   6          1HH1      ARG   6 -12.452   6.512   4.867
   46   1HH2  ARG   6          1HH2      ARG   6 -11.724   4.249   7.526
   47   2HH2  ARG   6          2HH2      ARG   6 -12.720   4.522   6.136
   48    H    GLY   7           H        GLY   7  -4.401   5.780   4.099
   49   1HA   GLY   7          1HA       GLY   7  -2.496   4.581   4.266
   50   2HA   GLY   7          2HA       GLY   7  -2.411   5.104   5.953
   51    H    ARG   8           H        ARG   8  -5.104   3.073   4.643
   52    HA   ARG   8           HA       ARG   8  -4.023   0.628   5.760
   53   1HB   ARG   8          2HB       ARG   8  -6.789   1.775   6.258
   54   2HB   ARG   8          1HB       ARG   8  -6.185   0.170   6.739
   55   1HG   ARG   8          2HG       ARG   8  -4.269   1.332   7.875
   56   2HG   ARG   8          1HG       ARG   8  -5.028   2.854   7.532
   57   1HD   ARG   8          2HD       ARG   8  -6.966   2.378   8.871
   58   2HD   ARG   8          1HD       ARG   8  -6.411   0.710   9.116
   59    HE   ARG   8           HE       ARG   8  -5.204   1.376  10.880
   60   1HH1  ARG   8          1HH2      ARG   8  -5.282   4.306   8.758
   61   2HH1  ARG   8          2HH2      ARG   8  -4.586   5.296   9.971
   62   1HH2  ARG   8          2HH1      ARG   8  -4.193   2.739  12.384
   63   2HH2  ARG   8          1HH1      ARG   8  -3.900   4.405  12.017
   64    H    CYS   9           H        CYS   9  -4.730  -1.060   4.467
   65    HA   CYS   9           HA       CYS   9  -6.757  -0.616   2.360
   66   1HB   CYS   9          1HB       CYS   9  -3.976  -1.592   1.886
   67   2HB   CYS   9          2HB       CYS   9  -5.232  -2.675   1.329
   68    HA   PRO  10           HA       PRO  10  -8.529  -4.298   4.026
   69   1HB   PRO  10          2HB       PRO  10  -8.756  -5.524   1.298
   70   2HB   PRO  10          1HB       PRO  10 -10.052  -5.184   2.478
   71   1HG   PRO  10          2HG       PRO  10  -9.739  -3.670   0.249
   72   2HG   PRO  10          1HG       PRO  10 -10.140  -2.897   1.814
   73   1HD   PRO  10          2HD       PRO  10  -7.395  -3.172   0.534
   74   2HD   PRO  10          1HD       PRO  10  -8.178  -1.719   1.213
   75    H    SER  11           H        SER  11  -8.409  -6.683   3.978
   76    HA   SER  11           HA       SER  11  -7.053  -8.442   4.605
   77   1HB   SER  11          2HB       SER  11  -8.411  -8.901   2.535
   78   2HB   SER  11          1HB       SER  11  -7.033  -8.389   1.540
   79    HG   SER  11           HG       SER  11  -5.843 -10.095   2.555
   80    H    GLY  12           H        GLY  12  -5.456  -6.629   5.159
   81   1HA   GLY  12          1HA       GLY  12  -3.240  -6.165   5.651
   82   2HA   GLY  12          2HA       GLY  12  -2.985  -7.902   5.419
   83    H    MET  13           H        MET  13  -3.904  -5.359   3.041
   84    HA   MET  13           HA       MET  13  -1.412  -5.923   1.445
   85   1HB   MET  13          1HB       MET  13  -3.660  -4.002   0.881
   86   2HB   MET  13          2HB       MET  13  -2.367  -4.457  -0.215
   87   1HG   MET  13          1HG       MET  13  -4.552  -6.326   0.814
   88   2HG   MET  13          2HG       MET  13  -4.531  -5.514  -0.746
   89   1HE   MET  13          3HE       MET  13  -5.153  -8.526  -0.525
   90   2HE   MET  13          2HE       MET  13  -5.006  -7.653  -2.071
   91   3HE   MET  13          1HE       MET  13  -4.137  -9.185  -1.830
   92    H    CYS  14           H        CYS  14   0.347  -4.467   1.413
   93    HA   CYS  14           HA       CYS  14   0.370  -2.606   3.715
   94   1HB   CYS  14          1HB       CYS  14   2.480  -3.309   1.634
   95   2HB   CYS  14          2HB       CYS  14   2.674  -2.131   2.923
   96    H    CYS  15           H        CYS  15   0.338  -0.369   3.455
   97    HA   CYS  15           HA       CYS  15  -0.285   0.769   0.851
   98   1HB   CYS  15          1HB       CYS  15   0.489   2.212   3.394
   99   2HB   CYS  15          2HB       CYS  15  -0.247   2.912   1.946
  100    H    SER  16           H        SER  16   1.236   1.281  -0.611
  101    HA   SER  16           HA       SER  16   4.028   1.025  -0.224
  102   1HB   SER  16          2HB       SER  16   4.218   2.478  -2.286
  103   2HB   SER  16          1HB       SER  16   3.244   1.055  -2.512
  104    HG   SER  16           HG       SER  16   1.420   2.565  -1.870
  105    H    GLN  17           H        GLN  17   5.614   2.856  -0.006
  106    HA   GLN  17           HA       GLN  17   4.922   5.115   1.540
  107   1HB   GLN  17          2HB       GLN  17   7.059   5.939   1.194
  108   2HB   GLN  17          1HB       GLN  17   7.192   4.169   1.268
  109   1HG   GLN  17          2HG       GLN  17   6.989   4.177  -1.254
  110   2HG   GLN  17          1HG       GLN  17   7.142   5.953  -1.171
  111   1HE2  GLN  17          2HE2      GLN  17  10.629   5.749   0.014
  112   2HE2  GLN  17          1HE2      GLN  17   9.140   6.555   0.466
  113    H    PHE  18           H        PHE  18   4.422   4.600  -1.959
  114    HA   PHE  18           HA       PHE  18   4.131   7.259  -2.719
  115   1HB   PHE  18          2HB       PHE  18   3.220   4.816  -4.013
  116   2HB   PHE  18          1HB       PHE  18   3.915   6.252  -4.682
  117    HD1  PHE  18           HD2      PHE  18   6.458   6.745  -3.679
  118    HD2  PHE  18           HD1      PHE  18   4.613   2.955  -4.584
  119    HE1  PHE  18           HE2      PHE  18   8.697   5.689  -3.867
  120    HE2  PHE  18           HE1      PHE  18   6.847   1.881  -4.647
  121    HZ   PHE  18           HZ       PHE  18   8.893   3.249  -4.297
  122    H    GLY  19           H        GLY  19   2.041   5.195  -0.904
  123   1HA   GLY  19          1HA       GLY  19   0.032   5.623  -0.146
  124   2HA   GLY  19          2HA       GLY  19  -0.128   6.869  -1.357
  125    H    TYR  20           H        TYR  20   0.709   3.961  -2.903
  126    HA   TYR  20           HA       TYR  20  -2.130   3.086  -3.334
  127   1HB   TYR  20          1HB       TYR  20   0.385   2.101  -4.720
  128   2HB   TYR  20          2HB       TYR  20  -1.267   1.810  -5.237
  129    HD1  TYR  20           HD1      TYR  20  -2.695   4.109  -5.655
  130    HD2  TYR  20           HD2      TYR  20   1.596   3.825  -5.818
  131    HE1  TYR  20           HE1      TYR  20  -2.526   6.590  -5.624
  132    HE2  TYR  20           HE2      TYR  20   1.748   6.296  -5.876
  133    HH   TYR  20           HH       TYR  20   0.496   7.992  -4.625
  134    H    CYS  21           H        CYS  21  -1.739   0.320  -3.665
  135    HA   CYS  21           HA       CYS  21  -0.356  -0.511  -1.248
  136   1HB   CYS  21          1HB       CYS  21  -2.115  -0.913   0.137
  137   2HB   CYS  21          2HB       CYS  21  -2.768   0.465  -0.763
  138    H    GLY  22           H        GLY  22  -0.128  -2.738  -0.895
  139   1HA   GLY  22          1HA       GLY  22  -1.292  -4.766  -2.341
  140   2HA   GLY  22          2HA       GLY  22   0.204  -4.311  -3.196
  141    H    LYS  23           H        LYS  23  -0.403  -6.718  -1.602
  142    HA   LYS  23           HA       LYS  23   1.119  -6.508   0.893
  143   1HB   LYS  23          2HB       LYS  23  -0.812  -7.951   0.647
  144   2HB   LYS  23          1HB       LYS  23   0.023  -8.943  -0.554
  145   1HG   LYS  23          2HG       LYS  23   1.778  -9.392   1.266
  146   2HG   LYS  23          1HG       LYS  23   0.698  -8.625   2.427
  147   1HD   LYS  23          2HD       LYS  23  -0.154 -10.958   0.630
  148   2HD   LYS  23          1HD       LYS  23   0.715 -11.218   2.133
  149   1HE   LYS  23          2HE       LYS  23  -1.742 -11.510   2.375
  150   2HE   LYS  23          1HE       LYS  23  -1.037 -10.328   3.489
  151   1HZ   LYS  23          3HZ       LYS  23  -2.398  -9.544   0.989
  152   2HZ   LYS  23          2HZ       LYS  23  -3.117  -9.571   2.470
  153   3HZ   LYS  23          1HZ       LYS  23  -1.856  -8.588   2.215
  154    H    GLY  24           H        GLY  24   3.087  -5.590  -0.398
  155   1HA   GLY  24          1HA       GLY  24   4.983  -7.664  -0.384
  156   2HA   GLY  24          2HA       GLY  24   4.663  -7.249  -2.082
  157    HA   PRO  25           HA       PRO  25   7.870  -4.672   0.274
  158   1HB   PRO  25          2HB       PRO  25  10.174  -5.402  -1.028
  159   2HB   PRO  25          1HB       PRO  25   9.439  -6.345   0.298
  160   1HG   PRO  25          2HG       PRO  25   9.129  -6.802  -2.677
  161   2HG   PRO  25          1HG       PRO  25   9.521  -8.007  -1.417
  162   1HD   PRO  25          2HD       PRO  25   6.987  -7.664  -2.349
  163   2HD   PRO  25          1HD       PRO  25   7.265  -8.029  -0.629
  164    H    LYS  26           H        LYS  26   7.239  -5.062  -3.176
  165    HA   LYS  26           HA       LYS  26   8.416  -2.723  -4.229
  166   1HB   LYS  26          2HB       LYS  26   5.702  -3.963  -4.862
  167   2HB   LYS  26          1HB       LYS  26   6.534  -2.729  -5.827
  168   1HG   LYS  26          2HG       LYS  26   8.518  -4.350  -5.965
  169   2HG   LYS  26          1HG       LYS  26   7.442  -5.602  -5.338
  170   1HD   LYS  26          2HD       LYS  26   7.060  -3.958  -7.884
  171   2HD   LYS  26          1HD       LYS  26   7.623  -5.635  -7.794
  172   1HE   LYS  26          2HE       LYS  26   5.422  -6.288  -6.750
  173   2HE   LYS  26          1HE       LYS  26   4.854  -4.621  -6.961
  174   1HZ   LYS  26          2HZ       LYS  26   5.130  -4.885  -9.327
  175   2HZ   LYS  26          1HZ       LYS  26   5.648  -6.438  -9.140
  176   3HZ   LYS  26          3HZ       LYS  26   4.112  -6.025  -8.729
  177    H    TYR  27           H        TYR  27   5.415  -3.131  -2.221
  178    HA   TYR  27           HA       TYR  27   5.013  -0.221  -2.230
  179   1HB   TYR  27          1HB       TYR  27   3.474  -2.519  -0.944
  180   2HB   TYR  27          2HB       TYR  27   3.035  -0.917  -0.915
  181    HD1  TYR  27           HD2      TYR  27   3.601  -3.815  -3.207
  182    HD2  TYR  27           HD1      TYR  27   1.487  -0.111  -2.635
  183    HE1  TYR  27           HE2      TYR  27   2.422  -4.135  -5.363
  184    HE2  TYR  27           HE1      TYR  27   0.428  -0.362  -4.843
  185    HH   TYR  27           HH       TYR  27   0.090  -1.759  -6.637
  186    H    CYS  28           H        CYS  28   5.042  -2.873   0.050
  187    HA   CYS  28           HA       CYS  28   5.170  -1.411   2.363
  188   1HB   CYS  28          1HB       CYS  28   4.756  -4.022   1.775
  189   2HB   CYS  28          2HB       CYS  28   6.385  -4.167   2.420
  190    H    GLY  29           H        GLY  29   7.943  -2.513   0.477
  191   1HA   GLY  29          1HA       GLY  29   9.867  -2.317   2.466
  192   2HA   GLY  29          2HA       GLY  29  10.171  -2.242   0.730
  193    H    ARG  30           HN       ARG  30  11.564  -0.677   2.603
  194    HA   ARG  30           HA       ARG  30  12.665   1.284   2.367
  195   1HB   ARG  30          1HB       ARG  30  10.572   2.233   0.490
  196   2HB   ARG  30          2HB       ARG  30  12.125   2.976   0.824
  197   1HG   ARG  30          1HG       ARG  30  13.405   1.156  -0.020
  198   2HG   ARG  30          2HG       ARG  30  12.030   0.052  -0.083
  199   1HD   ARG  30          1HD       ARG  30  12.415   2.527  -1.722
  200   2HD   ARG  30          2HD       ARG  30  12.550   0.847  -2.297
  201    HE   ARG  30           HE       ARG  30  10.136   2.456  -1.777
  202   1HH1  ARG  30          2HH2      ARG  30  11.218  -0.847  -2.276
  203   2HH1  ARG  30          1HH2      ARG  30   9.673  -1.589  -1.902
  204   1HH2  ARG  30          2HH1      ARG  30   8.232   0.692  -0.529
  205   2HH2  ARG  30          1HH1      ARG  30   7.770   0.184  -2.107
  No match found for entry  HXTARG          30
   
  No H/Q in entry =         206
  Start of MODEL           9
 Raw file had  213 H/Q atoms
  Start of MODEL    9
    1   1H    VAL   1          3H        VAL   1  -4.503   1.270  -7.141
    2   2H    VAL   1          1H        VAL   1  -5.127  -0.260  -6.854
    3   3H    VAL   1          2H        VAL   1  -5.732   0.718  -8.056
    4    HA   VAL   1           HA       VAL   1  -7.270   1.050  -6.403
    5    HB   VAL   1           HB       VAL   1  -6.614   1.544  -4.078
    6   1HG1  VAL   1          3HG1      VAL   1  -7.124  -0.804  -4.795
    7   2HG1  VAL   1          2HG1      VAL   1  -5.379  -1.100  -4.969
    8   3HG1  VAL   1          1HG1      VAL   1  -6.060  -0.693  -3.386
    9   1HG2  VAL   1          2HG2      VAL   1  -4.313   2.447  -4.477
   10   2HG2  VAL   1          1HG2      VAL   1  -4.358   1.186  -3.250
   11   3HG2  VAL   1          3HG2      VAL   1  -3.760   0.807  -4.877
   12    H    GLY   2           H        GLY   2  -7.879   3.292  -5.479
   13   1HA   GLY   2          1HA       GLY   2  -6.752   5.454  -7.005
   14   2HA   GLY   2          2HA       GLY   2  -7.835   5.588  -5.606
   15    H    GLU   3           H        GLU   3  -6.613   4.640  -3.482
   16    HA   GLU   3           HA       GLU   3  -3.881   4.718  -3.144
   17   1HB   GLU   3          2HB       GLU   3  -3.841   6.748  -1.577
   18   2HB   GLU   3          1HB       GLU   3  -3.743   7.071  -3.306
   19   1HG   GLU   3          2HG       GLU   3  -6.051   7.772  -3.398
   20   2HG   GLU   3          1HG       GLU   3  -6.342   7.203  -1.736
   21    HE1  GLU   3           HE2      GLU   3  -4.147  10.564  -2.246
   22    H    CYS   4           H        CYS   4  -3.567   4.569  -0.660
   23    HA   CYS   4           HA       CYS   4  -5.322   2.640   0.411
   24   1HB   CYS   4          1HB       CYS   4  -3.740   4.559   2.103
   25   2HB   CYS   4          2HB       CYS   4  -4.295   2.970   2.553
   26    H    VAL   5           H        VAL   5  -6.679   2.758   2.309
   27    HA   VAL   5           HA       VAL   5  -8.612   4.972   1.927
   28    HB   VAL   5           HB       VAL   5  -8.991   2.351   3.400
   29   1HG1  VAL   5          1HG1      VAL   5 -10.599   4.245   3.917
   30   2HG1  VAL   5          3HG1      VAL   5 -10.923   4.408   2.189
   31   3HG1  VAL   5          2HG1      VAL   5 -11.390   2.922   3.047
   32   1HG2  VAL   5          3HG2      VAL   5  -9.492   3.136   0.495
   33   2HG2  VAL   5          2HG2      VAL   5  -8.433   1.837   1.083
   34   3HG2  VAL   5          1HG2      VAL   5 -10.185   1.693   1.272
   35    H    ARG   6           H        ARG   6  -7.022   6.234   2.887
   36    HA   ARG   6           HA       ARG   6  -6.231   7.651   4.532
   37   1HB   ARG   6          2HB       ARG   6  -7.892   6.202   6.600
   38   2HB   ARG   6          1HB       ARG   6  -7.188   7.798   6.715
   39   1HG   ARG   6          2HG       ARG   6  -8.834   8.836   5.523
   40   2HG   ARG   6          1HG       ARG   6  -9.117   7.482   4.436
   41   1HD   ARG   6          2HD       ARG   6 -10.041   7.632   7.327
   42   2HD   ARG   6          1HD       ARG   6 -11.045   7.824   5.868
   43    HE   ARG   6           HE       ARG   6  -9.587   5.349   5.774
   44   1HH1  ARG   6          1HH2      ARG   6 -12.370   6.774   7.396
   45   2HH1  ARG   6          2HH2      ARG   6 -13.174   5.262   7.689
   46   1HH2  ARG   6          2HH1      ARG   6 -10.574   3.367   6.120
   47   2HH2  ARG   6          1HH1      ARG   6 -12.107   3.241   6.931
   48    H    GLY   7           H        GLY   7  -4.644   5.766   3.689
   49   1HA   GLY   7          1HA       GLY   7  -2.679   4.703   4.142
   50   2HA   GLY   7          2HA       GLY   7  -2.795   5.353   5.775
   51    H    ARG   8           H        ARG   8  -5.341   3.247   4.537
   52    HA   ARG   8           HA       ARG   8  -4.412   0.898   6.017
   53   1HB   ARG   8          2HB       ARG   8  -7.152   2.202   6.099
   54   2HB   ARG   8          1HB       ARG   8  -6.684   0.649   6.837
   55   1HG   ARG   8          2HG       ARG   8  -4.806   1.860   7.989
   56   2HG   ARG   8          1HG       ARG   8  -5.429   3.362   7.391
   57   1HD   ARG   8          2HD       ARG   8  -7.505   3.167   8.593
   58   2HD   ARG   8          1HD       ARG   8  -7.090   1.513   9.083
   59    HE   ARG   8           HE       ARG   8  -5.970   2.308  10.852
   60   1HH1  ARG   8          2HH1      ARG   8  -5.760   4.980   8.434
   61   2HH1  ARG   8          1HH1      ARG   8  -5.142   6.088   9.588
   62   1HH2  ARG   8          2HH2      ARG   8  -5.044   3.804  12.291
   63   2HH2  ARG   8          1HH2      ARG   8  -4.660   5.410  11.773
   64    H    CYS   9           H        CYS   9  -4.450  -0.760   4.579
   65    HA   CYS   9           HA       CYS   9  -6.026  -0.589   2.074
   66   1HB   CYS   9          1HB       CYS   9  -3.689  -2.349   2.863
   67   2HB   CYS   9          2HB       CYS   9  -4.519  -2.364   1.309
   68    HA   PRO  10           HA       PRO  10  -8.397  -4.131   3.509
   69   1HB   PRO  10          2HB       PRO  10  -8.191  -5.375   0.800
   70   2HB   PRO  10          1HB       PRO  10  -9.657  -4.919   1.709
   71   1HG   PRO  10          2HG       PRO  10  -8.804  -3.508  -0.442
   72   2HG   PRO  10          1HG       PRO  10  -9.489  -2.666   0.983
   73   1HD   PRO  10          2HD       PRO  10  -6.557  -3.082   0.304
   74   2HD   PRO  10          1HD       PRO  10  -7.398  -1.586   0.802
   75    H    SER  11           H        SER  11  -8.344  -6.461   3.562
   76    HA   SER  11           HA       SER  11  -7.124  -8.232   4.483
   77   1HB   SER  11          2HB       SER  11  -6.796  -9.732   2.452
   78   2HB   SER  11          1HB       SER  11  -8.345  -8.879   2.474
   79    HG   SER  11           HG       SER  11  -6.246  -7.542   1.233
   80    H    GLY  12           H        GLY  12  -5.471  -6.499   5.103
   81   1HA   GLY  12          1HA       GLY  12  -3.272  -6.145   5.750
   82   2HA   GLY  12          2HA       GLY  12  -3.079  -7.895   5.567
   83    H    MET  13           H        MET  13  -3.740  -5.401   3.054
   84    HA   MET  13           HA       MET  13  -1.197  -6.071   1.616
   85   1HB   MET  13          1HB       MET  13  -3.617  -4.341   1.083
   86   2HB   MET  13          2HB       MET  13  -2.110  -4.038   0.214
   87   1HG   MET  13          1HG       MET  13  -3.748  -5.459  -1.003
   88   2HG   MET  13          2HG       MET  13  -2.155  -6.180  -0.817
   89   1HE   MET  13          1HE       MET  13  -3.235  -8.430  -1.729
   90   2HE   MET  13          3HE       MET  13  -4.631  -9.219  -0.951
   91   3HE   MET  13          2HE       MET  13  -4.843  -7.660  -1.776
   92    H    CYS  14           H        CYS  14   0.499  -4.377   1.342
   93    HA   CYS  14           HA       CYS  14   0.637  -2.607   3.745
   94   1HB   CYS  14          1HB       CYS  14   2.710  -3.194   1.597
   95   2HB   CYS  14          2HB       CYS  14   2.891  -2.119   2.977
   96    H    CYS  15           H        CYS  15   0.687  -0.335   3.465
   97    HA   CYS  15           HA       CYS  15  -0.149   0.692   0.935
   98   1HB   CYS  15          1HB       CYS  15   0.911   2.231   3.274
   99   2HB   CYS  15          2HB       CYS  15   0.396   2.966   1.755
  100    H    SER  16           H        SER  16   1.126   1.418  -0.805
  101    HA   SER  16           HA       SER  16   3.902   0.786  -0.743
  102   1HB   SER  16          2HB       SER  16   4.183   2.270  -2.732
  103   2HB   SER  16          1HB       SER  16   3.065   0.960  -2.947
  104    HG   SER  16           HG       SER  16   2.136   2.821  -3.728
  105    H    GLN  17           H        GLN  17   5.701   2.525  -0.765
  106    HA   GLN  17           HA       GLN  17   5.381   4.614   1.151
  107   1HB   GLN  17          2HB       GLN  17   7.513   5.399   0.536
  108   2HB   GLN  17          1HB       GLN  17   7.477   3.634   0.664
  109   1HG   GLN  17          2HG       GLN  17   6.959   3.707  -1.898
  110   2HG   GLN  17          1HG       GLN  17   7.495   5.396  -1.752
  111   1HE2  GLN  17          2HE2      GLN  17  10.282   2.370  -1.089
  112   2HE2  GLN  17          1HE2      GLN  17   8.655   2.178  -0.443
  113    H    PHE  18           H        PHE  18   4.427   4.484  -2.286
  114    HA   PHE  18           HA       PHE  18   3.900   7.221  -2.621
  115   1HB   PHE  18          2HB       PHE  18   2.998   4.981  -4.227
  116   2HB   PHE  18          1HB       PHE  18   3.631   6.523  -4.668
  117    HD1  PHE  18           HD2      PHE  18   6.211   6.954  -3.955
  118    HD2  PHE  18           HD1      PHE  18   4.404   3.171  -4.973
  119    HE1  PHE  18           HE2      PHE  18   8.456   5.983  -4.381
  120    HE2  PHE  18           HE1      PHE  18   6.655   2.175  -5.260
  121    HZ   PHE  18           HZ       PHE  18   8.683   3.585  -4.979
  122    H    GLY  19           H        GLY  19   2.335   5.034  -0.654
  123   1HA   GLY  19          1HA       GLY  19   0.351   5.013   0.306
  124   2HA   GLY  19          2HA       GLY  19   0.070   6.529  -0.528
  125    H    TYR  20           H        TYR  20   0.651   3.599  -2.339
  126    HA   TYR  20           HA       TYR  20  -2.252   3.191  -2.961
  127   1HB   TYR  20          1HB       TYR  20   0.194   2.110  -4.423
  128   2HB   TYR  20          2HB       TYR  20  -1.467   1.952  -4.952
  129    HD1  TYR  20           HD2      TYR  20  -2.742   4.425  -5.048
  130    HD2  TYR  20           HD1      TYR  20   1.457   3.684  -5.658
  131    HE1  TYR  20           HE2      TYR  20  -2.426   6.779  -5.745
  132    HE2  TYR  20           HE1      TYR  20   1.740   6.014  -6.462
  133    HH   TYR  20           HH       TYR  20  -0.928   8.383  -6.404
  134    H    CYS  21           H        CYS  21  -2.041   0.375  -3.573
  135    HA   CYS  21           HA       CYS  21  -1.303  -0.685  -0.859
  136   1HB   CYS  21          1HB       CYS  21  -3.882  -1.003  -2.404
  137   2HB   CYS  21          2HB       CYS  21  -3.393  -2.041  -1.057
  138    H    GLY  22           H        GLY  22  -0.253  -2.659  -0.862
  139   1HA   GLY  22          1HA       GLY  22  -0.895  -4.665  -2.661
  140   2HA   GLY  22          2HA       GLY  22   0.642  -3.943  -3.182
  141    H    LYS  23           H        LYS  23  -0.154  -6.564  -1.887
  142    HA   LYS  23           HA       LYS  23   1.215  -6.564   0.725
  143   1HB   LYS  23          2HB       LYS  23  -0.847  -7.914   0.238
  144   2HB   LYS  23          1HB       LYS  23   0.094  -8.881  -0.902
  145   1HG   LYS  23          2HG       LYS  23   1.677  -9.389   1.075
  146   2HG   LYS  23          1HG       LYS  23   0.482  -8.634   2.123
  147   1HD   LYS  23          2HD       LYS  23   0.149 -11.066   0.290
  148   2HD   LYS  23          1HD       LYS  23   0.247 -11.108   2.047
  149   1HE   LYS  23          2HE       LYS  23  -2.017  -9.900   0.373
  150   2HE   LYS  23          1HE       LYS  23  -2.075 -11.416   1.270
  151   1HZ   LYS  23          1HZ       LYS  23  -1.687  -8.771   2.531
  152   2HZ   LYS  23          3HZ       LYS  23  -3.112  -9.552   2.445
  153   3HZ   LYS  23          2HZ       LYS  23  -1.873 -10.196   3.308
  154    H    GLY  24           H        GLY  24   3.256  -5.653  -0.457
  155   1HA   GLY  24          1HA       GLY  24   5.040  -7.798  -0.410
  156   2HA   GLY  24          2HA       GLY  24   4.808  -7.362  -2.123
  157    HA   PRO  25           HA       PRO  25   8.209  -4.940   0.309
  158   1HB   PRO  25          2HB       PRO  25   9.724  -6.053  -2.069
  159   2HB   PRO  25          1HB       PRO  25  10.339  -5.677  -0.434
  160   1HG   PRO  25          2HG       PRO  25   9.715  -8.232  -1.064
  161   2HG   PRO  25          1HG       PRO  25   9.165  -7.557   0.499
  162   1HD   PRO  25          2HD       PRO  25   7.568  -7.897  -2.049
  163   2HD   PRO  25          1HD       PRO  25   7.123  -8.258  -0.358
  164    H    LYS  26           H        LYS  26   7.504  -5.136  -3.193
  165    HA   LYS  26           HA       LYS  26   8.593  -2.733  -4.110
  166   1HB   LYS  26          2HB       LYS  26   5.992  -4.129  -4.893
  167   2HB   LYS  26          1HB       LYS  26   6.707  -2.778  -5.782
  168   1HG   LYS  26          2HG       LYS  26   8.787  -4.092  -6.131
  169   2HG   LYS  26          1HG       LYS  26   8.049  -5.481  -5.310
  170   1HD   LYS  26          2HD       LYS  26   6.227  -5.512  -6.999
  171   2HD   LYS  26          1HD       LYS  26   6.962  -4.114  -7.814
  172   1HE   LYS  26          2HE       LYS  26   9.035  -5.451  -8.227
  173   2HE   LYS  26          1HE       LYS  26   8.288  -6.850  -7.436
  174   1HZ   LYS  26          3HZ       LYS  26   7.310  -5.548  -9.894
  175   2HZ   LYS  26          2HZ       LYS  26   8.117  -6.976  -9.812
  176   3HZ   LYS  26          1HZ       LYS  26   6.613  -6.848  -9.163
  177    H    TYR  27           H        TYR  27   5.622  -3.242  -2.198
  178    HA   TYR  27           HA       TYR  27   4.992  -0.359  -2.290
  179   1HB   TYR  27          1HB       TYR  27   3.611  -2.828  -1.201
  180   2HB   TYR  27          2HB       TYR  27   3.072  -1.278  -0.866
  181    HD1  TYR  27           HD2      TYR  27   3.898  -3.554  -3.758
  182    HD2  TYR  27           HD1      TYR  27   1.314  -0.427  -2.317
  183    HE1  TYR  27           HE2      TYR  27   2.726  -3.509  -5.939
  184    HE2  TYR  27           HE1      TYR  27   0.238  -0.295  -4.543
  185    HH   TYR  27           HH       TYR  27   0.012  -1.295  -6.600
  186    H    CYS  28           H        CYS  28   5.301  -3.056  -0.043
  187    HA   CYS  28           HA       CYS  28   5.147  -1.601   2.267
  188   1HB   CYS  28          1HB       CYS  28   5.215  -4.253   1.748
  189   2HB   CYS  28          2HB       CYS  28   6.820  -4.075   2.462
  190    H    GLY  29           H        GLY  29   8.108  -2.126   0.429
  191   1HA   GLY  29          1HA       GLY  29  10.037  -1.238   2.166
  192   2HA   GLY  29          2HA       GLY  29  10.015  -0.905   0.429
  193    H    ARG  30           HN       ARG  30  10.741   0.902   2.777
  194    HA   ARG  30           HA       ARG  30   8.647   3.029   2.609
  195   1HB   ARG  30          1HB       ARG  30  11.067   2.768   4.417
  196   2HB   ARG  30          2HB       ARG  30   9.843   4.037   4.473
  197   1HG   ARG  30          1HG       ARG  30   9.388   1.074   5.090
  198   2HG   ARG  30          2HG       ARG  30   9.493   2.410   6.231
  199   1HD   ARG  30          1HD       ARG  30   7.197   2.047   6.053
  200   2HD   ARG  30          2HD       ARG  30   7.504   3.470   5.033
  201    HE   ARG  30           HE       ARG  30   7.462   0.747   3.782
  202   1HH1  ARG  30          1HH2      ARG  30   5.391   3.329   4.784
  203   2HH1  ARG  30          2HH2      ARG  30   4.306   3.272   3.425
  204   1HH2  ARG  30          2HH1      ARG  30   6.314   1.022   1.564
  205   2HH2  ARG  30          1HH1      ARG  30   4.645   1.271   1.926
  No match found for entry  HXTARG          30
   
  No H/Q in entry =         206
  Start of MODEL          10
 Raw file had  213 H/Q atoms
  Start of MODEL   10
    1   1H    VAL   1          3H        VAL   1  -1.993  -2.430  -5.418
    2   2H    VAL   1          1H        VAL   1  -2.500  -2.770  -6.937
    3   3H    VAL   1          2H        VAL   1  -0.946  -2.164  -6.664
    4    HA   VAL   1           HA       VAL   1  -1.722  -0.140  -5.964
    5    HB   VAL   1           HB       VAL   1  -3.069   0.738  -7.838
    6   1HG1  VAL   1          3HG1      VAL   1  -0.625   0.393  -8.083
    7   2HG1  VAL   1          2HG1      VAL   1  -0.925  -1.219  -8.772
    8   3HG1  VAL   1          1HG1      VAL   1  -1.495   0.230  -9.617
    9   1HG2  VAL   1          3HG2      VAL   1  -4.631  -1.181  -8.152
   10   2HG2  VAL   1          2HG2      VAL   1  -3.830  -0.700  -9.653
   11   3HG2  VAL   1          1HG2      VAL   1  -3.292  -2.154  -8.800
   12    H    GLY   2           H        GLY   2  -3.749   1.343  -5.639
   13   1HA   GLY   2          1HA       GLY   2  -6.187   1.002  -4.869
   14   2HA   GLY   2          2HA       GLY   2  -5.477  -0.159  -3.734
   15    H    GLU   3           H        GLU   3  -5.760   3.239  -4.558
   16    HA   GLU   3           HA       GLU   3  -3.943   4.429  -2.838
   17   1HB   GLU   3          2HB       GLU   3  -5.443   6.359  -2.886
   18   2HB   GLU   3          1HB       GLU   3  -4.961   5.734  -4.465
   19   1HG   GLU   3          2HG       GLU   3  -7.207   4.619  -4.689
   20   2HG   GLU   3          1HG       GLU   3  -7.683   5.337  -3.143
   21    HE1  GLU   3           HE2      GLU   3  -8.093   8.519  -4.508
   22    H    CYS   4           H        CYS   4  -3.792   4.025  -0.833
   23    HA   CYS   4           HA       CYS   4  -5.619   2.528   0.690
   24   1HB   CYS   4          1HB       CYS   4  -3.365   4.229   1.729
   25   2HB   CYS   4          2HB       CYS   4  -4.297   3.184   2.713
   26    H    VAL   5           H        VAL   5  -6.517   2.995   2.684
   27    HA   VAL   5           HA       VAL   5  -8.330   5.353   2.458
   28    HB   VAL   5           HB       VAL   5  -8.663   2.833   4.121
   29   1HG1  VAL   5          1HG1      VAL   5 -10.580   5.065   3.237
   30   2HG1  VAL   5          3HG1      VAL   5 -11.043   3.626   4.172
   31   3HG1  VAL   5          2HG1      VAL   5  -9.990   4.852   4.888
   32   1HG2  VAL   5          2HG2      VAL   5  -9.644   3.602   1.338
   33   2HG2  VAL   5          1HG2      VAL   5  -8.600   2.230   1.759
   34   3HG2  VAL   5          3HG2      VAL   5 -10.290   2.238   2.281
   35    H    ARG   6           H        ARG   6  -6.408   6.424   3.053
   36    HA   ARG   6           HA       ARG   6  -5.014   7.605   4.490
   37   1HB   ARG   6          2HB       ARG   6  -7.070   7.041   6.669
   38   2HB   ARG   6          1HB       ARG   6  -5.739   8.199   6.723
   39   1HG   ARG   6          2HG       ARG   6  -6.722   9.390   4.747
   40   2HG   ARG   6          1HG       ARG   6  -8.076   8.252   4.759
   41   1HD   ARG   6          2HD       ARG   6  -8.802  10.262   5.915
   42   2HD   ARG   6          1HD       ARG   6  -8.675   8.937   7.055
   43    HE   ARG   6           HE       ARG   6  -7.024  10.007   8.205
   44   1HH1  ARG   6          2HH1      ARG   6  -7.345  11.571   5.067
   45   2HH1  ARG   6          1HH1      ARG   6  -6.364  12.948   5.458
   46   1HH2  ARG   6          1HH2      ARG   6  -5.689  11.809   8.771
   47   2HH2  ARG   6          2HH2      ARG   6  -5.383  13.066   7.620
   48    H    GLY   7           H        GLY   7  -4.016   5.366   3.832
   49   1HA   GLY   7          1HA       GLY   7  -2.137   4.262   4.375
   50   2HA   GLY   7          2HA       GLY   7  -2.307   4.821   6.028
   51    H    ARG   8           H        ARG   8  -4.950   2.878   4.643
   52    HA   ARG   8           HA       ARG   8  -3.979   0.362   5.728
   53   1HB   ARG   8          2HB       ARG   8  -6.710   1.578   6.128
   54   2HB   ARG   8          1HB       ARG   8  -6.181  -0.047   6.625
   55   1HG   ARG   8          2HG       ARG   8  -4.291   1.007   7.863
   56   2HG   ARG   8          1HG       ARG   8  -4.912   2.571   7.555
   57   1HD   ARG   8          2HD       ARG   8  -6.239   0.391   9.166
   58   2HD   ARG   8          1HD       ARG   8  -5.657   1.950   9.775
   59    HE   ARG   8           HE       ARG   8  -8.252   1.379   8.815
   60   1HH1  ARG   8          2HH1      ARG   8  -5.927   4.041   8.504
   61   2HH1  ARG   8          1HH1      ARG   8  -6.826   4.829   7.246
   62   1HH2  ARG   8          1HH2      ARG   8  -9.594   2.666   7.358
   63   2HH2  ARG   8          2HH2      ARG   8  -8.866   4.102   6.666
   64    H    CYS   9           H        CYS   9  -4.644  -1.231   4.250
   65    HA   CYS   9           HA       CYS   9  -6.672  -0.608   2.164
   66   1HB   CYS   9          1HB       CYS   9  -3.908  -1.577   1.680
   67   2HB   CYS   9          2HB       CYS   9  -5.139  -2.656   1.063
   68    HA   PRO  10           HA       PRO  10  -8.607  -4.378   3.432
   69   1HB   PRO  10          2HB       PRO  10  -8.569  -5.405   0.607
   70   2HB   PRO  10          1HB       PRO  10  -9.965  -5.216   1.705
   71   1HG   PRO  10          2HG       PRO  10  -9.561  -3.492  -0.337
   72   2HG   PRO  10          1HG       PRO  10 -10.062  -2.865   1.264
   73   1HD   PRO  10          2HD       PRO  10  -7.251  -3.002   0.122
   74   2HD   PRO  10          1HD       PRO  10  -8.086  -1.614   0.876
   75    H    SER  11           H        SER  11  -8.470  -6.759   3.258
   76    HA   SER  11           HA       SER  11  -7.179  -8.490   4.018
   77   1HB   SER  11          2HB       SER  11  -8.134  -8.961   1.729
   78   2HB   SER  11          1HB       SER  11  -6.628  -8.364   1.001
   79    HG   SER  11           HG       SER  11  -5.550 -10.041   2.150
   80    H    GLY  12           H        GLY  12  -5.810  -6.546   4.774
   81   1HA   GLY  12          1HA       GLY  12  -3.744  -5.842   5.552
   82   2HA   GLY  12          2HA       GLY  12  -3.335  -7.566   5.552
   83    H    MET  13           H        MET  13  -4.019  -5.323   2.815
   84    HA   MET  13           HA       MET  13  -1.387  -5.944   1.570
   85   1HB   MET  13          1HB       MET  13  -3.518  -3.956   0.794
   86   2HB   MET  13          2HB       MET  13  -2.045  -4.278  -0.109
   87   1HG   MET  13          1HG       MET  13  -2.760  -6.640  -0.410
   88   2HG   MET  13          2HG       MET  13  -4.268  -6.281   0.441
   89   1HE   MET  13          1HE       MET  13  -4.233  -7.676  -2.349
   90   2HE   MET  13          3HE       MET  13  -5.728  -7.216  -1.493
   91   3HE   MET  13          2HE       MET  13  -5.508  -6.772  -3.201
   92    H    CYS  14           H        CYS  14   0.395  -4.477   1.482
   93    HA   CYS  14           HA       CYS  14   0.439  -2.545   3.740
   94   1HB   CYS  14          1HB       CYS  14   2.576  -3.293   1.712
   95   2HB   CYS  14          2HB       CYS  14   2.747  -2.171   3.059
   96    H    CYS  15           H        CYS  15   0.634  -0.309   3.335
   97    HA   CYS  15           HA       CYS  15  -0.104   0.643   0.687
   98   1HB   CYS  15          1HB       CYS  15   0.753   2.257   3.088
   99   2HB   CYS  15          2HB       CYS  15   0.000   2.873   1.609
  100    H    SER  16           H        SER  16   1.329   2.098  -0.508
  101    HA   SER  16           HA       SER  16   4.118   1.170  -0.502
  102   1HB   SER  16          2HB       SER  16   4.192   2.709  -2.614
  103   2HB   SER  16          1HB       SER  16   3.368   1.189  -2.719
  104    HG   SER  16           HG       SER  16   1.395   2.325  -2.267
  105    H    GLN  17           H        GLN  17   5.779   3.178  -0.799
  106    HA   GLN  17           HA       GLN  17   5.337   5.368   0.941
  107   1HB   GLN  17          2HB       GLN  17   7.231   6.388   0.130
  108   2HB   GLN  17          1HB       GLN  17   7.549   4.646   0.157
  109   1HG   GLN  17          2HG       GLN  17   6.943   4.541  -2.239
  110   2HG   GLN  17          1HG       GLN  17   6.712   6.309  -2.223
  111   1HE2  GLN  17          2HE2      GLN  17  10.282   7.013  -1.820
  112   2HE2  GLN  17          1HE2      GLN  17   8.755   7.489  -1.101
  113    H    PHE  18           H        PHE  18   4.170   4.845  -2.398
  114    HA   PHE  18           HA       PHE  18   3.451   7.485  -2.988
  115   1HB   PHE  18          2HB       PHE  18   2.884   4.861  -4.142
  116   2HB   PHE  18          1HB       PHE  18   2.912   6.382  -4.941
  117    HD1  PHE  18           HD1      PHE  18   5.354   7.692  -4.550
  118    HD2  PHE  18           HD2      PHE  18   4.651   3.450  -4.912
  119    HE1  PHE  18           HE1      PHE  18   7.725   7.346  -5.184
  120    HE2  PHE  18           HE2      PHE  18   7.026   3.112  -5.518
  121    HZ   PHE  18           HZ       PHE  18   8.575   5.057  -5.636
  122    H    GLY  19           H        GLY  19   2.064   5.360  -0.784
  123   1HA   GLY  19          1HA       GLY  19   0.079   5.274   0.175
  124   2HA   GLY  19          2HA       GLY  19  -0.323   6.677  -0.799
  125    H    TYR  20           H        TYR  20   0.530   4.014  -2.771
  126    HA   TYR  20           HA       TYR  20  -2.302   3.089  -3.132
  127   1HB   TYR  20          1HB       TYR  20   0.159   2.345  -4.706
  128   2HB   TYR  20          2HB       TYR  20  -1.475   1.907  -5.094
  129    HD1  TYR  20           HD2      TYR  20  -3.212   3.858  -5.473
  130    HD2  TYR  20           HD1      TYR  20   1.065   4.358  -5.667
  131    HE1  TYR  20           HE2      TYR  20  -3.518   5.983  -6.700
  132    HE2  TYR  20           HE1      TYR  20   0.754   6.494  -6.890
  133    HH   TYR  20           HH       TYR  20  -2.477   7.802  -7.667
  134    H    CYS  21           H        CYS  21  -1.863   0.380  -3.632
  135    HA   CYS  21           HA       CYS  21  -0.279  -0.564  -1.325
  136   1HB   CYS  21          1HB       CYS  21  -2.033  -1.251   0.006
  137   2HB   CYS  21          2HB       CYS  21  -2.604   0.285  -0.647
  138    H    GLY  22           H        GLY  22  -0.047  -2.774  -0.980
  139   1HA   GLY  22          1HA       GLY  22  -1.145  -4.793  -2.492
  140   2HA   GLY  22          2HA       GLY  22   0.407  -4.347  -3.256
  141    H    LYS  23           H        LYS  23  -0.349  -6.749  -1.659
  142    HA   LYS  23           HA       LYS  23   1.080  -6.515   0.895
  143   1HB   LYS  23          2HB       LYS  23  -0.924  -7.976   0.554
  144   2HB   LYS  23          1HB       LYS  23   0.038  -8.995  -0.523
  145   1HG   LYS  23          2HG       LYS  23   1.678  -9.286   1.443
  146   2HG   LYS  23          1HG       LYS  23   0.490  -8.485   2.462
  147   1HD   LYS  23          2HD       LYS  23   0.142 -11.050   0.817
  148   2HD   LYS  23          1HD       LYS  23   0.398 -10.994   2.558
  149   1HE   LYS  23          2HE       LYS  23  -2.050  -9.914   1.063
  150   2HE   LYS  23          1HE       LYS  23  -1.975 -11.419   1.977
  151   1HZ   LYS  23          1HZ       LYS  23  -1.560  -8.746   3.161
  152   2HZ   LYS  23          3HZ       LYS  23  -2.960  -9.568   3.190
  153   3HZ   LYS  23          2HZ       LYS  23  -1.641 -10.173   3.976
  154    H    GLY  24           H        GLY  24   3.065  -5.621  -0.379
  155   1HA   GLY  24          1HA       GLY  24   4.920  -7.711  -0.169
  156   2HA   GLY  24          2HA       GLY  24   4.726  -7.344  -1.900
  157    HA   PRO  25           HA       PRO  25   7.969  -4.746   0.590
  158   1HB   PRO  25          2HB       PRO  25   9.638  -5.951  -1.631
  159   2HB   PRO  25          1HB       PRO  25  10.145  -5.485   0.019
  160   1HG   PRO  25          2HG       PRO  25   9.597  -8.077  -0.519
  161   2HG   PRO  25          1HG       PRO  25   8.938  -7.335   0.970
  162   1HD   PRO  25          2HD       PRO  25   7.516  -7.816  -1.659
  163   2HD   PRO  25          1HD       PRO  25   6.973  -8.118   0.014
  164    H    LYS  26           H        LYS  26   7.341  -5.093  -2.909
  165    HA   LYS  26           HA       LYS  26   8.564  -2.760  -3.869
  166   1HB   LYS  26          2HB       LYS  26   6.011  -4.176  -4.757
  167   2HB   LYS  26          1HB       LYS  26   6.760  -2.841  -5.648
  168   1HG   LYS  26          2HG       LYS  26   8.909  -4.120  -5.741
  169   2HG   LYS  26          1HG       LYS  26   8.122  -5.491  -4.945
  170   1HD   LYS  26          2HD       LYS  26   6.539  -5.686  -6.845
  171   2HD   LYS  26          1HD       LYS  26   7.321  -4.295  -7.632
  172   1HE   LYS  26          2HE       LYS  26   9.498  -5.541  -7.652
  173   2HE   LYS  26          1HE       LYS  26   8.705  -6.934  -6.898
  174   1HZ   LYS  26          2HZ       LYS  26   7.332  -7.129  -8.861
  175   2HZ   LYS  26          1HZ       LYS  26   8.073  -5.833  -9.558
  176   3HZ   LYS  26          3HZ       LYS  26   8.926  -7.203  -9.253
  177    H    TYR  27           H        TYR  27   5.454  -3.110  -2.107
  178    HA   TYR  27           HA       TYR  27   5.089  -0.181  -2.130
  179   1HB   TYR  27          1HB       TYR  27   3.445  -2.449  -0.980
  180   2HB   TYR  27          2HB       TYR  27   3.056  -0.851  -0.897
  181    HD1  TYR  27           HD1      TYR  27   3.682  -3.619  -3.359
  182    HD2  TYR  27           HD2      TYR  27   1.548   0.038  -2.604
  183    HE1  TYR  27           HE1      TYR  27   2.548  -3.826  -5.540
  184    HE2  TYR  27           HE2      TYR  27   0.513  -0.097  -4.845
  185    HH   TYR  27           HH       TYR  27   1.269  -2.700  -7.117
  186    H    CYS  28           H        CYS  28   5.009  -2.914   0.065
  187    HA   CYS  28           HA       CYS  28   4.967  -1.573   2.420
  188   1HB   CYS  28          1HB       CYS  28   4.776  -4.173   1.802
  189   2HB   CYS  28          2HB       CYS  28   6.426  -4.219   2.414
  190    H    GLY  29           H        GLY  29   7.949  -2.415   0.728
  191   1HA   GLY  29          1HA       GLY  29   9.788  -1.925   2.739
  192   2HA   GLY  29          2HA       GLY  29  10.088  -1.760   1.004
  193    H    ARG  30           HN       ARG  30  11.134   0.033   2.999
  194    HA   ARG  30           HA       ARG  30  11.089   2.175   3.809
  195   1HB   ARG  30          1HB       ARG  30  11.788   3.760   2.199
  196   2HB   ARG  30          2HB       ARG  30  12.652   2.239   2.297
  197   1HG   ARG  30          1HG       ARG  30  12.579   2.774   0.055
  198   2HG   ARG  30          2HG       ARG  30  11.481   1.407   0.240
  199   1HD   ARG  30          1HD       ARG  30  10.337   4.160   0.549
  200   2HD   ARG  30          2HD       ARG  30  10.928   3.727  -1.059
  201    HE   ARG  30           HE       ARG  30   8.834   2.351   0.578
  202   1HH1  ARG  30          1HH1      ARG  30   9.786   3.194  -2.688
  203   2HH1  ARG  30          2HH1      ARG  30   9.232   1.740  -3.465
  204   1HH2  ARG  30          1HH2      ARG  30   7.734   0.565  -0.381
  205   2HH2  ARG  30          2HH2      ARG  30   7.806   0.269  -2.090
  No match found for entry  HXTARG          30
   
