*HEADER    HORMONE/GROWTH FACTOR                   03-OCT-01   1K3M              
*TITLE     NMR STRUCTURE OF HUMAN INSULIN MUTANT ILE-A2-ALA, HIS-B10-            
*TITLE    2 ASP, PRO-B28-LYS, LYS-B29-PRO, 15 STRUCTURES                         
*COMPND    MOL_ID: 1;                                                            
*COMPND   2 MOLECULE: INSULIN;                                                   
*COMPND   3 CHAIN: A;                                                            
*COMPND   4 FRAGMENT: INSULIN A CHAIN (RESIDUES 90-110);                         
*COMPND   5 ENGINEERED: YES;                                                     
*COMPND   6 MUTATION: YES;                                                       
*COMPND   7 MOL_ID: 2;                                                           
*COMPND   8 MOLECULE: INSULIN;                                                   
*COMPND   9 CHAIN: B;                                                            
*COMPND  10 FRAGMENT: INSULIN B CHAIN (RESIDUES 25-54);                          
*COMPND  11 ENGINEERED: YES;                                                     
*COMPND  12 MUTATION: YES                                                        
*SOURCE    MOL_ID: 1;                                                            
*SOURCE   2 SYNTHETIC: YES;                                                      
*SOURCE   3 OTHER_DETAILS: THE PEPTIDE WAS CHEMICALLY SYNTHESIZED. THE           
*SOURCE   4 SEQUENCE OF THE PEPTIDE IS NATURALLY FOUND IN HOMO SAPIENS           
*SOURCE   5 (HUMAN).;                                                            
*SOURCE   6 MOL_ID: 2;                                                           
*SOURCE   7 SYNTHETIC: YES;                                                      
*SOURCE   8 OTHER_DETAILS: THE PEPTIDE WAS CHEMICALLY SYNTHESIZED. THE           
*SOURCE   9 SEQUENCE OF THE PEPTIDE IS NATURALLY FOUND IN HOMO SAPIENS           
*SOURCE  10 (HUMAN).                                                             
*KEYWDS    HORMONE, HUMAN INSULIN, MUTANT                                        
*EXPDTA    NMR, 15 STRUCTURES                                                    
*AUTHOR    B.XU, Q.X.HUA, S.H.NAKAGAWA, W.JIA, Y.C.CHU,                          
*AUTHOR   2 P.G.KATSOYANNIS, M.A.WEISS                                           
*REVDAT   1   17-OCT-01 1K3M    0                                                
!BIOSYM restraint 1
!
#chiral
1:ALA_2:CA         S
1:VAL_3:CA         S
1:GLU-_4:CA        S
1:GLN_5:CA         S
1:CYS_6:CA         R
1:CYS_7:CA         R
1:THR_8:CA         S
1:SER_9:CA         S
1:ILE_10:CA        S
1:CYS_11:CA        R
1:SER_12:CA        S
1:LEU_13:CA        S
1:TYR_14:CA        S
1:GLN_15:CA        S
1:LEU_16:CA        S
1:GLU-_17:CA       S
1:ASN_18:CA        S
1:TYR_19:CA        S
1:CYS_20:CA        R
1:ASNC_21:CA       S
1:PHEN_22:CA       S
1:VAL_23:CA        S
1:ASN_24:CA        S
1:GLN_25:CA        S
1:HIS_26:CA        S
1:LEU_27:CA        S
1:CYS_28:CA        R
1:SER_30:CA        S
1:ASP-_31:CA       S
1:LEU_32:CA        S
1:VAL_33:CA        S
1:GLU-_34:CA       S
1:ALA_35:CA        S
1:LEU_36:CA        S
1:TYR_37:CA        S
1:LEU_38:CA        S
1:VAL_39:CA        S
1:CYS_40:CA        R
1:GLU-_42:CA       S
1:ARG+_43:CA       S
1:PHE_45:CA        S
1:PHE_46:CA        S
1:TYR_47:CA        S
1:THR_48:CA        S
1:LYS+_49:CA       S
1:PRO_50:CA        S
1:THRC_51:CA       S
1:ILE_10:CB        S
1:THR_8:CB         R
1:THR_48:CB        R
1:THRC_51:CB       R
!