  No H/Q in entry =         206
  Start of MODEL          11
 Raw file had  213 H/Q atoms
  Start of MODEL   11
    1   1H    VAL   1          2H        VAL   1  -1.183  -0.882  -5.388
    2   2H    VAL   1          3H        VAL   1  -0.428  -0.964  -6.861
    3   3H    VAL   1          1H        VAL   1  -0.419   0.423  -5.985
    4    HA   VAL   1           HA       VAL   1  -2.135   0.990  -7.372
    5    HB   VAL   1           HB       VAL   1  -3.883  -0.666  -8.027
    6   1HG1  VAL   1          2HG1      VAL   1  -1.964  -0.180  -9.510
    7   2HG1  VAL   1          1HG1      VAL   1  -1.061  -1.531  -8.793
    8   3HG1  VAL   1          3HG1      VAL   1  -2.556  -1.838  -9.692
    9   1HG2  VAL   1          3HG2      VAL   1  -3.639  -2.287  -6.151
   10   2HG2  VAL   1          2HG2      VAL   1  -3.505  -3.065  -7.732
   11   3HG2  VAL   1          1HG2      VAL   1  -2.046  -2.767  -6.775
   12    H    GLY   2           H        GLY   2  -4.613   1.426  -6.662
   13   1HA   GLY   2          1HA       GLY   2  -6.259   1.436  -5.056
   14   2HA   GLY   2          2HA       GLY   2  -5.399   0.173  -4.170
   15    H    GLU   3           H        GLU   3  -5.475   3.651  -4.840
   16    HA   GLU   3           HA       GLU   3  -3.807   4.747  -2.977
   17   1HB   GLU   3          2HB       GLU   3  -5.334   6.635  -2.915
   18   2HB   GLU   3          1HB       GLU   3  -4.849   6.112  -4.526
   19   1HG   GLU   3          2HG       GLU   3  -6.979   6.025  -5.139
   20   2HG   GLU   3          1HG       GLU   3  -7.287   4.706  -4.012
   21    HE1  GLU   3           HE2      GLU   3  -7.707   5.438  -1.756
   22    H    CYS   4           H        CYS   4  -3.698   4.236  -0.949
   23    HA   CYS   4           HA       CYS   4  -5.574   2.636   0.436
   24   1HB   CYS   4          1HB       CYS   4  -3.325   4.279   1.584
   25   2HB   CYS   4          2HB       CYS   4  -4.424   3.469   2.601
   26    H    VAL   5           H        VAL   5  -6.473   3.090   2.485
   27    HA   VAL   5           HA       VAL   5  -8.249   5.511   2.490
   28    HB   VAL   5           HB       VAL   5  -8.898   2.615   3.200
   29   1HG1  VAL   5          2HG1      VAL   5 -10.649   5.122   3.225
   30   2HG1  VAL   5          1HG1      VAL   5 -11.221   3.460   3.480
   31   3HG1  VAL   5          3HG1      VAL   5 -10.127   4.202   4.654
   32   1HG2  VAL   5          1HG2      VAL   5  -9.826   4.377   0.887
   33   2HG2  VAL   5          3HG2      VAL   5  -8.793   2.938   0.763
   34   3HG2  VAL   5          2HG2      VAL   5 -10.475   2.771   1.279
   35    H    ARG   6           H        ARG   6  -7.206   6.692   4.042
   36    HA   ARG   6           HA       ARG   6  -6.167   7.271   5.987
   37   1HB   ARG   6          2HB       ARG   6  -8.043   5.196   7.202
   38   2HB   ARG   6          1HB       ARG   6  -7.230   6.517   8.055
   39   1HG   ARG   6          2HG       ARG   6  -8.438   8.171   6.630
   40   2HG   ARG   6          1HG       ARG   6  -9.304   6.837   5.835
   41   1HD   ARG   6          2HD       ARG   6 -10.237   6.136   8.014
   42   2HD   ARG   6          1HD       ARG   6  -9.393   7.495   8.806
   43    HE   ARG   6           HE       ARG   6 -10.942   8.529   6.669
   44   1HH1  ARG   6          2HH1      ARG   6 -11.425   7.007   9.805
   45   2HH1  ARG   6          1HH1      ARG   6 -12.953   7.765  10.134
   46   1HH2  ARG   6          1HH2      ARG   6 -12.977   9.568   7.055
   47   2HH2  ARG   6          2HH2      ARG   6 -13.852   9.262   8.518
   48    H    GLY   7           H        GLY   7  -4.652   5.598   4.494
   49   1HA   GLY   7          1HA       GLY   7  -2.750   4.362   4.589
   50   2HA   GLY   7          2HA       GLY   7  -2.724   4.682   6.325
   51    H    ARG   8           H        ARG   8  -5.368   2.855   4.626
   52    HA   ARG   8           HA       ARG   8  -4.284   0.314   5.471
   53   1HB   ARG   8          2HB       ARG   8  -7.139   1.223   5.942
   54   2HB   ARG   8          1HB       ARG   8  -6.474  -0.408   6.205
   55   1HG   ARG   8          2HG       ARG   8  -4.678   0.721   7.619
   56   2HG   ARG   8          1HG       ARG   8  -5.620   2.173   7.517
   57   1HD   ARG   8          2HD       ARG   8  -7.575   1.018   8.544
   58   2HD   ARG   8          1HD       ARG   8  -6.622  -0.452   8.744
   59    HE   ARG   8           HE       ARG   8  -6.607   1.952  10.370
   60   1HH1  ARG   8          1HH2      ARG   8  -4.514  -0.648   9.271
   61   2HH1  ARG   8          2HH2      ARG   8  -3.407  -0.568  10.607
   62   1HH2  ARG   8          2HH1      ARG   8  -5.157   2.123  12.166
   63   2HH2  ARG   8          1HH1      ARG   8  -3.793   1.064  12.294
   64    H    CYS   9           H        CYS   9  -4.870  -1.233   4.026
   65    HA   CYS   9           HA       CYS   9  -6.770  -0.759   1.815
   66   1HB   CYS   9          1HB       CYS   9  -3.883  -1.517   1.527
   67   2HB   CYS   9          2HB       CYS   9  -5.035  -2.534   0.671
   68    HA   PRO  10           HA       PRO  10  -8.432  -4.520   3.183
   69   1HB   PRO  10          2HB       PRO  10  -8.215  -5.800   0.466
   70   2HB   PRO  10          1HB       PRO  10  -9.657  -5.636   1.511
   71   1HG   PRO  10          2HG       PRO  10  -9.315  -4.053  -0.616
   72   2HG   PRO  10          1HG       PRO  10  -9.887  -3.325   0.917
   73   1HD   PRO  10          2HD       PRO  10  -7.058  -3.335  -0.193
   74   2HD   PRO  10          1HD       PRO  10  -7.987  -1.974   0.492
   75    H    SER  11           H        SER  11  -8.226  -6.835   3.419
   76    HA   SER  11           HA       SER  11  -6.967  -8.368   4.518
   77   1HB   SER  11          2HB       SER  11  -6.081  -9.967   2.811
   78   2HB   SER  11          1HB       SER  11  -7.497  -9.156   2.122
   79    HG   SER  11           HG       SER  11  -5.870  -7.565   1.299
   80    H    GLY  12           H        GLY  12  -5.805  -6.172   5.043
   81   1HA   GLY  12          1HA       GLY  12  -3.825  -5.148   5.793
   82   2HA   GLY  12          2HA       GLY  12  -3.270  -6.797   6.122
   83    H    MET  13           H        MET  13  -4.020  -5.299   2.929
   84    HA   MET  13           HA       MET  13  -1.433  -5.890   1.731
   85   1HB   MET  13          1HB       MET  13  -3.625  -3.932   1.180
   86   2HB   MET  13          2HB       MET  13  -2.156  -3.921   0.202
   87   1HG   MET  13          1HG       MET  13  -2.610  -6.116  -0.647
   88   2HG   MET  13          2HG       MET  13  -3.943  -6.360   0.486
   89   1HE   MET  13          2HE       MET  13  -4.400  -7.117  -2.409
   90   2HE   MET  13          1HE       MET  13  -5.726  -7.060  -1.218
   91   3HE   MET  13          3HE       MET  13  -5.922  -6.287  -2.807
   92    H    CYS  14           H        CYS  14   0.418  -4.380   1.511
   93    HA   CYS  14           HA       CYS  14   0.606  -2.565   3.852
   94   1HB   CYS  14          1HB       CYS  14   2.601  -3.216   1.649
   95   2HB   CYS  14          2HB       CYS  14   2.864  -2.148   3.022
   96    H    CYS  15           H        CYS  15   0.285  -0.351   3.622
   97    HA   CYS  15           HA       CYS  15  -0.304   0.792   1.024
   98   1HB   CYS  15          1HB       CYS  15   0.340   2.265   3.569
   99   2HB   CYS  15          2HB       CYS  15  -0.312   2.958   2.077
  100    H    SER  16           H        SER  16   1.034   1.769  -0.287
  101    HA   SER  16           HA       SER  16   3.679   0.843  -0.489
  102   1HB   SER  16          2HB       SER  16   3.612   2.085  -2.624
  103   2HB   SER  16          1HB       SER  16   2.081   1.254  -2.326
  104    HG   SER  16           HG       SER  16   1.273   3.233  -1.507
  105    H    GLN  17           H        GLN  17   5.140   2.801  -1.580
  106    HA   GLN  17           HA       GLN  17   5.794   4.870   0.431
  107   1HB   GLN  17          2HB       GLN  17   7.709   5.286  -0.653
  108   2HB   GLN  17          1HB       GLN  17   7.590   3.561  -0.266
  109   1HG   GLN  17          2HG       GLN  17   6.708   4.679  -2.888
  110   2HG   GLN  17          1HG       GLN  17   8.423   4.357  -2.534
  111   1HE2  GLN  17          2HE2      GLN  17   8.081   0.781  -2.900
  112   2HE2  GLN  17          1HE2      GLN  17   9.154   2.097  -2.426
  113    H    PHE  18           H        PHE  18   3.746   4.489  -2.417
  114    HA   PHE  18           HA       PHE  18   3.875   7.243  -3.211
  115   1HB   PHE  18          2HB       PHE  18   3.047   4.639  -4.270
  116   2HB   PHE  18          1HB       PHE  18   2.987   6.103  -5.136
  117    HD1  PHE  18           HD2      PHE  18   5.584   7.410  -4.732
  118    HD2  PHE  18           HD1      PHE  18   4.667   3.223  -5.288
  119    HE1  PHE  18           HE2      PHE  18   7.887   7.001  -5.527
  120    HE2  PHE  18           HE1      PHE  18   6.967   2.835  -6.101
  121    HZ   PHE  18           HZ       PHE  18   8.589   4.717  -6.213
  122    H    GLY  19           H        GLY  19   2.083   5.922  -0.881
  123   1HA   GLY  19          1HA       GLY  19   0.022   6.167  -0.081
  124   2HA   GLY  19          2HA       GLY  19  -0.215   7.319  -1.381
  125    H    TYR  20           H        TYR  20   0.604   4.447  -2.837
  126    HA   TYR  20           HA       TYR  20  -2.180   3.414  -3.207
  127   1HB   TYR  20          1HB       TYR  20   0.456   2.762  -4.561
  128   2HB   TYR  20          2HB       TYR  20  -1.055   2.007  -4.965
  129    HD1  TYR  20           HD1      TYR  20  -3.040   3.485  -5.739
  130    HD2  TYR  20           HD2      TYR  20   1.050   4.821  -5.675
  131    HE1  TYR  20           HE1      TYR  20  -3.624   5.351  -7.268
  132    HE2  TYR  20           HE2      TYR  20   0.468   6.689  -7.183
  133    HH   TYR  20           HH       TYR  20  -1.222   7.760  -8.342
  134    H    CYS  21           H        CYS  21  -1.419   0.670  -3.541
  135    HA   CYS  21           HA       CYS  21   0.102  -0.136  -1.179
  136   1HB   CYS  21          1HB       CYS  21  -1.746  -0.996   0.038
  137   2HB   CYS  21          2HB       CYS  21  -2.314   0.560  -0.560
  138    H    GLY  22           H        GLY  22  -0.063  -2.530  -0.822
  139   1HA   GLY  22          1HA       GLY  22  -1.258  -4.365  -2.389
  140   2HA   GLY  22          2HA       GLY  22   0.280  -4.101  -3.224
  141    H    LYS  23           H        LYS  23  -0.506  -6.436  -1.867
  142    HA   LYS  23           HA       LYS  23   0.869  -6.571   0.728
  143   1HB   LYS  23          2HB       LYS  23  -1.297  -7.792   0.003
  144   2HB   LYS  23          1HB       LYS  23  -0.256  -8.892  -0.895
  145   1HG   LYS  23          2HG       LYS  23   0.985  -9.267   1.340
  146   2HG   LYS  23          1HG       LYS  23  -0.320  -8.375   2.120
  147   1HD   LYS  23          2HD       LYS  23  -0.400 -11.026   0.623
  148   2HD   LYS  23          1HD       LYS  23  -0.811 -10.733   2.310
  149   1HE   LYS  23          2HE       LYS  23  -2.413  -9.968  -0.181
  150   2HE   LYS  23          1HE       LYS  23  -2.847 -11.151   1.054
  151   1HZ   LYS  23          1HZ       LYS  23  -2.644  -8.243   1.514
  152   2HZ   LYS  23          3HZ       LYS  23  -4.049  -9.070   1.348
  153   3HZ   LYS  23          2HZ       LYS  23  -3.103  -9.327   2.635
  154    H    GLY  24           H        GLY  24   2.896  -5.707  -0.540
  155   1HA   GLY  24          1HA       GLY  24   4.623  -7.935  -0.551
  156   2HA   GLY  24          2HA       GLY  24   4.388  -7.401  -2.232
  157    HA   PRO  25           HA       PRO  25   7.887  -5.345   0.410
  158   1HB   PRO  25          2HB       PRO  25   9.446  -6.432  -1.948
  159   2HB   PRO  25          1HB       PRO  25   9.995  -6.187  -0.265
  160   1HG   PRO  25          2HG       PRO  25   9.232  -8.653  -1.069
  161   2HG   PRO  25          1HG       PRO  25   8.647  -8.023   0.500
  162   1HD   PRO  25          2HD       PRO  25   7.170  -8.110  -2.141
  163   2HD   PRO  25          1HD       PRO  25   6.622  -8.536  -0.497
  164    H    LYS  26           H        LYS  26   7.418  -5.288  -3.138
  165    HA   LYS  26           HA       LYS  26   8.839  -3.001  -3.843
  166   1HB   LYS  26          2HB       LYS  26   6.175  -4.059  -4.889
  167   2HB   LYS  26          1HB       LYS  26   7.090  -2.756  -5.661
  168   1HG   LYS  26          2HG       LYS  26   9.031  -4.242  -5.946
  169   2HG   LYS  26          1HG       LYS  26   8.136  -5.588  -5.208
  170   1HD   LYS  26          2HD       LYS  26   6.385  -5.400  -6.958
  171   2HD   LYS  26          1HD       LYS  26   7.271  -4.092  -7.739
  172   1HE   LYS  26          2HE       LYS  26   8.276  -6.965  -7.355
  173   2HE   LYS  26          1HE       LYS  26   7.577  -6.315  -8.843
  174   1HZ   LYS  26          1HZ       LYS  26   9.398  -4.749  -8.955
  175   2HZ   LYS  26          3HZ       LYS  26  10.073  -5.379  -7.591
  176   3HZ   LYS  26          2HZ       LYS  26   9.946  -6.298  -8.945
  177    H    TYR  27           H        TYR  27   5.630  -3.219  -2.337
  178    HA   TYR  27           HA       TYR  27   5.276  -0.275  -2.311
  179   1HB   TYR  27          1HB       TYR  27   3.617  -2.666  -1.402
  180   2HB   TYR  27          2HB       TYR  27   3.135  -1.089  -1.229
  181    HD1  TYR  27           HD1      TYR  27   3.546   0.263  -3.830
  182    HD2  TYR  27           HD2      TYR  27   2.793  -3.921  -3.223
  183    HE1  TYR  27           HE1      TYR  27   2.226   0.221  -5.912
  184    HE2  TYR  27           HE2      TYR  27   1.641  -4.016  -5.410
  185    HH   TYR  27           HH       TYR  27   1.032  -2.814  -7.294
  186    H    CYS  28           H        CYS  28   5.182  -3.078  -0.212
  187    HA   CYS  28           HA       CYS  28   4.930  -1.781   2.161
  188   1HB   CYS  28          1HB       CYS  28   4.919  -4.361   1.630
  189   2HB   CYS  28          2HB       CYS  28   6.588  -4.303   2.211
  190    H    GLY  29           H        GLY  29   8.066  -2.786   0.842
  191   1HA   GLY  29          1HA       GLY  29  10.249  -2.093   1.362
  192   2HA   GLY  29          2HA       GLY  29   9.441  -0.536   1.158
  193    H    ARG  30           HN       ARG  30  10.530   0.665   2.671
  194    HA   ARG  30           HA       ARG  30  11.440   1.366   4.603
  195   1HB   ARG  30          1HB       ARG  30   8.544   0.726   5.282
  196   2HB   ARG  30          2HB       ARG  30   9.638   1.559   6.380
  197   1HG   ARG  30          1HG       ARG  30   8.470   3.253   5.278
  198   2HG   ARG  30          2HG       ARG  30  10.128   3.279   4.664
  199   1HD   ARG  30          1HD       ARG  30   8.455   3.757   2.932
  200   2HD   ARG  30          2HD       ARG  30   9.411   2.351   2.547
  201    HE   ARG  30           HE       ARG  30   7.573   0.885   3.212
  202   1HH1  ARG  30          2HH2      ARG  30   6.469   4.262   3.209
  203   2HH1  ARG  30          1HH2      ARG  30   4.963   3.865   2.388
  204   1HH2  ARG  30          1HH1      ARG  30   5.666   0.545   1.855
  205   2HH2  ARG  30          2HH1      ARG  30   4.331   1.548   2.302
  No match found for entry  HXTARG          30
   
  No H/Q in entry =         206
  Start of MODEL          12
 Raw file had  213 H/Q atoms
  Start of MODEL   12
    1   1H    VAL   1          3H        VAL   1  -4.703   3.889  -9.796
    2   2H    VAL   1          1H        VAL   1  -4.975   2.256 -10.052
    3   3H    VAL   1          2H        VAL   1  -6.214   3.367 -10.114
    4    HA   VAL   1           HA       VAL   1  -6.475   2.490  -8.024
    5    HB   VAL   1           HB       VAL   1  -4.462   1.223  -7.900
    6   1HG1  VAL   1          2HG1      VAL   1  -2.920   3.839  -7.587
    7   2HG1  VAL   1          1HG1      VAL   1  -2.242   2.214  -7.387
    8   3HG1  VAL   1          3HG1      VAL   1  -2.827   2.728  -8.969
    9   1HG2  VAL   1          2HG2      VAL   1  -5.535   1.840  -5.737
   10   2HG2  VAL   1          1HG2      VAL   1  -3.818   1.434  -5.624
   11   3HG2  VAL   1          3HG2      VAL   1  -4.316   3.128  -5.546
   12    H    GLY   2           H        GLY   2  -6.591   3.819  -5.990
   13   1HA   GLY   2          1HA       GLY   2  -6.445   6.731  -6.622
   14   2HA   GLY   2          2HA       GLY   2  -7.365   5.967  -5.319
   15    H    GLU   3           H        GLU   3  -6.259   5.229  -3.410
   16    HA   GLU   3           HA       GLU   3  -3.563   5.039  -2.996
   17   1HB   GLU   3          2HB       GLU   3  -3.586   7.020  -1.194
   18   2HB   GLU   3          1HB       GLU   3  -2.950   7.210  -2.825
   19   1HG   GLU   3          2HG       GLU   3  -4.864   8.424  -3.570
   20   2HG   GLU   3          1HG       GLU   3  -5.804   7.960  -2.147
   21    HE1  GLU   3           HE2      GLU   3  -2.886   9.604  -3.129
   22    H    CYS   4           H        CYS   4  -3.318   4.595  -0.542
   23    HA   CYS   4           HA       CYS   4  -5.275   2.754   0.282
   24   1HB   CYS   4          1HB       CYS   4  -3.143   4.152   1.817
   25   2HB   CYS   4          2HB       CYS   4  -4.360   3.421   2.749
   26    H    VAL   5           H        VAL   5  -6.371   2.790   2.372
   27    HA   VAL   5           HA       VAL   5  -8.475   4.895   2.188
   28    HB   VAL   5           HB       VAL   5  -8.597   2.224   3.602
   29   1HG1  VAL   5          2HG1      VAL   5 -10.707   4.259   2.690
   30   2HG1  VAL   5          1HG1      VAL   5 -11.066   2.673   3.408
   31   3HG1  VAL   5          3HG1      VAL   5 -10.284   3.926   4.374
   32   1HG2  VAL   5          3HG2      VAL   5  -9.387   3.090   0.789
   33   2HG2  VAL   5          2HG2      VAL   5  -8.212   1.834   1.227
   34   3HG2  VAL   5          1HG2      VAL   5  -9.930   1.578   1.553
   35    H    ARG   6           H        ARG   6  -6.625   6.015   3.016
   36    HA   ARG   6           HA       ARG   6  -5.505   7.278   4.570
   37   1HB   ARG   6          2HB       ARG   6  -7.699   6.653   6.542
   38   2HB   ARG   6          1HB       ARG   6  -6.494   7.936   6.625
   39   1HG   ARG   6          2HG       ARG   6  -8.781   7.666   4.646
   40   2HG   ARG   6          1HG       ARG   6  -8.534   8.885   5.900
   41   1HD   ARG   6          2HD       ARG   6  -7.989  10.087   4.022
   42   2HD   ARG   6          1HD       ARG   6  -6.383   9.534   4.531
   43    HE   ARG   6           HE       ARG   6  -7.709   7.678   2.737
   44   1HH1  ARG   6          2HH1      ARG   6  -6.067  10.841   2.536
   45   2HH1  ARG   6          1HH1      ARG   6  -5.515  10.526   0.896
   46   1HH2  ARG   6          1HH2      ARG   6  -6.749   7.283   0.663
   47   2HH2  ARG   6          2HH2      ARG   6  -6.056   8.656  -0.165
   48    H    GLY   7           H        GLY   7  -4.283   5.122   4.083
   49   1HA   GLY   7          1HA       GLY   7  -2.444   4.084   4.878
   50   2HA   GLY   7          2HA       GLY   7  -2.902   4.548   6.507
   51    H    ARG   8           H        ARG   8  -5.197   2.697   4.533
   52    HA   ARG   8           HA       ARG   8  -4.765   0.200   5.966
   53   1HB   ARG   8          2HB       ARG   8  -7.315   1.765   5.610
   54   2HB   ARG   8          1HB       ARG   8  -7.135   0.161   6.354
   55   1HG   ARG   8          2HG       ARG   8  -5.504   1.112   7.953
   56   2HG   ARG   8          1HG       ARG   8  -5.746   2.712   7.327
   57   1HD   ARG   8          2HD       ARG   8  -8.029   1.094   8.419
   58   2HD   ARG   8          1HD       ARG   8  -7.115   2.349   9.317
   59    HE   ARG   8           HE       ARG   8  -7.834   3.458   6.824
   60   1HH1  ARG   8          1HH2      ARG   8  -9.538   2.507   9.752
   61   2HH1  ARG   8          2HH2      ARG   8 -10.888   3.573   9.486
   62   1HH2  ARG   8          2HH1      ARG   8  -9.477   4.748   6.396
   63   2HH2  ARG   8          1HH1      ARG   8 -10.853   4.960   7.468
   64    H    CYS   9           H        CYS   9  -5.063  -1.447   4.384
   65    HA   CYS   9           HA       CYS   9  -7.014  -1.046   2.228
   66   1HB   CYS   9          1HB       CYS   9  -4.128  -1.681   1.803
   67   2HB   CYS   9          2HB       CYS   9  -5.274  -2.767   1.031
   68    HA   PRO  10           HA       PRO  10  -8.483  -4.962   3.506
   69   1HB   PRO  10          2HB       PRO  10  -8.359  -6.045   0.704
   70   2HB   PRO  10          1HB       PRO  10  -9.756  -5.985   1.817
   71   1HG   PRO  10          2HG       PRO  10  -9.544  -4.281  -0.245
   72   2HG   PRO  10          1HG       PRO  10 -10.106  -3.669   1.342
   73   1HD   PRO  10          2HD       PRO  10  -7.310  -3.488   0.164
   74   2HD   PRO  10          1HD       PRO  10  -8.284  -2.210   0.939
   75    H    SER  11           H        SER  11  -8.109  -7.276   3.511
   76    HA   SER  11           HA       SER  11  -6.664  -8.671   4.568
   77   1HB   SER  11          2HB       SER  11  -5.758 -10.241   2.851
   78   2HB   SER  11          1HB       SER  11  -7.303  -9.596   2.275
   79    HG   SER  11           HG       SER  11  -6.049  -7.974   1.141
   80    H    GLY  12           H        GLY  12  -5.632  -6.405   5.014
   81   1HA   GLY  12          1HA       GLY  12  -3.699  -5.244   5.644
   82   2HA   GLY  12          2HA       GLY  12  -3.023  -6.848   5.976
   83    H    MET  13           H        MET  13  -4.006  -5.398   2.818
   84    HA   MET  13           HA       MET  13  -1.417  -5.922   1.558
   85   1HB   MET  13          1HB       MET  13  -3.494  -3.857   0.829
   86   2HB   MET  13          2HB       MET  13  -2.144  -4.341  -0.173
   87   1HG   MET  13          1HG       MET  13  -3.826  -6.631   0.596
   88   2HG   MET  13          2HG       MET  13  -4.737  -5.381  -0.232
   89   1HE   MET  13          2HE       MET  13  -3.300  -4.112  -2.375
   90   2HE   MET  13          1HE       MET  13  -3.343  -5.229  -3.758
   91   3HE   MET  13          3HE       MET  13  -4.791  -5.004  -2.752
   92    H    CYS  14           H        CYS  14   0.419  -4.462   1.449
   93    HA   CYS  14           HA       CYS  14   0.454  -2.639   3.763
   94   1HB   CYS  14          1HB       CYS  14   2.589  -3.222   1.677
   95   2HB   CYS  14          2HB       CYS  14   2.738  -2.226   3.122
   96    H    CYS  15           H        CYS  15   0.287  -0.399   3.572
   97    HA   CYS  15           HA       CYS  15  -0.364   0.769   1.044
   98   1HB   CYS  15          1HB       CYS  15   0.498   2.214   3.537
   99   2HB   CYS  15          2HB       CYS  15  -0.258   2.928   2.103
  100    H    SER  16           H        SER  16   0.866   1.906  -0.328
  101    HA   SER  16           HA       SER  16   3.355   0.734  -0.845
  102   1HB   SER  16          2HB       SER  16   1.591   1.686  -2.502
  103   2HB   SER  16          1HB       SER  16   2.237   3.255  -2.091
  104    HG   SER  16           HG       SER  16   3.519   1.130  -3.437
  105    H    GLN  17           H        GLN  17   4.902   2.508  -1.961
  106    HA   GLN  17           HA       GLN  17   5.930   4.481   0.010
  107   1HB   GLN  17          2HB       GLN  17   7.890   4.649  -1.263
  108   2HB   GLN  17          1HB       GLN  17   7.559   2.938  -0.916
  109   1HG   GLN  17          2HG       GLN  17   6.464   2.774  -3.159
  110   2HG   GLN  17          1HG       GLN  17   6.978   4.459  -3.442
  111   1HE2  GLN  17          2HE2      GLN  17   9.720   1.413  -3.772
  112   2HE2  GLN  17          1HE2      GLN  17   8.098   1.053  -3.203
  113    H    PHE  18           H        PHE  18   4.135   4.058  -3.082
  114    HA   PHE  18           HA       PHE  18   4.097   6.777  -3.850
  115   1HB   PHE  18          2HB       PHE  18   2.918   4.256  -4.759
  116   2HB   PHE  18          1HB       PHE  18   3.077   5.704  -5.660
  117    HD1  PHE  18           HD1      PHE  18   5.733   6.631  -5.622
  118    HD2  PHE  18           HD2      PHE  18   4.363   2.536  -5.565
  119    HE1  PHE  18           HE1      PHE  18   7.946   5.870  -6.435
  120    HE2  PHE  18           HE2      PHE  18   6.585   1.788  -6.361
  121    HZ   PHE  18           HZ       PHE  18   8.381   3.454  -6.795
  122    H    GLY  19           H        GLY  19   2.584   5.514  -1.338
  123   1HA   GLY  19          1HA       GLY  19   0.698   5.910  -0.201
  124   2HA   GLY  19          2HA       GLY  19   0.346   7.085  -1.454
  125    H    TYR  20           H        TYR  20   0.666   4.167  -2.985
  126    HA   TYR  20           HA       TYR  20  -2.217   3.444  -3.055
  127   1HB   TYR  20          1HB       TYR  20   0.204   2.256  -4.434
  128   2HB   TYR  20          2HB       TYR  20  -1.464   2.023  -4.929
  129    HD1  TYR  20           HD1      TYR  20  -2.371   4.989  -4.764
  130    HD2  TYR  20           HD2      TYR  20   1.127   3.111  -6.429
  131    HE1  TYR  20           HE1      TYR  20  -1.883   7.041  -6.040
  132    HE2  TYR  20           HE2      TYR  20   1.544   5.134  -7.795
  133    HH   TYR  20           HH       TYR  20  -0.458   8.076  -7.509
  134    H    CYS  21           H        CYS  21  -1.744   0.578  -3.480
  135    HA   CYS  21           HA       CYS  21  -0.471  -0.272  -1.016
  136   1HB   CYS  21          1HB       CYS  21  -2.285  -0.983   0.202
  137   2HB   CYS  21          2HB       CYS  21  -2.870   0.530  -0.508
  138    H    GLY  22           H        GLY  22  -0.076  -2.514  -0.836
  139   1HA   GLY  22          1HA       GLY  22  -0.936  -4.405  -2.690
  140   2HA   GLY  22          2HA       GLY  22   0.630  -3.744  -3.216
  141    H    LYS  23           H        LYS  23  -0.348  -6.366  -1.938
  142    HA   LYS  23           HA       LYS  23   0.973  -6.470   0.661
  143   1HB   LYS  23          2HB       LYS  23  -1.145  -7.695  -0.130
  144   2HB   LYS  23          1HB       LYS  23  -0.079  -8.779  -1.026
  145   1HG   LYS  23          2HG       LYS  23   1.098  -9.183   1.254
  146   2HG   LYS  23          1HG       LYS  23  -0.268  -8.350   1.995
  147   1HD   LYS  23          2HD       LYS  23  -0.204 -10.946   0.398
  148   2HD   LYS  23          1HD       LYS  23  -0.689 -10.734   2.077
  149   1HE   LYS  23          2HE       LYS  23  -2.222  -9.918  -0.443
  150   2HE   LYS  23          1HE       LYS  23  -2.661 -11.159   0.732
  151   1HZ   LYS  23          3HZ       LYS  23  -2.961  -9.376   2.376
  152   2HZ   LYS  23          2HZ       LYS  23  -2.591  -8.259   1.256
  153   3HZ   LYS  23          1HZ       LYS  23  -3.952  -9.170   1.112
  154    H    GLY  24           H        GLY  24   3.035  -5.596  -0.552
  155   1HA   GLY  24          1HA       GLY  24   4.839  -7.778  -0.481
  156   2HA   GLY  24          2HA       GLY  24   4.614  -7.266  -2.173
  157    HA   PRO  25           HA       PRO  25   7.995  -5.085   0.525
  158   1HB   PRO  25          2HB       PRO  25   9.582  -5.981  -1.899
  159   2HB   PRO  25          1HB       PRO  25  10.148  -5.752  -0.219
  160   1HG   PRO  25          2HG       PRO  25   9.517  -8.237  -1.079
  161   2HG   PRO  25          1HG       PRO  25   8.925  -7.686   0.516
  162   1HD   PRO  25          2HD       PRO  25   7.405  -7.814  -2.094
  163   2HD   PRO  25          1HD       PRO  25   6.904  -8.279  -0.445
  164    H    LYS  26           H        LYS  26   7.607  -4.876  -3.037
  165    HA   LYS  26           HA       LYS  26   8.783  -2.393  -3.529
  166   1HB   LYS  26          2HB       LYS  26   6.338  -3.699  -4.803
  167   2HB   LYS  26          1HB       LYS  26   7.121  -2.241  -5.429
  168   1HG   LYS  26          2HG       LYS  26   9.247  -3.456  -5.730
  169   2HG   LYS  26          1HG       LYS  26   8.553  -4.908  -5.010
  170   1HD   LYS  26          2HD       LYS  26   8.587  -5.189  -7.380
  171   2HD   LYS  26          1HD       LYS  26   6.901  -5.069  -6.847
  172   1HE   LYS  26          2HE       LYS  26   6.788  -2.723  -7.628
  173   2HE   LYS  26          1HE       LYS  26   8.518  -2.740  -8.014
  174   1HZ   LYS  26          1HZ       LYS  26   6.454  -4.385  -9.329
  175   2HZ   LYS  26          3HZ       LYS  26   7.161  -3.039  -9.951
  176   3HZ   LYS  26          2HZ       LYS  26   8.060  -4.388  -9.696
  177    H    TYR  27           H        TYR  27   5.643  -3.077  -2.049
  178    HA   TYR  27           HA       TYR  27   4.874  -0.219  -2.035
  179   1HB   TYR  27          1HB       TYR  27   3.551  -2.856  -1.287
  180   2HB   TYR  27          2HB       TYR  27   2.880  -1.381  -0.858
  181    HD1  TYR  27           HD2      TYR  27   4.092  -3.331  -3.859
  182    HD2  TYR  27           HD1      TYR  27   1.346  -0.398  -2.384
  183    HE1  TYR  27           HE2      TYR  27   3.189  -3.046  -6.143
  184    HE2  TYR  27           HE1      TYR  27   0.448  -0.068  -4.695
  185    HH   TYR  27           HH       TYR  27   1.666  -1.917  -7.481
  186    H    CYS  28           H        CYS  28   5.183  -3.041   0.021
  187    HA   CYS  28           HA       CYS  28   4.697  -1.817   2.409
  188   1HB   CYS  28          1HB       CYS  28   4.942  -4.388   1.770
  189   2HB   CYS  28          2HB       CYS  28   6.559  -4.187   2.462
  190    H    GLY  29           H        GLY  29   7.885  -2.194   0.963
  191   1HA   GLY  29          1HA       GLY  29   9.936  -1.201   1.529
  192   2HA   GLY  29          2HA       GLY  29   8.853   0.173   1.705
  193    H    ARG  30           HN       ARG  30   9.514   1.209   3.439
  194    HA   ARG  30           HA       ARG  30  10.793   0.252   5.689
  195   1HB   ARG  30          1HB       ARG  30  10.405   2.247   6.805
  196   2HB   ARG  30          2HB       ARG  30  10.774   2.580   5.117
  197   1HG   ARG  30          1HG       ARG  30   8.012   2.703   6.448
  198   2HG   ARG  30          2HG       ARG  30   9.065   4.034   5.976
  199   1HD   ARG  30          1HD       ARG  30   7.747   4.077   4.252
  200   2HD   ARG  30          2HD       ARG  30   8.948   2.967   3.584
  201    HE   ARG  30           HE       ARG  30   7.183   1.203   4.656
  202   1HH1  ARG  30          1HH2      ARG  30   6.473   4.127   2.781
  203   2HH1  ARG  30          2HH2      ARG  30   4.992   3.534   2.085
  204   1HH2  ARG  30          2HH1      ARG  30   5.365   0.316   3.528
  205   2HH2  ARG  30          1HH1      ARG  30   4.309   1.262   2.559
  No match found for entry  HXTARG          30
   
  No H/Q in entry =         206
  Start of MODEL          13
 Raw file had  213 H/Q atoms
  Start of MODEL   13
    1   1H    VAL   1          1H        VAL   1  -4.480  -0.625  -3.662
    2   2H    VAL   1          2H        VAL   1  -4.879  -1.775  -4.748
    3   3H    VAL   1          3H        VAL   1  -3.287  -1.614  -4.277
    4    HA   VAL   1           HA       VAL   1  -2.991   0.358  -5.394
    5    HB   VAL   1           HB       VAL   1  -3.866   0.093  -7.668
    6   1HG1  VAL   1          1HG1      VAL   1  -1.926  -1.236  -6.928
    7   2HG1  VAL   1          3HG1      VAL   1  -3.002  -2.575  -6.474
    8   3HG1  VAL   1          2HG1      VAL   1  -2.876  -2.069  -8.168
    9   1HG2  VAL   1          1HG2      VAL   1  -6.184  -0.667  -7.126
   10   2HG2  VAL   1          3HG2      VAL   1  -5.366  -1.705  -8.301
   11   3HG2  VAL   1          2HG2      VAL   1  -5.534  -2.244  -6.625
   12    H    GLY   2           H        GLY   2  -4.348   2.039  -6.911
   13   1HA   GLY   2          1HA       GLY   2  -5.821   3.782  -6.926
   14   2HA   GLY   2          2HA       GLY   2  -6.985   2.681  -6.177
   15    H    GLU   3           H        GLU   3  -3.941   3.643  -4.658
   16    HA   GLU   3           HA       GLU   3  -3.408   4.814  -2.841
   17   1HB   GLU   3          2HB       GLU   3  -3.831   6.764  -3.413
   18   2HB   GLU   3          1HB       GLU   3  -5.491   6.487  -3.943
   19   1HG   GLU   3          2HG       GLU   3  -4.643   6.775  -1.039
   20   2HG   GLU   3          1HG       GLU   3  -5.087   8.130  -2.068
   21    HE1  GLU   3           HE2      GLU   3  -7.103   5.458  -2.806
   22    H    CYS   4           H        CYS   4  -3.402   4.482  -0.713
   23    HA   CYS   4           HA       CYS   4  -5.396   2.573   0.327
   24   1HB   CYS   4          1HB       CYS   4  -3.152   3.969   1.677
   25   2HB   CYS   4          2HB       CYS   4  -4.409   3.370   2.640
   26    H    VAL   5           H        VAL   5  -6.545   2.923   2.160
   27    HA   VAL   5           HA       VAL   5  -8.358   5.245   1.709
   28    HB   VAL   5           HB       VAL   5  -8.929   2.646   3.160
   29   1HG1  VAL   5          2HG1      VAL   5 -10.699   4.868   1.989
   30   2HG1  VAL   5          1HG1      VAL   5 -11.303   3.354   2.700
   31   3HG1  VAL   5          3HG1      VAL   5 -10.490   4.549   3.715
   32   1HG2  VAL   5          3HG2      VAL   5  -9.323   3.514   0.263
   33   2HG2  VAL   5          2HG2      VAL   5  -8.350   2.149   0.845
   34   3HG2  VAL   5          1HG2      VAL   5 -10.111   2.094   0.990
   35    H    ARG   6           H        ARG   6  -6.535   6.220   2.707
   36    HA   ARG   6           HA       ARG   6  -5.536   7.480   4.386
   37   1HB   ARG   6          2HB       ARG   6  -7.921   6.889   6.137
   38   2HB   ARG   6          1HB       ARG   6  -6.711   8.151   6.338
   39   1HG   ARG   6          2HG       ARG   6  -8.740   7.930   4.065
   40   2HG   ARG   6          1HG       ARG   6  -8.741   9.063   5.420
   41   1HD   ARG   6          2HD       ARG   6  -7.962  10.366   3.662
   42   2HD   ARG   6          1HD       ARG   6  -6.500   9.920   4.556
   43    HE   ARG   6           HE       ARG   6  -7.408   8.306   2.188
   44   1HH1  ARG   6          2HH1      ARG   6  -5.177  10.817   3.245
   45   2HH1  ARG   6          1HH1      ARG   6  -3.911  10.371   2.146
   46   1HH2  ARG   6          1HH2      ARG   6  -5.771   7.654   0.753
   47   2HH2  ARG   6          2HH2      ARG   6  -4.272   8.538   0.666
   48    H    GLY   7           H        GLY   7  -4.377   5.260   3.947
   49   1HA   GLY   7          1HA       GLY   7  -2.664   4.098   4.852
   50   2HA   GLY   7          2HA       GLY   7  -3.165   4.644   6.446
   51    H    ARG   8           H        ARG   8  -5.461   2.909   4.383
   52    HA   ARG   8           HA       ARG   8  -5.290   0.428   5.913
   53   1HB   ARG   8          2HB       ARG   8  -7.702   2.119   5.269
   54   2HB   ARG   8          1HB       ARG   8  -7.691   0.531   6.067
   55   1HG   ARG   8          2HG       ARG   8  -6.153   1.435   7.788
   56   2HG   ARG   8          1HG       ARG   8  -6.248   3.026   7.101
   57   1HD   ARG   8          2HD       ARG   8  -8.696   1.551   8.042
   58   2HD   ARG   8          1HD       ARG   8  -7.803   2.793   8.976
   59    HE   ARG   8           HE       ARG   8  -8.261   3.867   6.415
   60   1HH1  ARG   8          2HH1      ARG   8 -10.264   3.023   9.183
   61   2HH1  ARG   8          1HH1      ARG   8 -11.555   4.113   8.766
   62   1HH2  ARG   8          2HH2      ARG   8  -9.827   5.186   5.804
   63   2HH2  ARG   8          1HH2      ARG   8 -11.293   5.454   6.734
   64    H    CYS   9           H        CYS   9  -5.351  -1.229   4.378
   65    HA   CYS   9           HA       CYS   9  -7.118  -0.994   2.048
   66   1HB   CYS   9          1HB       CYS   9  -4.177  -1.609   1.914
   67   2HB   CYS   9          2HB       CYS   9  -5.247  -2.717   1.090
   68    HA   PRO  10           HA       PRO  10  -8.590  -4.888   3.431
   69   1HB   PRO  10          2HB       PRO  10  -8.100  -6.112   0.723
   70   2HB   PRO  10          1HB       PRO  10  -9.609  -6.095   1.680
   71   1HG   PRO  10          2HG       PRO  10  -9.313  -4.453  -0.437
   72   2HG   PRO  10          1HG       PRO  10 -10.031  -3.813   1.074
   73   1HD   PRO  10          2HD       PRO  10  -7.158  -3.556   0.128
   74   2HD   PRO  10          1HD       PRO  10  -8.253  -2.287   0.745
   75    H    SER  11           H        SER  11  -8.150  -7.225   3.536
   76    HA   SER  11           HA       SER  11  -6.715  -8.704   4.593
   77   1HB   SER  11          2HB       SER  11  -5.838 -10.152   2.701
   78   2HB   SER  11          1HB       SER  11  -7.491  -9.587   2.414
   79    HG   SER  11           HG       SER  11  -5.158  -8.307   1.422
   80    H    GLY  12           H        GLY  12  -5.581  -6.590   5.243
   81   1HA   GLY  12          1HA       GLY  12  -3.624  -5.589   5.981
   82   2HA   GLY  12          2HA       GLY  12  -3.023  -7.246   6.153
   83    H    MET  13           H        MET  13  -3.887  -5.317   3.239
   84    HA   MET  13           HA       MET  13  -1.378  -5.844   1.855
   85   1HB   MET  13          1HB       MET  13  -3.501  -3.785   1.496
   86   2HB   MET  13          2HB       MET  13  -2.088  -3.879   0.442
   87   1HG   MET  13          1HG       MET  13  -2.693  -6.101  -0.301
   88   2HG   MET  13          2HG       MET  13  -4.021  -6.191   0.852
   89   1HE   MET  13          2HE       MET  13  -4.680  -7.100  -1.883
   90   2HE   MET  13          1HE       MET  13  -5.958  -6.778  -0.684
   91   3HE   MET  13          3HE       MET  13  -6.113  -6.147  -2.338
   92    H    CYS  14           H        CYS  14   0.423  -4.307   1.560
   93    HA   CYS  14           HA       CYS  14   0.806  -2.511   3.909
   94   1HB   CYS  14          1HB       CYS  14   2.574  -3.159   1.518
   95   2HB   CYS  14          2HB       CYS  14   2.882  -1.875   2.676
   96    H    CYS  15           H        CYS  15   0.388  -0.353   3.706
   97    HA   CYS  15           HA       CYS  15  -0.454   0.795   1.140
   98   1HB   CYS  15          1HB       CYS  15   0.185   2.207   3.736
   99   2HB   CYS  15          2HB       CYS  15  -0.566   2.911   2.296
  100    H    SER  16           H        SER  16   1.060   1.232  -0.317
  101    HA   SER  16           HA       SER  16   3.729   0.627   0.012
  102   1HB   SER  16          2HB       SER  16   4.119   1.981  -2.110
  103   2HB   SER  16          1HB       SER  16   2.822   0.837  -2.239
  104    HG   SER  16           HG       SER  16   1.455   2.685  -1.476
  105    H    GLN  17           H        GLN  17   5.613   2.055  -0.101
  106    HA   GLN  17           HA       GLN  17   5.775   4.414   1.446
  107   1HB   GLN  17          2HB       GLN  17   7.934   4.692   0.535
  108   2HB   GLN  17          1HB       GLN  17   7.621   2.957   0.761
  109   1HG   GLN  17          2HG       GLN  17   6.671   3.169  -1.719
  110   2HG   GLN  17          1HG       GLN  17   7.700   4.615  -1.718
  111   1HE2  GLN  17          2HE2      GLN  17   9.256   0.778  -1.871
  112   2HE2  GLN  17          1HE2      GLN  17   7.570   1.050  -1.472
  113    H    PHE  18           H        PHE  18   4.521   4.016  -1.905
  114    HA   PHE  18           HA       PHE  18   4.563   6.716  -2.656
  115   1HB   PHE  18          2HB       PHE  18   3.389   4.276  -3.750
  116   2HB   PHE  18          1HB       PHE  18   3.860   5.699  -4.583
  117    HD1  PHE  18           HD2      PHE  18   6.543   6.329  -4.076
  118    HD2  PHE  18           HD1      PHE  18   4.745   2.418  -4.400
  119    HE1  PHE  18           HE2      PHE  18   8.753   5.347  -4.624
  120    HE2  PHE  18           HE1      PHE  18   6.970   1.434  -4.848
  121    HZ   PHE  18           HZ       PHE  18   8.975   2.894  -4.980
  122    H    GLY  19           H        GLY  19   2.497   5.100  -0.487
  123   1HA   GLY  19          1HA       GLY  19   0.483   5.592   0.289
  124   2HA   GLY  19          2HA       GLY  19   0.452   6.910  -0.861
  125    H    TYR  20           H        TYR  20   0.932   4.085  -2.600
  126    HA   TYR  20           HA       TYR  20  -1.955   3.448  -3.100
  127   1HB   TYR  20          1HB       TYR  20   0.611   2.520  -4.453
  128   2HB   TYR  20          2HB       TYR  20  -0.985   1.988  -4.907
  129    HD1  TYR  20           HD1      TYR  20   1.278   4.935  -4.895
  130    HD2  TYR  20           HD2      TYR  20  -2.485   3.329  -6.239
  131    HE1  TYR  20           HE1      TYR  20   0.909   6.953  -6.281
  132    HE2  TYR  20           HE2      TYR  20  -2.857   5.348  -7.618
  133    HH   TYR  20           HH       TYR  20  -2.016   7.396  -8.288
  134    H    CYS  21           H        CYS  21  -1.489   0.615  -3.555
  135    HA   CYS  21           HA       CYS  21  -0.337  -0.326  -1.077
  136   1HB   CYS  21          1HB       CYS  21  -2.163  -0.692   0.222
  137   2HB   CYS  21          2HB       CYS  21  -2.810   0.678  -0.698
  138    H    GLY  22           H        GLY  22  -0.106  -2.536  -0.850
  139   1HA   GLY  22          1HA       GLY  22  -1.282  -4.502  -2.361
  140   2HA   GLY  22          2HA       GLY  22   0.201  -4.020  -3.231
  141    H    LYS  23           H        LYS  23  -0.430  -6.474  -1.674
  142    HA   LYS  23           HA       LYS  23   0.993  -6.263   0.863
  143   1HB   LYS  23          2HB       LYS  23  -1.111  -7.651   0.326
  144   2HB   LYS  23          1HB       LYS  23  -0.040  -8.793  -0.483
  145   1HG   LYS  23          2HG       LYS  23   1.226  -9.027   1.696
  146   2HG   LYS  23          1HG       LYS  23   0.071  -7.896   2.432
  147   1HD   LYS  23          2HD       LYS  23  -1.789  -9.539   1.654
  148   2HD   LYS  23          1HD       LYS  23  -0.481 -10.643   1.217
  149   1HE   LYS  23          2HE       LYS  23  -1.216 -11.325   3.375
  150   2HE   LYS  23          1HE       LYS  23   0.332 -10.507   3.634
  151   1HZ   LYS  23          3HZ       LYS  23  -2.352  -9.324   4.018
  152   2HZ   LYS  23          2HZ       LYS  23  -1.342  -9.811   5.224
  153   3HZ   LYS  23          1HZ       LYS  23  -0.959  -8.521   4.276
  154    H    GLY  24           H        GLY  24   2.984  -5.451  -0.490
  155   1HA   GLY  24          1HA       GLY  24   4.847  -7.500  -0.078
  156   2HA   GLY  24          2HA       GLY  24   4.604  -7.362  -1.838
  157    HA   PRO  25           HA       PRO  25   8.049  -4.581   0.080
  158   1HB   PRO  25          2HB       PRO  25   9.454  -6.080  -2.147
  159   2HB   PRO  25          1HB       PRO  25  10.143  -5.439  -0.627
  160   1HG   PRO  25          2HG       PRO  25   9.489  -8.058  -0.787
  161   2HG   PRO  25          1HG       PRO  25   9.010  -7.122   0.661
  162   1HD   PRO  25          2HD       PRO  25   7.300  -7.885  -1.715
  163   2HD   PRO  25          1HD       PRO  25   6.933  -7.933   0.033
  164    H    LYS  26           H        LYS  26   7.184  -5.307  -3.322
  165    HA   LYS  26           HA       LYS  26   8.304  -3.078  -4.595
  166   1HB   LYS  26          2HB       LYS  26   5.695  -4.544  -5.177
  167   2HB   LYS  26          1HB       LYS  26   6.439  -3.340  -6.242
  168   1HG   LYS  26          2HG       LYS  26   8.498  -4.743  -6.404
  169   2HG   LYS  26          1HG       LYS  26   7.777  -5.930  -5.331
  170   1HD   LYS  26          2HD       LYS  26   7.579  -6.687  -7.636
  171   2HD   LYS  26          1HD       LYS  26   6.002  -6.446  -6.895
  172   1HE   LYS  26          2HE       LYS  26   6.065  -5.666  -9.239
  173   2HE   LYS  26          1HE       LYS  26   5.637  -4.373  -8.121
  174   1HZ   LYS  26          3HZ       LYS  26   8.316  -4.800  -9.289
  175   2HZ   LYS  26          2HZ       LYS  26   7.228  -3.663  -9.765
  176   3HZ   LYS  26          1HZ       LYS  26   7.896  -3.575  -8.268
  177    H    TYR  27           H        TYR  27   5.405  -3.231  -2.544
  178    HA   TYR  27           HA       TYR  27   4.779  -0.376  -3.045
  179   1HB   TYR  27          1HB       TYR  27   3.459  -2.657  -1.504
  180   2HB   TYR  27          2HB       TYR  27   2.928  -1.082  -1.394
  181    HD1  TYR  27           HD2      TYR  27   3.480  -3.864  -3.834
  182    HD2  TYR  27           HD1      TYR  27   1.288  -0.227  -3.077
  183    HE1  TYR  27           HE2      TYR  27   2.285  -4.108  -5.983
  184    HE2  TYR  27           HE1      TYR  27   0.224  -0.399  -5.277
  185    HH   TYR  27           HH       TYR  27   0.772  -3.166  -7.458
  186    H    CYS  28           H        CYS  28   5.190  -2.708  -0.466
  187    HA   CYS  28           HA       CYS  28   5.152  -0.990   1.670
  188   1HB   CYS  28          1HB       CYS  28   5.034  -3.638   1.420
  189   2HB   CYS  28          2HB       CYS  28   6.726  -3.560   1.898
  190    H    GLY  29           H        GLY  29   8.022  -2.151  -0.026
  191   1HA   GLY  29          1HA       GLY  29  10.294  -1.627   0.197
  192   2HA   GLY  29          2HA       GLY  29   9.605  -0.024   0.287
  193    H    ARG  30           HN       ARG  30  10.323   1.034   1.857
  194    HA   ARG  30           HA       ARG  30  12.000   0.069   3.989
  195   1HB   ARG  30          1HB       ARG  30  10.847   2.819   3.496
  196   2HB   ARG  30          2HB       ARG  30  12.165   2.417   4.611
  197   1HG   ARG  30          1HG       ARG  30  13.537   1.561   2.733
  198   2HG   ARG  30          2HG       ARG  30  12.238   1.914   1.594
  199   1HD   ARG  30          1HD       ARG  30  12.395   4.369   2.586
  200   2HD   ARG  30          2HD       ARG  30  13.937   3.807   3.215
  201    HE   ARG  30           HE       ARG  30  14.861   4.011   1.162
  202   1HH1  ARG  30          2HH2      ARG  30  11.421   3.885   0.894
  203   2HH1  ARG  30          1HH2      ARG  30  11.237   3.822  -0.822
  204   1HH2  ARG  30          1HH1      ARG  30  14.826   4.168  -1.307
  205   2HH2  ARG  30          2HH1      ARG  30  13.304   4.224  -2.088
  No match found for entry  HXTARG          30
   
  No H/Q in entry =         206
  Start of MODEL          14
 Raw file had  213 H/Q atoms
  Start of MODEL   14
    1   1H    VAL   1          1H        VAL   1  -4.709   0.227  -7.735
    2   2H    VAL   1          2H        VAL   1  -5.001  -1.398  -7.447
    3   3H    VAL   1          3H        VAL   1  -6.017  -0.484  -8.396
    4    HA   VAL   1           HA       VAL   1  -7.157  -0.490  -6.419
    5    HB   VAL   1           HB       VAL   1  -6.050  -0.019  -4.262
    6   1HG1  VAL   1          3HG1      VAL   1  -6.387  -2.369  -5.009
    7   2HG1  VAL   1          2HG1      VAL   1  -4.734  -2.387  -5.665
    8   3HG1  VAL   1          1HG1      VAL   1  -4.997  -2.173  -3.931
    9   1HG2  VAL   1          2HG2      VAL   1  -4.087   1.270  -5.023
   10   2HG2  VAL   1          1HG2      VAL   1  -3.613  -0.115  -4.045
   11   3HG2  VAL   1          3HG2      VAL   1  -3.411  -0.183  -5.798
   12    H    GLY   2           H        GLY   2  -7.860   1.569  -5.191
   13   1HA   GLY   2          1HA       GLY   2  -7.545   3.877  -6.876
   14   2HA   GLY   2          2HA       GLY   2  -8.342   3.813  -5.295
   15    H    GLU   3           H        GLU   3  -6.689   3.447  -3.373
   16    HA   GLU   3           HA       GLU   3  -4.024   4.182  -3.473
   17   1HB   GLU   3          2HB       GLU   3  -4.306   6.391  -2.220
   18   2HB   GLU   3          1HB       GLU   3  -4.537   6.455  -3.966
   19   1HG   GLU   3          2HG       GLU   3  -6.922   6.583  -3.758
   20   2HG   GLU   3          1HG       GLU   3  -6.867   6.141  -2.038
   21    HE2  GLU   3           HE2      GLU   3  -6.265   9.941  -3.155
   22    H    CYS   4           H        CYS   4  -3.392   4.448  -1.040
   23    HA   CYS   4           HA       CYS   4  -4.861   2.584   0.608
   24   1HB   CYS   4          1HB       CYS   4  -3.288   4.739   1.934
   25   2HB   CYS   4          2HB       CYS   4  -3.429   3.053   2.363
   26    H    VAL   5           H        VAL   5  -6.183   2.918   2.335
   27    HA   VAL   5           HA       VAL   5  -7.819   5.389   2.272
   28    HB   VAL   5           HB       VAL   5  -8.309   2.806   3.781
   29   1HG1  VAL   5          1HG1      VAL   5 -10.049   5.224   3.092
   30   2HG1  VAL   5          3HG1      VAL   5 -10.610   3.746   3.906
   31   3HG1  VAL   5          2HG1      VAL   5  -9.454   4.817   4.712
   32   1HG2  VAL   5          1HG2      VAL   5  -9.245   3.802   1.059
   33   2HG2  VAL   5          3HG2      VAL   5  -8.284   2.348   1.386
   34   3HG2  VAL   5          2HG2      VAL   5  -9.963   2.426   1.928
   35    H    ARG   6           H        ARG   6  -5.877   6.342   2.824
   36    HA   ARG   6           HA       ARG   6  -4.268   7.318   4.171
   37   1HB   ARG   6          2HB       ARG   6  -6.518   7.335   6.193
   38   2HB   ARG   6          1HB       ARG   6  -5.091   8.376   6.222
   39   1HG   ARG   6          2HG       ARG   6  -7.182   8.356   3.987
   40   2HG   ARG   6          1HG       ARG   6  -7.207   9.413   5.389
   41   1HD   ARG   6          2HD       ARG   6  -6.315  10.720   3.606
   42   2HD   ARG   6          1HD       ARG   6  -5.033  10.398   4.760
   43    HE   ARG   6           HE       ARG   6  -3.833   9.364   3.136
   44   1HH1  ARG   6          2HH1      ARG   6  -7.211   9.426   2.020
   45   2HH1  ARG   6          1HH1      ARG   6  -6.792   8.791   0.434
   46   1HH2  ARG   6          1HH2      ARG   6  -3.377   8.425   1.025
   47   2HH2  ARG   6          2HH2      ARG   6  -4.724   8.202  -0.069
   48    H    GLY   7           H        GLY   7  -3.669   4.855   3.914
   49   1HA   GLY   7          1HA       GLY   7  -1.994   3.577   4.722
   50   2HA   GLY   7          2HA       GLY   7  -2.248   4.240   6.328
   51    H    ARG   8           H        ARG   8  -4.881   2.748   4.428
   52    HA   ARG   8           HA       ARG   8  -4.827   0.259   5.954
   53   1HB   ARG   8          2HB       ARG   8  -7.243   2.007   5.507
   54   2HB   ARG   8          1HB       ARG   8  -7.174   0.434   6.331
   55   1HG   ARG   8          2HG       ARG   8  -5.492   1.428   7.895
   56   2HG   ARG   8          1HG       ARG   8  -5.681   2.948   7.092
   57   1HD   ARG   8          2HD       ARG   8  -8.202   2.843   7.569
   58   2HD   ARG   8          1HD       ARG   8  -7.844   1.454   8.606
   59    HE   ARG   8           HE       ARG   8  -7.207   2.908  10.251
   60   1HH1  ARG   8          1HH2      ARG   8  -6.944   4.653   7.148
   61   2HH1  ARG   8          2HH2      ARG   8  -5.839   5.805   7.787
   62   1HH2  ARG   8          2HH1      ARG   8  -6.174   4.778  11.163
   63   2HH2  ARG   8          1HH1      ARG   8  -5.779   6.130  10.150
   64    H    CYS   9           H        CYS   9  -5.036  -1.369   4.346
   65    HA   CYS   9           HA       CYS   9  -6.950  -0.925   2.191
   66   1HB   CYS   9          1HB       CYS   9  -4.046  -1.574   1.818
   67   2HB   CYS   9          2HB       CYS   9  -5.196  -2.533   0.906
   68    HA   PRO  10           HA       PRO  10  -8.516  -4.720   3.472
   69   1HB   PRO  10          2HB       PRO  10  -8.463  -5.866   0.692
   70   2HB   PRO  10          1HB       PRO  10  -9.856  -5.685   1.796
   71   1HG   PRO  10          2HG       PRO  10  -9.533  -4.030  -0.311
   72   2HG   PRO  10          1HG       PRO  10 -10.040  -3.358   1.270
   73   1HD   PRO  10          2HD       PRO  10  -7.239  -3.425   0.094
   74   2HD   PRO  10          1HD       PRO  10  -8.121  -2.051   0.813
   75    H    SER  11           H        SER  11  -8.331  -7.123   3.408
   76    HA   SER  11           HA       SER  11  -6.999  -8.866   4.087
   77   1HB   SER  11          2HB       SER  11  -6.300 -10.029   1.919
   78   2HB   SER  11          1HB       SER  11  -7.912  -9.302   1.808
   79    HG   SER  11           HG       SER  11  -5.982  -7.504   1.143
   80    H    GLY  12           H        GLY  12  -5.677  -6.924   4.954
   81   1HA   GLY  12          1HA       GLY  12  -3.599  -6.194   5.727
   82   2HA   GLY  12          2HA       GLY  12  -3.128  -7.897   5.599
   83    H    MET  13           H        MET  13  -3.991  -5.509   3.048
   84    HA   MET  13           HA       MET  13  -1.491  -5.910   1.540
   85   1HB   MET  13          1HB       MET  13  -3.745  -3.950   1.431
   86   2HB   MET  13          2HB       MET  13  -2.325  -3.791   0.387
   87   1HG   MET  13          1HG       MET  13  -2.759  -6.015  -0.575
   88   2HG   MET  13          2HG       MET  13  -4.157  -6.221   0.471
   89   1HE   MET  13          2HE       MET  13  -4.527  -6.817  -2.453
   90   2HE   MET  13          1HE       MET  13  -5.918  -6.710  -1.343
   91   3HE   MET  13          3HE       MET  13  -5.960  -5.865  -2.907
   92    H    CYS  14           H        CYS  14   0.283  -4.392   1.415
   93    HA   CYS  14           HA       CYS  14   0.669  -2.758   3.871
   94   1HB   CYS  14          1HB       CYS  14   2.438  -3.388   1.478
   95   2HB   CYS  14          2HB       CYS  14   2.813  -2.165   2.680
   96    H    CYS  15           H        CYS  15   0.442  -0.547   3.776
   97    HA   CYS  15           HA       CYS  15  -0.507   0.730   1.301
   98   1HB   CYS  15          1HB       CYS  15  -1.330   1.595   3.423
   99   2HB   CYS  15          2HB       CYS  15   0.326   1.868   3.998
  100    H    SER  16           H        SER  16   0.798   1.910  -0.050
  101    HA   SER  16           HA       SER  16   3.459   1.005  -0.306
  102   1HB   SER  16          2HB       SER  16   1.934   1.732  -2.207
  103   2HB   SER  16          1HB       SER  16   2.106   3.378  -1.657
  104    HG   SER  16           HG       SER  16   4.069   1.641  -2.758
  105    H    GLN  17           H        GLN  17   4.838   3.154  -1.125
  106    HA   GLN  17           HA       GLN  17   5.005   5.304   0.936
  107   1HB   GLN  17          2HB       GLN  17   7.233   5.664   0.410
  108   2HB   GLN  17          1HB       GLN  17   7.001   3.917   0.658
  109   1HG   GLN  17          2HG       GLN  17   6.658   3.781  -1.874
  110   2HG   GLN  17          1HG       GLN  17   7.252   5.462  -1.906
  111   1HE2  GLN  17          2HE2      GLN  17   9.873   2.397  -0.882
  112   2HE2  GLN  17          1HE2      GLN  17   8.182   2.273  -0.398
  113    H    PHE  18           H        PHE  18   4.243   4.401  -2.470
  114    HA   PHE  18           HA       PHE  18   4.159   7.014  -3.514
  115   1HB   PHE  18          2HB       PHE  18   3.347   4.368  -4.453
  116   2HB   PHE  18          1HB       PHE  18   3.778   5.741  -5.383
  117    HD1  PHE  18           HD1      PHE  18   6.316   6.715  -4.586
  118    HD2  PHE  18           HD2      PHE  18   4.967   2.620  -4.781
  119    HE1  PHE  18           HE1      PHE  18   8.667   5.931  -4.642
  120    HE2  PHE  18           HE2      PHE  18   7.313   1.844  -4.731
  121    HZ   PHE  18           HZ       PHE  18   9.172   3.502  -4.687
  122    H    GLY  19           H        GLY  19   2.142   5.698  -1.329
  123   1HA   GLY  19          1HA       GLY  19   0.076   6.184  -0.679
  124   2HA   GLY  19          2HA       GLY  19  -0.035   7.170  -2.123
  125    H    TYR  20           H        TYR  20   0.667   4.166  -3.267
  126    HA   TYR  20           HA       TYR  20  -2.162   3.203  -3.444
  127   1HB   TYR  20          1HB       TYR  20   0.329   2.233  -4.875
  128   2HB   TYR  20          2HB       TYR  20  -1.285   1.647  -5.179
  129    HD1  TYR  20           HD1      TYR  20  -3.078   3.238  -6.093
  130    HD2  TYR  20           HD2      TYR  20   1.084   4.349  -5.839
  131    HE1  TYR  20           HE1      TYR  20  -3.538   5.307  -7.379
  132    HE2  TYR  20           HE2      TYR  20   0.594   6.454  -7.025
  133    HH   TYR  20           HH       TYR  20  -1.036   7.781  -7.966
  134    H    CYS  21           H        CYS  21  -1.655   0.403  -3.595
  135    HA   CYS  21           HA       CYS  21  -0.320  -0.287  -1.101
  136   1HB   CYS  21          1HB       CYS  21  -2.184  -0.853   0.196
  137   2HB   CYS  21          2HB       CYS  21  -2.541   0.768  -0.395
  138    H    GLY  22           H        GLY  22  -0.321  -2.624  -0.723
  139   1HA   GLY  22          1HA       GLY  22  -1.557  -4.560  -2.207
  140   2HA   GLY  22          2HA       GLY  22  -0.086  -4.118  -3.113
  141    H    LYS  23           H        LYS  23  -0.582  -6.574  -1.650
  142    HA   LYS  23           HA       LYS  23   0.991  -6.457   0.830
  143   1HB   LYS  23          2HB       LYS  23  -0.973  -7.954   0.551
  144   2HB   LYS  23          1HB       LYS  23  -0.083  -8.869  -0.673
  145   1HG   LYS  23          2HG       LYS  23   1.735  -9.236   1.120
  146   2HG   LYS  23          1HG       LYS  23   0.617  -8.548   2.290
  147   1HD   LYS  23          2HD       LYS  23   0.216 -11.012   0.508
  148   2HD   LYS  23          1HD       LYS  23   0.599 -11.053   2.227
  149   1HE   LYS  23          2HE       LYS  23  -1.986  -9.986   0.971
  150   2HE   LYS  23          1HE       LYS  23  -1.793 -11.522   1.814
  151   1HZ   LYS  23          3HZ       LYS  23  -1.407  -8.872   3.065
  152   2HZ   LYS  23          2HZ       LYS  23  -2.748  -9.780   3.173
  153   3HZ   LYS  23          1HZ       LYS  23  -1.337 -10.327   3.833
  154    H    GLY  24           H        GLY  24   2.984  -5.488  -0.374
  155   1HA   GLY  24          1HA       GLY  24   4.784  -7.631  -0.543
  156   2HA   GLY  24          2HA       GLY  24   4.501  -7.039  -2.198
  157    HA   PRO  25           HA       PRO  25   7.978  -4.879   0.391
  158   1HB   PRO  25          2HB       PRO  25   9.439  -5.762  -2.112
  159   2HB   PRO  25          1HB       PRO  25  10.086  -5.548  -0.459
  160   1HG   PRO  25          2HG       PRO  25   9.433  -8.027  -1.318
  161   2HG   PRO  25          1HG       PRO  25   8.914  -7.501   0.311
  162   1HD   PRO  25          2HD       PRO  25   7.273  -7.586  -2.230
  163   2HD   PRO  25          1HD       PRO  25   6.852  -8.107  -0.576
  164    H    LYS  26           H        LYS  26   7.288  -4.755  -3.109
  165    HA   LYS  26           HA       LYS  26   8.331  -2.250  -3.786
  166   1HB   LYS  26          2HB       LYS  26   5.808  -3.656  -4.766
  167   2HB   LYS  26          1HB       LYS  26   6.521  -2.216  -5.516
  168   1HG   LYS  26          2HG       LYS  26   8.597  -3.418  -6.007
  169   2HG   LYS  26          1HG       LYS  26   8.019  -4.851  -5.156
  170   1HD   LYS  26          2HD       LYS  26   7.789  -5.208  -7.516
  171   2HD   LYS  26          1HD       LYS  26   6.181  -5.128  -6.776
  172   1HE   LYS  26          2HE       LYS  26   5.880  -2.813  -7.597
  173   2HE   LYS  26          1HE       LYS  26   7.544  -2.785  -8.208
  174   1HZ   LYS  26          2HZ       LYS  26   5.379  -4.533  -9.185
  175   2HZ   LYS  26          1HZ       LYS  26   5.953  -3.190  -9.936
  176   3HZ   LYS  26          3HZ       LYS  26   6.921  -4.506  -9.767
  177    H    TYR  27           H        TYR  27   5.383  -3.004  -1.927
  178    HA   TYR  27           HA       TYR  27   4.578  -0.175  -1.877
  179   1HB   TYR  27          1HB       TYR  27   3.386  -2.679  -0.674
  180   2HB   TYR  27          2HB       TYR  27   2.751  -1.159  -0.558
  181    HD1  TYR  27           HD2      TYR  27   3.456  -3.991  -2.870
  182    HD2  TYR  27           HD1      TYR  27   1.467  -0.219  -2.482
  183    HE1  TYR  27           HE2      TYR  27   2.456  -4.274  -5.125
  184    HE2  TYR  27           HE1      TYR  27   0.569  -0.422  -4.779
  185    HH   TYR  27           HH       TYR  27   0.341  -1.809  -6.604
  186    H    CYS  28           H        CYS  28   5.085  -2.888   0.308
  187    HA   CYS  28           HA       CYS  28   4.997  -1.587   2.699
  188   1HB   CYS  28          1HB       CYS  28   6.979  -3.842   2.288
  189   2HB   CYS  28          2HB       CYS  28   6.153  -3.414   3.780
  190    H    GLY  29           H        GLY  29   7.929  -1.862   0.728
  191   1HA   GLY  29          1HA       GLY  29   9.852  -0.740   2.316
  192   2HA   GLY  29          2HA       GLY  29   9.708  -0.454   0.576
  193    H    ARG  30           HN       ARG  30  10.439   1.464   2.826
  194    HA   ARG  30           HA       ARG  30   8.215   3.458   2.663
  195   1HB   ARG  30          1HB       ARG  30  10.707   3.397   4.393
  196   2HB   ARG  30          2HB       ARG  30   9.439   4.624   4.425
  197   1HG   ARG  30          1HG       ARG  30   9.110   1.683   5.205
  198   2HG   ARG  30          2HG       ARG  30   9.200   3.081   6.272
  199   1HD   ARG  30          1HD       ARG  30   6.918   2.675   6.197
  200   2HD   ARG  30          2HD       ARG  30   7.141   4.002   5.043
  201    HE   ARG  30           HE       ARG  30   7.114   1.152   4.067
  202   1HH1  ARG  30          2HH2      ARG  30   5.078   4.026   4.577
  203   2HH1  ARG  30          1HH2      ARG  30   4.085   3.681   3.162
  204   1HH2  ARG  30          1HH1      ARG  30   5.906   1.165   1.876
  205   2HH2  ARG  30          2HH1      ARG  30   4.239   1.387   2.332
  No match found for entry  HXTARG          30
   