#distance
1:GLYN_1:CA        1:VAL_3:CA          4.700  7.200  1.00  1.00 1000.000
1:ALA_2:CA         1:GLU-_4:CA         4.700  7.200  1.00  1.00 1000.000
1:VAL_3:CA         1:GLN_5:CA          4.700  7.200  1.00  1.00 1000.000
1:GLU-_4:CA        1:CYS_6:CA          4.700  7.200  1.00  1.00 1000.000
1:GLN_5:CA         1:CYS_7:CA          4.700  7.200  1.00  1.00 1000.000
1:CYS_6:CA         1:THR_8:CA          4.700  7.200  1.00  1.00 1000.000
1:CYS_7:CA         1:SER_9:CA          4.700  7.200  1.00  1.00 1000.000
1:THR_8:CA         1:ILE_10:CA         4.700  7.200  1.00  1.00 1000.000
1:SER_9:CA         1:CYS_11:CA         4.700  7.200  1.00  1.00 1000.000
1:ILE_10:CA        1:SER_12:CA         4.700  7.200  1.00  1.00 1000.000
1:CYS_11:CA        1:LEU_13:CA         4.700  7.200  1.00  1.00 1000.000
1:SER_12:CA        1:TYR_14:CA         4.700  7.200  1.00  1.00 1000.000
1:LEU_13:CA        1:GLN_15:CA         4.700  7.200  1.00  1.00 1000.000
1:TYR_14:CA        1:LEU_16:CA         4.700  7.200  1.00  1.00 1000.000
1:GLN_15:CA        1:GLU-_17:CA        4.700  7.200  1.00  1.00 1000.000
1:LEU_16:CA        1:ASN_18:CA         4.700  7.200  1.00  1.00 1000.000
1:GLU-_17:CA       1:TYR_19:CA         4.700  7.200  1.00  1.00 1000.000
1:ASN_18:CA        1:CYS_20:CA         4.700  7.200  1.00  1.00 1000.000
1:TYR_19:CA        1:ASNC_21:CA        4.700  7.200  1.00  1.00 1000.000
1:PHEN_22:CA       1:ASN_24:CA         4.700  7.200  1.00  1.00 1000.000
1:VAL_23:CA        1:GLN_25:CA         4.700  7.200  1.00  1.00 1000.000
1:ASN_24:CA        1:HIS_26:CA         4.700  7.200  1.00  1.00 1000.000
1:GLN_25:CA        1:LEU_27:CA         4.700  7.200  1.00  1.00 1000.000
1:HIS_26:CA        1:CYS_28:CA         4.700  7.200  1.00  1.00 1000.000
1:LEU_27:CA        1:GLY_29:CA         4.700  7.200  1.00  1.00 1000.000
1:CYS_28:CA        1:SER_30:CA         4.700  7.200  1.00  1.00 1000.000
1:GLY_29:CA        1:ASP-_31:CA        4.700  7.200  1.00  1.00 1000.000
1:SER_30:CA        1:LEU_32:CA         4.700  7.200  1.00  1.00 1000.000
1:ASP-_31:CA       1:VAL_33:CA         4.700  7.200  1.00  1.00 1000.000
1:LEU_32:CA        1:GLU-_34:CA        4.700  7.200  1.00  1.00 1000.000
1:VAL_33:CA        1:ALA_35:CA         4.700  7.200  1.00  1.00 1000.000
1:GLU-_34:CA       1:LEU_36:CA         4.700  7.200  1.00  1.00 1000.000
1:ALA_35:CA        1:TYR_37:CA         4.700  7.200  1.00  1.00 1000.000
1:LEU_36:CA        1:LEU_38:CA         4.700  7.200  1.00  1.00 1000.000
1:TYR_37:CA        1:VAL_39:CA         4.700  7.200  1.00  1.00 1000.000
1:LEU_38:CA        1:CYS_40:CA         4.700  7.200  1.00  1.00 1000.000
1:VAL_39:CA        1:GLY_41:CA         4.700  7.200  1.00  1.00 1000.000
1:CYS_40:CA        1:GLU-_42:CA        4.700  7.200  1.00  1.00 1000.000
1:GLY_41:CA        1:ARG+_43:CA        4.700  7.200  1.00  1.00 1000.000
1:GLU-_42:CA       1:GLY_44:CA         4.700  7.200  1.00  1.00 1000.000
1:ARG+_43:CA       1:PHE_45:CA         4.700  7.200  1.00  1.00 1000.000