  No H/Q in entry =         206
  Start of MODEL          15
 Raw file had  213 H/Q atoms
  Start of MODEL   15
    1   1H    VAL   1          1H        VAL   1  -5.474   1.626  -2.885
    2   2H    VAL   1          2H        VAL   1  -6.678   0.699  -3.448
    3   3H    VAL   1          3H        VAL   1  -5.218  -0.011  -3.054
    4    HA   VAL   1           HA       VAL   1  -4.174   1.126  -4.861
    5    HB   VAL   1           HB       VAL   1  -6.701  -0.011  -5.921
    6   1HG1  VAL   1          1HG1      VAL   1  -3.878   0.085  -7.057
    7   2HG1  VAL   1          3HG1      VAL   1  -5.253  -0.744  -7.812
    8   3HG1  VAL   1          2HG1      VAL   1  -5.280   1.011  -7.640
    9   1HG2  VAL   1          2HG2      VAL   1  -4.205  -1.512  -5.015
   10   2HG2  VAL   1          1HG2      VAL   1  -5.833  -1.670  -4.314
   11   3HG2  VAL   1          3HG2      VAL   1  -5.523  -2.230  -5.956
   12    H    GLY   2           H        GLY   2  -4.237   2.905  -6.346
   13   1HA   GLY   2          1HA       GLY   2  -5.102   4.890  -7.301
   14   2HA   GLY   2          2HA       GLY   2  -6.594   4.720  -6.360
   15    H    GLU   3           H        GLU   3  -5.555   4.110  -3.901
   16    HA   GLU   3           HA       GLU   3  -3.341   5.542  -2.930
   17   1HB   GLU   3          2HB       GLU   3  -4.577   6.919  -1.303
   18   2HB   GLU   3          1HB       GLU   3  -4.613   7.496  -2.975
   19   1HG   GLU   3          2HG       GLU   3  -6.902   6.634  -3.275
   20   2HG   GLU   3          1HG       GLU   3  -6.893   5.951  -1.645
   21    HE2  GLU   3           HE2      GLU   3  -7.776   9.786  -2.221
   22    H    CYS   4           H        CYS   4  -3.371   4.952  -0.464
   23    HA   CYS   4           HA       CYS   4  -4.788   2.397   0.102
   24   1HB   CYS   4          1HB       CYS   4  -2.859   3.952   1.618
   25   2HB   CYS   4          2HB       CYS   4  -4.191   3.582   2.612
   26    H    VAL   5           H        VAL   5  -6.012   2.408   2.161
   27    HA   VAL   5           HA       VAL   5  -8.367   4.235   1.802
   28    HB   VAL   5           HB       VAL   5  -8.244   1.542   3.190
   29   1HG1  VAL   5          2HG1      VAL   5 -10.546   3.437   2.508
   30   2HG1  VAL   5          1HG1      VAL   5 -10.725   1.807   3.193
   31   3HG1  VAL   5          3HG1      VAL   5  -9.949   3.083   4.141
   32   1HG2  VAL   5          2HG2      VAL   5  -9.322   2.398   0.470
   33   2HG2  VAL   5          1HG2      VAL   5  -7.978   1.278   0.768
   34   3HG2  VAL   5          3HG2      VAL   5  -9.621   0.818   1.230
   35    H    ARG   6           H        ARG   6  -7.144   5.831   2.706
   36    HA   ARG   6           HA       ARG   6  -6.323   7.224   4.385
   37   1HB   ARG   6          2HB       ARG   6  -8.289   5.678   6.104
   38   2HB   ARG   6          1HB       ARG   6  -7.527   7.201   6.545
   39   1HG   ARG   6          2HG       ARG   6  -9.398   6.828   4.149
   40   2HG   ARG   6          1HG       ARG   6  -9.847   7.417   5.747
   41   1HD   ARG   6          2HD       ARG   6  -9.616   9.387   4.580
   42   2HD   ARG   6          1HD       ARG   6  -8.074   9.249   5.448
   43    HE   ARG   6           HE       ARG   6  -8.042   8.099   2.755
   44   1HH1  ARG   6          1HH2      ARG   6  -7.805  11.147   4.504
   45   2HH1  ARG   6          2HH2      ARG   6  -6.887  11.969   3.283
   46   1HH2  ARG   6          2HH1      ARG   6  -6.881   9.182   1.052
   47   2HH2  ARG   6          1HH1      ARG   6  -6.320  10.800   1.299
   48    H    GLY   7           H        GLY   7  -4.550   5.399   3.778
   49   1HA   GLY   7          1HA       GLY   7  -2.562   4.575   4.509
   50   2HA   GLY   7          2HA       GLY   7  -2.918   5.294   6.078
   51    H    ARG   8           H        ARG   8  -5.094   2.815   4.666
   52    HA   ARG   8           HA       ARG   8  -3.925   0.618   6.078
   53   1HB   ARG   8          2HB       ARG   8  -6.831   1.442   6.406
   54   2HB   ARG   8          1HB       ARG   8  -6.062  -0.052   7.001
   55   1HG   ARG   8          2HG       ARG   8  -4.343   1.474   8.101
   56   2HG   ARG   8          1HG       ARG   8  -5.389   2.799   7.708
   57   1HD   ARG   8          2HD       ARG   8  -7.267   1.701   8.969
   58   2HD   ARG   8          1HD       ARG   8  -6.157   0.446   9.520
   59    HE   ARG   8           HE       ARG   8  -6.480   3.148  10.516
   60   1HH1  ARG   8          1HH2      ARG   8  -4.038   0.665  10.058
   61   2HH1  ARG   8          2HH2      ARG   8  -2.988   1.202  11.335
   62   1HH2  ARG   8          2HH1      ARG   8  -5.121   3.924  12.220
   63   2HH2  ARG   8          1HH1      ARG   8  -3.633   3.118  12.592
   64    H    CYS   9           H        CYS   9  -4.686  -1.311   4.844
   65    HA   CYS   9           HA       CYS   9  -6.749  -0.921   2.798
   66   1HB   CYS   9          1HB       CYS   9  -3.936  -1.493   2.137
   67   2HB   CYS   9          2HB       CYS   9  -5.014  -2.735   1.599
   68    HA   PRO  10           HA       PRO  10  -8.098  -4.770   4.380
   69   1HB   PRO  10          2HB       PRO  10  -9.432  -5.963   2.344
   70   2HB   PRO  10          1HB       PRO  10  -9.944  -4.390   3.014
   71   1HG   PRO  10          2HG       PRO  10  -8.356  -4.916   0.505
   72   2HG   PRO  10          1HG       PRO  10  -9.712  -3.779   0.742
   73   1HD   PRO  10          2HD       PRO  10  -7.002  -3.163   0.831
   74   2HD   PRO  10          1HD       PRO  10  -8.222  -2.138   1.614
   75    H    SER  11           H        SER  11  -8.080  -7.174   3.980
   76    HA   SER  11           HA       SER  11  -6.666  -8.845   4.394
   77   1HB   SER  11          2HB       SER  11  -6.039  -9.969   2.239
   78   2HB   SER  11          1HB       SER  11  -7.627  -9.184   2.091
   79    HG   SER  11           HG       SER  11  -6.036  -7.309   1.389
   80    H    GLY  12           H        GLY  12  -5.544  -6.691   5.107
   81   1HA   GLY  12          1HA       GLY  12  -3.592  -5.584   5.706
   82   2HA   GLY  12          2HA       GLY  12  -2.917  -7.214   5.879
   83    H    MET  13           H        MET  13  -4.025  -5.396   2.956
   84    HA   MET  13           HA       MET  13  -1.420  -5.855   1.634
   85   1HB   MET  13          1HB       MET  13  -3.610  -3.991   0.703
   86   2HB   MET  13          2HB       MET  13  -2.185  -4.513  -0.167
   87   1HG   MET  13          1HG       MET  13  -3.382  -6.935   0.543
   88   2HG   MET  13          2HG       MET  13  -4.753  -5.881   0.201
   89   1HE   MET  13          3HE       MET  13  -5.335  -7.824  -1.577
   90   2HE   MET  13          2HE       MET  13  -4.275  -8.220  -2.950
   91   3HE   MET  13          1HE       MET  13  -3.776  -8.638  -1.294
   92    H    CYS  14           H        CYS  14   0.224  -4.331   1.288
   93    HA   CYS  14           HA       CYS  14   0.503  -2.544   3.605
   94   1HB   CYS  14          1HB       CYS  14   2.335  -3.307   1.293
   95   2HB   CYS  14          2HB       CYS  14   2.730  -2.123   2.532
   96    H    CYS  15           H        CYS  15   0.451  -0.292   3.467
   97    HA   CYS  15           HA       CYS  15  -0.465   0.939   1.038
   98   1HB   CYS  15          1HB       CYS  15   0.693   2.315   3.458
   99   2HB   CYS  15          2HB       CYS  15  -0.196   3.068   2.125
  100    H    SER  16           H        SER  16   0.686   1.748  -0.588
  101    HA   SER  16           HA       SER  16   3.201   0.634  -0.982
  102   1HB   SER  16          2HB       SER  16   1.503   1.497  -2.785
  103   2HB   SER  16          1HB       SER  16   2.249   3.065  -2.520
  104    HG   SER  16           HG       SER  16   3.472   0.733  -3.517
  105    H    GLN  17           H        GLN  17   5.163   2.047  -1.783
  106    HA   GLN  17           HA       GLN  17   5.990   4.017   0.177
  107   1HB   GLN  17          2HB       GLN  17   7.945   4.327  -1.068
  108   2HB   GLN  17          1HB       GLN  17   7.589   2.591  -0.954
  109   1HG   GLN  17          2HG       GLN  17   6.475   2.766  -3.196
  110   2HG   GLN  17          1HG       GLN  17   7.030   4.460  -3.248
  111   1HE2  GLN  17          2HE2      GLN  17   9.787   1.418  -3.762
  112   2HE2  GLN  17          1HE2      GLN  17   8.224   1.044  -3.044
  113    H    PHE  18           H        PHE  18   4.238   4.099  -2.962
  114    HA   PHE  18           HA       PHE  18   4.248   6.883  -3.326
  115   1HB   PHE  18          2HB       PHE  18   2.857   4.611  -4.542
  116   2HB   PHE  18          1HB       PHE  18   3.176   6.145  -5.235
  117    HD1  PHE  18           HD1      PHE  18   5.868   6.806  -5.181
  118    HD2  PHE  18           HD2      PHE  18   4.161   2.853  -5.511
  119    HE1  PHE  18           HE1      PHE  18   7.990   5.959  -6.143
  120    HE2  PHE  18           HE2      PHE  18   6.287   2.020  -6.464
  121    HZ   PHE  18           HZ       PHE  18   8.207   3.571  -6.779
  122    H    GLY  19           H        GLY  19   2.652   5.197  -1.003
  123   1HA   GLY  19          1HA       GLY  19   0.780   5.499   0.176
  124   2HA   GLY  19          2HA       GLY  19   0.597   6.975  -0.754
  125    H    TYR  20           H        TYR  20   0.676   4.163  -2.656
  126    HA   TYR  20           HA       TYR  20  -2.278   3.779  -2.963
  127   1HB   TYR  20          1HB       TYR  20   0.192   2.797  -4.446
  128   2HB   TYR  20          2HB       TYR  20  -1.376   2.112  -4.724
  129    HD1  TYR  20           HD2      TYR  20  -0.534   5.797  -4.370
  130    HD2  TYR  20           HD1      TYR  20  -1.904   2.573  -6.904
  131    HE1  TYR  20           HE2      TYR  20  -1.276   7.422  -6.033
  132    HE2  TYR  20           HE1      TYR  20  -2.687   4.237  -8.558
  133    HH   TYR  20           HH       TYR  20  -2.529   7.741  -7.950
  134    H    CYS  21           H        CYS  21  -1.886   0.888  -3.471
  135    HA   CYS  21           HA       CYS  21  -0.672  -0.088  -1.088
  136   1HB   CYS  21          1HB       CYS  21  -2.366  -0.619   0.289
  137   2HB   CYS  21          2HB       CYS  21  -3.131   0.766  -0.499
  138    H    GLY  22           H        GLY  22  -0.424  -2.363  -0.959
  139   1HA   GLY  22          1HA       GLY  22  -1.465  -4.246  -2.686
  140   2HA   GLY  22          2HA       GLY  22  -0.004  -3.588  -3.466
  141    H    LYS  23           H        LYS  23  -0.683  -6.222  -2.002
  142    HA   LYS  23           HA       LYS  23   0.900  -6.146   0.435
  143   1HB   LYS  23          2HB       LYS  23  -1.238  -7.461  -0.041
  144   2HB   LYS  23          1HB       LYS  23  -0.254  -8.592  -0.959
  145   1HG   LYS  23          2HG       LYS  23   1.148  -8.941   1.118
  146   2HG   LYS  23          1HG       LYS  23   0.076  -7.815   1.977
  147   1HD   LYS  23          2HD       LYS  23  -1.874  -9.387   1.266
  148   2HD   LYS  23          1HD       LYS  23  -0.622 -10.503   0.709
  149   1HE   LYS  23          2HE       LYS  23  -1.202 -11.245   2.890
  150   2HE   LYS  23          1HE       LYS  23   0.359 -10.430   3.078
  151   1HZ   LYS  23          2HZ       LYS  23  -0.923  -8.456   3.835
  152   2HZ   LYS  23          1HZ       LYS  23  -2.306  -9.300   3.671
  153   3HZ   LYS  23          3HZ       LYS  23  -1.196  -9.772   4.788
  154    H    GLY  24           H        GLY  24   2.956  -5.379  -0.820
  155   1HA   GLY  24          1HA       GLY  24   4.598  -7.732  -1.039
  156   2HA   GLY  24          2HA       GLY  24   4.388  -6.917  -2.608
  157    HA   PRO  25           HA       PRO  25   8.008  -5.534   0.295
  158   1HB   PRO  25          2HB       PRO  25   9.436  -6.106  -2.319
  159   2HB   PRO  25          1HB       PRO  25  10.070  -6.223  -0.653
  160   1HG   PRO  25          2HG       PRO  25   9.206  -8.459  -1.905
  161   2HG   PRO  25          1HG       PRO  25   8.714  -8.157  -0.212
  162   1HD   PRO  25          2HD       PRO  25   7.103  -7.699  -2.730
  163   2HD   PRO  25          1HD       PRO  25   6.616  -8.413  -1.168
  164    H    LYS  26           H        LYS  26   7.650  -4.713  -3.184
  165    HA   LYS  26           HA       LYS  26   8.887  -2.198  -3.184
  166   1HB   LYS  26          2HB       LYS  26   6.566  -3.313  -4.815
  167   2HB   LYS  26          1HB       LYS  26   7.306  -1.745  -5.152
  168   1HG   LYS  26          2HG       LYS  26   9.548  -2.897  -5.323
  169   2HG   LYS  26          1HG       LYS  26   8.733  -4.456  -5.197
  170   1HD   LYS  26          2HD       LYS  26   8.272  -2.343  -7.358
  171   2HD   LYS  26          1HD       LYS  26   9.288  -3.784  -7.520
  172   1HE   LYS  26          2HE       LYS  26   7.258  -5.224  -7.090
  173   2HE   LYS  26          1HE       LYS  26   6.259  -3.759  -7.083
  174   1HZ   LYS  26          3HZ       LYS  26   6.945  -3.359  -9.351
  175   2HZ   LYS  26          2HZ       LYS  26   7.865  -4.724  -9.358
  176   3HZ   LYS  26          1HZ       LYS  26   6.233  -4.832  -9.209
  177    H    TYR  27           H        TYR  27   5.729  -3.067  -1.888
  178    HA   TYR  27           HA       TYR  27   4.867  -0.255  -1.791
  179   1HB   TYR  27          1HB       TYR  27   3.598  -2.962  -1.307
  180   2HB   TYR  27          2HB       TYR  27   2.852  -1.563  -0.741
  181    HD1  TYR  27           HD1      TYR  27   4.384  -3.032  -3.888
  182    HD2  TYR  27           HD2      TYR  27   1.213  -0.672  -2.228
  183    HE1  TYR  27           HE1      TYR  27   3.573  -2.548  -6.170
  184    HE2  TYR  27           HE2      TYR  27   0.359  -0.206  -4.532
  185    HH   TYR  27           HH       TYR  27   1.996  -1.424  -7.452
  186    H    CYS  28           H        CYS  28   5.218  -3.118   0.206
  187    HA   CYS  28           HA       CYS  28   4.848  -2.017   2.760
  188   1HB   CYS  28          1HB       CYS  28   6.695  -4.327   2.066
  189   2HB   CYS  28          2HB       CYS  28   6.021  -3.965   3.654
  190    H    GLY  29           H        GLY  29   7.984  -2.662   1.226
  191   1HA   GLY  29          1HA       GLY  29  10.143  -2.014   1.867
  192   2HA   GLY  29          2HA       GLY  29   9.381  -0.433   1.679
  193    H    ARG  30           HN       ARG  30  10.259   0.702   3.309
  194    HA   ARG  30           HA       ARG  30  10.525   1.554   5.428
  195   1HB   ARG  30          1HB       ARG  30   8.035  -0.089   5.899
  196   2HB   ARG  30          2HB       ARG  30   8.620   1.241   6.912
  197   1HG   ARG  30          1HG       ARG  30   8.408   2.830   5.052
  198   2HG   ARG  30          2HG       ARG  30   7.911   1.538   3.945
  199   1HD   ARG  30          1HD       ARG  30   5.980   1.033   5.478
  200   2HD   ARG  30          2HD       ARG  30   6.480   2.407   6.464
  201    HE   ARG  30           HE       ARG  30   5.648   3.891   4.968
  202   1HH1  ARG  30          1HH1      ARG  30   5.804   0.732   3.392
  203   2HH1  ARG  30          2HH1      ARG  30   4.585   1.011   2.195
  204   1HH2  ARG  30          1HH2      ARG  30   4.080   4.451   3.163
  205   2HH2  ARG  30          2HH2      ARG  30   3.728   3.245   2.003
  No match found for entry  HXTARG          30
   
  No H/Q in entry =         206
  Start of MODEL          16
 Raw file had  213 H/Q atoms
  Start of MODEL   16
    1   1H    VAL   1          2H        VAL   1  -1.484  -2.230  -5.542
    2   2H    VAL   1          3H        VAL   1  -2.021  -2.780  -6.984
    3   3H    VAL   1          1H        VAL   1  -0.499  -2.063  -6.861
    4    HA   VAL   1           HA       VAL   1  -1.417  -0.007  -6.346
    5    HB   VAL   1           HB       VAL   1  -2.759   0.545  -8.345
    6   1HG1  VAL   1          2HG1      VAL   1  -0.283   0.371  -8.486
    7   2HG1  VAL   1          1HG1      VAL   1  -0.450  -1.318  -9.030
    8   3HG1  VAL   1          3HG1      VAL   1  -1.099   0.002 -10.013
    9   1HG2  VAL   1          1HG2      VAL   1  -4.155  -1.510  -8.498
   10   2HG2  VAL   1          3HG2      VAL   1  -3.322  -1.145 -10.013
   11   3HG2  VAL   1          2HG2      VAL   1  -2.719  -2.444  -8.975
   12    H    GLY   2           H        GLY   2  -3.486   1.374  -6.106
   13   1HA   GLY   2          1HA       GLY   2  -6.031   0.460  -6.007
   14   2HA   GLY   2          2HA       GLY   2  -5.448   0.082  -4.376
   15    H    GLU   3           H        GLU   3  -4.316   1.812  -3.287
   16    HA   GLU   3           HA       GLU   3  -3.933   4.299  -3.008
   17   1HB   GLU   3          2HB       GLU   3  -5.449   5.114  -4.522
   18   2HB   GLU   3          1HB       GLU   3  -6.826   4.470  -3.527
   19   1HG   GLU   3          2HG       GLU   3  -6.196   5.994  -1.708
   20   2HG   GLU   3          1HG       GLU   3  -4.767   6.526  -2.614
   21    HE1  GLU   3           HE2      GLU   3  -8.407   7.761  -3.865
   22    H    CYS   4           H        CYS   4  -3.713   4.500  -0.937
   23    HA   CYS   4           HA       CYS   4  -4.952   2.562   0.871
   24   1HB   CYS   4          1HB       CYS   4  -3.506   4.899   1.988
   25   2HB   CYS   4          2HB       CYS   4  -3.630   3.262   2.564
   26    H    VAL   5           H        VAL   5  -6.303   2.944   2.552
   27    HA   VAL   5           HA       VAL   5  -8.256   5.149   2.095
   28    HB   VAL   5           HB       VAL   5  -8.585   2.577   3.683
   29   1HG1  VAL   5          1HG1      VAL   5 -10.539   4.734   2.717
   30   2HG1  VAL   5          3HG1      VAL   5 -11.003   3.216   3.517
   31   3HG1  VAL   5          2HG1      VAL   5 -10.090   4.442   4.405
   32   1HG2  VAL   5          1HG2      VAL   5  -9.390   3.369   0.846
   33   2HG2  VAL   5          3HG2      VAL   5  -8.265   2.075   1.303
   34   3HG2  VAL   5          2HG2      VAL   5  -9.983   1.924   1.697
   35    H    ARG   6           H        ARG   6  -6.663   6.495   2.925
   36    HA   ARG   6           HA       ARG   6  -5.588   7.785   4.516
   37   1HB   ARG   6          2HB       ARG   6  -7.697   6.794   6.479
   38   2HB   ARG   6          1HB       ARG   6  -6.558   8.123   6.717
   39   1HG   ARG   6          2HG       ARG   6  -7.510   9.265   4.699
   40   2HG   ARG   6          1HG       ARG   6  -8.719   7.970   4.568
   41   1HD   ARG   6          2HD       ARG   6  -9.552   8.521   6.836
   42   2HD   ARG   6          1HD       ARG   6  -8.329   9.813   6.963
   43    HE   ARG   6           HE       ARG   6  -9.854  10.205   4.592
   44   1HH1  ARG   6          1HH2      ARG   6 -10.217  10.410   8.090
   45   2HH1  ARG   6          2HH2      ARG   6 -11.438  11.644   8.064
   46   1HH2  ARG   6          2HH1      ARG   6 -11.482  11.852   4.504
   47   2HH2  ARG   6          1HH1      ARG   6 -12.173  12.478   5.963
   48    H    GLY   7           H        GLY   7  -4.210   5.819   3.819
   49   1HA   GLY   7          1HA       GLY   7  -2.221   4.941   4.377
   50   2HA   GLY   7          2HA       GLY   7  -2.496   5.452   6.034
   51    H    ARG   8           H        ARG   8  -4.910   3.246   4.725
   52    HA   ARG   8           HA       ARG   8  -3.718   0.906   5.991
   53   1HB   ARG   8          2HB       ARG   8  -6.521   1.925   6.385
   54   2HB   ARG   8          1HB       ARG   8  -5.826   0.414   7.026
   55   1HG   ARG   8          2HG       ARG   8  -3.971   1.800   8.041
   56   2HG   ARG   8          1HG       ARG   8  -4.816   3.230   7.608
   57   1HD   ARG   8          2HD       ARG   8  -5.582   1.124   9.609
   58   2HD   ARG   8          1HD       ARG   8  -5.368   2.857   9.897
   59    HE   ARG   8           HE       ARG   8  -7.780   1.548   9.430
   60   1HH1  ARG   8          2HH1      ARG   8  -6.230   4.481   8.049
   61   2HH1  ARG   8          1HH1      ARG   8  -7.539   4.732   6.966
   62   1HH2  ARG   8          1HH2      ARG   8  -9.663   2.271   8.324
   63   2HH2  ARG   8          2HH2      ARG   8  -9.612   3.741   7.402
   64    H    CYS   9           H        CYS   9  -4.183  -0.829   4.607
   65    HA   CYS   9           HA       CYS   9  -5.931  -0.398   2.241
   66   1HB   CYS   9          1HB       CYS   9  -3.255  -1.757   2.565
   67   2HB   CYS   9          2HB       CYS   9  -4.289  -2.087   1.187
   68    HA   PRO  10           HA       PRO  10  -8.185  -3.907   3.469
   69   1HB   PRO  10          2HB       PRO  10  -8.199  -5.068   0.714
   70   2HB   PRO  10          1HB       PRO  10  -9.583  -4.525   1.702
   71   1HG   PRO  10          2HG       PRO  10  -8.701  -3.113  -0.434
   72   2HG   PRO  10          1HG       PRO  10  -9.246  -2.267   1.048
   73   1HD   PRO  10          2HD       PRO  10  -6.391  -2.914   0.226
   74   2HD   PRO  10          1HD       PRO  10  -7.079  -1.370   0.788
   75    H    SER  11           H        SER  11  -8.356  -6.272   3.423
   76    HA   SER  11           HA       SER  11  -7.304  -8.188   4.210
   77   1HB   SER  11          2HB       SER  11  -8.459  -8.500   1.994
   78   2HB   SER  11          1HB       SER  11  -6.923  -8.169   1.167
   79    HG   SER  11           HG       SER  11  -6.078 -10.000   2.311
   80    H    GLY  12           H        GLY  12  -5.563  -6.590   4.958
   81   1HA   GLY  12          1HA       GLY  12  -3.348  -6.321   5.609
   82   2HA   GLY  12          2HA       GLY  12  -3.205  -8.067   5.349
   83    H    MET  13           H        MET  13  -3.842  -5.515   2.905
   84    HA   MET  13           HA       MET  13  -1.324  -6.136   1.423
   85   1HB   MET  13          1HB       MET  13  -3.738  -4.346   0.948
   86   2HB   MET  13          2HB       MET  13  -2.236  -4.120   0.060
   87   1HG   MET  13          1HG       MET  13  -3.890  -5.453  -1.180
   88   2HG   MET  13          2HG       MET  13  -2.357  -6.283  -0.939
   89   1HE   MET  13          3HE       MET  13  -3.388  -8.497  -1.820
   90   2HE   MET  13          2HE       MET  13  -4.878  -9.218  -1.166
   91   3HE   MET  13          1HE       MET  13  -4.953  -7.678  -2.052
   92    H    CYS  14           H        CYS  14   0.370  -4.465   1.256
   93    HA   CYS  14           HA       CYS  14   0.490  -2.877   3.752
   94   1HB   CYS  14          1HB       CYS  14   2.506  -3.237   1.510
   95   2HB   CYS  14          2HB       CYS  14   2.701  -2.237   2.942
   96    H    CYS  15           H        CYS  15   0.221  -0.683   3.771
   97    HA   CYS  15           HA       CYS  15  -0.735   0.686   1.367
   98   1HB   CYS  15          1HB       CYS  15  -1.644   1.447   3.496
   99   2HB   CYS  15          2HB       CYS  15  -0.018   1.670   4.168
  100    H    SER  16           H        SER  16   0.541   1.303  -0.105
  101    HA   SER  16           HA       SER  16   3.252   0.680  -0.196
  102   1HB   SER  16          2HB       SER  16   1.725   2.592  -1.972
  103   2HB   SER  16          1HB       SER  16   3.193   1.722  -2.407
  104    HG   SER  16           HG       SER  16   0.696   0.537  -1.697
  105    H    GLN  17           H        GLN  17   5.147   2.044  -0.216
  106    HA   GLN  17           HA       GLN  17   5.248   4.496   1.104
  107   1HB   GLN  17          2HB       GLN  17   7.393   4.869   0.172
  108   2HB   GLN  17          1HB       GLN  17   7.193   3.186   0.699
  109   1HG   GLN  17          2HG       GLN  17   6.621   2.560  -1.627
  110   2HG   GLN  17          1HG       GLN  17   6.921   4.254  -2.095
  111   1HE2  GLN  17          2HE2      GLN  17  10.053   1.781  -2.131
  112   2HE2  GLN  17          1HE2      GLN  17   8.378   1.271  -2.298
  113    H    PHE  18           H        PHE  18   4.214   3.942  -2.293
  114    HA   PHE  18           HA       PHE  18   4.112   6.633  -3.080
  115   1HB   PHE  18          2HB       PHE  18   3.141   4.105  -4.180
  116   2HB   PHE  18          1HB       PHE  18   3.545   5.546  -5.023
  117    HD1  PHE  18           HD1      PHE  18   6.137   6.392  -4.491
  118    HD2  PHE  18           HD2      PHE  18   4.683   2.331  -4.603
  119    HE1  PHE  18           HE1      PHE  18   8.449   5.565  -4.818
  120    HE2  PHE  18           HE2      PHE  18   7.004   1.511  -4.878
  121    HZ   PHE  18           HZ       PHE  18   8.890   3.125  -4.988
  122    H    GLY  19           H        GLY  19   2.177   5.122  -0.879
  123   1HA   GLY  19          1HA       GLY  19   0.149   5.542  -0.090
  124   2HA   GLY  19          2HA       GLY  19   0.061   6.802  -1.303
  125    H    TYR  20           H        TYR  20   0.550   3.869  -2.847
  126    HA   TYR  20           HA       TYR  20  -2.310   3.212  -3.246
  127   1HB   TYR  20          1HB       TYR  20   0.182   2.177  -4.609
  128   2HB   TYR  20          2HB       TYR  20  -1.449   1.751  -5.052
  129    HD1  TYR  20           HD1      TYR  20  -3.127   3.694  -5.633
  130    HD2  TYR  20           HD2      TYR  20   1.166   4.113  -5.657
  131    HE1  TYR  20           HE1      TYR  20  -3.330   5.746  -6.999
  132    HE2  TYR  20           HE2      TYR  20   0.956   6.172  -7.000
  133    HH   TYR  20           HH       TYR  20  -0.493   7.674  -7.991
  134    H    CYS  21           H        CYS  21  -2.053   0.427  -3.702
  135    HA   CYS  21           HA       CYS  21  -1.455  -0.523  -0.904
  136   1HB   CYS  21          1HB       CYS  21  -3.871  -1.115  -2.687
  137   2HB   CYS  21          2HB       CYS  21  -3.467  -1.988  -1.210
  138    H    GLY  22           H        GLY  22  -0.446  -2.605  -0.826
  139   1HA   GLY  22          1HA       GLY  22  -1.213  -4.612  -2.501
  140   2HA   GLY  22          2HA       GLY  22   0.262  -4.009  -3.239
  141    H    LYS  23           H        LYS  23  -0.354  -6.513  -1.907
  142    HA   LYS  23           HA       LYS  23   1.140  -6.591   0.623
  143   1HB   LYS  23          2HB       LYS  23  -0.937  -7.946   0.101
  144   2HB   LYS  23          1HB       LYS  23   0.011  -8.866  -1.068
  145   1HG   LYS  23          2HG       LYS  23   1.587  -9.451   0.870
  146   2HG   LYS  23          1HG       LYS  23   0.416  -8.710   1.959
  147   1HD   LYS  23          2HD       LYS  23   0.035 -11.094   0.077
  148   2HD   LYS  23          1HD       LYS  23   0.114 -11.166   1.834
  149   1HE   LYS  23          2HE       LYS  23  -2.116  -9.899   0.154
  150   2HE   LYS  23          1HE       LYS  23  -2.204 -11.429   1.022
  151   1HZ   LYS  23          2HZ       LYS  23  -1.771  -8.828   2.349
  152   2HZ   LYS  23          1HZ       LYS  23  -3.229  -9.539   2.206
  153   3HZ   LYS  23          3HZ       LYS  23  -2.043 -10.263   3.082
  154    H    GLY  24           H        GLY  24   3.049  -5.558  -0.695
  155   1HA   GLY  24          1HA       GLY  24   4.913  -7.683  -1.212
  156   2HA   GLY  24          2HA       GLY  24   4.505  -6.806  -2.700
  157    HA   PRO  25           HA       PRO  25   7.894  -5.101   0.162
  158   1HB   PRO  25          2HB       PRO  25  10.143  -5.465  -1.384
  159   2HB   PRO  25          1HB       PRO  25   9.424  -6.715  -0.335
  160   1HG   PRO  25          2HG       PRO  25   9.042  -6.368  -3.312
  161   2HG   PRO  25          1HG       PRO  25   9.389  -7.870  -2.414
  162   1HD   PRO  25          2HD       PRO  25   6.861  -7.174  -3.184
  163   2HD   PRO  25          1HD       PRO  25   7.137  -8.025  -1.646
  164    H    LYS  26           H        LYS  26   7.752  -4.499  -3.369
  165    HA   LYS  26           HA       LYS  26   9.012  -2.007  -3.527
  166   1HB   LYS  26          2HB       LYS  26   6.616  -3.172  -5.008
  167   2HB   LYS  26          1HB       LYS  26   7.311  -1.605  -5.429
  168   1HG   LYS  26          2HG       LYS  26   9.516  -2.647  -5.796
  169   2HG   LYS  26          1HG       LYS  26   8.843  -4.247  -5.414
  170   1HD   LYS  26          2HD       LYS  26   7.224  -4.034  -7.272
  171   2HD   LYS  26          1HD       LYS  26   7.855  -2.441  -7.688
  172   1HE   LYS  26          2HE       LYS  26   9.437  -5.068  -7.771
  173   2HE   LYS  26          1HE       LYS  26   8.687  -4.285  -9.167
  174   1HZ   LYS  26          1HZ       LYS  26  10.122  -2.388  -8.813
  175   2HZ   LYS  26          3HZ       LYS  26  10.852  -3.131  -7.537
  176   3HZ   LYS  26          2HZ       LYS  26  10.995  -3.759  -9.046
  177    H    TYR  27           H        TYR  27   5.813  -2.770  -2.273
  178    HA   TYR  27           HA       TYR  27   5.028   0.066  -1.983
  179   1HB   TYR  27          1HB       TYR  27   3.752  -2.653  -1.438
  180   2HB   TYR  27          2HB       TYR  27   2.942  -1.225  -1.167
  181    HD1  TYR  27           HD1      TYR  27   4.008   0.226  -3.878
  182    HD2  TYR  27           HD2      TYR  27   2.536  -3.743  -3.142
  183    HE1  TYR  27           HE1      TYR  27   2.812   0.299  -6.013
  184    HE2  TYR  27           HE2      TYR  27   1.363  -3.695  -5.336
  185    HH   TYR  27           HH       TYR  27   1.521  -0.917  -7.506
  186    H    CYS  28           H        CYS  28   5.202  -2.876  -0.079
  187    HA   CYS  28           HA       CYS  28   4.793  -1.705   2.363
  188   1HB   CYS  28          1HB       CYS  28   4.990  -4.270   1.658
  189   2HB   CYS  28          2HB       CYS  28   6.603  -4.110   2.363
  190    H    GLY  29           H        GLY  29   7.990  -2.434   1.001
  191   1HA   GLY  29          1HA       GLY  29  10.126  -1.718   1.648
  192   2HA   GLY  29          2HA       GLY  29   9.280  -0.170   1.575
  193    H    ARG  30           HN       ARG  30  10.231   0.897   3.248
  194    HA   ARG  30           HA       ARG  30  11.009   1.392   5.357
  195   1HB   ARG  30          1HB       ARG  30   8.042   0.763   5.670
  196   2HB   ARG  30          2HB       ARG  30   9.021   1.555   6.896
  197   1HG   ARG  30          1HG       ARG  30   7.950   3.293   5.815
  198   2HG   ARG  30          2HG       ARG  30   9.642   3.360   5.318
  199   1HD   ARG  30          1HD       ARG  30   8.066   3.908   3.485
  200   2HD   ARG  30          2HD       ARG  30   9.082   2.544   3.108
  201    HE   ARG  30           HE       ARG  30   7.282   1.012   3.461
  202   1HH1  ARG  30          1HH1      ARG  30   6.151   4.176   4.232
  203   2HH1  ARG  30          2HH1      ARG  30   4.530   3.993   3.632
  204   1HH2  ARG  30          2HH2      ARG  30   5.284   0.824   2.142
  205   2HH2  ARG  30          1HH2      ARG  30   3.939   1.692   2.780
  No match found for entry  HXTARG          30
   
  No H/Q in entry =         206
  Start of MODEL          17
 Raw file had  213 H/Q atoms
  Start of MODEL   17
    1   1H    VAL   1          1H        VAL   1  -4.277   0.898  -7.165
    2   2H    VAL   1          2H        VAL   1  -5.015  -0.536  -6.705
    3   3H    VAL   1          3H        VAL   1  -5.513   0.311  -8.047
    4    HA   VAL   1           HA       VAL   1  -7.072   0.967  -6.515
    5    HB   VAL   1           HB       VAL   1  -6.456   1.709  -4.246
    6   1HG1  VAL   1          2HG1      VAL   1  -7.113  -0.671  -4.689
    7   2HG1  VAL   1          1HG1      VAL   1  -5.390  -1.105  -4.744
    8   3HG1  VAL   1          3HG1      VAL   1  -6.097  -0.452  -3.258
    9   1HG2  VAL   1          1HG2      VAL   1  -4.088   2.400  -4.654
   10   2HG2  VAL   1          3HG2      VAL   1  -4.257   1.298  -3.291
   11   3HG2  VAL   1          2HG2      VAL   1  -3.638   0.692  -4.841
   12    H    GLY   2           H        GLY   2  -7.522   3.350  -5.874
   13   1HA   GLY   2          1HA       GLY   2  -6.143   5.226  -7.589
   14   2HA   GLY   2          2HA       GLY   2  -7.292   5.603  -6.289
   15    H    GLU   3           H        GLU   3  -6.289   4.800  -3.981
   16    HA   GLU   3           HA       GLU   3  -3.509   4.964  -3.587
   17   1HB   GLU   3          2HB       GLU   3  -3.798   6.999  -1.991
   18   2HB   GLU   3          1HB       GLU   3  -3.418   7.202  -3.698
   19   1HG   GLU   3          2HG       GLU   3  -5.085   8.788  -2.974
   20   2HG   GLU   3          1HG       GLU   3  -5.722   7.727  -4.236
   21    HE1  GLU   3           HE2      GLU   3  -6.781   7.113  -0.398
   22    H    CYS   4           H        CYS   4  -3.338   4.992  -1.049
   23    HA   CYS   4           HA       CYS   4  -4.820   2.845   0.021
   24   1HB   CYS   4          1HB       CYS   4  -3.594   5.048   1.692
   25   2HB   CYS   4          2HB       CYS   4  -3.951   3.416   2.210
   26    H    VAL   5           H        VAL   5  -6.163   2.818   1.922
   27    HA   VAL   5           HA       VAL   5  -8.416   4.771   1.735
   28    HB   VAL   5           HB       VAL   5  -8.363   1.934   2.852
   29   1HG1  VAL   5          3HG1      VAL   5 -10.646   3.894   2.334
   30   2HG1  VAL   5          2HG1      VAL   5 -10.824   2.209   2.869
   31   3HG1  VAL   5          1HG1      VAL   5 -10.047   3.393   3.931
   32   1HG2  VAL   5          2HG2      VAL   5  -9.425   3.032   0.211
   33   2HG2  VAL   5          1HG2      VAL   5  -8.092   1.876   0.412
   34   3HG2  VAL   5          3HG2      VAL   5  -9.738   1.400   0.841
   35    H    ARG   6           H        ARG   6  -7.680   6.362   3.087
   36    HA   ARG   6           HA       ARG   6  -6.873   7.426   4.951
   37   1HB   ARG   6          2HB       ARG   6  -8.393   5.229   6.418
   38   2HB   ARG   6          1HB       ARG   6  -7.900   6.798   7.075
   39   1HG   ARG   6          2HG       ARG   6  -9.308   7.938   5.343
   40   2HG   ARG   6          1HG       ARG   6  -9.863   6.351   4.780
   41   1HD   ARG   6          2HD       ARG   6 -10.748   5.835   7.026
   42   2HD   ARG   6          1HD       ARG   6 -10.277   7.422   7.619
   43    HE   ARG   6           HE       ARG   6 -12.566   6.682   5.976
   44   1HH1  ARG   6          2HH1      ARG   6 -10.427   9.370   6.739
   45   2HH1  ARG   6          1HH1      ARG   6 -11.578  10.618   6.368
   46   1HH2  ARG   6          1HH2      ARG   6 -14.128   8.300   5.446
   47   2HH2  ARG   6          2HH2      ARG   6 -13.733   9.980   5.594
   48    H    GLY   7           H        GLY   7  -4.987   5.916   3.795
   49   1HA   GLY   7          1HA       GLY   7  -2.879   5.177   4.085
   50   2HA   GLY   7          2HA       GLY   7  -3.015   5.624   5.786
   51    H    ARG   8           H        ARG   8  -5.381   3.204   4.641
   52    HA   ARG   8           HA       ARG   8  -3.844   0.973   5.673
   53   1HB   ARG   8          2HB       ARG   8  -6.734   1.744   6.197
   54   2HB   ARG   8          1HB       ARG   8  -5.916   0.248   6.709
   55   1HG   ARG   8          2HG       ARG   8  -4.177   1.638   7.827
   56   2HG   ARG   8          1HG       ARG   8  -5.048   3.082   7.421
   57   1HD   ARG   8          2HD       ARG   8  -7.013   2.406   8.688
   58   2HD   ARG   8          1HD       ARG   8  -6.234   0.859   9.070
   59    HE   ARG   8           HE       ARG   8  -5.161   1.819  10.798
   60   1HH1  ARG   8          1HH2      ARG   8  -5.758   4.544   8.506
   61   2HH1  ARG   8          2HH2      ARG   8  -5.329   5.729   9.670
   62   1HH2  ARG   8          2HH1      ARG   8  -4.505   3.446  12.248
   63   2HH2  ARG   8          1HH1      ARG   8  -4.543   5.114  11.787
   64    H    CYS   9           H        CYS   9  -4.761  -0.946   4.711
   65    HA   CYS   9           HA       CYS   9  -6.135  -0.657   2.112
   66   1HB   CYS   9          1HB       CYS   9  -3.554  -2.104   2.790
   67   2HB   CYS   9          2HB       CYS   9  -4.448  -2.323   1.296
   68    HA   PRO  10           HA       PRO  10  -8.342  -4.227   3.509
   69   1HB   PRO  10          2HB       PRO  10  -8.052  -5.556   0.842
   70   2HB   PRO  10          1HB       PRO  10  -9.548  -5.109   1.709
   71   1HG   PRO  10          2HG       PRO  10  -8.685  -3.735  -0.454
   72   2HG   PRO  10          1HG       PRO  10  -9.398  -2.866   0.940
   73   1HD   PRO  10          2HD       PRO  10  -6.450  -3.255   0.308
   74   2HD   PRO  10          1HD       PRO  10  -7.323  -1.764   0.757
   75    H    SER  11           H        SER  11  -8.292  -6.561   3.652
   76    HA   SER  11           HA       SER  11  -7.121  -8.298   4.663
   77   1HB   SER  11          2HB       SER  11  -8.182  -8.738   2.330
   78   2HB   SER  11          1HB       SER  11  -6.531  -8.700   1.693
   79    HG   SER  11           HG       SER  11  -7.616 -10.481   3.637
   80    H    GLY  12           H        GLY  12  -5.498  -6.554   5.322
   81   1HA   GLY  12          1HA       GLY  12  -3.313  -6.118   5.982
   82   2HA   GLY  12          2HA       GLY  12  -3.076  -7.867   5.858
   83    H    MET  13           H        MET  13  -3.765  -5.481   3.262
   84    HA   MET  13           HA       MET  13  -1.208  -6.109   1.845
   85   1HB   MET  13          1HB       MET  13  -3.647  -4.394   1.297
   86   2HB   MET  13          2HB       MET  13  -2.147  -4.130   0.409
   87   1HG   MET  13          1HG       MET  13  -3.776  -5.540  -0.794
   88   2HG   MET  13          2HG       MET  13  -2.212  -6.307  -0.558
   89   1HE   MET  13          1HE       MET  13  -3.122  -8.587  -1.362
   90   2HE   MET  13          3HE       MET  13  -4.585  -9.355  -0.700
   91   3HE   MET  13          2HE       MET  13  -4.721  -7.845  -1.627
   92    H    CYS  14           H        CYS  14   0.441  -4.354   1.537
   93    HA   CYS  14           HA       CYS  14   0.584  -2.662   3.975
   94   1HB   CYS  14          1HB       CYS  14   2.496  -3.010   1.636
   95   2HB   CYS  14          2HB       CYS  14   2.682  -1.842   2.919
   96    H    CYS  15           H        CYS  15   0.082  -0.522   3.922
   97    HA   CYS  15           HA       CYS  15  -0.826   0.764   1.432
   98   1HB   CYS  15          1HB       CYS  15  -1.901   1.527   3.483
   99   2HB   CYS  15          2HB       CYS  15  -0.330   1.817   4.252
  100    H    SER  16           H        SER  16   0.688   1.091   0.015
  101    HA   SER  16           HA       SER  16   3.371   0.555   0.288
  102   1HB   SER  16          2HB       SER  16   3.617   1.211  -1.892
  103   2HB   SER  16          1HB       SER  16   1.891   0.739  -1.774
  104    HG   SER  16           HG       SER  16   2.192   2.613  -2.976
  105    H    GLN  17           H        GLN  17   5.260   2.004   0.216
  106    HA   GLN  17           HA       GLN  17   5.179   4.398   1.751
  107   1HB   GLN  17          2HB       GLN  17   7.420   4.744   1.152
  108   2HB   GLN  17          1HB       GLN  17   7.106   3.021   1.456
  109   1HG   GLN  17          2HG       GLN  17   6.625   2.950  -1.130
  110   2HG   GLN  17          1HG       GLN  17   7.525   4.485  -1.120
  111   1HE2  GLN  17          2HE2      GLN  17   9.411   0.828  -0.495
  112   2HE2  GLN  17          1HE2      GLN  17   7.679   0.983  -0.764
  113    H    PHE  18           H        PHE  18   4.366   3.917  -1.715
  114    HA   PHE  18           HA       PHE  18   4.380   6.657  -2.407
  115   1HB   PHE  18          2HB       PHE  18   3.567   4.168  -3.699
  116   2HB   PHE  18          1HB       PHE  18   3.986   5.654  -4.432
  117    HD1  PHE  18           HD2      PHE  18   6.493   6.549  -3.694
  118    HD2  PHE  18           HD1      PHE  18   5.213   2.431  -3.944
  119    HE1  PHE  18           HE2      PHE  18   8.856   5.813  -3.834
  120    HE2  PHE  18           HE1      PHE  18   7.576   1.710  -4.054
  121    HZ   PHE  18           HZ       PHE  18   9.401   3.391  -3.995
  122    H    GLY  19           H        GLY  19   2.309   5.053  -0.393
  123   1HA   GLY  19          1HA       GLY  19   0.218   5.316   0.228
  124   2HA   GLY  19          2HA       GLY  19   0.225   6.742  -0.793
  125    H    TYR  20           H        TYR  20   0.678   3.444  -1.894
  126    HA   TYR  20           HA       TYR  20  -2.065   3.221  -3.060
  127   1HB   TYR  20          1HB       TYR  20   0.480   1.923  -4.125
  128   2HB   TYR  20          2HB       TYR  20  -1.106   1.826  -4.862
  129    HD1  TYR  20           HD2      TYR  20  -2.196   4.321  -5.308
  130    HD2  TYR  20           HD1      TYR  20   1.988   3.298  -5.293
  131    HE1  TYR  20           HE2      TYR  20  -1.676   6.449  -6.446
  132    HE2  TYR  20           HE1      TYR  20   2.498   5.401  -6.504
  133    HH   TYR  20           HH       TYR  20  -0.017   7.810  -7.280
  134    H    CYS  21           H        CYS  21  -1.966   0.393  -3.519
  135    HA   CYS  21           HA       CYS  21  -1.471  -0.618  -0.726
  136   1HB   CYS  21          1HB       CYS  21  -3.880  -1.035  -2.536
  137   2HB   CYS  21          2HB       CYS  21  -3.513  -2.030  -1.130
  138    H    GLY  22           H        GLY  22  -0.313  -2.563  -0.650
  139   1HA   GLY  22          1HA       GLY  22  -1.087  -4.640  -2.267
  140   2HA   GLY  22          2HA       GLY  22   0.407  -4.036  -2.979
  141    H    LYS  23           H        LYS  23  -0.269  -6.516  -1.552
  142    HA   LYS  23           HA       LYS  23   1.243  -6.486   0.975
  143   1HB   LYS  23          2HB       LYS  23  -0.836  -7.892   0.562
  144   2HB   LYS  23          1HB       LYS  23   0.100  -8.843  -0.589
  145   1HG   LYS  23          2HG       LYS  23   1.750  -9.273   1.360
  146   2HG   LYS  23          1HG       LYS  23   0.541  -8.563   2.423
  147   1HD   LYS  23          2HD       LYS  23   0.288 -11.016   0.607
  148   2HD   LYS  23          1HD       LYS  23   0.390 -11.040   2.365
  149   1HE   LYS  23          2HE       LYS  23  -1.922  -9.928   0.686
  150   2HE   LYS  23          1HE       LYS  23  -1.921 -11.441   1.589
  151   1HZ   LYS  23          3HZ       LYS  23  -1.630  -8.779   2.843
  152   2HZ   LYS  23          2HZ       LYS  23  -3.026  -9.609   2.747
  153   3HZ   LYS  23          1HZ       LYS  23  -1.776 -10.209   3.621
  154    H    GLY  24           H        GLY  24   3.156  -5.533  -0.405
  155   1HA   GLY  24          1HA       GLY  24   5.024  -7.640  -0.635
  156   2HA   GLY  24          2HA       GLY  24   4.527  -7.160  -2.273
  157    HA   PRO  25           HA       PRO  25   8.084  -4.809  -0.240
  158   1HB   PRO  25          2HB       PRO  25  10.155  -5.520  -1.906
  159   2HB   PRO  25          1HB       PRO  25   9.600  -6.498  -0.519
  160   1HG   PRO  25          2HG       PRO  25   8.857  -6.842  -3.429
  161   2HG   PRO  25          1HG       PRO  25   9.374  -8.099  -2.270
  162   1HD   PRO  25          2HD       PRO  25   6.750  -7.651  -2.834
  163   2HD   PRO  25          1HD       PRO  25   7.251  -8.078  -1.180
  164    H    LYS  26           H        LYS  26   7.249  -5.068  -3.707
  165    HA   LYS  26           HA       LYS  26   8.405  -2.706  -4.692
  166   1HB   LYS  26          2HB       LYS  26   5.741  -4.040  -5.347
  167   2HB   LYS  26          1HB       LYS  26   6.403  -2.662  -6.238
  168   1HG   LYS  26          2HG       LYS  26   8.434  -3.940  -6.786
  169   2HG   LYS  26          1HG       LYS  26   7.780  -5.363  -5.942
  170   1HD   LYS  26          2HD       LYS  26   5.875  -5.455  -7.525
  171   2HD   LYS  26          1HD       LYS  26   6.367  -3.921  -8.238
  172   1HE   LYS  26          2HE       LYS  26   6.998  -5.690  -9.744
  173   2HE   LYS  26          1HE       LYS  26   8.449  -4.907  -9.108
  174   1HZ   LYS  26          3HZ       LYS  26   7.334  -7.474  -8.169
  175   2HZ   LYS  26          2HZ       LYS  26   8.641  -7.292  -9.146
  176   3HZ   LYS  26          1HZ       LYS  26   8.704  -6.759  -7.595
  177    H    TYR  27           H        TYR  27   5.529  -3.088  -2.606
  178    HA   TYR  27           HA       TYR  27   4.923  -0.214  -2.778
  179   1HB   TYR  27          1HB       TYR  27   3.600  -2.619  -1.436
  180   2HB   TYR  27          2HB       TYR  27   2.995  -1.086  -1.325
  181    HD1  TYR  27           HD2      TYR  27   2.544   0.195  -3.770
  182    HD2  TYR  27           HD1      TYR  27   3.150  -4.045  -3.360
  183    HE1  TYR  27           HE2      TYR  27   1.024  -0.181  -5.657
  184    HE2  TYR  27           HE1      TYR  27   1.786  -4.407  -5.406
  185    HH   TYR  27           HH       TYR  27   0.021  -1.755  -7.017
  186    H    CYS  28           H        CYS  28   5.282  -2.724  -0.392
  187    HA   CYS  28           HA       CYS  28   5.409  -1.058   1.873
  188   1HB   CYS  28          1HB       CYS  28   4.743  -3.587   1.468
  189   2HB   CYS  28          2HB       CYS  28   6.408  -3.914   1.921
  190    H    GLY  29           H        GLY  29   7.959  -2.580  -0.005
  191   1HA   GLY  29          1HA       GLY  29   9.941  -3.206   1.650
  192   2HA   GLY  29          2HA       GLY  29  10.273  -2.509   0.076
  193    H    ARG  30           HN       ARG  30  11.243  -2.311   3.014
  194    HA   ARG  30           HA       ARG  30  11.543   0.655   3.286
  195   1HB   ARG  30          1HB       ARG  30  12.084  -1.549   5.310
  196   2HB   ARG  30          2HB       ARG  30  12.142   0.186   5.611
  197   1HG   ARG  30          1HG       ARG  30   9.600  -1.402   4.955
  198   2HG   ARG  30          2HG       ARG  30  10.166  -0.962   6.561
  199   1HD   ARG  30          1HD       ARG  30   8.491   0.617   6.003
  200   2HD   ARG  30          2HD       ARG  30  10.063   1.438   5.959
  201    HE   ARG  30           HE       ARG  30   8.732   0.321   3.499
  202   1HH1  ARG  30          2HH1      ARG  30   9.255   3.217   5.304
  203   2HH1  ARG  30          1HH1      ARG  30   9.678   4.278   3.999
  204   1HH2  ARG  30          2HH2      ARG  30   9.687   1.538   1.647
  205   2HH2  ARG  30          1HH2      ARG  30   9.810   3.217   1.674
  No match found for entry  HXTARG          30
   
  No H/Q in entry =         206
  Start of MODEL          18
 Raw file had  213 H/Q atoms
  Start of MODEL   18
    1   1H    VAL   1          3H        VAL   1  -4.015   0.290  -7.714
    2   2H    VAL   1          1H        VAL   1  -4.637  -1.239  -7.415
    3   3H    VAL   1          2H        VAL   1  -5.307  -0.234  -8.561
    4    HA   VAL   1           HA       VAL   1  -6.725   0.062  -6.812
    5    HB   VAL   1           HB       VAL   1  -5.454  -1.126  -5.165
    6   1HG1  VAL   1          3HG1      VAL   1  -3.151  -0.300  -5.608
    7   2HG1  VAL   1          2HG1      VAL   1  -3.599   1.299  -4.971
    8   3HG1  VAL   1          1HG1      VAL   1  -3.583  -0.115  -3.909
    9   1HG2  VAL   1          2HG2      VAL   1  -7.216   0.424  -4.368
   10   2HG2  VAL   1          1HG2      VAL   1  -5.950   0.088  -3.178
   11   3HG2  VAL   1          3HG2      VAL   1  -5.949   1.631  -4.033
   12    H    GLY   2           H        GLY   2  -7.323   2.193  -5.908
   13   1HA   GLY   2          1HA       GLY   2  -6.426   4.336  -7.632
   14   2HA   GLY   2          2HA       GLY   2  -7.562   4.471  -6.278
   15    H    GLU   3           H        GLU   3  -6.237   3.839  -4.044
   16    HA   GLU   3           HA       GLU   3  -3.587   4.623  -3.703
   17   1HB   GLU   3          2HB       GLU   3  -4.170   6.681  -2.277
   18   2HB   GLU   3          1HB       GLU   3  -4.128   6.916  -4.025
   19   1HG   GLU   3          2HG       GLU   3  -6.491   6.967  -4.215
   20   2HG   GLU   3          1HG       GLU   3  -6.726   6.278  -2.593
   21    HE1  GLU   3           HE2      GLU   3  -5.546  10.157  -2.808
   22    H    CYS   4           H        CYS   4  -3.344   4.733  -1.193
   23    HA   CYS   4           HA       CYS   4  -4.621   2.539   0.049
   24   1HB   CYS   4          1HB       CYS   4  -3.588   4.945   1.542
   25   2HB   CYS   4          2HB       CYS   4  -3.739   3.335   2.174
   26    H    VAL   5           H        VAL   5  -5.997   2.494   1.815
   27    HA   VAL   5           HA       VAL   5  -8.392   4.222   1.520
   28    HB   VAL   5           HB       VAL   5  -8.047   1.650   3.116
   29   1HG1  VAL   5          2HG1      VAL   5 -10.481   3.302   2.284
   30   2HG1  VAL   5          1HG1      VAL   5 -10.529   1.742   3.138
   31   3HG1  VAL   5          3HG1      VAL   5  -9.839   3.166   3.932
   32   1HG2  VAL   5          1HG2      VAL   5  -9.189   2.182   0.336
   33   2HG2  VAL   5          3HG2      VAL   5  -7.775   1.183   0.720
   34   3HG2  VAL   5          2HG2      VAL   5  -9.383   0.661   1.239
   35    H    ARG   6           H        ARG   6  -7.053   5.832   2.197
   36    HA   ARG   6           HA       ARG   6  -6.111   7.372   3.669
   37   1HB   ARG   6          2HB       ARG   6  -8.244   6.259   5.526
   38   2HB   ARG   6          1HB       ARG   6  -7.404   7.796   5.752
   39   1HG   ARG   6          2HG       ARG   6  -9.074   7.134   3.276
   40   2HG   ARG   6          1HG       ARG   6  -9.721   7.930   4.699
   41   1HD   ARG   6          2HD       ARG   6  -8.678   9.913   4.327
   42   2HD   ARG   6          1HD       ARG   6  -7.263   9.240   3.562
   43    HE   ARG   6           HE       ARG   6  -9.732  10.107   2.298
   44   1HH1  ARG   6          2HH1      ARG   6  -6.981   7.915   1.901
   45   2HH1  ARG   6          1HH1      ARG   6  -6.993   8.003   0.150
   46   1HH2  ARG   6          1HH2      ARG   6  -9.726  10.185  -0.073
   47   2HH2  ARG   6          2HH2      ARG   6  -8.475   9.287  -0.912
   48    H    GLY   7           H        GLY   7  -4.519   5.426   3.330
   49   1HA   GLY   7          1HA       GLY   7  -2.450   5.081   4.114
   50   2HA   GLY   7          2HA       GLY   7  -2.951   5.606   5.711
   51    H    ARG   8           H        ARG   8  -5.065   3.069   4.642
   52    HA   ARG   8           HA       ARG   8  -3.419   0.896   5.629
   53   1HB   ARG   8          2HB       ARG   8  -6.257   1.489   6.426
   54   2HB   ARG   8          1HB       ARG   8  -5.326  -0.010   6.718
   55   1HG   ARG   8          2HG       ARG   8  -3.470   1.557   7.656
   56   2HG   ARG   8          1HG       ARG   8  -4.668   2.815   7.612
   57   1HD   ARG   8          2HD       ARG   8  -4.525   1.958   9.799
   58   2HD   ARG   8          1HD       ARG   8  -6.116   1.545   9.136
   59    HE   ARG   8           HE       ARG   8  -3.801  -0.225   9.794
   60   1HH1  ARG   8          2HH1      ARG   8  -7.070  -0.093   8.462
   61   2HH1  ARG   8          1HH1      ARG   8  -7.406  -1.779   8.693
   62   1HH2  ARG   8          1HH2      ARG   8  -4.201  -2.471  10.085
   63   2HH2  ARG   8          2HH2      ARG   8  -5.716  -3.163   9.610
   64    H    CYS   9           H        CYS   9  -4.471  -1.081   4.616
   65    HA   CYS   9           HA       CYS   9  -6.565  -0.664   2.642
   66   1HB   CYS   9          1HB       CYS   9  -3.793  -1.569   1.983
   67   2HB   CYS   9          2HB       CYS   9  -5.098  -2.558   1.358
   68    HA   PRO  10           HA       PRO  10  -8.180  -4.319   4.411
   69   1HB   PRO  10          2HB       PRO  10  -8.595  -5.577   1.715
   70   2HB   PRO  10          1HB       PRO  10  -9.806  -5.227   2.979
   71   1HG   PRO  10          2HG       PRO  10  -9.661  -3.699   0.739
   72   2HG   PRO  10          1HG       PRO  10  -9.896  -2.924   2.335
   73   1HD   PRO  10          2HD       PRO  10  -7.287  -3.289   0.820
   74   2HD   PRO  10          1HD       PRO  10  -7.975  -1.805   1.531
   75    H    SER  11           H        SER  11  -8.173  -6.737   4.359
   76    HA   SER  11           HA       SER  11  -6.846  -8.572   4.910
   77   1HB   SER  11          2HB       SER  11  -6.816  -9.910   2.777
   78   2HB   SER  11          1HB       SER  11  -8.330  -9.018   2.994
   79    HG   SER  11           HG       SER  11  -6.119  -8.067   1.494
   80    H    GLY  12           H        GLY  12  -5.091  -6.973   5.516
   81   1HA   GLY  12          1HA       GLY  12  -2.818  -6.638   5.817
   82   2HA   GLY  12          2HA       GLY  12  -2.668  -8.350   5.389
   83    H    MET  13           H        MET  13  -3.736  -5.592   3.349
   84    HA   MET  13           HA       MET  13  -1.408  -5.980   1.486
   85   1HB   MET  13          1HB       MET  13  -3.834  -4.209   1.362
   86   2HB   MET  13          2HB       MET  13  -2.627  -4.365   0.088
   87   1HG   MET  13          1HG       MET  13  -4.526  -6.552   1.065
   88   2HG   MET  13          2HG       MET  13  -4.724  -5.571  -0.381
   89   1HE   MET  13          2HE       MET  13  -5.198  -8.494  -0.710
   90   2HE   MET  13          1HE       MET  13  -5.055  -7.388  -2.098
   91   3HE   MET  13          3HE       MET  13  -4.162  -8.925  -2.091
   92    H    CYS  14           H        CYS  14   0.320  -4.443   1.467
   93    HA   CYS  14           HA       CYS  14   0.374  -2.773   3.893
   94   1HB   CYS  14          1HB       CYS  14   2.458  -2.776   1.657
   95   2HB   CYS  14          2HB       CYS  14   2.581  -2.191   3.289
   96    H    CYS  15           H        CYS  15  -0.051  -0.577   3.840
   97    HA   CYS  15           HA       CYS  15  -0.729   0.769   1.300
   98   1HB   CYS  15          1HB       CYS  15  -1.935   1.521   3.270
   99   2HB   CYS  15          2HB       CYS  15  -0.422   1.729   4.177
  100    H    SER  16           H        SER  16   0.901   1.303  -0.013
  101    HA   SER  16           HA       SER  16   3.577   0.888   0.622
  102   1HB   SER  16          2HB       SER  16   4.132   2.092  -1.464
  103   2HB   SER  16          1HB       SER  16   2.773   0.998  -1.689
  104    HG   SER  16           HG       SER  16   1.429   2.876  -1.217
  105    H    GLN  17           H        GLN  17   5.293   2.567   0.974
  106    HA   GLN  17           HA       GLN  17   4.648   4.991   2.336
  107   1HB   GLN  17          2HB       GLN  17   6.924   5.531   2.240
  108   2HB   GLN  17          1HB       GLN  17   6.735   3.794   2.551
  109   1HG   GLN  17          2HG       GLN  17   6.814   3.651  -0.095
  110   2HG   GLN  17          1HG       GLN  17   7.592   5.241   0.083
  111   1HE2  GLN  17          2HE2      GLN  17  10.374   3.647   2.015
  112   2HE2  GLN  17          1HE2      GLN  17   9.392   5.110   2.021
  113    H    PHE  18           H        PHE  18   4.475   4.245  -1.139
  114    HA   PHE  18           HA       PHE  18   4.583   6.876  -2.106
  115   1HB   PHE  18          2HB       PHE  18   3.783   4.335  -3.296
  116   2HB   PHE  18          1HB       PHE  18   4.511   5.708  -4.026
  117    HD1  PHE  18           HD1      PHE  18   6.889   6.348  -2.518
  118    HD2  PHE  18           HD2      PHE  18   5.320   2.505  -3.699
  119    HE1  PHE  18           HE1      PHE  18   9.156   5.366  -2.353
  120    HE2  PHE  18           HE2      PHE  18   7.601   1.550  -3.574
  121    HZ   PHE  18           HZ       PHE  18   9.509   2.951  -2.831
  122    H    GLY  19           H        GLY  19   2.146   5.335  -0.340
  123   1HA   GLY  19          1HA       GLY  19   0.039   5.913  -0.024
  124   2HA   GLY  19          2HA       GLY  19   0.243   7.081  -1.307
  125    H    TYR  20           H        TYR  20   0.978   4.036  -2.569
  126    HA   TYR  20           HA       TYR  20  -1.842   3.336  -3.337
  127   1HB   TYR  20          1HB       TYR  20   0.782   2.287  -4.452
  128   2HB   TYR  20          2HB       TYR  20  -0.806   1.858  -5.035
  129    HD1  TYR  20           HD1      TYR  20  -2.245   3.506  -6.247
  130    HD2  TYR  20           HD2      TYR  20   1.747   4.529  -4.969
  131    HE1  TYR  20           HE1      TYR  20  -2.443   5.716  -7.355
  132    HE2  TYR  20           HE2      TYR  20   1.492   6.769  -5.967
  133    HH   TYR  20           HH       TYR  20   0.066   8.231  -7.034
  134    H    CYS  21           H        CYS  21  -1.461   0.510  -3.551
  135    HA   CYS  21           HA       CYS  21  -0.259  -0.314  -1.057
  136   1HB   CYS  21          1HB       CYS  21  -2.082  -0.780   0.274
  137   2HB   CYS  21          2HB       CYS  21  -2.560   0.761  -0.429
  138    H    GLY  22           H        GLY  22  -0.327  -2.617  -0.636
  139   1HA   GLY  22          1HA       GLY  22  -1.596  -4.590  -1.996
  140   2HA   GLY  22          2HA       GLY  22  -0.204  -4.205  -3.019
  141    H    LYS  23           H        LYS  23  -0.566  -6.577  -1.552
  142    HA   LYS  23           HA       LYS  23   1.098  -6.548   0.865
  143   1HB   LYS  23          2HB       LYS  23  -0.859  -7.954   0.623
  144   2HB   LYS  23          1HB       LYS  23  -0.123  -8.841  -0.713
  145   1HG   LYS  23          2HG       LYS  23   1.722  -9.495   0.943
  146   2HG   LYS  23          1HG       LYS  23   0.728  -8.827   2.235
  147   1HD   LYS  23          2HD       LYS  23  -0.251 -10.968   0.267
  148   2HD   LYS  23          1HD       LYS  23   0.652 -11.370   1.717
  149   1HE   LYS  23          2HE       LYS  23  -1.784 -11.661   2.020
  150   2HE   LYS  23          1HE       LYS  23  -1.051 -10.554   3.191
  151   1HZ   LYS  23          1HZ       LYS  23  -2.485  -9.608   0.788
  152   2HZ   LYS  23          3HZ       LYS  23  -3.163  -9.728   2.288
  153   3HZ   LYS  23          2HZ       LYS  23  -1.903  -8.740   2.059
  154    H    GLY  24           H        GLY  24   3.104  -5.609  -0.343
  155   1HA   GLY  24          1HA       GLY  24   4.878  -7.692  -0.464
  156   2HA   GLY  24          2HA       GLY  24   4.486  -7.373  -2.174
  157    HA   PRO  25           HA       PRO  25   8.245  -4.942  -0.514
  158   1HB   PRO  25          2HB       PRO  25   9.213  -6.202  -3.091
  159   2HB   PRO  25          1HB       PRO  25  10.159  -5.797  -1.628
  160   1HG   PRO  25          2HG       PRO  25   9.331  -8.341  -2.006
  161   2HG   PRO  25          1HG       PRO  25   9.120  -7.586  -0.397
  162   1HD   PRO  25          2HD       PRO  25   7.050  -7.939  -2.578
  163   2HD   PRO  25          1HD       PRO  25   6.929  -8.230  -0.819
  164    H    LYS  26           H        LYS  26   6.487  -5.040  -3.591
  165    HA   LYS  26           HA       LYS  26   7.455  -2.676  -4.831
  166   1HB   LYS  26          2HB       LYS  26   4.672  -3.866  -4.576
  167   2HB   LYS  26          1HB       LYS  26   5.036  -2.438  -5.555
  168   1HG   LYS  26          2HG       LYS  26   6.565  -3.795  -6.974
  169   2HG   LYS  26          1HG       LYS  26   6.290  -5.196  -5.929
  170   1HD   LYS  26          2HD       LYS  26   4.853  -5.538  -7.777
  171   2HD   LYS  26          1HD       LYS  26   3.817  -5.017  -6.445
  172   1HE   LYS  26          2HE       LYS  26   4.108  -2.591  -7.511
  173   2HE   LYS  26          1HE       LYS  26   4.723  -3.470  -8.912
  174   1HZ   LYS  26          1HZ       LYS  26   2.550  -4.687  -8.845
  175   2HZ   LYS  26          3HZ       LYS  26   2.042  -3.607  -7.689
  176   3HZ   LYS  26          2HZ       LYS  26   2.442  -3.082  -9.188
  177    H    TYR  27           H        TYR  27   4.890  -3.102  -2.258
  178    HA   TYR  27           HA       TYR  27   4.497  -0.219  -2.280
  179   1HB   TYR  27          1HB       TYR  27   3.121  -2.478  -0.774
  180   2HB   TYR  27          2HB       TYR  27   2.591  -0.914  -0.809
  181    HD1  TYR  27           HD1      TYR  27   1.564   0.059  -3.070
  182    HD2  TYR  27           HD2      TYR  27   2.837  -4.048  -2.662
  183    HE1  TYR  27           HE1      TYR  27   0.779  -0.394  -5.329
  184    HE2  TYR  27           HE2      TYR  27   1.962  -4.515  -4.929
  185    HH   TYR  27           HH       TYR  27   0.367  -2.047  -6.889
  186    H    CYS  28           H        CYS  28   4.733  -2.714   0.233
  187    HA   CYS  28           HA       CYS  28   5.457  -0.940   2.307
  188   1HB   CYS  28          1HB       CYS  28   6.475  -3.426   3.124
  189   2HB   CYS  28          2HB       CYS  28   4.977  -2.667   3.555
  190    H    GLY  29           H        GLY  29   7.529  -3.613   1.292
  191   1HA   GLY  29          1HA       GLY  29   9.846  -3.825   1.128
  192   2HA   GLY  29          2HA       GLY  29   9.624  -2.478   0.026
  193    H    ARG  30           HN       ARG  30  11.148  -1.087   0.485
  194    HA   ARG  30           HA       ARG  30  12.452  -0.718   2.956
  195   1HB   ARG  30          1HB       ARG  30  13.683   1.070   2.048
  196   2HB   ARG  30          2HB       ARG  30  13.702  -0.375   1.053
  197   1HG   ARG  30          1HG       ARG  30  12.210   2.231   0.428
  198   2HG   ARG  30          2HG       ARG  30  13.686   1.607  -0.279
  199   1HD   ARG  30          1HD       ARG  30  12.233   0.963  -1.855
  200   2HD   ARG  30          2HD       ARG  30  12.307  -0.505  -0.862
  201    HE   ARG  30           HE       ARG  30  10.154   1.358  -0.075
  202   1HH1  ARG  30          1HH1      ARG  30  11.005  -0.847  -2.669
  203   2HH1  ARG  30          2HH1      ARG  30   9.452  -1.652  -2.685
  204   1HH2  ARG  30          2HH2      ARG  30   7.921   0.315  -0.251
  205   2HH2  ARG  30          1HH2      ARG  30   7.605  -0.264  -1.853
  No match found for entry  HXTARG          30
   
  No H/Q in entry =         206
  Start of MODEL          19
 Raw file had  213 H/Q atoms
  Start of MODEL   19
    1   1H    VAL   1          2H        VAL   1  -4.909  -0.704  -7.895
    2   2H    VAL   1          3H        VAL   1  -5.134  -2.282  -7.376
    3   3H    VAL   1          1H        VAL   1  -6.273  -1.493  -8.299
    4    HA   VAL   1           HA       VAL   1  -7.164  -1.274  -6.207
    5    HB   VAL   1           HB       VAL   1  -5.837  -0.531  -4.278
    6   1HG1  VAL   1          3HG1      VAL   1  -6.122  -2.963  -4.713
    7   2HG1  VAL   1          2HG1      VAL   1  -4.559  -2.988  -5.562
    8   3HG1  VAL   1          1HG1      VAL   1  -4.626  -2.589  -3.846
    9   1HG2  VAL   1          3HG2      VAL   1  -4.044   0.742  -5.452
   10   2HG2  VAL   1          2HG2      VAL   1  -3.407  -0.441  -4.315
   11   3HG2  VAL   1          1HG2      VAL   1  -3.362  -0.787  -6.050
   12    H    GLY   2           H        GLY   2  -7.617   0.963  -5.049
   13   1HA   GLY   2          1HA       GLY   2  -7.335   3.157  -6.997
   14   2HA   GLY   2          2HA       GLY   2  -8.169   3.198  -5.436
   15    H    GLU   3           H        GLU   3  -6.881   3.327  -3.456
   16    HA   GLU   3           HA       GLU   3  -4.057   3.552  -3.433
   17   1HB   GLU   3          2HB       GLU   3  -5.830   6.018  -3.062
   18   2HB   GLU   3          1HB       GLU   3  -4.364   5.815  -2.119
   19   1HG   GLU   3          2HG       GLU   3  -3.134   5.438  -4.377
   20   2HG   GLU   3          1HG       GLU   3  -4.597   6.089  -5.135
   21    HE1  GLU   3           HE2      GLU   3  -2.477   6.754  -2.466
   22    H    CYS   4           H        CYS   4  -3.618   4.003  -0.951
   23    HA   CYS   4           HA       CYS   4  -5.462   2.329   0.636
   24   1HB   CYS   4          1HB       CYS   4  -3.087   3.974   1.450
   25   2HB   CYS   4          2HB       CYS   4  -4.188   3.415   2.629
   26    H    VAL   5           H        VAL   5  -6.303   3.159   2.575
   27    HA   VAL   5           HA       VAL   5  -7.891   5.684   2.195
   28    HB   VAL   5           HB       VAL   5  -8.786   2.978   3.264
   29   1HG1  VAL   5          2HG1      VAL   5 -10.307   5.608   2.879
   30   2HG1  VAL   5          1HG1      VAL   5 -11.046   4.055   3.321
   31   3HG1  VAL   5          3HG1      VAL   5  -9.931   4.848   4.439
   32   1HG2  VAL   5          3HG2      VAL   5  -9.472   4.485   0.700
   33   2HG2  VAL   5          2HG2      VAL   5  -8.578   2.955   0.817
   34   3HG2  VAL   5          1HG2      VAL   5 -10.287   3.011   1.266
   35    H    ARG   6           H        ARG   6  -6.589   6.893   3.494
   36    HA   ARG   6           HA       ARG   6  -5.409   7.603   5.329
   37   1HB   ARG   6          2HB       ARG   6  -7.816   6.406   6.749
   38   2HB   ARG   6          1HB       ARG   6  -6.610   7.473   7.500
   39   1HG   ARG   6          2HG       ARG   6  -7.134   9.220   5.787
   40   2HG   ARG   6          1HG       ARG   6  -8.402   8.172   5.130
   41   1HD   ARG   6          2HD       ARG   6  -9.574   8.177   7.293
   42   2HD   ARG   6          1HD       ARG   6  -8.344   9.208   8.014
   43    HE   ARG   6           HE       ARG   6 -10.538   9.940   6.240
   44   1HH1  ARG   6          2HH1      ARG   6  -7.335  10.950   7.304
   45   2HH1  ARG   6          1HH1      ARG   6  -7.584  12.643   7.005
   46   1HH2  ARG   6          1HH2      ARG   6 -10.908  12.178   5.803
   47   2HH2  ARG   6          2HH2      ARG   6  -9.667  13.346   6.109
   48    H    GLY   7           H        GLY   7  -4.215   5.602   4.283
   49   1HA   GLY   7          1HA       GLY   7  -2.436   4.288   4.661
   50   2HA   GLY   7          2HA       GLY   7  -2.558   4.713   6.369
   51    H    ARG   8           H        ARG   8  -5.174   2.973   4.603
   52    HA   ARG   8           HA       ARG   8  -4.448   0.415   5.765
   53   1HB   ARG   8          2HB       ARG   8  -7.162   1.746   5.945
   54   2HB   ARG   8          1HB       ARG   8  -6.739   0.092   6.461
   55   1HG   ARG   8          2HG       ARG   8  -4.886   1.124   7.848
   56   2HG   ARG   8          1HG       ARG   8  -5.539   2.682   7.483
   57   1HD   ARG   8          2HD       ARG   8  -6.904   0.455   9.008
   58   2HD   ARG   8          1HD       ARG   8  -6.352   1.994   9.678
   59    HE   ARG   8           HE       ARG   8  -8.845   1.414   8.359
   60   1HH1  ARG   8          1HH2      ARG   8  -6.507   4.135   8.357
   61   2HH1  ARG   8          2HH2      ARG   8  -7.719   5.317   8.635
   62   1HH2  ARG   8          2HH1      ARG   8 -10.437   3.050   8.360
   63   2HH2  ARG   8          1HH1      ARG   8  -9.989   4.723   8.386
   64    H    CYS   9           H        CYS   9  -4.969  -1.157   4.276
   65    HA   CYS   9           HA       CYS   9  -6.873  -0.644   2.076
   66   1HB   CYS   9          1HB       CYS   9  -4.015  -1.464   1.738
   67   2HB   CYS   9          2HB       CYS   9  -5.177  -2.516   0.963
   68    HA   PRO  10           HA       PRO  10  -8.641  -4.462   3.298
   69   1HB   PRO  10          2HB       PRO  10  -8.289  -5.595   0.527
   70   2HB   PRO  10          1HB       PRO  10  -9.773  -5.524   1.519
   71   1HG   PRO  10          2HG       PRO  10  -9.416  -3.799  -0.516
   72   2HG   PRO  10          1HG       PRO  10 -10.042  -3.184   1.045
   73   1HD   PRO  10          2HD       PRO  10  -7.187  -3.095   0.022
   74   2HD   PRO  10          1HD       PRO  10  -8.162  -1.780   0.737
   75    H    SER  11           H        SER  11  -8.396  -6.802   3.328
   76    HA   SER  11           HA       SER  11  -7.062  -8.455   4.279
   77   1HB   SER  11          2HB       SER  11  -6.453  -9.905   2.294
   78   2HB   SER  11          1HB       SER  11  -8.051  -9.162   2.123
   79    HG   SER  11           HG       SER  11  -5.653  -8.095   1.040
   80    H    GLY  12           H        GLY  12  -5.667  -6.536   4.989
   81   1HA   GLY  12          1HA       GLY  12  -3.575  -5.870   5.728
   82   2HA   GLY  12          2HA       GLY  12  -3.164  -7.591   5.655
   83    H    MET  13           H        MET  13  -3.933  -5.241   3.034
   84    HA   MET  13           HA       MET  13  -1.392  -5.785   1.611
   85   1HB   MET  13          1HB       MET  13  -3.547  -3.752   1.244
   86   2HB   MET  13          2HB       MET  13  -2.132  -3.865   0.199
   87   1HG   MET  13          1HG       MET  13  -2.776  -6.149  -0.462
   88   2HG   MET  13          2HG       MET  13  -4.176  -6.085   0.607
   89   1HE   MET  13          1HE       MET  13  -4.762  -7.062  -2.104
   90   2HE   MET  13          3HE       MET  13  -6.093  -6.563  -1.027
   91   3HE   MET  13          2HE       MET  13  -6.063  -6.013  -2.717
   92    H    CYS  14           H        CYS  14   0.424  -4.309   1.501
   93    HA   CYS  14           HA       CYS  14   0.644  -2.515   3.869
   94   1HB   CYS  14          1HB       CYS  14   2.638  -3.176   1.668
   95   2HB   CYS  14          2HB       CYS  14   2.890  -2.071   3.016
   96    H    CYS  15           H        CYS  15   0.534  -0.284   3.590
   97    HA   CYS  15           HA       CYS  15  -0.239   0.812   0.991
   98   1HB   CYS  15          1HB       CYS  15   0.545   2.297   3.507
   99   2HB   CYS  15          2HB       CYS  15  -0.251   2.960   2.073
  100    H    SER  16           H        SER  16   1.219   1.405  -0.505
  101    HA   SER  16           HA       SER  16   4.003   1.044  -0.172
  102   1HB   SER  16          2HB       SER  16   4.227   2.403  -2.281
  103   2HB   SER  16          1HB       SER  16   3.178   1.029  -2.421
  104    HG   SER  16           HG       SER  16   1.458   2.667  -1.781
  105    H    GLN  17           H        GLN  17   5.660   2.835  -0.180
  106    HA   GLN  17           HA       GLN  17   5.183   5.195   1.321
  107   1HB   GLN  17          2HB       GLN  17   7.324   5.932   0.682
  108   2HB   GLN  17          1HB       GLN  17   7.372   4.189   0.997
  109   1HG   GLN  17          2HG       GLN  17   6.956   3.893  -1.514
  110   2HG   GLN  17          1HG       GLN  17   7.245   5.645  -1.638
  111   1HE2  GLN  17          2HE2      GLN  17  10.793   5.285  -1.544
  112   2HE2  GLN  17          1HE2      GLN  17   9.420   6.354  -1.730
  113    H    PHE  18           H        PHE  18   4.412   4.483  -2.097
  114    HA   PHE  18           HA       PHE  18   4.143   7.113  -3.000
  115   1HB   PHE  18          2HB       PHE  18   3.250   4.551  -4.072
  116   2HB   PHE  18          1HB       PHE  18   3.776   5.964  -4.897
  117    HD1  PHE  18           HD1      PHE  18   6.351   6.713  -4.198
  118    HD2  PHE  18           HD2      PHE  18   4.744   2.726  -4.519
  119    HE1  PHE  18           HE1      PHE  18   8.646   5.793  -4.419
  120    HE2  PHE  18           HE2      PHE  18   7.042   1.799  -4.561
  121    HZ   PHE  18           HZ       PHE  18   8.999   3.334  -4.527
  122    H    GLY  19           H        GLY  19   2.208   5.382  -0.826
  123   1HA   GLY  19          1HA       GLY  19   0.144   5.691  -0.112
  124   2HA   GLY  19          2HA       GLY  19   0.022   6.975  -1.299
  125    H    TYR  20           H        TYR  20   0.806   4.044  -2.833
  126    HA   TYR  20           HA       TYR  20  -2.028   3.232  -3.323
  127   1HB   TYR  20          1HB       TYR  20   0.525   2.390  -4.720
  128   2HB   TYR  20          2HB       TYR  20  -1.062   1.769  -5.095
  129    HD1  TYR  20           HD1      TYR  20   1.029   4.843  -5.218
  130    HD2  TYR  20           HD2      TYR  20  -2.660   2.978  -6.428
  131    HE1  TYR  20           HE1      TYR  20   0.465   6.839  -6.573
  132    HE2  TYR  20           HE2      TYR  20  -3.221   4.964  -7.785
  133    HH   TYR  20           HH       TYR  20  -2.608   7.116  -8.372
  134    H    CYS  21           H        CYS  21  -1.466   0.420  -3.662
  135    HA   CYS  21           HA       CYS  21  -0.213  -0.383  -1.174
  136   1HB   CYS  21          1HB       CYS  21  -2.070  -0.886   0.120
  137   2HB   CYS  21          2HB       CYS  21  -2.547   0.640  -0.641
  138    H    GLY  22           H        GLY  22  -0.116  -2.641  -0.785
  139   1HA   GLY  22          1HA       GLY  22  -1.312  -4.616  -2.264
  140   2HA   GLY  22          2HA       GLY  22   0.225  -4.228  -3.087
  141    H    LYS  23           H        LYS  23  -0.497  -6.609  -1.527
  142    HA   LYS  23           HA       LYS  23   1.064  -6.465   0.969
  143   1HB   LYS  23          2HB       LYS  23  -0.986  -7.886   0.728
  144   2HB   LYS  23          1HB       LYS  23  -0.121  -8.883  -0.447
  145   1HG   LYS  23          2HG       LYS  23   1.661  -9.240   1.397
  146   2HG   LYS  23          1HG       LYS  23   0.534  -8.487   2.515
  147   1HD   LYS  23          2HD       LYS  23   0.120 -10.996   0.801
  148   2HD   LYS  23          1HD       LYS  23   0.440 -10.988   2.533
  149   1HE   LYS  23          2HE       LYS  23  -2.066  -9.900   1.145
  150   2HE   LYS  23          1HE       LYS  23  -1.949 -11.407   2.053
  151   1HZ   LYS  23          3HZ       LYS  23  -1.512  -8.728   3.216
  152   2HZ   LYS  23          2HZ       LYS  23  -2.900  -9.567   3.301
  153   3HZ   LYS  23          1HZ       LYS  23  -1.543 -10.153   4.040
  154    H    GLY  24           H        GLY  24   2.994  -5.581  -0.404
  155   1HA   GLY  24          1HA       GLY  24   4.773  -7.764  -0.508
  156   2HA   GLY  24          2HA       GLY  24   4.442  -7.234  -2.173
  157    HA   PRO  25           HA       PRO  25   8.013  -5.032   0.236
  158   1HB   PRO  25          2HB       PRO  25   9.449  -6.117  -2.200
  159   2HB   PRO  25          1HB       PRO  25  10.097  -5.828  -0.560
  160   1HG   PRO  25          2HG       PRO  25   9.370  -8.330  -1.282
  161   2HG   PRO  25          1HG       PRO  25   8.867  -7.699   0.314
  162   1HD   PRO  25          2HD       PRO  25   7.226  -7.863  -2.225
  163   2HD   PRO  25          1HD       PRO  25   6.797  -8.298  -0.549
  164    H    LYS  26           H        LYS  26   7.235  -5.117  -3.249
  165    HA   LYS  26           HA       LYS  26   8.478  -2.786  -4.147
  166   1HB   LYS  26          2HB       LYS  26   5.802  -4.009  -4.948
  167   2HB   LYS  26          1HB       LYS  26   6.613  -2.701  -5.826
  168   1HG   LYS  26          2HG       LYS  26   8.562  -4.142  -6.271
  169   2HG   LYS  26          1HG       LYS  26   7.872  -5.431  -5.299
  170   1HD   LYS  26          2HD       LYS  26   7.537  -5.902  -7.676
  171   2HD   LYS  26          1HD       LYS  26   6.017  -5.759  -6.800
  172   1HE   LYS  26          2HE       LYS  26   5.902  -4.693  -9.019
  173   2HE   LYS  26          1HE       LYS  26   5.582  -3.545  -7.721
  174   1HZ   LYS  26          3HZ       LYS  26   8.151  -3.836  -9.149
  175   2HZ   LYS  26          2HZ       LYS  26   7.046  -2.642  -9.386
  176   3HZ   LYS  26          1HZ       LYS  26   7.837  -2.748  -7.951
  177    H    TYR  27           H        TYR  27   5.484  -3.105  -2.229
  178    HA   TYR  27           HA       TYR  27   5.045  -0.187  -2.286
  179   1HB   TYR  27          1HB       TYR  27   3.505  -2.489  -0.992
  180   2HB   TYR  27          2HB       TYR  27   3.066  -0.895  -0.983
  181    HD1  TYR  27           HD2      TYR  27   3.666  -3.838  -3.208
  182    HD2  TYR  27           HD1      TYR  27   1.507  -0.139  -2.782
  183    HE1  TYR  27           HE2      TYR  27   2.549  -4.214  -5.387
  184    HE2  TYR  27           HE1      TYR  27   0.528  -0.436  -5.012
  185    HH   TYR  27           HH       TYR  27   0.267  -1.862  -6.797
  186    H    CYS  28           H        CYS  28   5.120  -2.897  -0.092
  187    HA   CYS  28           HA       CYS  28   5.134  -1.531   2.253
  188   1HB   CYS  28          1HB       CYS  28   4.958  -4.137   1.680
  189   2HB   CYS  28          2HB       CYS  28   6.624  -4.157   2.253
  190    H    GLY  29           H        GLY  29   8.022  -2.780   0.670
  191   1HA   GLY  29          1HA       GLY  29  10.185  -2.459   0.827
  192   2HA   GLY  29          2HA       GLY  29   9.727  -0.751   0.795
  193    H    ARG  30           HN       ARG  30   8.847  -1.563   3.615
  194    HA   ARG  30           HA       ARG  30  11.397  -1.025   5.075
  195   1HB   ARG  30          1HB       ARG  30   8.565  -0.129   5.491
  196   2HB   ARG  30          2HB       ARG  30   9.845   0.067   6.702
  197   1HG   ARG  30          1HG       ARG  30  10.881   1.696   5.588
  198   2HG   ARG  30          2HG       ARG  30  10.820   0.873   4.027
  199   1HD   ARG  30          1HD       ARG  30   8.376   2.146   5.203
  200   2HD   ARG  30          2HD       ARG  30   9.561   3.101   4.314
  201    HE   ARG  30           HE       ARG  30   7.819   0.896   3.283
  202   1HH1  ARG  30          1HH2      ARG  30  10.486   3.058   2.577
  203   2HH1  ARG  30          2HH2      ARG  30  10.205   3.138   0.847
  204   1HH2  ARG  30          1HH1      ARG  30   7.451   0.918   0.821
  205   2HH2  ARG  30          2HH1      ARG  30   8.557   1.898  -0.081
  No match found for entry  HXTARG          30
   
  No H/Q in entry =         206
  Start of MODEL          20
 Raw file had  213 H/Q atoms
  Start of MODEL   20
    1   1H    VAL   1          3H        VAL   1  -4.334  -2.498  -5.577
    2   2H    VAL   1          1H        VAL   1  -3.005  -2.639  -6.581
    3   3H    VAL   1          2H        VAL   1  -2.881  -1.979  -5.064
    4    HA   VAL   1           HA       VAL   1  -3.054  -0.042  -6.215
    5    HB   VAL   1           HB       VAL   1  -4.481   0.192  -8.241
    6   1HG1  VAL   1          3HG1      VAL   1  -2.063  -0.301  -8.419
    7   2HG1  VAL   1          2HG1      VAL   1  -2.419  -2.041  -8.476
    8   3HG1  VAL   1          1HG1      VAL   1  -2.998  -0.973  -9.764
    9   1HG2  VAL   1          2HG2      VAL   1  -6.107  -1.645  -7.808
   10   2HG2  VAL   1          1HG2      VAL   1  -5.344  -1.776  -9.398
   11   3HG2  VAL   1          3HG2      VAL   1  -4.822  -2.842  -8.085
   12    H    GLY   2           H        GLY   2  -5.112   1.544  -6.496
   13   1HA   GLY   2          1HA       GLY   2  -7.573   1.510  -6.010
   14   2HA   GLY   2          2HA       GLY   2  -7.172   0.772  -4.452
   15    H    GLU   3           H        GLU   3  -5.075   2.026  -3.590
   16    HA   GLU   3           HA       GLU   3  -4.097   4.142  -3.006
   17   1HB   GLU   3          2HB       GLU   3  -5.402   5.454  -4.418
   18   2HB   GLU   3          1HB       GLU   3  -6.727   5.400  -3.181
   19   1HG   GLU   3          2HG       GLU   3  -5.126   6.467  -1.569
   20   2HG   GLU   3          1HG       GLU   3  -3.937   6.583  -2.879
   21    HE1  GLU   3           HE2      GLU   3  -5.893   9.019  -4.638
   22    H    CYS   4           H        CYS   4  -3.775   4.420  -0.870
   23    HA   CYS   4           HA       CYS   4  -5.174   2.607   0.947
   24   1HB   CYS   4          1HB       CYS   4  -3.519   4.855   1.986
   25   2HB   CYS   4          2HB       CYS   4  -3.636   3.247   2.626
   26    H    VAL   5           H        VAL   5  -6.384   3.053   2.682
   27    HA   VAL   5           HA       VAL   5  -8.005   5.540   2.553
   28    HB   VAL   5           HB       VAL   5  -8.426   3.069   4.252
   29   1HG1  VAL   5          1HG1      VAL   5 -10.140   5.509   3.598
   30   2HG1  VAL   5          3HG1      VAL   5 -10.663   4.098   4.548
   31   3HG1  VAL   5          2HG1      VAL   5  -9.396   5.169   5.173
   32   1HG2  VAL   5          1HG2      VAL   5  -9.577   3.948   1.577
   33   2HG2  VAL   5          3HG2      VAL   5  -8.629   2.485   1.898
   34   3HG2  VAL   5          2HG2      VAL   5 -10.248   2.644   2.586
   35    H    ARG   6           H        ARG   6  -5.961   6.413   2.817
   36    HA   ARG   6           HA       ARG   6  -4.206   7.423   3.852
   37   1HB   ARG   6          2HB       ARG   6  -6.533   8.077   5.698
   38   2HB   ARG   6          1HB       ARG   6  -4.919   8.789   5.850
   39   1HG   ARG   6          2HG       ARG   6  -6.047  10.346   4.541
   40   2HG   ARG   6          1HG       ARG   6  -5.041   9.461   3.406
   41   1HD   ARG   6          2HD       ARG   6  -7.296   8.084   2.926
   42   2HD   ARG   6          1HD       ARG   6  -8.045   9.405   3.779
   43    HE   ARG   6           HE       ARG   6  -7.367  10.927   2.106
   44   1HH1  ARG   6          1HH2      ARG   6  -6.525   7.512   1.069
   45   2HH1  ARG   6          2HH2      ARG   6  -6.439   8.039  -0.570
   46   1HH2  ARG   6          2HH1      ARG   6  -7.145  11.392  -0.165
   47   2HH2  ARG   6          1HH1      ARG   6  -6.713  10.080  -1.242
   48    H    GLY   7           H        GLY   7  -3.706   5.034   3.962
   49   1HA   GLY   7          1HA       GLY   7  -1.863   4.042   4.901
   50   2HA   GLY   7          2HA       GLY   7  -2.407   4.533   6.503
   51    H    ARG   8           H        ARG   8  -5.196   3.437   5.238
   52    HA   ARG   8           HA       ARG   8  -4.906   0.750   6.403
   53   1HB   ARG   8          2HB       ARG   8  -7.300   2.480   5.956
   54   2HB   ARG   8          1HB       ARG   8  -7.248   0.914   6.784
   55   1HG   ARG   8          2HG       ARG   8  -5.758   1.823   8.496
   56   2HG   ARG   8          1HG       ARG   8  -5.576   3.335   7.633
   57   1HD   ARG   8          2HD       ARG   8  -8.151   3.560   7.765
   58   2HD   ARG   8          1HD       ARG   8  -8.053   2.255   8.958
   59    HE   ARG   8           HE       ARG   8  -7.364   3.807  10.516
   60   1HH1  ARG   8          1HH2      ARG   8  -6.738   5.171   7.290
   61   2HH1  ARG   8          2HH2      ARG   8  -5.623   6.353   7.858
   62   1HH2  ARG   8          2HH1      ARG   8  -6.242   5.686  11.313
   63   2HH2  ARG   8          1HH1      ARG   8  -5.652   6.878  10.198
   64    H    CYS   9           H        CYS   9  -4.530  -0.622   4.801
   65    HA   CYS   9           HA       CYS   9  -6.008  -0.501   2.217
   66   1HB   CYS   9          1HB       CYS   9  -3.358  -1.731   2.974
   67   2HB   CYS   9          2HB       CYS   9  -4.155  -2.062   1.470
   68    HA   PRO  10           HA       PRO  10  -7.989  -4.176   3.582
   69   1HB   PRO  10          2HB       PRO  10  -9.050  -5.193   1.312
   70   2HB   PRO  10          1HB       PRO  10  -9.419  -3.534   1.848
   71   1HG   PRO  10          2HG       PRO  10  -7.394  -4.426  -0.225
   72   2HG   PRO  10          1HG       PRO  10  -8.592  -3.109  -0.357
   73   1HD   PRO  10          2HD       PRO  10  -5.919  -2.807   0.376
   74   2HD   PRO  10          1HD       PRO  10  -7.176  -1.642   0.841
   75    H    SER  11           H        SER  11  -8.250  -6.547   3.211
   76    HA   SER  11           HA       SER  11  -7.220  -8.551   3.571
   77   1HB   SER  11          2HB       SER  11  -6.778  -9.563   1.304
   78   2HB   SER  11          1HB       SER  11  -8.204  -8.510   1.281
   79    HG   SER  11           HG       SER  11  -6.187  -6.929   0.740
   80    H    GLY  12           H        GLY  12  -5.629  -6.957   4.645
   81   1HA   GLY  12          1HA       GLY  12  -3.459  -6.555   5.408
   82   2HA   GLY  12          2HA       GLY  12  -3.187  -8.272   5.062
   83    H    MET  13           H        MET  13  -3.896  -5.593   2.766
   84    HA   MET  13           HA       MET  13  -1.315  -6.017   1.329
   85   1HB   MET  13          1HB       MET  13  -3.692  -4.159   0.912
   86   2HB   MET  13          2HB       MET  13  -2.218  -4.099  -0.048
   87   1HG   MET  13          1HG       MET  13  -2.591  -6.405  -0.816
   88   2HG   MET  13          2HG       MET  13  -4.050  -6.516   0.171
   89   1HE   MET  13          3HE       MET  13  -5.361  -7.359  -1.963
   90   2HE   MET  13          2HE       MET  13  -5.424  -6.465  -3.497
   91   3HE   MET  13          1HE       MET  13  -3.893  -7.195  -2.959
   92    H    CYS  14           H        CYS  14   0.270  -4.309   1.182
   93    HA   CYS  14           HA       CYS  14   0.405  -2.770   3.712
   94   1HB   CYS  14          1HB       CYS  14   2.482  -3.200   1.544
   95   2HB   CYS  14          2HB       CYS  14   2.685  -2.367   3.079
   96    H    CYS  15           H        CYS  15   0.278  -0.549   3.703
   97    HA   CYS  15           HA       CYS  15  -0.569   0.826   1.275
   98   1HB   CYS  15          1HB       CYS  15  -1.450   1.568   3.446
   99   2HB   CYS  15          2HB       CYS  15   0.194   1.909   4.018
  100    H    SER  16           H        SER  16   0.772   1.395  -0.204
  101    HA   SER  16           HA       SER  16   3.511   0.837  -0.142
  102   1HB   SER  16          2HB       SER  16   3.446   1.621  -2.477
  103   2HB   SER  16          1HB       SER  16   1.968   0.715  -2.092
  104    HG   SER  16           HG       SER  16   0.937   2.653  -1.684
  105    H    GLN  17           H        GLN  17   5.049   2.502  -1.320
  106    HA   GLN  17           HA       GLN  17   5.415   4.940   0.207
  107   1HB   GLN  17          2HB       GLN  17   7.342   5.312  -1.055
  108   2HB   GLN  17          1HB       GLN  17   7.294   3.620  -0.520
  109   1HG   GLN  17          2HG       GLN  17   6.308   3.027  -2.746
  110   2HG   GLN  17          1HG       GLN  17   6.534   4.733  -3.208
  111   1HE2  GLN  17          2HE2      GLN  17   9.757   2.192  -3.221
  112   2HE2  GLN  17          1HE2      GLN  17   8.203   1.598  -2.666
  113    H    PHE  18           H        PHE  18   3.692   4.059  -2.810
  114    HA   PHE  18           HA       PHE  18   3.528   6.654  -3.889
  115   1HB   PHE  18          2HB       PHE  18   2.400   4.023  -4.481
  116   2HB   PHE  18          1HB       PHE  18   2.580   5.345  -5.559
  117    HD1  PHE  18           HD2      PHE  18   5.166   6.260  -5.753
  118    HD2  PHE  18           HD1      PHE  18   3.922   2.234  -4.845
  119    HE1  PHE  18           HE2      PHE  18   7.401   5.417  -6.415
  120    HE2  PHE  18           HE1      PHE  18   6.181   1.400  -5.474
  121    HZ   PHE  18           HZ       PHE  18   7.914   2.993  -6.268
  122    H    GLY  19           H        GLY  19   1.975   5.460  -1.249
  123   1HA   GLY  19          1HA       GLY  19  -0.015   5.644  -0.268
  124   2HA   GLY  19          2HA       GLY  19  -0.326   6.900  -1.456
  125    H    TYR  20           H        TYR  20   0.344   3.848  -2.878
  126    HA   TYR  20           HA       TYR  20  -2.513   3.067  -3.209
  127   1HB   TYR  20          1HB       TYR  20  -0.026   2.043  -4.575
  128   2HB   TYR  20          2HB       TYR  20  -1.649   1.594  -4.996
  129    HD1  TYR  20           HD2      TYR  20  -3.250   3.964  -5.228
  130    HD2  TYR  20           HD1      TYR  20   0.893   3.396  -6.287
  131    HE1  TYR  20           HE2      TYR  20  -3.342   5.970  -6.655
  132    HE2  TYR  20           HE1      TYR  20   0.786   5.400  -7.741
  133    HH   TYR  20           HH       TYR  20  -2.163   7.391  -8.045
  134    H    CYS  21           H        CYS  21  -2.314   0.429  -3.508
  135    HA   CYS  21           HA       CYS  21  -1.490  -0.529  -0.783
  136   1HB   CYS  21          1HB       CYS  21  -4.092  -0.980  -2.320
  137   2HB   CYS  21          2HB       CYS  21  -3.606  -1.887  -0.890
  138    H    GLY  22           H        GLY  22  -0.367  -2.561  -0.859
  139   1HA   GLY  22          1HA       GLY  22  -1.355  -4.619  -2.399
  140   2HA   GLY  22          2HA       GLY  22   0.091  -4.027  -3.238
  141    H    LYS  23           H        LYS  23  -0.383  -6.519  -1.796
  142    HA   LYS  23           HA       LYS  23   1.210  -6.434   0.674
  143   1HB   LYS  23          2HB       LYS  23  -0.785  -7.931   0.330
  144   2HB   LYS  23          1HB       LYS  23   0.140  -8.833  -0.863
  145   1HG   LYS  23          2HG       LYS  23   1.899  -9.217   0.948
  146   2HG   LYS  23          1HG       LYS  23   0.773  -8.558   2.130
  147   1HD   LYS  23          2HD       LYS  23   0.044 -10.891   0.283
  148   2HD   LYS  23          1HD       LYS  23   1.002 -11.143   1.732
  149   1HE   LYS  23          2HE       LYS  23  -1.392 -11.640   2.101
  150   2HE   LYS  23          1HE       LYS  23  -0.745 -10.415   3.205
  151   1HZ   LYS  23          2HZ       LYS  23  -2.274  -9.745   0.778
  152   2HZ   LYS  23          1HZ       LYS  23  -2.943  -9.810   2.275
  153   3HZ   LYS  23          3HZ       LYS  23  -1.761  -8.741   1.987
  154    H    GLY  24           H        GLY  24   3.175  -5.447  -0.574
  155   1HA   GLY  24          1HA       GLY  24   4.940  -7.629  -1.015
  156   2HA   GLY  24          2HA       GLY  24   4.624  -6.796  -2.551
  157    HA   PRO  25           HA       PRO  25   8.061  -5.184   0.485
  158   1HB   PRO  25          2HB       PRO  25   9.758  -5.754  -1.961
  159   2HB   PRO  25          1HB       PRO  25  10.222  -5.831  -0.237
  160   1HG   PRO  25          2HG       PRO  25   9.576  -8.107  -1.547
  161   2HG   PRO  25          1HG       PRO  25   8.905  -7.813   0.085
  162   1HD   PRO  25          2HD       PRO  25   7.540  -7.411  -2.588
  163   2HD   PRO  25          1HD       PRO  25   6.938  -8.172  -1.096
  164    H    LYS  26           H        LYS  26   7.896  -4.454  -3.026
  165    HA   LYS  26           HA       LYS  26   9.180  -1.973  -3.064
  166   1HB   LYS  26          2HB       LYS  26   6.831  -3.020  -4.702
  167   2HB   LYS  26          1HB       LYS  26   7.677  -1.510  -5.062
  168   1HG   LYS  26          2HG       LYS  26   9.829  -2.759  -5.286
  169   2HG   LYS  26          1HG       LYS  26   8.998  -4.265  -4.900
  170   1HD   LYS  26          2HD       LYS  26   9.295  -4.212  -7.245
  171   2HD   LYS  26          1HD       LYS  26   7.565  -3.997  -6.927
  172   1HE   LYS  26          2HE       LYS  26   7.752  -1.573  -7.362
  173   2HE   LYS  26          1HE       LYS  26   9.515  -1.697  -7.486
  174   1HZ   LYS  26          3HZ       LYS  26   7.584  -2.941  -9.331
  175   2HZ   LYS  26          2HZ       LYS  26   8.475  -1.594  -9.626
  176   3HZ   LYS  26          1HZ       LYS  26   9.224  -3.044  -9.449
  177    H    TYR  27           H        TYR  27   5.942  -2.745  -1.904
  178    HA   TYR  27           HA       TYR  27   5.244   0.113  -1.502
  179   1HB   TYR  27          1HB       TYR  27   3.818  -2.560  -1.309
  180   2HB   TYR  27          2HB       TYR  27   3.068  -1.171  -0.802
  181    HD1  TYR  27           HD2      TYR  27   5.011  -0.181  -3.728
  182    HD2  TYR  27           HD1      TYR  27   1.548  -2.418  -2.554
  183    HE1  TYR  27           HE2      TYR  27   4.144  -0.025  -6.020
  184    HE2  TYR  27           HE1      TYR  27   0.608  -2.176  -4.859
  185    HH   TYR  27           HH       TYR  27   1.030  -1.430  -7.014
  186    H    CYS  28           H        CYS  28   5.264  -2.977   0.136
  187    HA   CYS  28           HA       CYS  28   4.782  -2.038   2.666
  188   1HB   CYS  28          1HB       CYS  28   4.851  -4.514   1.664
  189   2HB   CYS  28          2HB       CYS  28   6.429  -4.547   2.468
  190    H    GLY  29           H        GLY  29   7.971  -2.068   1.202
  191   1HA   GLY  29          1HA       GLY  29   9.570  -1.666   3.402
  192   2HA   GLY  29          2HA       GLY  29   9.794  -0.874   1.833
  193    H    ARG  30           HN       ARG  30  10.441   0.662   4.085
  194    HA   ARG  30           HA       ARG  30   9.721   2.108   5.729
  195   1HB   ARG  30          1HB       ARG  30   9.557   4.288   4.947
  196   2HB   ARG  30          2HB       ARG  30  10.848   3.330   4.247
  197   1HG   ARG  30          1HG       ARG  30  10.028   4.664   2.550
  198   2HG   ARG  30          2HG       ARG  30   9.521   3.020   2.162
  199   1HD   ARG  30          1HD       ARG  30   7.700   4.826   3.788
  200   2HD   ARG  30          2HD       ARG  30   7.855   5.114   2.035
  201    HE   ARG  30           HE       ARG  30   7.478   2.381   2.433
  202   1HH1  ARG  30          1HH1      ARG  30   5.456   5.227   2.819
  203   2HH1  ARG  30          2HH1      ARG  30   4.031   4.389   2.228
  204   1HH2  ARG  30          1HH2      ARG  30   5.576   1.189   2.278
  205   2HH2  ARG  30          2HH2      ARG  30   4.054   1.936   2.615
  No match found for entry  HXTARG          30
   
  No H/Q in entry =         206
  Start of MODEL          21
 Raw file had  213 H/Q atoms
  Start of MODEL   21
    1   1H    VAL   1          3H        VAL   1  -1.517  -2.427  -4.911
    2   2H    VAL   1          1H        VAL   1  -2.183  -3.445  -6.008
    3   3H    VAL   1          2H        VAL   1  -0.872  -2.476  -6.434
    4    HA   VAL   1           HA       VAL   1  -2.172  -0.525  -6.068
    5    HB   VAL   1           HB       VAL   1  -3.842  -0.723  -7.876
    6   1HG1  VAL   1          3HG1      VAL   1  -1.427  -0.410  -8.398
    7   2HG1  VAL   1          2HG1      VAL   1  -1.269  -2.171  -8.611
    8   3HG1  VAL   1          1HG1      VAL   1  -2.331  -1.238  -9.676
    9   1HG2  VAL   1          3HG2      VAL   1  -4.711  -3.006  -7.393
   10   2HG2  VAL   1          2HG2      VAL   1  -4.197  -2.818  -9.074
   11   3HG2  VAL   1          1HG2      VAL   1  -3.168  -3.701  -7.937
   12    H    GLY   2           H        GLY   2  -4.657   0.185  -6.009
   13   1HA   GLY   2          1HA       GLY   2  -6.814  -0.745  -4.991
   14   2HA   GLY   2          2HA       GLY   2  -5.821  -1.065  -3.558
   15    H    GLU   3           H        GLU   3  -4.208   0.941  -3.324
   16    HA   GLU   3           HA       GLU   3  -3.799   3.095  -2.839
   17   1HB   GLU   3          2HB       GLU   3  -6.575   3.910  -3.743
   18   2HB   GLU   3          1HB       GLU   3  -5.303   4.961  -3.130
   19   1HG   GLU   3          2HG       GLU   3  -3.788   4.274  -4.929
   20   2HG   GLU   3          1HG       GLU   3  -5.054   3.248  -5.642
   21    HE1  GLU   3           HE2      GLU   3  -6.912   6.075  -6.728
   22    H    CYS   4           H        CYS   4  -3.605   3.491  -0.639
   23    HA   CYS   4           HA       CYS   4  -5.567   2.132   1.046
   24   1HB   CYS   4          1HB       CYS   4  -3.207   3.798   1.837
   25   2HB   CYS   4          2HB       CYS   4  -4.322   3.174   2.952
   26    H    VAL   5           H        VAL   5  -6.539   3.018   2.718
   27    HA   VAL   5           HA       VAL   5  -7.982   5.588   2.169
   28    HB   VAL   5           HB       VAL   5  -8.918   3.138   3.705
   29   1HG1  VAL   5          3HG1      VAL   5 -10.327   5.733   2.894
   30   2HG1  VAL   5          2HG1      VAL   5 -11.119   4.325   3.632
   31   3HG1  VAL   5          1HG1      VAL   5  -9.930   5.253   4.555
   32   1HG2  VAL   5          2HG2      VAL   5  -9.603   4.213   0.934
   33   2HG2  VAL   5          1HG2      VAL   5  -8.772   2.687   1.296
   34   3HG2  VAL   5          3HG2      VAL   5 -10.466   2.897   1.760
   35    H    ARG   6           H        ARG   6  -6.258   6.632   3.003
   36    HA   ARG   6           HA       ARG   6  -4.803   7.561   4.527
   37   1HB   ARG   6          2HB       ARG   6  -7.211   7.404   6.363
   38   2HB   ARG   6          1HB       ARG   6  -5.815   8.475   6.545
   39   1HG   ARG   6          2HG       ARG   6  -7.822   8.499   4.243
   40   2HG   ARG   6          1HG       ARG   6  -7.760   9.623   5.609
   41   1HD   ARG   6          2HD       ARG   6  -5.505  10.380   4.875
   42   2HD   ARG   6          1HD       ARG   6  -5.641   9.324   3.440
   43    HE   ARG   6           HE       ARG   6  -7.944  10.953   3.552
   44   1HH1  ARG   6          1HH1      ARG   6  -4.480  11.271   2.991
   45   2HH1  ARG   6          2HH1      ARG   6  -4.603  12.645   1.939
   46   1HH2  ARG   6          1HH2      ARG   6  -8.159  12.790   2.157
   47   2HH2  ARG   6          2HH2      ARG   6  -6.757  13.529   1.461
   48    H    GLY   7           H        GLY   7  -4.156   5.064   4.210
   49   1HA   GLY   7          1HA       GLY   7  -2.497   3.869   5.163
   50   2HA   GLY   7          2HA       GLY   7  -3.023   4.352   6.757
   51    H    ARG   8           H        ARG   8  -5.449   2.950   4.606
   52    HA   ARG   8           HA       ARG   8  -5.369   0.324   5.929
   53   1HB   ARG   8          2HB       ARG   8  -7.772   2.048   5.354
   54   2HB   ARG   8          1HB       ARG   8  -7.748   0.435   6.098
   55   1HG   ARG   8          2HG       ARG   8  -6.265   1.347   7.883
   56   2HG   ARG   8          1HG       ARG   8  -6.353   2.913   7.143
   57   1HD   ARG   8          2HD       ARG   8  -8.910   2.800   7.326
   58   2HD   ARG   8          1HD       ARG   8  -8.668   1.361   8.328
   59    HE   ARG   8           HE       ARG   8  -8.201   2.728  10.101
   60   1HH1  ARG   8          1HH2      ARG   8  -7.640   4.632   7.129
   61   2HH1  ARG   8          2HH2      ARG   8  -6.630   5.766   7.934
   62   1HH2  ARG   8          2HH1      ARG   8  -7.278   4.552  11.205
   63   2HH2  ARG   8          1HH1      ARG   8  -6.791   5.954  10.305
   64    H    CYS   9           H        CYS   9  -5.095  -1.133   4.171
   65    HA   CYS   9           HA       CYS   9  -6.948  -0.821   1.876
   66   1HB   CYS   9          1HB       CYS   9  -4.019  -1.470   1.733
   67   2HB   CYS   9          2HB       CYS   9  -5.114  -2.483   0.812
   68    HA   PRO  10           HA       PRO  10  -8.566  -4.646   3.116
   69   1HB   PRO  10          2HB       PRO  10  -8.235  -5.805   0.359
   70   2HB   PRO  10          1HB       PRO  10  -9.720  -5.681   1.345
   71   1HG   PRO  10          2HG       PRO  10  -9.298  -4.021  -0.735
   72   2HG   PRO  10          1HG       PRO  10  -9.956  -3.363   0.795
   73   1HD   PRO  10          2HD       PRO  10  -7.073  -3.311  -0.161
   74   2HD   PRO  10          1HD       PRO  10  -8.065  -1.979   0.490
   75    H    SER  11           H        SER  11  -8.285  -7.045   3.100
   76    HA   SER  11           HA       SER  11  -6.971  -8.701   3.958
   77   1HB   SER  11          2HB       SER  11  -5.957  -9.887   1.932
   78   2HB   SER  11          1HB       SER  11  -7.566  -9.225   1.592
   79    HG   SER  11           HG       SER  11  -5.711  -7.335   1.116
   80    H    GLY  12           H        GLY  12  -5.869  -6.616   4.843
   81   1HA   GLY  12          1HA       GLY  12  -3.943  -5.648   5.746
   82   2HA   GLY  12          2HA       GLY  12  -3.377  -7.319   5.912
   83    H    MET  13           H        MET  13  -4.029  -5.300   3.004
   84    HA   MET  13           HA       MET  13  -1.468  -5.826   1.734
   85   1HB   MET  13          1HB       MET  13  -3.573  -3.740   1.410
   86   2HB   MET  13          2HB       MET  13  -2.092  -3.689   0.448
   87   1HG   MET  13          1HG       MET  13  -2.594  -5.858  -0.539
   88   2HG   MET  13          2HG       MET  13  -4.018  -6.045   0.470
   89   1HE   MET  13          1HE       MET  13  -4.442  -6.681  -2.368
   90   2HE   MET  13          3HE       MET  13  -5.845  -6.413  -1.302
   91   3HE   MET  13          2HE       MET  13  -5.784  -5.642  -2.903
   92    H    CYS  14           H        CYS  14   0.383  -4.354   1.593
   93    HA   CYS  14           HA       CYS  14   0.727  -2.668   4.023
   94   1HB   CYS  14          1HB       CYS  14   2.604  -3.241   1.696
   95   2HB   CYS  14          2HB       CYS  14   2.916  -2.171   3.060
   96    H    CYS  15           H        CYS  15   0.496  -0.438   3.866
   97    HA   CYS  15           HA       CYS  15  -0.311   0.760   1.334
   98   1HB   CYS  15          1HB       CYS  15   0.549   2.165   3.858
   99   2HB   CYS  15          2HB       CYS  15  -0.268   2.875   2.457
  100    H    SER  16           H        SER  16   0.973   1.877  -0.048
  101    HA   SER  16           HA       SER  16   3.655   0.888  -0.275
  102   1HB   SER  16          2HB       SER  16   3.671   2.022  -2.380
  103   2HB   SER  16          1HB       SER  16   2.074   1.284  -2.142
  104    HG   SER  16           HG       SER  16   1.373   3.339  -1.358
  105    H    GLN  17           H        GLN  17   5.167   2.904  -1.234
  106    HA   GLN  17           HA       GLN  17   5.284   5.096   0.780
  107   1HB   GLN  17          2HB       GLN  17   7.503   5.478   0.214
  108   2HB   GLN  17          1HB       GLN  17   7.257   3.756   0.580
  109   1HG   GLN  17          2HG       GLN  17   7.012   3.354  -1.884
  110   2HG   GLN  17          1HG       GLN  17   7.432   5.075  -2.122
  111   1HE2  GLN  17          2HE2      GLN  17  10.362   2.505  -0.656
  112   2HE2  GLN  17          1HE2      GLN  17   8.664   2.127  -0.376
  113    H    PHE  18           H        PHE  18   3.984   4.404  -2.379
  114    HA   PHE  18           HA       PHE  18   4.319   6.929  -3.576
  115   1HB   PHE  18          2HB       PHE  18   2.683   4.619  -4.275
  116   2HB   PHE  18          1HB       PHE  18   3.484   5.746  -5.288
  117    HD1  PHE  18           HD1      PHE  18   6.289   5.743  -4.523
  118    HD2  PHE  18           HD2      PHE  18   3.517   2.469  -4.921
  119    HE1  PHE  18           HE1      PHE  18   8.185   4.154  -4.696
  120    HE2  PHE  18           HE2      PHE  18   5.430   0.871  -5.010
  121    HZ   PHE  18           HZ       PHE  18   7.750   1.706  -4.846
  122    H    GLY  19           H        GLY  19   2.317   6.017  -1.038
  123   1HA   GLY  19          1HA       GLY  19   0.289   6.544  -0.297
  124   2HA   GLY  19          2HA       GLY  19   0.163   7.620  -1.675
  125    H    TYR  20           H        TYR  20   0.887   4.502  -2.780
  126    HA   TYR  20           HA       TYR  20  -1.944   3.696  -3.132
  127   1HB   TYR  20          1HB       TYR  20   0.556   2.879  -4.635
  128   2HB   TYR  20          2HB       TYR  20  -0.951   2.018  -4.783
  129    HD1  TYR  20           HD1      TYR  20   0.159   5.601  -5.053
  130    HD2  TYR  20           HD2      TYR  20  -2.272   2.388  -6.598
  131    HE1  TYR  20           HE1      TYR  20  -0.695   7.097  -6.804
  132    HE2  TYR  20           HE2      TYR  20  -3.073   3.883  -8.399
  133    HH   TYR  20           HH       TYR  20  -2.156   7.319  -8.583
  134    H    CYS  21           H        CYS  21  -1.251   0.864  -3.406
  135    HA   CYS  21           HA       CYS  21  -0.022   0.045  -0.924
  136   1HB   CYS  21          1HB       CYS  21  -1.938  -0.651   0.245
  137   2HB   CYS  21          2HB       CYS  21  -2.446   0.912  -0.415
  138    H    GLY  22           H        GLY  22  -0.121  -2.348  -0.649
  139   1HA   GLY  22          1HA       GLY  22  -1.432  -4.165  -2.122
  140   2HA   GLY  22          2HA       GLY  22  -0.006  -3.862  -3.117
  141    H    LYS  23           H        LYS  23  -0.647  -6.239  -1.659
  142    HA   LYS  23           HA       LYS  23   0.914  -6.309   0.802
  143   1HB   LYS  23          2HB       LYS  23  -1.295  -7.562   0.234
  144   2HB   LYS  23          1HB       LYS  23  -0.289  -8.698  -0.657
  145   1HG   LYS  23          2HG       LYS  23   1.021  -9.077   1.481
  146   2HG   LYS  23          1HG       LYS  23  -0.084  -7.950   2.295
  147   1HD   LYS  23          2HD       LYS  23  -2.006  -9.504   1.450
  148   2HD   LYS  23          1HD       LYS  23  -0.728 -10.628   0.980
  149   1HE   LYS  23          2HE       LYS  23  -1.467 -11.359   3.118
  150   2HE   LYS  23          1HE       LYS  23   0.089 -10.566   3.410
  151   1HZ   LYS  23          1HZ       LYS  23  -1.197  -8.580   4.092
  152   2HZ   LYS  23          3HZ       LYS  23  -2.587  -9.374   3.805
  153   3HZ   LYS  23          2HZ       LYS  23  -1.588  -9.891   5.007
  154    H    GLY  24           H        GLY  24   2.878  -5.498  -0.586
  155   1HA   GLY  24          1HA       GLY  24   4.606  -7.723  -0.509
  156   2HA   GLY  24          2HA       GLY  24   4.344  -7.279  -2.213
  157    HA   PRO  25           HA       PRO  25   7.893  -5.063   0.233
  158   1HB   PRO  25          2HB       PRO  25   9.375  -6.253  -2.125
  159   2HB   PRO  25          1HB       PRO  25   9.983  -5.918  -0.478
  160   1HG   PRO  25          2HG       PRO  25   9.217  -8.429  -1.126
  161   2HG   PRO  25          1HG       PRO  25   8.682  -7.724   0.428
  162   1HD   PRO  25          2HD       PRO  25   7.111  -7.962  -2.147
  163   2HD   PRO  25          1HD       PRO  25   6.623  -8.302  -0.465
  164    H    LYS  26           H        LYS  26   7.288  -5.187  -3.296
  165    HA   LYS  26           HA       LYS  26   8.613  -2.857  -4.106
  166   1HB   LYS  26          2HB       LYS  26   6.040  -4.146  -5.113
  167   2HB   LYS  26          1HB       LYS  26   6.823  -2.772  -5.908
  168   1HG   LYS  26          2HG       LYS  26   8.897  -4.057  -6.191
  169   2HG   LYS  26          1HG       LYS  26   8.148  -5.472  -5.418
  170   1HD   LYS  26          2HD       LYS  26   6.464  -5.604  -7.226
  171   2HD   LYS  26          1HD       LYS  26   7.026  -4.073  -7.893
  172   1HE   LYS  26          2HE       LYS  26   7.859  -5.872  -9.274
  173   2HE   LYS  26          1HE       LYS  26   9.205  -5.038  -8.489
  174   1HZ   LYS  26          3HZ       LYS  26   8.041  -7.608  -7.620
  175   2HZ   LYS  26          2HZ       LYS  26   9.452  -7.419  -8.439
  176   3HZ   LYS  26          1HZ       LYS  26   9.317  -6.844  -6.908
  177    H    TYR  27           H        TYR  27   5.504  -3.158  -2.394
  178    HA   TYR  27           HA       TYR  27   5.094  -0.220  -2.474
  179   1HB   TYR  27          1HB       TYR  27   3.494  -2.569  -1.384
  180   2HB   TYR  27          2HB       TYR  27   3.048  -0.972  -1.245
  181    HD1  TYR  27           HD1      TYR  27   3.241   0.322  -3.820
  182    HD2  TYR  27           HD2      TYR  27   2.604  -3.876  -3.156
  183    HE1  TYR  27           HE1      TYR  27   1.952   0.209  -5.913
  184    HE2  TYR  27           HE2      TYR  27   1.377  -4.016  -5.308
  185    HH   TYR  27           HH       TYR  27   0.960  -1.260  -7.452
  186    H    CYS  28           H        CYS  28   5.123  -2.929  -0.266
  187    HA   CYS  28           HA       CYS  28   4.965  -1.588   2.088
  188   1HB   CYS  28          1HB       CYS  28   4.939  -4.171   1.556
  189   2HB   CYS  28          2HB       CYS  28   6.634  -4.110   2.049
  190    H    GLY  29           H        GLY  29   7.989  -2.211   0.377
  191   1HA   GLY  29          1HA       GLY  29   9.900  -1.392   2.156
  192   2HA   GLY  29          2HA       GLY  29   9.928  -1.046   0.419
  193    H    ARG  30           HN       ARG  30  10.720   0.724   2.748
  194    HA   ARG  30           HA       ARG  30   8.802   3.005   2.421
  195   1HB   ARG  30          1HB       ARG  30  11.076   2.620   4.395
  196   2HB   ARG  30          2HB       ARG  30   9.960   3.985   4.326
  197   1HG   ARG  30          1HG       ARG  30   9.235   1.100   5.040
  198   2HG   ARG  30          2HG       ARG  30   9.371   2.482   6.120
  199   1HD   ARG  30          1HD       ARG  30   7.081   2.331   5.831
  200   2HD   ARG  30          2HD       ARG  30   7.545   3.611   4.692
  201    HE   ARG  30           HE       ARG  30   7.349   0.794   3.677
  202   1HH1  ARG  30          2HH1      ARG  30   5.418   3.687   4.306
  203   2HH1  ARG  30          1HH1      ARG  30   4.386   3.446   2.901
  204   1HH2  ARG  30          1HH2      ARG  30   6.161   0.927   1.465
  205   2HH2  ARG  30          2HH2      ARG  30   4.497   1.117   2.021
  No match found for entry  HXTARG          30
   
  No H/Q in entry =         206
  Start of MODEL          22
 Raw file had  213 H/Q atoms
  Start of MODEL   22
    1   1H    VAL   1          2H        VAL   1  -2.014  -1.339  -5.105
    2   2H    VAL   1          3H        VAL   1  -2.447  -2.204  -6.396
    3   3H    VAL   1          1H        VAL   1  -0.985  -1.414  -6.413
    4    HA   VAL   1           HA       VAL   1  -1.966   0.660  -6.721
    5    HB   VAL   1           HB       VAL   1  -3.750   0.508  -8.362
    6   1HG1  VAL   1          2HG1      VAL   1  -1.420   0.036  -9.054
    7   2HG1  VAL   1          1HG1      VAL   1  -1.698  -1.702  -8.805
    8   3HG1  VAL   1          3HG1      VAL   1  -2.611  -0.825 -10.043
    9   1HG2  VAL   1          1HG2      VAL   1  -5.133  -1.294  -7.328
   10   2HG2  VAL   1          3HG2      VAL   1  -4.776  -1.592  -9.032
   11   3HG2  VAL   1          2HG2      VAL   1  -3.901  -2.490  -7.786
   12    H    GLY   2           H        GLY   2  -4.327   1.883  -6.657
   13   1HA   GLY   2          1HA       GLY   2  -6.330   2.217  -5.523
   14   2HA   GLY   2          2HA       GLY   2  -6.059   0.756  -4.568
   15    H    GLU   3           H        GLU   3  -5.268   4.156  -4.913
   16    HA   GLU   3           HA       GLU   3  -3.672   4.782  -2.842
   17   1HB   GLU   3          2HB       GLU   3  -4.821   6.898  -2.645
   18   2HB   GLU   3          1HB       GLU   3  -4.273   6.476  -4.268
   19   1HG   GLU   3          2HG       GLU   3  -6.510   6.029  -5.034
   20   2HG   GLU   3          1HG       GLU   3  -7.166   6.076  -3.391
   21    HE2  GLU   3           HE2      GLU   3  -6.881   9.451  -5.402
   22    H    CYS   4           H        CYS   4  -3.703   4.273  -0.913
   23    HA   CYS   4           HA       CYS   4  -5.384   2.630   0.435
   24   1HB   CYS   4          1HB       CYS   4  -3.728   4.749   1.828
   25   2HB   CYS   4          2HB       CYS   4  -4.356   3.313   2.576
   26    H    VAL   5           H        VAL   5  -6.563   2.897   2.479
   27    HA   VAL   5           HA       VAL   5  -8.759   4.827   2.039
   28    HB   VAL   5           HB       VAL   5  -8.603   2.549   4.035
   29   1HG1  VAL   5          2HG1      VAL   5 -10.384   4.328   4.406
   30   2HG1  VAL   5          1HG1      VAL   5 -10.914   4.101   2.738
   31   3HG1  VAL   5          3HG1      VAL   5 -11.089   2.781   3.916
   32   1HG2  VAL   5          1HG2      VAL   5  -9.538   2.641   1.135
   33   2HG2  VAL   5          3HG2      VAL   5  -8.270   1.603   1.817
   34   3HG2  VAL   5          2HG2      VAL   5  -9.958   1.336   2.270
   35    H    ARG   6           H        ARG   6  -6.905   6.172   2.502
   36    HA   ARG   6           HA       ARG   6  -5.778   7.780   3.660
   37   1HB   ARG   6          2HB       ARG   6  -7.853   7.564   5.831
   38   2HB   ARG   6          1HB       ARG   6  -6.708   8.875   5.539
   39   1HG   ARG   6          2HG       ARG   6  -9.065   8.036   3.803
   40   2HG   ARG   6          1HG       ARG   6  -8.832   9.526   4.713
   41   1HD   ARG   6          2HD       ARG   6  -8.482  10.250   2.579
   42   2HD   ARG   6          1HD       ARG   6  -6.813   9.968   3.110
   43    HE   ARG   6           HE       ARG   6  -7.845   7.597   1.891
   44   1HH1  ARG   6          2HH1      ARG   6  -7.187  10.889   0.808
   45   2HH1  ARG   6          1HH1      ARG   6  -6.838  10.413  -0.832
   46   1HH2  ARG   6          1HH2      ARG   6  -7.101   6.941  -0.187
   47   2HH2  ARG   6          2HH2      ARG   6  -6.934   8.153  -1.429
   48    H    GLY   7           H        GLY   7  -4.546   5.623   3.538
   49   1HA   GLY   7          1HA       GLY   7  -2.608   4.809   4.307
   50   2HA   GLY   7          2HA       GLY   7  -2.889   5.629   5.838
   51    H    ARG   8           H        ARG   8  -5.246   3.232   4.629
   52    HA   ARG   8           HA       ARG   8  -4.196   1.056   6.218
   53   1HB   ARG   8          2HB       ARG   8  -7.038   2.099   6.245
   54   2HB   ARG   8          1HB       ARG   8  -6.445   0.611   7.027
   55   1HG   ARG   8          2HG       ARG   8  -4.697   2.001   8.166
   56   2HG   ARG   8          1HG       ARG   8  -5.431   3.435   7.593
   57   1HD   ARG   8          2HD       ARG   8  -6.644   1.416   9.490
   58   2HD   ARG   8          1HD       ARG   8  -6.221   3.094   9.863
   59    HE   ARG   8           HE       ARG   8  -8.712   2.155   8.926
   60   1HH1  ARG   8          1HH2      ARG   8  -6.602   4.938   8.289
   61   2HH1  ARG   8          2HH2      ARG   8  -7.499   5.439   6.889
   62   1HH2  ARG   8          2HH1      ARG   8 -10.102   3.101   7.275
   63   2HH2  ARG   8          1HH1      ARG   8  -9.456   4.457   6.375
   64    H    CYS   9           H        CYS   9  -4.765  -0.857   5.113
   65    HA   CYS   9           HA       CYS   9  -6.015  -0.678   2.417
   66   1HB   CYS   9          1HB       CYS   9  -3.587  -2.173   3.412
   67   2HB   CYS   9          2HB       CYS   9  -4.331  -2.505   1.881
   68    HA   PRO  10           HA       PRO  10  -8.083  -4.418   3.844
   69   1HB   PRO  10          2HB       PRO  10  -9.045  -5.463   1.545
   70   2HB   PRO  10          1HB       PRO  10  -9.531  -3.839   2.097
   71   1HG   PRO  10          2HG       PRO  10  -7.469  -4.570   0.010
   72   2HG   PRO  10          1HG       PRO  10  -8.711  -3.291  -0.070
   73   1HD   PRO  10          2HD       PRO  10  -6.033  -2.972   0.680
   74   2HD   PRO  10          1HD       PRO  10  -7.299  -1.806   1.105
   75    H    SER  11           H        SER  11  -8.166  -6.788   3.400
   76    HA   SER  11           HA       SER  11  -7.017  -8.730   3.699
   77   1HB   SER  11          2HB       SER  11  -6.498  -9.609   1.367
   78   2HB   SER  11          1HB       SER  11  -8.017  -8.696   1.425
   79    HG   SER  11           HG       SER  11  -6.032  -6.968   0.952
   80    H    GLY  12           H        GLY  12  -5.508  -7.049   4.783
   81   1HA   GLY  12          1HA       GLY  12  -3.366  -6.594   5.585
   82   2HA   GLY  12          2HA       GLY  12  -3.066  -8.312   5.272
   83    H    MET  13           H        MET  13  -3.723  -5.636   2.961
   84    HA   MET  13           HA       MET  13  -1.098  -6.089   1.606
   85   1HB   MET  13          1HB       MET  13  -3.422  -4.214   1.048
   86   2HB   MET  13          2HB       MET  13  -1.925  -4.243   0.120
   87   1HG   MET  13          1HG       MET  13  -2.389  -6.581  -0.531
   88   2HG   MET  13          2HG       MET  13  -3.886  -6.549   0.410
   89   1HE   MET  13          2HE       MET  13  -5.153  -7.435  -1.745
   90   2HE   MET  13          1HE       MET  13  -5.089  -6.623  -3.324
   91   3HE   MET  13          3HE       MET  13  -3.632  -7.410  -2.673
   92    H    CYS  14           H        CYS  14   0.431  -4.218   1.366
   93    HA   CYS  14           HA       CYS  14   0.471  -2.560   3.857
   94   1HB   CYS  14          1HB       CYS  14   2.616  -3.060   1.758
   95   2HB   CYS  14          2HB       CYS  14   2.767  -2.055   3.192
   96    H    CYS  15           H        CYS  15   0.487  -0.283   3.656
   97    HA   CYS  15           HA       CYS  15  -0.179   0.864   1.095
   98   1HB   CYS  15          1HB       CYS  15   0.658   2.319   3.570
   99   2HB   CYS  15          2HB       CYS  15   0.251   3.086   2.032
  100    H    SER  16           H        SER  16   1.174   1.014  -0.508
  101    HA   SER  16           HA       SER  16   3.923   0.758  -0.476
  102   1HB   SER  16          2HB       SER  16   3.960   2.303  -2.518
  103   2HB   SER  16          1HB       SER  16   3.062   0.835  -2.662
  104    HG   SER  16           HG       SER  16   1.184   2.125  -1.965
  105    H    GLN  17           H        GLN  17   5.658   2.482  -0.454
  106    HA   GLN  17           HA       GLN  17   5.214   4.740   1.236
  107   1HB   GLN  17          2HB       GLN  17   7.383   5.474   0.691
  108   2HB   GLN  17          1HB       GLN  17   7.344   3.728   1.003
  109   1HG   GLN  17          2HG       GLN  17   7.083   3.450  -1.541
  110   2HG   GLN  17          1HG       GLN  17   7.432   5.195  -1.617
  111   1HE2  GLN  17          2HE2      GLN  17  10.451   2.680  -0.218
  112   2HE2  GLN  17          1HE2      GLN  17   8.769   2.239   0.057
  113    H    PHE  18           H        PHE  18   4.411   4.258  -2.176
  114    HA   PHE  18           HA       PHE  18   3.973   6.923  -2.896
  115   1HB   PHE  18          2HB       PHE  18   3.079   4.429  -4.096
  116   2HB   PHE  18          1HB       PHE  18   3.613   5.895  -4.839
  117    HD1  PHE  18           HD1      PHE  18   6.235   6.516  -4.006
  118    HD2  PHE  18           HD2      PHE  18   4.519   2.635  -4.794
  119    HE1  PHE  18           HE1      PHE  18   8.507   5.543  -4.224
  120    HE2  PHE  18           HE2      PHE  18   6.791   1.647  -4.860
  121    HZ   PHE  18           HZ       PHE  18   8.788   3.103  -4.590
  122    H    GLY  19           H        GLY  19   2.265   5.020  -0.717
  123   1HA   GLY  19          1HA       GLY  19   0.311   5.292   0.240
  124   2HA   GLY  19          2HA       GLY  19   0.072   6.639  -0.852
  125    H    TYR  20           H        TYR  20   0.533   3.737  -2.577
  126    HA   TYR  20           HA       TYR  20  -2.381   3.138  -2.886
  127   1HB   TYR  20          1HB       TYR  20  -0.070   1.857  -4.299
  128   2HB   TYR  20          2HB       TYR  20  -1.729   1.818  -4.769
  129    HD1  TYR  20           HD2      TYR  20  -2.866   4.162  -5.323
  130    HD2  TYR  20           HD1      TYR  20   1.375   3.434  -5.370
  131    HE1  TYR  20           HE2      TYR  20  -2.518   6.292  -6.547
  132    HE2  TYR  20           HE1      TYR  20   1.723   5.553  -6.606
  133    HH   TYR  20           HH       TYR  20   0.731   7.472  -7.427
  134    H    CYS  21           H        CYS  21  -2.578   0.536  -3.176
  135    HA   CYS  21           HA       CYS  21  -1.464  -0.606  -0.628
  136   1HB   CYS  21          1HB       CYS  21  -4.075  -1.092  -2.078
  137   2HB   CYS  21          2HB       CYS  21  -3.456  -2.113  -0.769
  138    H    GLY  22           H        GLY  22  -0.354  -2.582  -0.677
  139   1HA   GLY  22          1HA       GLY  22  -0.977  -4.540  -2.534
  140   2HA   GLY  22          2HA       GLY  22   0.553  -3.794  -3.042
  141    H    LYS  23           H        LYS  23  -0.262  -6.453  -1.807
  142    HA   LYS  23           HA       LYS  23   1.296  -6.584   0.703
  143   1HB   LYS  23          2HB       LYS  23  -0.790  -7.939   0.328
  144   2HB   LYS  23          1HB       LYS  23   0.046  -8.804  -0.964
  145   1HG   LYS  23          2HG       LYS  23   1.821  -9.399   0.845
  146   2HG   LYS  23          1HG       LYS  23   0.669  -8.790   2.027
  147   1HD   LYS  23          2HD       LYS  23   0.317 -11.065   0.005
  148   2HD   LYS  23          1HD       LYS  23   0.521 -11.258   1.744
  149   1HE   LYS  23          2HE       LYS  23  -1.884  -9.989   0.325
  150   2HE   LYS  23          1HE       LYS  23  -1.832 -11.596   1.047
  151   1HZ   LYS  23          2HZ       LYS  23  -1.452  -9.100   2.577
  152   2HZ   LYS  23          1HZ       LYS  23  -2.868  -9.890   2.444
  153   3HZ   LYS  23          3HZ       LYS  23  -1.589 -10.615   3.194
  154    H    GLY  24           H        GLY  24   3.280  -5.632  -0.518
  155   1HA   GLY  24          1HA       GLY  24   4.992  -7.818  -0.742
  156   2HA   GLY  24          2HA       GLY  24   4.711  -7.221  -2.397
  157    HA   PRO  25           HA       PRO  25   8.206  -5.060   0.152
  158   1HB   PRO  25          2HB       PRO  25   9.691  -6.010  -2.313
  159   2HB   PRO  25          1HB       PRO  25  10.315  -5.781  -0.654
  160   1HG   PRO  25          2HG       PRO  25   9.649  -8.265  -1.492
  161   2HG   PRO  25          1HG       PRO  25   9.116  -7.713   0.124
  162   1HD   PRO  25          2HD       PRO  25   7.503  -7.806  -2.437
  163   2HD   PRO  25          1HD       PRO  25   7.059  -8.314  -0.785
  164    H    LYS  26           H        LYS  26   7.491  -5.013  -3.355
  165    HA   LYS  26           HA       LYS  26   8.592  -2.544  -4.087
  166   1HB   LYS  26          2HB       LYS  26   6.060  -3.971  -5.021
  167   2HB   LYS  26          1HB       LYS  26   6.669  -2.486  -5.763
  168   1HG   LYS  26          2HG       LYS  26   8.819  -3.566  -6.268
  169   2HG   LYS  26          1HG       LYS  26   8.242  -5.089  -5.552
  170   1HD   LYS  26          2HD       LYS  26   6.452  -5.242  -7.255
  171   2HD   LYS  26          1HD       LYS  26   6.844  -3.628  -7.845
  172   1HE   LYS  26          2HE       LYS  26   7.720  -5.259  -9.400
  173   2HE   LYS  26          1HE       LYS  26   9.046  -4.366  -8.645
  174   1HZ   LYS  26          2HZ       LYS  26   8.154  -7.076  -7.884
  175   2HZ   LYS  26          1HZ       LYS  26   9.485  -6.716  -8.776
  176   3HZ   LYS  26          3HZ       LYS  26   9.411  -6.253  -7.203
  177    H    TYR  27           H        TYR  27   5.633  -3.184  -2.198
  178    HA   TYR  27           HA       TYR  27   4.983  -0.305  -2.162
  179   1HB   TYR  27          1HB       TYR  27   3.588  -2.817  -1.175
  180   2HB   TYR  27          2HB       TYR  27   3.045  -1.276  -0.833
  181    HD1  TYR  27           HD2      TYR  27   3.966  -3.415  -3.819
  182    HD2  TYR  27           HD1      TYR  27   1.222  -0.513  -2.212
  183    HE1  TYR  27           HE2      TYR  27   2.795  -3.329  -5.986
  184    HE2  TYR  27           HE1      TYR  27   0.117  -0.350  -4.414
  185    HH   TYR  27           HH       TYR  27   1.170  -2.250  -7.227
  186    H    CYS  28           H        CYS  28   5.226  -3.105  -0.022
  187    HA   CYS  28           HA       CYS  28   5.087  -1.691   2.331
  188   1HB   CYS  28          1HB       CYS  28   4.988  -4.310   1.768
  189   2HB   CYS  28          2HB       CYS  28   6.625  -4.264   2.432
  190    H    GLY  29           H        GLY  29   8.018  -2.271   0.470
  191   1HA   GLY  29          1HA       GLY  29  10.013  -1.573   2.202
  192   2HA   GLY  29          2HA       GLY  29   9.952  -1.103   0.497
  193    H    ARG  30           HN       ARG  30  10.799   0.442   2.984
  194    HA   ARG  30           HA       ARG  30   8.927   2.780   2.874
  195   1HB   ARG  30          1HB       ARG  30  11.182   2.171   4.818
  196   2HB   ARG  30          2HB       ARG  30  10.063   3.531   4.905
  197   1HG   ARG  30          1HG       ARG  30   9.351   0.589   5.304
  198   2HG   ARG  30          2HG       ARG  30   9.495   1.848   6.524
  199   1HD   ARG  30          1HD       ARG  30   7.198   1.672   6.226
  200   2HD   ARG  30          2HD       ARG  30   7.640   3.119   5.293
  201    HE   ARG  30           HE       ARG  30   7.533   0.513   3.855
  202   1HH1  ARG  30          1HH1      ARG  30   5.430   2.917   5.152
  203   2HH1  ARG  30          2HH1      ARG  30   4.252   2.873   3.869
  204   1HH2  ARG  30          1HH2      ARG  30   6.306   0.885   1.727
  205   2HH2  ARG  30          2HH2      ARG  30   4.645   1.240   2.107
  No match found for entry  HXTARG          30
   
  No H/Q in entry =         206
  Start of MODEL          23
 Raw file had  213 H/Q atoms
  Start of MODEL   23
    1   1H    VAL   1          1H        VAL   1  -4.230   0.594  -3.535
    2   2H    VAL   1          2H        VAL   1  -5.038  -0.547  -4.365
    3   3H    VAL   1          3H        VAL   1  -3.440  -0.811  -3.943
    4    HA   VAL   1           HA       VAL   1  -2.699   0.812  -5.428
    5    HB   VAL   1           HB       VAL   1  -4.762  -0.770  -6.861
    6   1HG1  VAL   1          3HG1      VAL   1  -2.070   0.341  -7.758
    7   2HG1  VAL   1          2HG1      VAL   1  -3.083  -0.752  -8.719
    8   3HG1  VAL   1          1HG1      VAL   1  -3.673   0.861  -8.330
    9   1HG2  VAL   1          2HG2      VAL   1  -1.967  -1.609  -5.992
   10   2HG2  VAL   1          1HG2      VAL   1  -3.498  -2.351  -5.472
   11   3HG2  VAL   1          3HG2      VAL   1  -2.968  -2.509  -7.144
   12    H    GLY   2           H        GLY   2  -3.142   2.694  -6.737
   13   1HA   GLY   2          1HA       GLY   2  -4.499   4.338  -7.742
   14   2HA   GLY   2          2HA       GLY   2  -5.908   3.775  -6.824
   15    H    GLU   3           H        GLU   3  -4.799   3.489  -4.320
   16    HA   GLU   3           HA       GLU   3  -3.157   5.474  -3.282
   17   1HB   GLU   3          2HB       GLU   3  -4.797   6.734  -1.975
   18   2HB   GLU   3          1HB       GLU   3  -4.760   7.126  -3.694
   19   1HG   GLU   3          2HG       GLU   3  -6.813   5.845  -4.100
   20   2HG   GLU   3          1HG       GLU   3  -6.817   5.243  -2.434
   21    HE2  GLU   3           HE2      GLU   3  -9.175   7.895  -2.335
   22    H    CYS   4           H        CYS   4  -3.307   5.195  -0.820
   23    HA   CYS   4           HA       CYS   4  -4.251   2.599   0.122
   24   1HB   CYS   4          1HB       CYS   4  -3.608   5.003   1.855
   25   2HB   CYS   4          2HB       CYS   4  -3.658   3.318   2.327
   26    H    VAL   5           H        VAL   5  -5.872   2.473   1.950
   27    HA   VAL   5           HA       VAL   5  -8.238   4.216   1.365
   28    HB   VAL   5           HB       VAL   5  -8.148   1.263   2.049
   29   1HG1  VAL   5          1HG1      VAL   5 -10.454   3.183   1.419
   30   2HG1  VAL   5          3HG1      VAL   5 -10.610   1.417   1.523
   31   3HG1  VAL   5          2HG1      VAL   5 -10.190   2.348   2.958
   32   1HG2  VAL   5          3HG2      VAL   5  -8.851   2.767  -0.519
   33   2HG2  VAL   5          2HG2      VAL   5  -7.432   1.734  -0.288
   34   3HG2  VAL   5          1HG2      VAL   5  -9.047   1.019  -0.267
   35    H    ARG   6           H        ARG   6  -7.430   5.593   2.844
   36    HA   ARG   6           HA       ARG   6  -7.209   6.700   4.816
   37   1HB   ARG   6          2HB       ARG   6  -8.397   4.365   6.311
   38   2HB   ARG   6          1HB       ARG   6  -8.229   6.009   6.863
   39   1HG   ARG   6          2HG       ARG   6 -10.111   6.770   5.854
   40   2HG   ARG   6          1HG       ARG   6  -9.868   5.827   4.384
   41   1HD   ARG   6          2HD       ARG   6 -10.910   4.755   7.032
   42   2HD   ARG   6          1HD       ARG   6 -11.864   5.022   5.551
   43    HE   ARG   6           HE       ARG   6  -9.763   3.460   4.725
   44   1HH1  ARG   6          2HH1      ARG   6 -12.249   2.836   7.128
   45   2HH1  ARG   6          1HH1      ARG   6 -11.779   1.180   7.379
   46   1HH2  ARG   6          1HH2      ARG   6  -9.046   1.487   5.065
   47   2HH2  ARG   6          2HH2      ARG   6  -9.911   0.319   6.047
   48    H    GLY   7           H        GLY   7  -5.037   5.595   3.788
   49   1HA   GLY   7          1HA       GLY   7  -2.869   5.160   4.302
   50   2HA   GLY   7          2HA       GLY   7  -3.284   5.525   5.975
   51    H    ARG   8           H        ARG   8  -5.110   2.832   4.748
   52    HA   ARG   8           HA       ARG   8  -3.223   0.782   5.366
   53   1HB   ARG   8          2HB       ARG   8  -5.972   0.991   6.656
   54   2HB   ARG   8          1HB       ARG   8  -4.873  -0.414   6.712
   55   1HG   ARG   8          2HG       ARG   8  -3.093   1.247   7.500
   56   2HG   ARG   8          1HG       ARG   8  -4.377   2.384   7.728
   57   1HD   ARG   8          2HD       ARG   8  -5.520   0.840   9.316
   58   2HD   ARG   8          1HD       ARG   8  -4.217  -0.335   9.147
   59    HE   ARG   8           HE       ARG   8  -4.279   2.078  10.754
   60   1HH1  ARG   8          1HH2      ARG   8  -2.073  -0.001   8.970
   61   2HH1  ARG   8          2HH2      ARG   8  -0.663   0.393   9.905
   62   1HH2  ARG   8          2HH1      ARG   8  -2.432   2.656  12.021
   63   2HH2  ARG   8          1HH1      ARG   8  -0.884   1.957  11.681
   64    H    CYS   9           H        CYS   9  -4.370  -1.241   4.448
   65    HA   CYS   9           HA       CYS   9  -6.653  -0.788   2.675
   66   1HB   CYS   9          1HB       CYS   9  -3.893  -1.457   1.815
   67   2HB   CYS   9          2HB       CYS   9  -5.130  -2.436   1.104
   68    HA   PRO  10           HA       PRO  10  -7.903  -4.508   4.447
   69   1HB   PRO  10          2HB       PRO  10  -9.395  -5.806   2.582
   70   2HB   PRO  10          1HB       PRO  10  -9.819  -4.182   3.188
   71   1HG   PRO  10          2HG       PRO  10  -8.395  -4.892   0.627
   72   2HG   PRO  10          1HG       PRO  10  -9.736  -3.734   0.854
   73   1HD   PRO  10          2HD       PRO  10  -7.085  -3.068   0.716
   74   2HD   PRO  10          1HD       PRO  10  -8.217  -2.062   1.635
   75    H    SER  11           H        SER  11  -8.074  -6.943   4.219
   76    HA   SER  11           HA       SER  11  -6.842  -8.776   4.544
   77   1HB   SER  11          2HB       SER  11  -6.416  -9.912   2.360
   78   2HB   SER  11          1HB       SER  11  -7.928  -8.981   2.306
   79    HG   SER  11           HG       SER  11  -6.115  -7.285   1.538
   80    H    GLY  12           H        GLY  12  -5.464  -6.853   5.362
   81   1HA   GLY  12          1HA       GLY  12  -3.362  -6.090   6.006
   82   2HA   GLY  12          2HA       GLY  12  -2.878  -7.789   5.874
   83    H    MET  13           H        MET  13  -3.932  -5.495   3.302
   84    HA   MET  13           HA       MET  13  -1.499  -5.859   1.699
   85   1HB   MET  13          1HB       MET  13  -3.820  -3.957   1.696
   86   2HB   MET  13          2HB       MET  13  -2.463  -3.731   0.579
   87   1HG   MET  13          1HG       MET  13  -2.891  -5.880  -0.460
   88   2HG   MET  13          2HG       MET  13  -4.159  -6.255   0.706
   89   1HE   MET  13          3HE       MET  13  -4.679  -6.675  -2.280
   90   2HE   MET  13          2HE       MET  13  -5.966  -6.822  -1.056
   91   3HE   MET  13          1HE       MET  13  -6.242  -5.861  -2.526
   92    H    CYS  14           H        CYS  14   0.237  -4.207   1.500
   93    HA   CYS  14           HA       CYS  14   0.569  -2.610   3.996
   94   1HB   CYS  14          1HB       CYS  14   2.377  -3.053   1.593
   95   2HB   CYS  14          2HB       CYS  14   2.657  -1.860   2.856
   96    H    CYS  15           H        CYS  15   0.109  -0.462   4.007
   97    HA   CYS  15           HA       CYS  15  -0.760   0.967   1.576
   98   1HB   CYS  15          1HB       CYS  15  -1.770   1.657   3.653
   99   2HB   CYS  15          2HB       CYS  15  -0.196   1.822   4.449
  100    H    SER  16           H        SER  16   0.703   1.563   0.179
  101    HA   SER  16           HA       SER  16   3.315   0.629   0.307
  102   1HB   SER  16          2HB       SER  16   3.550   1.515  -1.908
  103   2HB   SER  16          1HB       SER  16   1.859   0.994  -1.701
  104    HG   SER  16           HG       SER  16   1.391   3.166  -1.174
  105    H    GLN  17           H        GLN  17   5.168   2.064  -0.486
  106    HA   GLN  17           HA       GLN  17   5.701   4.452   1.065
  107   1HB   GLN  17          2HB       GLN  17   7.861   4.344   0.205
  108   2HB   GLN  17          1HB       GLN  17   7.301   2.722   0.678
  109   1HG   GLN  17          2HG       GLN  17   6.558   2.532  -1.806
  110   2HG   GLN  17          1HG       GLN  17   7.681   3.894  -2.024
  111   1HE2  GLN  17          2HE2      GLN  17   9.327   0.328  -2.269
  112   2HE2  GLN  17          1HE2      GLN  17   7.767   0.806  -2.872
  113    H    PHE  18           H        PHE  18   4.120   3.880  -2.092
  114    HA   PHE  18           HA       PHE  18   4.626   6.447  -3.164
  115   1HB   PHE  18          2HB       PHE  18   2.845   4.298  -4.008
  116   2HB   PHE  18          1HB       PHE  18   3.735   5.443  -4.921
  117    HD1  PHE  18           HD2      PHE  18   6.504   5.235  -4.249
  118    HD2  PHE  18           HD1      PHE  18   3.542   2.146  -4.757
  119    HE1  PHE  18           HE2      PHE  18   8.287   3.617  -4.842
  120    HE2  PHE  18           HE1      PHE  18   5.335   0.523  -5.316
  121    HZ   PHE  18           HZ       PHE  18   7.705   1.255  -5.358
  122    H    GLY  19           H        GLY  19   2.629   5.588  -0.638
  123   1HA   GLY  19          1HA       GLY  19   0.613   6.138   0.133
  124   2HA   GLY  19          2HA       GLY  19   0.617   7.389  -1.098
  125    H    TYR  20           H        TYR  20   1.010   4.339  -2.536
  126    HA   TYR  20           HA       TYR  20  -1.897   3.841  -3.058
  127   1HB   TYR  20          1HB       TYR  20   0.637   2.758  -4.382
  128   2HB   TYR  20          2HB       TYR  20  -0.965   2.180  -4.707
  129    HD1  TYR  20           HD1      TYR  20  -0.671   5.885  -4.394
  130    HD2  TYR  20           HD2      TYR  20  -0.605   2.478  -7.062
  131    HE1  TYR  20           HE1      TYR  20  -1.404   7.306  -6.221
  132    HE2  TYR  20           HE2      TYR  20  -1.420   3.936  -8.894
  133    HH   TYR  20           HH       TYR  20  -2.256   7.358  -8.363
  134    H    CYS  21           H        CYS  21  -1.530   0.970  -3.351
  135    HA   CYS  21           HA       CYS  21  -0.333   0.069  -0.871
  136   1HB   CYS  21          1HB       CYS  21  -2.186  -0.491   0.388
  137   2HB   CYS  21          2HB       CYS  21  -2.627   1.105  -0.204
  138    H    GLY  22           H        GLY  22  -0.312  -2.269  -0.688
  139   1HA   GLY  22          1HA       GLY  22  -1.774  -4.044  -2.130
  140   2HA   GLY  22          2HA       GLY  22  -0.343  -3.725  -3.132
  141    H    LYS  23           H        LYS  23  -0.866  -6.135  -1.860
  142    HA   LYS  23           HA       LYS  23   0.653  -6.338   0.639
  143   1HB   LYS  23          2HB       LYS  23  -1.507  -7.589   0.046
  144   2HB   LYS  23          1HB       LYS  23  -0.533  -8.614  -1.007
  145   1HG   LYS  23          2HG       LYS  23   0.863  -9.234   0.995
  146   2HG   LYS  23          1HG       LYS  23  -0.146  -8.160   1.984
  147   1HD   LYS  23          2HD       LYS  23  -2.171  -9.586   1.141
  148   2HD   LYS  23          1HD       LYS  23  -0.958 -10.698   0.497
  149   1HE   LYS  23          2HE       LYS  23  -1.594 -11.570   2.625
  150   2HE   LYS  23          1HE       LYS  23   0.015 -10.865   2.856
  151   1HZ   LYS  23          1HZ       LYS  23  -1.124  -8.885   3.771
  152   2HZ   LYS  23          3HZ       LYS  23  -2.569  -9.606   3.547
  153   3HZ   LYS  23          2HZ       LYS  23  -1.499 -10.245   4.622
  154    H    GLY  24           H        GLY  24   2.655  -5.404  -0.591
  155   1HA   GLY  24          1HA       GLY  24   4.363  -7.606  -0.560
  156   2HA   GLY  24          2HA       GLY  24   4.179  -7.137  -2.266
  157    HA   PRO  25           HA       PRO  25   7.664  -4.900   0.220
  158   1HB   PRO  25          2HB       PRO  25   9.189  -6.190  -2.057
  159   2HB   PRO  25          1HB       PRO  25   9.754  -5.820  -0.403
  160   1HG   PRO  25          2HG       PRO  25   8.986  -8.340  -1.016
  161   2HG   PRO  25          1HG       PRO  25   8.419  -7.597   0.510
  162   1HD   PRO  25          2HD       PRO  25   6.912  -7.861  -2.104
  163   2HD   PRO  25          1HD       PRO  25   6.379  -8.188  -0.432
  164    H    LYS  26           H        LYS  26   7.034  -5.207  -3.283
  165    HA   LYS  26           HA       LYS  26   8.320  -2.951  -4.304
  166   1HB   LYS  26          2HB       LYS  26   5.606  -4.142  -5.033
  167   2HB   LYS  26          1HB       LYS  26   6.460  -2.928  -5.997
  168   1HG   LYS  26          2HG       LYS  26   8.369  -4.445  -6.291
  169   2HG   LYS  26          1HG       LYS  26   7.546  -5.704  -5.345
  170   1HD   LYS  26          2HD       LYS  26   5.646  -5.677  -6.947
  171   2HD   LYS  26          1HD       LYS  26   6.473  -4.478  -7.940
  172   1HE   LYS  26          2HE       LYS  26   7.488  -7.307  -7.320
  173   2HE   LYS  26          1HE       LYS  26   6.657  -6.823  -8.804
  174   1HZ   LYS  26          2HZ       LYS  26   8.468  -5.313  -9.268
  175   2HZ   LYS  26          1HZ       LYS  26   9.262  -5.785  -7.904
  176   3HZ   LYS  26          3HZ       LYS  26   9.007  -6.857  -9.121
  177    H    TYR  27           H        TYR  27   5.240  -3.141  -2.494
  178    HA   TYR  27           HA       TYR  27   4.774  -0.231  -2.771
  179   1HB   TYR  27          1HB       TYR  27   3.294  -2.546  -1.428
  180   2HB   TYR  27          2HB       TYR  27   2.829  -0.951  -1.306
  181    HD1  TYR  27           HD2      TYR  27   2.479   0.360  -3.710
  182    HD2  TYR  27           HD1      TYR  27   2.541  -3.925  -3.250
  183    HE1  TYR  27           HE2      TYR  27   1.205   0.134  -5.796
  184    HE2  TYR  27           HE1      TYR  27   1.318  -4.151  -5.399
  185    HH   TYR  27           HH       TYR  27   0.391  -1.342  -7.388
  186    H    CYS  28           H        CYS  28   5.005  -2.744  -0.331
  187    HA   CYS  28           HA       CYS  28   4.852  -1.158   1.875
  188   1HB   CYS  28          1HB       CYS  28   4.942  -3.798   1.568
  189   2HB   CYS  28          2HB       CYS  28   6.604  -3.600   2.122
  190    H    GLY  29           H        GLY  29   7.808  -2.250   0.327
  191   1HA   GLY  29          1HA       GLY  29  10.064  -1.697   0.591
  192   2HA   GLY  29          2HA       GLY  29   9.299  -0.236   0.023
  193    H    ARG  30           HN       ARG  30  10.333   1.363   0.964
  194    HA   ARG  30           HA       ARG  30  11.457   2.671   2.519
  195   1HB   ARG  30          1HB       ARG  30   9.242   1.566   4.217
  196   2HB   ARG  30          2HB       ARG  30  10.324   2.861   4.736
  197   1HG   ARG  30          1HG       ARG  30   9.701   4.363   3.096
  198   2HG   ARG  30          2HG       ARG  30   9.070   3.139   2.000
  199   1HD   ARG  30          1HD       ARG  30   7.830   3.894   4.647
  200   2HD   ARG  30          2HD       ARG  30   7.357   4.504   3.031
  201    HE   ARG  30           HE       ARG  30   7.377   1.575   3.181
  202   1HH1  ARG  30          1HH2      ARG  30   5.409   4.453   3.724
  203   2HH1  ARG  30          2HH2      ARG  30   3.990   3.731   3.017
  204   1HH2  ARG  30          1HH1      ARG  30   5.430   0.464   3.112
  205   2HH2  ARG  30          2HH1      ARG  30   3.880   1.268   3.287
  No match found for entry  HXTARG          30
   
  No H/Q in entry =         206
  Start of MODEL          24
 Raw file had  213 H/Q atoms
  Start of MODEL   24
    1   1H    VAL   1          3H        VAL   1  -5.936   1.949  -3.065
    2   2H    VAL   1          1H        VAL   1  -7.022   0.984  -3.802
    3   3H    VAL   1          2H        VAL   1  -5.593   0.326  -3.222
    4    HA   VAL   1           HA       VAL   1  -4.379   1.707  -4.752
    5    HB   VAL   1           HB       VAL   1  -5.078   0.650  -6.915
    6   1HG1  VAL   1          1HG1      VAL   1  -3.435  -0.376  -5.392
    7   2HG1  VAL   1          3HG1      VAL   1  -4.737  -1.242  -4.551
    8   3HG1  VAL   1          2HG1      VAL   1  -4.386  -1.593  -6.253
    9   1HG2  VAL   1          2HG2      VAL   1  -7.518   0.459  -6.457
   10   2HG2  VAL   1          1HG2      VAL   1  -6.778  -1.082  -6.921
   11   3HG2  VAL   1          3HG2      VAL   1  -7.177  -0.777  -5.221
   12    H    GLY   2           H        GLY   2  -4.456   3.149  -6.593
   13   1HA   GLY   2          1HA       GLY   2  -5.399   5.051  -7.715
   14   2HA   GLY   2          2HA       GLY   2  -6.786   5.029  -6.593
   15    H    GLU   3           H        GLU   3  -5.773   4.535  -4.241
   16    HA   GLU   3           HA       GLU   3  -3.240   5.416  -3.520
   17   1HB   GLU   3          2HB       GLU   3  -4.077   7.130  -1.809
   18   2HB   GLU   3          1HB       GLU   3  -3.706   7.578  -3.470
   19   1HG   GLU   3          2HG       GLU   3  -5.713   8.680  -2.796
   20   2HG   GLU   3          1HG       GLU   3  -6.088   7.532  -4.083
   21    HE1  GLU   3           HE2      GLU   3  -7.116   6.823  -0.274
   22    H    CYS   4           H        CYS   4  -3.272   5.172  -0.984
   23    HA   CYS   4           HA       CYS   4  -4.576   2.750  -0.135
   24   1HB   CYS   4          1HB       CYS   4  -3.574   4.892   1.758
   25   2HB   CYS   4          2HB       CYS   4  -3.716   3.184   2.066
   26    H    VAL   5           H        VAL   5  -5.997   2.520   1.692
   27    HA   VAL   5           HA       VAL   5  -8.295   4.419   1.618
   28    HB   VAL   5           HB       VAL   5  -8.194   1.504   2.506
   29   1HG1  VAL   5          3HG1      VAL   5 -10.507   3.440   2.056
   30   2HG1  VAL   5          2HG1      VAL   5 -10.654   1.717   2.463
   31   3HG1  VAL   5          1HG1      VAL   5  -9.943   2.840   3.632
   32   1HG2  VAL   5          3HG2      VAL   5  -9.195   2.773  -0.081
   33   2HG2  VAL   5          2HG2      VAL   5  -7.839   1.638   0.078
   34   3HG2  VAL   5          1HG2      VAL   5  -9.484   1.090   0.413
   35    H    ARG   6           H        ARG   6  -7.644   5.914   3.104
   36    HA   ARG   6           HA       ARG   6  -6.847   6.857   5.026
   37   1HB   ARG   6          2HB       ARG   6  -8.372   4.563   6.329
   38   2HB   ARG   6          1HB       ARG   6  -7.841   6.058   7.116
   39   1HG   ARG   6          2HG       ARG   6  -9.215   7.377   5.483
   40   2HG   ARG   6          1HG       ARG   6  -9.831   5.856   4.813
   41   1HD   ARG   6          2HD       ARG   6 -10.722   5.274   7.123
   42   2HD   ARG   6          1HD       ARG   6 -10.111   6.817   7.697
   43    HE   ARG   6           HE       ARG   6 -11.866   7.935   6.788
   44   1HH1  ARG   6          2HH2      ARG   6 -11.749   4.730   5.344
   45   2HH1  ARG   6          1HH2      ARG   6 -13.305   4.823   4.577
   46   1HH2  ARG   6          2HH1      ARG   6 -13.938   8.126   5.772
   47   2HH2  ARG   6          1HH1      ARG   6 -14.569   6.825   4.820
   48    H    GLY   7           H        GLY   7  -4.926   5.473   3.781
   49   1HA   GLY   7          1HA       GLY   7  -2.782   4.869   4.109
   50   2HA   GLY   7          2HA       GLY   7  -3.015   5.160   5.830
   51    H    ARG   8           H        ARG   8  -5.198   2.683   4.585
   52    HA   ARG   8           HA       ARG   8  -3.324   0.513   4.890
   53   1HB   ARG   8          2HB       ARG   8  -5.948   0.883   6.336
   54   2HB   ARG   8          1HB       ARG   8  -5.270  -0.710   6.004
   55   1HG   ARG   8          2HG       ARG   8  -3.030   0.710   6.894
   56   2HG   ARG   8          1HG       ARG   8  -4.310   1.464   7.709
   57   1HD   ARG   8          2HD       ARG   8  -3.913  -0.253   9.256
   58   2HD   ARG   8          1HD       ARG   8  -4.916  -1.249   8.214
   59    HE   ARG   8           HE       ARG   8  -2.061  -1.370   8.704
   60   1HH1  ARG   8          1HH2      ARG   8  -4.447  -2.486   6.267
   61   2HH1  ARG   8          2HH2      ARG   8  -3.192  -3.136   5.235
   62   1HH2  ARG   8          1HH1      ARG   8  -0.505  -2.413   7.331
   63   2HH2  ARG   8          2HH1      ARG   8  -1.073  -3.164   5.854
   64    H    CYS   9           H        CYS   9  -4.545  -1.411   4.093
   65    HA   CYS   9           HA       CYS   9  -6.790  -0.978   2.329
   66   1HB   CYS   9          1HB       CYS   9  -4.085  -1.697   1.388
   67   2HB   CYS   9          2HB       CYS   9  -5.332  -2.808   0.848
   68    HA   PRO  10           HA       PRO  10  -8.244  -4.678   4.145
   69   1HB   PRO  10          2HB       PRO  10  -8.607  -5.953   1.442
   70   2HB   PRO  10          1HB       PRO  10  -9.811  -5.742   2.745
   71   1HG   PRO  10          2HG       PRO  10  -9.875  -4.140   0.569
   72   2HG   PRO  10          1HG       PRO  10 -10.074  -3.418   2.196
   73   1HD   PRO  10          2HD       PRO  10  -7.539  -3.574   0.530
   74   2HD   PRO  10          1HD       PRO  10  -8.269  -2.160   1.339
   75    H    SER  11           H        SER  11  -8.150  -7.119   4.137
   76    HA   SER  11           HA       SER  11  -6.855  -8.894   4.685
   77   1HB   SER  11          2HB       SER  11  -6.209 -10.053   2.528
   78   2HB   SER  11          1HB       SER  11  -7.802  -9.277   2.428
   79    HG   SER  11           HG       SER  11  -5.918  -7.499   1.710
   80    H    GLY  12           H        GLY  12  -5.559  -6.936   5.535
   81   1HA   GLY  12          1HA       GLY  12  -3.496  -6.106   6.243
   82   2HA   GLY  12          2HA       GLY  12  -2.968  -7.794   6.155
   83    H    MET  13           H        MET  13  -3.992  -5.593   3.492
   84    HA   MET  13           HA       MET  13  -1.520  -5.916   1.977
   85   1HB   MET  13          1HB       MET  13  -3.874  -4.056   1.863
   86   2HB   MET  13          2HB       MET  13  -2.472  -3.807   0.808
   87   1HG   MET  13          1HG       MET  13  -2.746  -5.985  -0.200
   88   2HG   MET  13          2HG       MET  13  -4.076  -6.389   0.886
   89   1HE   MET  13          3HE       MET  13  -4.381  -6.963  -2.073
   90   2HE   MET  13          2HE       MET  13  -5.755  -7.079  -0.945
   91   3HE   MET  13          1HE       MET  13  -5.938  -6.206  -2.482
   92    H    CYS  14           H        CYS  14   0.072  -4.118   1.631
   93    HA   CYS  14           HA       CYS  14   0.419  -2.412   4.064
   94   1HB   CYS  14          1HB       CYS  14   2.295  -3.038   1.756
   95   2HB   CYS  14          2HB       CYS  14   2.536  -1.758   2.931
   96    H    CYS  15           H        CYS  15   0.611  -0.193   3.758
   97    HA   CYS  15           HA       CYS  15  -0.557   0.992   1.287
   98   1HB   CYS  15          1HB       CYS  15  -1.608   1.753   3.313
   99   2HB   CYS  15          2HB       CYS  15  -0.042   2.069   4.088
  100    H    SER  16           H        SER  16   1.027   1.457  -0.158
  101    HA   SER  16           HA       SER  16   3.691   0.868   0.292
  102   1HB   SER  16          2HB       SER  16   4.174   2.078  -1.858
  103   2HB   SER  16          1HB       SER  16   2.824   0.981  -1.983
  104    HG   SER  16           HG       SER  16   1.494   2.877  -1.440
  105    H    GLN  17           H        GLN  17   5.611   2.388   0.247
  106    HA   GLN  17           HA       GLN  17   5.463   4.828   1.690
  107   1HB   GLN  17          2HB       GLN  17   7.654   5.242   1.134
  108   2HB   GLN  17          1HB       GLN  17   7.522   3.473   1.200
  109   1HG   GLN  17          2HG       GLN  17   7.080   3.528  -1.280
  110   2HG   GLN  17          1HG       GLN  17   7.459   5.273  -1.236
  111   1HE2  GLN  17          2HE2      GLN  17  10.996   4.773  -0.523
  112   2HE2  GLN  17          1HE2      GLN  17   9.645   5.728   0.037
  113    H    PHE  18           H        PHE  18   4.613   4.171  -1.737
  114    HA   PHE  18           HA       PHE  18   4.700   6.806  -2.676
  115   1HB   PHE  18          2HB       PHE  18   3.590   4.314  -3.723
  116   2HB   PHE  18          1HB       PHE  18   4.214   5.664  -4.577
  117    HD1  PHE  18           HD2      PHE  18   6.849   6.230  -3.731
  118    HD2  PHE  18           HD1      PHE  18   4.926   2.406  -4.266
  119    HE1  PHE  18           HE2      PHE  18   9.049   5.179  -4.170
  120    HE2  PHE  18           HE1      PHE  18   7.113   1.384  -4.785
  121    HZ   PHE  18           HZ       PHE  18   9.191   2.755  -4.699
  122    H    GLY  19           H        GLY  19   2.484   5.358  -0.576
  123   1HA   GLY  19          1HA       GLY  19   0.436   5.923   0.019
  124   2HA   GLY  19          2HA       GLY  19   0.530   7.182  -1.193
  125    H    TYR  20           H        TYR  20   0.991   4.148  -2.670
  126    HA   TYR  20           HA       TYR  20  -1.925   3.677  -3.206
  127   1HB   TYR  20          1HB       TYR  20   0.562   2.447  -4.498
  128   2HB   TYR  20          2HB       TYR  20  -1.067   2.042  -4.949
  129    HD1  TYR  20           HD1      TYR  20   1.472   4.749  -5.059
  130    HD2  TYR  20           HD2      TYR  20  -2.398   3.428  -6.410
  131    HE1  TYR  20           HE1      TYR  20   1.346   6.688  -6.596
  132    HE2  TYR  20           HE2      TYR  20  -2.502   5.342  -7.979
  133    HH   TYR  20           HH       TYR  20  -1.522   7.325  -8.623
  134    H    CYS  21           H        CYS  21  -1.752   0.824  -3.508
  135    HA   CYS  21           HA       CYS  21  -0.644  -0.080  -0.935
  136   1HB   CYS  21          1HB       CYS  21  -2.588  -0.480   0.160
  137   2HB   CYS  21          2HB       CYS  21  -3.064   0.992  -0.673
  138    H    GLY  22           H        GLY  22  -0.545  -2.352  -0.643
  139   1HA   GLY  22          1HA       GLY  22  -1.639  -4.277  -2.234
  140   2HA   GLY  22          2HA       GLY  22  -0.105  -3.828  -3.021
  141    H    LYS  23           H        LYS  23  -0.703  -6.275  -1.710
  142    HA   LYS  23           HA       LYS  23   0.723  -6.310   0.877
  143   1HB   LYS  23          2HB       LYS  23  -1.415  -7.630   0.331
  144   2HB   LYS  23          1HB       LYS  23  -0.422  -8.671  -0.682
  145   1HG   LYS  23          2HG       LYS  23   0.979  -9.181   1.362
  146   2HG   LYS  23          1HG       LYS  23  -0.095  -8.124   2.300
  147   1HD   LYS  23          2HD       LYS  23  -2.041  -9.645   1.432
  148   2HD   LYS  23          1HD       LYS  23  -0.770 -10.719   0.842
  149   1HE   LYS  23          2HE       LYS  23  -1.428 -11.587   2.960
  150   2HE   LYS  23          1HE       LYS  23   0.141 -10.811   3.230
  151   1HZ   LYS  23          3HZ       LYS  23  -1.105  -8.873   4.088
  152   2HZ   LYS  23          2HZ       LYS  23  -2.514  -9.651   3.823
  153   3HZ   LYS  23          1HZ       LYS  23  -1.456 -10.240   4.938
  154    H    GLY  24           H        GLY  24   2.735  -5.425  -0.381
  155   1HA   GLY  24          1HA       GLY  24   4.523  -7.590  -0.418
  156   2HA   GLY  24          2HA       GLY  24   4.151  -7.179  -2.108
  157    HA   PRO  25           HA       PRO  25   7.710  -4.812  -0.116
  158   1HB   PRO  25          2HB       PRO  25   9.814  -5.767  -1.583
  159   2HB   PRO  25          1HB       PRO  25   9.119  -6.629  -0.181
  160   1HG   PRO  25          2HG       PRO  25   8.494  -7.082  -3.111
  161   2HG   PRO  25          1HG       PRO  25   8.921  -8.306  -1.880
  162   1HD   PRO  25          2HD       PRO  25   6.342  -7.792  -2.544
  163   2HD   PRO  25          1HD       PRO  25   6.778  -8.132  -0.850
  164    H    LYS  26           H        LYS  26   6.582  -5.160  -3.429
  165    HA   LYS  26           HA       LYS  26   7.924  -2.961  -4.646
  166   1HB   LYS  26          2HB       LYS  26   5.073  -3.997  -4.971
  167   2HB   LYS  26          1HB       LYS  26   5.819  -2.738  -5.971
  168   1HG   LYS  26          2HG       LYS  26   7.582  -4.322  -6.693
  169   2HG   LYS  26          1HG       LYS  26   6.895  -5.579  -5.662
  170   1HD   LYS  26          2HD       LYS  26   6.212  -5.980  -7.923
  171   2HD   LYS  26          1HD       LYS  26   4.789  -5.536  -6.964
  172   1HE   LYS  26          2HE       LYS  26   4.814  -3.254  -7.907
  173   2HE   LYS  26          1HE       LYS  26   6.350  -3.577  -8.732
  174   1HZ   LYS  26          2HZ       LYS  26   3.778  -4.901  -9.298
  175   2HZ   LYS  26          1HZ       LYS  26   4.485  -3.728 -10.204
  176   3HZ   LYS  26          3HZ       LYS  26   5.200  -5.201 -10.078
  177    H    TYR  27           H        TYR  27   5.092  -3.134  -2.399
  178    HA   TYR  27           HA       TYR  27   4.690  -0.243  -2.572
  179   1HB   TYR  27          1HB       TYR  27   3.277  -2.498  -1.063
  180   2HB   TYR  27          2HB       TYR  27   2.787  -0.914  -1.029
  181    HD1  TYR  27           HD2      TYR  27   3.221  -3.869  -3.244
  182    HD2  TYR  27           HD1      TYR  27   1.259  -0.050  -2.846
  183    HE1  TYR  27           HE2      TYR  27   2.124  -4.171  -5.447
  184    HE2  TYR  27           HE1      TYR  27   0.289  -0.299  -5.075
  185    HH   TYR  27           HH       TYR  27  -0.024  -1.711  -6.873
  186    H    CYS  28           H        CYS  28   4.935  -2.716  -0.086
  187    HA   CYS  28           HA       CYS  28   5.133  -0.997   2.094
  188   1HB   CYS  28          1HB       CYS  28   4.685  -3.637   1.798
  189   2HB   CYS  28          2HB       CYS  28   6.329  -3.755   2.391
  190    H    GLY  29           H        GLY  29   7.698  -3.118   0.967
  191   1HA   GLY  29          1HA       GLY  29  10.070  -2.976   1.205
  192   2HA   GLY  29          2HA       GLY  29   9.630  -1.730   0.071
  193    H    ARG  30           HN       ARG  30  10.560   0.018   0.418
  194    HA   ARG  30           HA       ARG  30  12.188   0.717   2.657
  195   1HB   ARG  30          1HB       ARG  30  11.203   2.517   0.409
  196   2HB   ARG  30          2HB       ARG  30  12.570   2.788   1.465
  197   1HG   ARG  30          1HG       ARG  30  13.421   2.139  -0.636
  198   2HG   ARG  30          2HG       ARG  30  13.755   0.838   0.500
  199   1HD   ARG  30          1HD       ARG  30  13.059   0.194  -1.864
  200   2HD   ARG  30          2HD       ARG  30  12.222  -0.618  -0.545
  201    HE   ARG  30           HE       ARG  30  10.882   1.826  -1.542
  202   1HH1  ARG  30          1HH2      ARG  30  11.325  -1.574  -2.244
  203   2HH1  ARG  30          2HH2      ARG  30   9.640  -1.954  -2.441
  204   1HH2  ARG  30          2HH1      ARG  30   8.718   1.536  -2.220
  205   2HH2  ARG  30          1HH1      ARG  30   8.150   0.016  -2.839
  No match found for entry  HXTARG          30
   
  No H/Q in entry =         206
  Start of MODEL          25
 Raw file had  213 H/Q atoms
  Start of MODEL   25
    1   1H    VAL   1          2H        VAL   1  -5.988  -0.602  -7.958
    2   2H    VAL   1          3H        VAL   1  -6.182  -2.174  -7.412
    3   3H    VAL   1          1H        VAL   1  -7.462  -1.293  -8.008
    4    HA   VAL   1           HA       VAL   1  -7.777  -1.054  -5.761
    5    HB   VAL   1           HB       VAL   1  -5.936  -0.449  -4.231
    6   1HG1  VAL   1          2HG1      VAL   1  -6.568  -2.834  -4.537
    7   2HG1  VAL   1          1HG1      VAL   1  -5.294  -3.008  -5.765
    8   3HG1  VAL   1          3HG1      VAL   1  -4.866  -2.625  -4.095
    9   1HG2  VAL   1          2HG2      VAL   1  -4.063  -0.905  -6.606
   10   2HG2  VAL   1          1HG2      VAL   1  -4.369   0.645  -5.790
   11   3HG2  VAL   1          3HG2      VAL   1  -3.583  -0.674  -4.921
   12    H    GLY   2           H        GLY   2  -7.882   1.171  -4.564
   13   1HA   GLY   2          1HA       GLY   2  -7.824   3.358  -6.564
   14   2HA   GLY   2          2HA       GLY   2  -8.550   3.385  -4.951
   15    H    GLU   3           H        GLU   3  -7.170   3.625  -3.074
   16    HA   GLU   3           HA       GLU   3  -4.363   3.771  -3.258
   17   1HB   GLU   3          2HB       GLU   3  -5.956   6.305  -2.690
   18   2HB   GLU   3          1HB       GLU   3  -4.350   6.008  -2.017
   19   1HG   GLU   3          2HG       GLU   3  -3.444   5.741  -4.324
   20   2HG   GLU   3          1HG       GLU   3  -5.002   6.319  -4.955
   21    HE2  GLU   3           HE2      GLU   3  -3.062   7.809  -5.706
   22    H    CYS   4           H        CYS   4  -3.687   4.263  -0.869
   23    HA   CYS   4           HA       CYS   4  -5.212   2.607   0.958
   24   1HB   CYS   4          1HB       CYS   4  -3.512   4.810   2.030
   25   2HB   CYS   4          2HB       CYS   4  -3.679   3.179   2.636
   26    H    VAL   5           H        VAL   5  -6.478   3.179   2.645
   27    HA   VAL   5           HA       VAL   5  -7.982   5.724   2.374
   28    HB   VAL   5           HB       VAL   5  -8.592   3.321   4.114
   29   1HG1  VAL   5          2HG1      VAL   5 -10.196   5.775   3.249
   30   2HG1  VAL   5          1HG1      VAL   5 -10.826   4.411   4.202
   31   3HG1  VAL   5          3HG1      VAL   5  -9.587   5.475   4.887
   32   1HG2  VAL   5          1HG2      VAL   5  -9.523   4.130   1.333
   33   2HG2  VAL   5          3HG2      VAL   5  -8.649   2.652   1.777
   34   3HG2  VAL   5          2HG2      VAL   5 -10.308   2.887   2.335
   35    H    ARG   6           H        ARG   6  -5.905   6.485   2.768
   36    HA   ARG   6           HA       ARG   6  -4.247   7.568   3.897
   37   1HB   ARG   6          2HB       ARG   6  -6.373   8.075   5.977
   38   2HB   ARG   6          1HB       ARG   6  -4.860   8.963   5.755
   39   1HG   ARG   6          2HG       ARG   6  -7.239   8.855   3.852
   40   2HG   ARG   6          1HG       ARG   6  -6.649  10.214   4.805
   41   1HD   ARG   6          2HD       ARG   6  -5.899  10.785   2.722
   42   2HD   ARG   6          1HD       ARG   6  -4.454  10.007   3.396
   43    HE   ARG   6           HE       ARG   6  -6.130   8.110   2.001
   44   1HH1  ARG   6          2HH1      ARG   6  -4.103  10.881   1.178
   45   2HH1  ARG   6          1HH1      ARG   6  -3.706  10.280  -0.408
   46   1HH2  ARG   6          1HH2      ARG   6  -5.430   7.211   0.030
   47   2HH2  ARG   6          2HH2      ARG   6  -4.576   8.209  -1.121
   48    H    GLY   7           H        GLY   7  -3.723   5.120   3.964
   49   1HA   GLY   7          1HA       GLY   7  -2.068   3.897   4.876
   50   2HA   GLY   7          2HA       GLY   7  -2.305   4.704   6.423
   51    H    ARG   8           H        ARG   8  -4.897   3.108   4.590
   52    HA   ARG   8           HA       ARG   8  -4.967   0.745   6.315
   53   1HB   ARG   8          2HB       ARG   8  -7.313   2.483   5.584
   54   2HB   ARG   8          1HB       ARG   8  -7.334   0.981   6.535
   55   1HG   ARG   8          2HG       ARG   8  -5.703   2.070   8.104
   56   2HG   ARG   8          1HG       ARG   8  -5.822   3.527   7.173
   57   1HD   ARG   8          2HD       ARG   8  -8.313   3.596   7.566
   58   2HD   ARG   8          1HD       ARG   8  -8.106   2.216   8.659
   59    HE   ARG   8           HE       ARG   8  -7.452   3.662  10.300
   60   1HH1  ARG   8          2HH1      ARG   8  -6.945   5.337   7.206
   61   2HH1  ARG   8          1HH1      ARG   8  -5.760   6.414   7.840
   62   1HH2  ARG   8          1HH2      ARG   8  -6.270   5.434  11.231
   63   2HH2  ARG   8          2HH2      ARG   8  -5.725   6.734  10.219
   64    H    CYS   9           H        CYS   9  -4.969  -0.980   4.791
   65    HA   CYS   9           HA       CYS   9  -6.131  -0.557   2.100
   66   1HB   CYS   9          1HB       CYS   9  -3.537  -1.911   2.925
   67   2HB   CYS   9          2HB       CYS   9  -4.331  -2.195   1.392
   68    HA   PRO  10           HA       PRO  10  -8.331  -4.263   3.037
   69   1HB   PRO  10          2HB       PRO  10  -7.935  -5.366   0.298
   70   2HB   PRO  10          1HB       PRO  10  -9.457  -4.881   1.094
   71   1HG   PRO  10          2HG       PRO  10  -8.333  -3.443  -0.923
   72   2HG   PRO  10          1HG       PRO  10  -9.162  -2.630   0.441
   73   1HD   PRO  10          2HD       PRO  10  -6.178  -3.083   0.087
   74   2HD   PRO  10          1HD       PRO  10  -7.049  -1.589   0.523
   75    H    SER  11           H        SER  11  -8.267  -6.623   2.931
   76    HA   SER  11           HA       SER  11  -7.130  -8.457   3.790
   77   1HB   SER  11          2HB       SER  11  -8.018  -8.634   1.352
   78   2HB   SER  11          1HB       SER  11  -6.323  -8.513   0.849
   79    HG   SER  11           HG       SER  11  -7.535 -10.509   2.483
   80    H    GLY  12           H        GLY  12  -5.600  -6.801   4.777
   81   1HA   GLY  12          1HA       GLY  12  -3.468  -6.313   5.563
   82   2HA   GLY  12          2HA       GLY  12  -3.186  -8.053   5.378
   83    H    MET  13           H        MET  13  -3.774  -5.534   2.907
   84    HA   MET  13           HA       MET  13  -1.229  -6.129   1.497
   85   1HB   MET  13          1HB       MET  13  -3.512  -4.184   1.004
   86   2HB   MET  13          2HB       MET  13  -2.067  -4.280   0.003
   87   1HG   MET  13          1HG       MET  13  -2.603  -6.615  -0.573
   88   2HG   MET  13          2HG       MET  13  -4.037  -6.556   0.456
   89   1HE   MET  13          3HE       MET  13  -4.140  -7.550  -2.510
   90   2HE   MET  13          2HE       MET  13  -5.578  -7.409  -1.465
   91   3HE   MET  13          1HE       MET  13  -5.594  -6.712  -3.101
   92    H    CYS  14           H        CYS  14   0.439  -4.453   1.237
   93    HA   CYS  14           HA       CYS  14   0.631  -2.776   3.672
   94   1HB   CYS  14          1HB       CYS  14   2.619  -3.258   1.429
   95   2HB   CYS  14          2HB       CYS  14   2.826  -2.205   2.825
   96    H    CYS  15           H        CYS  15   0.287  -0.625   3.608
   97    HA   CYS  15           HA       CYS  15  -0.713   0.707   1.232
   98   1HB   CYS  15          1HB       CYS  15  -1.462   1.451   3.442
   99   2HB   CYS  15          2HB       CYS  15   0.211   1.741   3.952
  100    H    SER  16           H        SER  16   0.607   1.129  -0.442
  101    HA   SER  16           HA       SER  16   3.322   0.654  -0.395
  102   1HB   SER  16          2HB       SER  16   2.071   2.548  -2.382
  103   2HB   SER  16          1HB       SER  16   3.302   1.321  -2.655
  104    HG   SER  16           HG       SER  16   1.540  -0.209  -2.034
  105    H    GLN  17           H        GLN  17   5.197   2.080  -0.548
  106    HA   GLN  17           HA       GLN  17   5.251   4.512   0.810
  107   1HB   GLN  17          2HB       GLN  17   7.358   4.965  -0.164
  108   2HB   GLN  17          1HB       GLN  17   7.227   3.259   0.314
  109   1HG   GLN  17          2HG       GLN  17   6.613   2.687  -2.016
  110   2HG   GLN  17          1HG       GLN  17   6.810   4.410  -2.431
  111   1HE2  GLN  17          2HE2      GLN  17  10.097   2.059  -2.428
  112   2HE2  GLN  17          1HE2      GLN  17   8.474   1.388  -2.349
  113    H    PHE  18           H        PHE  18   4.133   3.964  -2.556
  114    HA   PHE  18           HA       PHE  18   3.916   6.636  -3.328
  115   1HB   PHE  18          2HB       PHE  18   2.800   4.162  -4.405
  116   2HB   PHE  18          1HB       PHE  18   3.317   5.581  -5.229
  117    HD1  PHE  18           HD1      PHE  18   5.924   6.217  -4.917
  118    HD2  PHE  18           HD2      PHE  18   4.225   2.253  -4.723
  119    HE1  PHE  18           HE1      PHE  18   8.164   5.229  -5.305
  120    HE2  PHE  18           HE2      PHE  18   6.487   1.277  -5.026
  121    HZ   PHE  18           HZ       PHE  18   8.452   2.761  -5.328
  122    H    GLY  19           H        GLY  19   2.074   4.956  -1.077
  123   1HA   GLY  19          1HA       GLY  19   0.098   5.271  -0.170
  124   2HA   GLY  19          2HA       GLY  19  -0.098   6.604  -1.290
  125    H    TYR  20           H        TYR  20   0.432   3.525  -2.744
  126    HA   TYR  20           HA       TYR  20  -2.455   3.020  -3.246
  127   1HB   TYR  20          1HB       TYR  20   0.019   1.978  -4.668
  128   2HB   TYR  20          2HB       TYR  20  -1.610   1.435  -5.003
  129    HD1  TYR  20           HD1      TYR  20   0.458   4.567  -5.048
  130    HD2  TYR  20           HD2      TYR  20  -3.037   2.525  -6.520
  131    HE1  TYR  20           HE1      TYR  20  -0.355   6.679  -6.056
  132    HE2  TYR  20           HE2      TYR  20  -3.751   4.577  -7.673
  133    HH   TYR  20           HH       TYR  20  -3.369   6.844  -7.947
  134    H    CYS  21           H        CYS  21  -2.111   0.164  -3.640
  135    HA   CYS  21           HA       CYS  21  -1.518  -0.713  -0.834
  136   1HB   CYS  21          1HB       CYS  21  -4.112  -1.079  -2.386
  137   2HB   CYS  21          2HB       CYS  21  -3.670  -2.011  -0.958
  138    H    GLY  22           H        GLY  22  -0.338  -2.689  -0.890
  139   1HA   GLY  22          1HA       GLY  22  -1.349  -4.789  -2.351
  140   2HA   GLY  22          2HA       GLY  22   0.066  -4.223  -3.251
  141    H    LYS  23           H        LYS  23  -0.362  -6.661  -1.771
  142    HA   LYS  23           HA       LYS  23   1.226  -6.570   0.696
  143   1HB   LYS  23          2HB       LYS  23  -0.794  -8.038   0.290
  144   2HB   LYS  23          1HB       LYS  23   0.171  -8.968  -0.859
  145   1HG   LYS  23          2HG       LYS  23   1.826  -9.351   1.082
  146   2HG   LYS  23          1HG       LYS  23   0.608  -8.658   2.151
  147   1HD   LYS  23          2HD       LYS  23   0.391 -11.128   0.357
  148   2HD   LYS  23          1HD       LYS  23   0.502 -11.139   2.113
  149   1HE   LYS  23          2HE       LYS  23  -1.843 -10.068   0.449
  150   2HE   LYS  23          1HE       LYS  23  -1.802 -11.602   1.311
  151   1HZ   LYS  23          1HZ       LYS  23  -1.548  -8.988   2.656
  152   2HZ   LYS  23          3HZ       LYS  23  -2.954  -9.789   2.489
  153   3HZ   LYS  23          2HZ       LYS  23  -1.729 -10.451   3.372
  154    H    GLY  24           H        GLY  24   3.104  -5.529  -0.638
  155   1HA   GLY  24          1HA       GLY  24   4.993  -7.662  -1.117
  156   2HA   GLY  24          2HA       GLY  24   4.633  -6.733  -2.584
  157    HA   PRO  25           HA       PRO  25   7.935  -5.105   0.424
  158   1HB   PRO  25          2HB       PRO  25  10.246  -5.526  -1.002
  159   2HB   PRO  25          1HB       PRO  25   9.441  -6.770  -0.008
  160   1HG   PRO  25          2HG       PRO  25   9.228  -6.380  -2.998
  161   2HG   PRO  25          1HG       PRO  25   9.493  -7.900  -2.101
  162   1HD   PRO  25          2HD       PRO  25   7.022  -7.129  -2.992
  163   2HD   PRO  25          1HD       PRO  25   7.205  -8.019  -1.462
  164    H    LYS  26           H        LYS  26   7.942  -4.542  -3.108
  165    HA   LYS  26           HA       LYS  26   9.221  -2.072  -3.317
  166   1HB   LYS  26          2HB       LYS  26   6.744  -3.163  -4.731
  167   2HB   LYS  26          1HB       LYS  26   7.560  -1.677  -5.221
  168   1HG   LYS  26          2HG       LYS  26   9.668  -2.934  -5.591
  169   2HG   LYS  26          1HG       LYS  26   8.854  -4.445  -5.138
  170   1HD   LYS  26          2HD       LYS  26   7.222  -4.117  -6.987
  171   2HD   LYS  26          1HD       LYS  26   8.042  -2.607  -7.438
  172   1HE   LYS  26          2HE       LYS  26  10.142  -3.883  -7.886
  173   2HE   LYS  26          1HE       LYS  26   9.322  -5.391  -7.445
  174   1HZ   LYS  26          2HZ       LYS  26   8.591  -3.643  -9.705
  175   2HZ   LYS  26          1HZ       LYS  26   9.388  -5.074  -9.809
  176   3HZ   LYS  26          3HZ       LYS  26   7.827  -5.044  -9.298
  177    H    TYR  27           H        TYR  27   6.015  -2.795  -2.089
  178    HA   TYR  27           HA       TYR  27   5.197   0.045  -1.887
  179   1HB   TYR  27          1HB       TYR  27   3.953  -2.701  -1.515
  180   2HB   TYR  27          2HB       TYR  27   3.096  -1.345  -1.039
  181    HD1  TYR  27           HD1      TYR  27   4.987  -0.415  -4.039
  182    HD2  TYR  27           HD2      TYR  27   1.623  -2.723  -2.707
  183    HE1  TYR  27           HE1      TYR  27   3.970  -0.192  -6.258
  184    HE2  TYR  27           HE2      TYR  27   0.563  -2.477  -4.955
  185    HH   TYR  27           HH       TYR  27   0.776  -1.566  -7.061
  186    H    CYS  28           H        CYS  28   5.391  -2.863   0.114
  187    HA   CYS  28           HA       CYS  28   4.916  -1.589   2.516
  188   1HB   CYS  28          1HB       CYS  28   5.312  -4.207   1.867
  189   2HB   CYS  28          2HB       CYS  28   6.808  -3.889   2.747
  190    H    GLY  29           H        GLY  29   8.141  -2.292   1.207
  191   1HA   GLY  29          1HA       GLY  29  10.245  -1.480   1.820
  192   2HA   GLY  29          2HA       GLY  29   9.356   0.040   1.689
  193    H    ARG  30           HN       ARG  30  10.252   1.183   3.341
  194    HA   ARG  30           HA       ARG  30  10.955   1.786   5.460
  195   1HB   ARG  30          1HB       ARG  30   7.974   1.177   5.655
  196   2HB   ARG  30          2HB       ARG  30   8.882   2.071   6.863
  197   1HG   ARG  30          1HG       ARG  30   7.868   3.714   5.635
  198   2HG   ARG  30          2HG       ARG  30   9.571   3.759   5.189
  199   1HD   ARG  30          1HD       ARG  30   8.065   4.162   3.266
  200   2HD   ARG  30          2HD       ARG  30   9.072   2.762   3.022
  201    HE   ARG  30           HE       ARG  30   7.248   1.283   3.417
  202   1HH1  ARG  30          1HH2      ARG  30   6.147   4.509   3.969
  203   2HH1  ARG  30          2HH2      ARG  30   4.530   4.306   3.367
  204   1HH2  ARG  30          1HH1      ARG  30   5.251   1.028   2.117
  205   2HH2  ARG  30          2HH1      ARG  30   3.914   1.971   2.625
  No match found for entry  HXTARG          30
   
  No H/Q in entry =         206
  Start of MODEL          26
 Raw file had  213 H/Q atoms
  Start of MODEL   26
    1   1H    VAL   1          2H        VAL   1  -6.156  -0.420  -7.630
    2   2H    VAL   1          3H        VAL   1  -6.303  -1.760  -6.643
    3   3H    VAL   1          1H        VAL   1  -7.643  -0.948  -7.203
    4    HA   VAL   1           HA       VAL   1  -7.399  -0.188  -5.038
    5    HB   VAL   1           HB       VAL   1  -5.270  -0.899  -4.431
    6   1HG1  VAL   1          2HG1      VAL   1  -4.072   0.760  -6.694
    7   2HG1  VAL   1          1HG1      VAL   1  -3.138  -0.075  -5.440
    8   3HG1  VAL   1          3HG1      VAL   1  -4.101  -1.013  -6.574
    9   1HG2  VAL   1          3HG2      VAL   1  -5.858   1.265  -3.372
   10   2HG2  VAL   1          2HG2      VAL   1  -4.113   1.015  -3.505
   11   3HG2  VAL   1          1HG2      VAL   1  -4.909   2.114  -4.621
   12    H    GLY   2           H        GLY   2  -7.780   2.020  -4.554
   13   1HA   GLY   2          1HA       GLY   2  -7.771   3.915  -6.867
   14   2HA   GLY   2          2HA       GLY   2  -8.657   4.096  -5.343
   15    H    GLU   3           H        GLU   3  -7.047   3.859  -3.321
   16    HA   GLU   3           HA       GLU   3  -4.345   4.509  -3.541
   17   1HB   GLU   3          2HB       GLU   3  -4.526   6.675  -2.204
   18   2HB   GLU   3          1HB       GLU   3  -4.911   6.796  -3.922
   19   1HG   GLU   3          2HG       GLU   3  -7.307   6.827  -3.444
   20   2HG   GLU   3          1HG       GLU   3  -6.999   6.517  -1.720
   21    HE1  GLU   3           HE2      GLU   3  -6.075  10.166  -3.203
   22    H    CYS   4           H        CYS   4  -3.623   4.697  -1.126
   23    HA   CYS   4           HA       CYS   4  -4.759   2.617   0.410
   24   1HB   CYS   4          1HB       CYS   4  -3.352   4.922   1.752
   25   2HB   CYS   4          2HB       CYS   4  -3.430   3.252   2.243
   26    H    VAL   5           H        VAL   5  -5.815   2.644   2.347
   27    HA   VAL   5           HA       VAL   5  -7.936   4.701   2.738
   28    HB   VAL   5           HB       VAL   5  -7.832   1.774   3.607
   29   1HG1  VAL   5          3HG1      VAL   5 -10.062   3.856   3.721
   30   2HG1  VAL   5          2HG1      VAL   5 -10.217   2.141   4.159
   31   3HG1  VAL   5          1HG1      VAL   5  -9.175   3.203   5.117
   32   1HG2  VAL   5          2HG2      VAL   5  -9.350   3.123   1.331
   33   2HG2  VAL   5          1HG2      VAL   5  -8.072   1.900   1.168
   34   3HG2  VAL   5          3HG2      VAL   5  -9.619   1.460   1.898
   35    H    ARG   6           H        ARG   6  -6.884   6.118   4.061
   36    HA   ARG   6           HA       ARG   6  -5.672   6.977   5.803
   37   1HB   ARG   6          2HB       ARG   6  -6.977   4.715   7.341
   38   2HB   ARG   6          1HB       ARG   6  -6.284   6.178   8.032
   39   1HG   ARG   6          2HG       ARG   6  -8.690   5.995   6.165
   40   2HG   ARG   6          1HG       ARG   6  -8.718   6.336   7.896
   41   1HD   ARG   6          2HD       ARG   6  -7.617   8.129   5.695
   42   2HD   ARG   6          1HD       ARG   6  -9.084   8.370   6.657
   43    HE   ARG   6           HE       ARG   6  -6.966   8.152   8.488
   44   1HH1  ARG   6          1HH1      ARG   6  -8.032  10.347   5.948
   45   2HH1  ARG   6          2HH1      ARG   6  -7.308  11.768   6.631
   46   1HH2  ARG   6          1HH2      ARG   6  -5.975  10.020   9.440
   47   2HH2  ARG   6          2HH2      ARG   6  -6.115  11.569   8.678
   48    H    GLY   7           H        GLY   7  -4.098   5.488   4.182
   49   1HA   GLY   7          1HA       GLY   7  -1.978   4.733   4.083
   50   2HA   GLY   7          2HA       GLY   7  -1.828   5.073   5.804
   51    H    ARG   8           H        ARG   8  -4.360   2.728   4.852
   52    HA   ARG   8           HA       ARG   8  -2.644   0.430   5.147
   53   1HB   ARG   8          2HB       ARG   8  -5.290   0.902   6.577
   54   2HB   ARG   8          1HB       ARG   8  -4.370  -0.625   6.520
   55   1HG   ARG   8          2HG       ARG   8  -2.369   0.728   7.325
   56   2HG   ARG   8          1HG       ARG   8  -3.466   2.040   7.628
   57   1HD   ARG   8          2HD       ARG   8  -4.774   0.635   9.208
   58   2HD   ARG   8          1HD       ARG   8  -3.671  -0.733   8.885
   59    HE   ARG   8           HE       ARG   8  -2.139   1.519   9.695
   60   1HH1  ARG   8          2HH1      ARG   8  -4.426  -0.783  11.050
   61   2HH1  ARG   8          1HH1      ARG   8  -3.797  -0.733  12.668
   62   1HH2  ARG   8          1HH2      ARG   8  -1.251   1.627  11.834
   63   2HH2  ARG   8          2HH2      ARG   8  -1.938   0.689  13.119
   64    H    CYS   9           H        CYS   9  -4.126  -1.406   4.292
   65    HA   CYS   9           HA       CYS   9  -6.379  -0.550   2.638
   66   1HB   CYS   9          1HB       CYS   9  -3.843  -1.632   1.568
   67   2HB   CYS   9          2HB       CYS   9  -5.281  -2.502   1.044
   68    HA   PRO  10           HA       PRO  10  -8.241  -4.212   4.205
   69   1HB   PRO  10          2HB       PRO  10  -8.958  -5.115   1.429
   70   2HB   PRO  10          1HB       PRO  10 -10.035  -4.855   2.830
   71   1HG   PRO  10          2HG       PRO  10  -9.965  -3.087   0.785
   72   2HG   PRO  10          1HG       PRO  10 -10.022  -2.490   2.473
   73   1HD   PRO  10          2HD       PRO  10  -7.576  -2.788   0.694
   74   2HD   PRO  10          1HD       PRO  10  -8.093  -1.385   1.668
   75    H    SER  11           H        SER  11  -8.381  -6.616   3.918
   76    HA   SER  11           HA       SER  11  -7.193  -8.541   4.167
   77   1HB   SER  11          2HB       SER  11  -6.977  -9.557   1.850
   78   2HB   SER  11          1HB       SER  11  -8.479  -8.637   2.048
   79    HG   SER  11           HG       SER  11  -6.612  -6.936   1.216
   80    H    GLY  12           H        GLY  12  -5.581  -6.801   4.959
   81   1HA   GLY  12          1HA       GLY  12  -3.364  -6.273   5.447
   82   2HA   GLY  12          2HA       GLY  12  -3.073  -8.004   5.196
   83    H    MET  13           H        MET  13  -4.081  -5.480   2.841
   84    HA   MET  13           HA       MET  13  -1.650  -5.980   1.166
   85   1HB   MET  13          1HB       MET  13  -4.016  -4.142   0.833
   86   2HB   MET  13          2HB       MET  13  -2.745  -4.359  -0.366
   87   1HG   MET  13          1HG       MET  13  -4.579  -6.598   0.605
   88   2HG   MET  13          2HG       MET  13  -4.940  -5.558  -0.771
   89   1HE   MET  13          3HE       MET  13  -5.093  -8.653  -0.920
   90   2HE   MET  13          2HE       MET  13  -5.389  -7.572  -2.303
   91   3HE   MET  13          1HE       MET  13  -4.279  -8.952  -2.475
   92    H    CYS  14           H        CYS  14   0.102  -4.475   1.155
   93    HA   CYS  14           HA       CYS  14   0.119  -2.728   3.533
   94   1HB   CYS  14          1HB       CYS  14   2.303  -3.392   1.524
   95   2HB   CYS  14          2HB       CYS  14   2.435  -2.355   2.940
   96    H    CYS  15           H        CYS  15   0.283  -0.486   3.422
   97    HA   CYS  15           HA       CYS  15  -0.520   0.829   0.952
   98   1HB   CYS  15          1HB       CYS  15  -1.317   1.660   3.075
   99   2HB   CYS  15          2HB       CYS  15   0.344   1.913   3.648
  100    H    SER  16           H        SER  16   0.808   1.442  -0.597
  101    HA   SER  16           HA       SER  16   3.567   0.957  -0.642
  102   1HB   SER  16          2HB       SER  16   3.531   2.007  -2.828
  103   2HB   SER  16          1HB       SER  16   2.013   1.121  -2.622
  104    HG   SER  16           HG       SER  16   1.089   3.093  -1.896
  105    H    GLN  17           H        GLN  17   5.008   2.911  -1.547
  106    HA   GLN  17           HA       GLN  17   5.151   5.131   0.384
  107   1HB   GLN  17          2HB       GLN  17   7.105   5.782  -0.587
  108   2HB   GLN  17          1HB       GLN  17   7.162   4.098  -0.035
  109   1HG   GLN  17          2HG       GLN  17   6.367   4.757  -2.830
  110   2HG   GLN  17          1HG       GLN  17   8.078   4.829  -2.328
  111   1HE2  GLN  17          2HE2      GLN  17   8.383   1.238  -2.022
  112   2HE2  GLN  17          1HE2      GLN  17   9.161   2.790  -1.704
  113    H    PHE  18           H        PHE  18   3.749   4.451  -2.832
  114    HA   PHE  18           HA       PHE  18   3.709   7.104  -3.777
  115   1HB   PHE  18          2HB       PHE  18   2.679   4.504  -4.639
  116   2HB   PHE  18          1HB       PHE  18   2.930   5.890  -5.612
  117    HD1  PHE  18           HD1      PHE  18   5.559   6.871  -5.286
  118    HD2  PHE  18           HD2      PHE  18   4.224   2.767  -5.188
  119    HE1  PHE  18           HE1      PHE  18   7.854   6.105  -5.811
  120    HE2  PHE  18           HE2      PHE  18   6.523   2.012  -5.705
  121    HZ   PHE  18           HZ       PHE  18   8.345   3.676  -6.013
  122    H    GLY  19           H        GLY  19   1.857   5.754  -1.407
  123   1HA   GLY  19          1HA       GLY  19  -0.195   6.062  -0.618
  124   2HA   GLY  19          2HA       GLY  19  -0.390   7.252  -1.891
  125    H    TYR  20           H        TYR  20   0.405   4.187  -3.190
  126    HA   TYR  20           HA       TYR  20  -2.441   3.292  -3.495
  127   1HB   TYR  20          1HB       TYR  20   0.089   2.511  -5.010
  128   2HB   TYR  20          2HB       TYR  20  -1.457   1.782  -5.284
  129    HD1  TYR  20           HD2      TYR  20   0.509   4.872  -5.773
  130    HD2  TYR  20           HD1      TYR  20  -3.328   3.005  -6.366
  131    HE1  TYR  20           HE2      TYR  20  -0.282   6.876  -6.998
  132    HE2  TYR  20           HE1      TYR  20  -4.058   4.937  -7.718
  133    HH   TYR  20           HH       TYR  20  -3.608   7.117  -8.284
  134    H    CYS  21           H        CYS  21  -1.794   0.490  -3.812
  135    HA   CYS  21           HA       CYS  21  -0.348  -0.254  -1.420
  136   1HB   CYS  21          1HB       CYS  21  -2.132  -0.855   0.004
  137   2HB   CYS  21          2HB       CYS  21  -2.576   0.751  -0.559
  138    H    GLY  22           H        GLY  22  -0.361  -2.595  -0.994
  139   1HA   GLY  22          1HA       GLY  22  -1.617  -4.536  -2.476
  140   2HA   GLY  22          2HA       GLY  22  -0.136  -4.084  -3.364
  141    H    LYS  23           H        LYS  23  -0.649  -6.540  -1.952
  142    HA   LYS  23           HA       LYS  23   0.855  -6.521   0.570
  143   1HB   LYS  23          2HB       LYS  23  -1.089  -7.976   0.202
  144   2HB   LYS  23          1HB       LYS  23  -0.221  -8.837  -1.078
  145   1HG   LYS  23          2HG       LYS  23   1.528  -9.407   0.737
  146   2HG   LYS  23          1HG       LYS  23   0.399  -8.742   1.914
  147   1HD   LYS  23          2HD       LYS  23   0.024 -11.100  -0.001
  148   2HD   LYS  23          1HD       LYS  23   0.161 -11.192   1.753
  149   1HE   LYS  23          2HE       LYS  23  -2.165 -10.012   0.139
  150   2HE   LYS  23          1HE       LYS  23  -2.170 -11.526   1.040
  151   1HZ   LYS  23          2HZ       LYS  23  -1.803  -8.872   2.280
  152   2HZ   LYS  23          1HZ       LYS  23  -3.224  -9.664   2.216
  153   3HZ   LYS  23          3HZ       LYS  23  -1.968 -10.298   3.069
  154    H    GLY  24           H        GLY  24   2.848  -5.501  -0.570
  155   1HA   GLY  24          1HA       GLY  24   4.648  -7.702  -0.947
  156   2HA   GLY  24          2HA       GLY  24   4.512  -6.724  -2.418
  157    HA   PRO  25           HA       PRO  25   7.492  -5.336   1.030
  158   1HB   PRO  25          2HB       PRO  25   9.931  -5.904  -0.091
  159   2HB   PRO  25          1HB       PRO  25   8.931  -7.106   0.768
  160   1HG   PRO  25          2HG       PRO  25   9.129  -6.669  -2.216
  161   2HG   PRO  25          1HG       PRO  25   9.188  -8.214  -1.324
  162   1HD   PRO  25          2HD       PRO  25   6.902  -7.276  -2.508
  163   2HD   PRO  25          1HD       PRO  25   6.829  -8.202  -0.993
  164    H    LYS  26           H        LYS  26   7.762  -4.785  -2.474
  165    HA   LYS  26           HA       LYS  26   9.212  -2.411  -2.631
  166   1HB   LYS  26          2HB       LYS  26   6.674  -3.263  -4.107
  167   2HB   LYS  26          1HB       LYS  26   7.648  -1.861  -4.554
  168   1HG   LYS  26          2HG       LYS  26   9.618  -3.294  -4.904
  169   2HG   LYS  26          1HG       LYS  26   8.669  -4.737  -4.486
  170   1HD   LYS  26          2HD       LYS  26   7.081  -4.239  -6.331
  171   2HD   LYS  26          1HD       LYS  26   8.032  -2.832  -6.801
  172   1HE   LYS  26          2HE       LYS  26   9.004  -5.742  -6.808
  173   2HE   LYS  26          1HE       LYS  26   8.437  -4.850  -8.224
  174   1HZ   LYS  26          3HZ       LYS  26  10.257  -3.310  -7.922
  175   2HZ   LYS  26          2HZ       LYS  26  10.811  -4.159  -6.623
  176   3HZ   LYS  26          1HZ       LYS  26  10.806  -4.846  -8.114
  177    H    TYR  27           H        TYR  27   5.846  -2.887  -1.642
  178    HA   TYR  27           HA       TYR  27   5.349   0.017  -1.389
  179   1HB   TYR  27          1HB       TYR  27   3.759  -2.566  -1.368
  180   2HB   TYR  27          2HB       TYR  27   3.026  -1.182  -0.749
  181    HD1  TYR  27           HD2      TYR  27   5.202  -0.224  -3.557
  182    HD2  TYR  27           HD1      TYR  27   1.500  -2.219  -2.665
  183    HE1  TYR  27           HE2      TYR  27   4.415   0.230  -5.834
  184    HE2  TYR  27           HE1      TYR  27   0.678  -1.721  -4.961
  185    HH   TYR  27           HH       TYR  27   1.187  -0.751  -6.996
  186    H    CYS  28           H        CYS  28   5.114  -2.944   0.491
  187    HA   CYS  28           HA       CYS  28   4.488  -1.743   2.935
  188   1HB   CYS  28          1HB       CYS  28   4.862  -4.358   2.181
  189   2HB   CYS  28          2HB       CYS  28   6.278  -4.113   3.205
  190    H    GLY  29           H        GLY  29   7.725  -2.528   1.750
  191   1HA   GLY  29          1HA       GLY  29   9.835  -1.748   2.397
  192   2HA   GLY  29          2HA       GLY  29   8.971  -0.230   2.171
  193    H    ARG  30           HN       ARG  30   9.692   1.031   3.731
  194    HA   ARG  30           HA       ARG  30   9.997   1.969   5.815
  195   1HB   ARG  30          1HB       ARG  30   7.653   0.164   6.413
  196   2HB   ARG  30          2HB       ARG  30   8.170   1.553   7.383
  197   1HG   ARG  30          1HG       ARG  30   7.793   3.092   5.515
  198   2HG   ARG  30          2HG       ARG  30   7.376   1.751   4.434
  199   1HD   ARG  30          1HD       ARG  30   5.516   1.125   6.017
  200   2HD   ARG  30          2HD       ARG  30   5.931   2.551   6.973
  201    HE   ARG  30           HE       ARG  30   4.851   3.895   5.519
  202   1HH1  ARG  30          1HH2      ARG  30   5.494   0.803   3.906
  203   2HH1  ARG  30          2HH2      ARG  30   4.429   1.049   2.561
  204   1HH2  ARG  30          1HH1      ARG  30   3.408   4.337   3.553
  205   2HH2  ARG  30          2HH1      ARG  30   3.235   3.077   2.405
  No match found for entry  HXTARG          30
   
  No H/Q in entry =         206
   
  No H/Q in entry =         206