1:GLY_44:CA        1:PHE_46:CA         4.700  7.200  1.00  1.00 1000.000
1:PHE_45:CA        1:TYR_47:CA         4.700  7.200  1.00  1.00 1000.000
1:PHE_46:CA        1:THR_48:CA         4.700  7.200  1.00  1.00 1000.000
1:TYR_47:CA        1:LYS+_49:CA        4.700  7.200  1.00  1.00 1000.000
1:THR_48:CA        1:PRO_50:CA         4.700  7.200  1.00  1.00 1000.000
1:LYS+_49:CA       1:THRC_51:CA        4.700  7.200  1.00  1.00 1000.000
1:SER_12:O         1:GLN_15:HN         2.300  2.600 10.00 10.00 1000.000
1:SER_12:O         1:GLN_15:N          2.700  3.300 10.00 10.00 1000.000
1:SER_12:O         1:LEU_16:HN         2.300  2.600 10.00 10.00 1000.000
1:SER_12:O         1:LEU_16:N          2.700  3.300 10.00 10.00 1000.000
1:LEU_13:O         1:GLU-_17:HN        2.300  2.600 10.00 10.00 1000.000
1:LEU_13:O         1:GLU-_17:N         2.700  3.300 10.00 10.00 1000.000
1:TYR_14:O         1:GLU-_17:HN        2.300  2.600 10.00 10.00 1000.000
1:TYR_14:O         1:GLU-_17:N         2.700  3.300 10.00 10.00 1000.000
1:GLN_15:O         1:ASN_18:HN         2.300  2.600 10.00 10.00 1000.000
1:GLN_15:O         1:ASN_18:N          2.700  3.300 10.00 10.00 1000.000
1:LEU_16:O         1:TYR_19:HN         2.300  2.600 10.00 10.00 1000.000
1:LEU_16:O         1:TYR_19:N          2.700  3.300 10.00 10.00 1000.000
1:GLU-_17:O        1:CYS_20:HN         2.300  2.600 10.00 10.00 1000.000
1:GLU-_17:O        1:CYS_20:N          2.700  3.300 10.00 10.00 1000.000
1:CYS_28:O         1:LEU_32:HN         2.300  2.600 10.00 10.00 1000.000
1:CYS_28:O         1:LEU_32:N          2.700  3.300 10.00 10.00 1000.000
1:GLY_29:O         1:LEU_32:HN         2.300  2.600 10.00 10.00 1000.000
1:GLY_29:O         1:LEU_32:N          2.700  3.300 10.00 10.00 1000.000
1:GLY_29:O         1:VAL_33:HN         2.300  2.600 10.00 10.00 1000.000
1:GLY_29:O         1:VAL_33:N          2.700  3.300 10.00 10.00 1000.000
1:ASP-_31:O        1:ALA_35:HN         2.300  2.600 10.00 10.00 1000.000
1:ASP-_31:O        1:ALA_35:N          2.700  3.300 10.00 10.00 1000.000
1:LEU_32:O         1:LEU_36:HN         2.300  2.600 10.00 10.00 1000.000
1:LEU_32:O         1:LEU_36:N          2.700  3.300 10.00 10.00 1000.000
1:VAL_33:O         1:TYR_37:HN         2.300  2.600 10.00 10.00 1000.000
1:VAL_33:O         1:TYR_37:N          2.700  3.300 10.00 10.00 1000.000
1:GLU-_34:O        1:LEU_38:HN         2.300  2.600 10.00 10.00 1000.000
1:GLU-_34:O        1:LEU_38:N          2.700  3.300 10.00 10.00 1000.000
1:ALA_35:O         1:VAL_39:HN         2.300  2.600 10.00 10.00 1000.000
1:ALA_35:O         1:VAL_39:N          2.700  3.300 10.00 10.00 1000.000
1:LEU_36:O         1:CYS_40:HN         2.300  2.600 10.00 10.00 1000.000
1:LEU_36:O         1:CYS_40:N          2.700  3.300 10.00 10.00 1000.000
1:ASNC_21:O        1:ARG+_43:HE        2.300  2.600 10.00 10.00 1000.000
1:ASNC_21:O        1:ARG+_43:NE        2.700  3.300 10.00 10.00 1000.000
!
#NOE_distance
1:ALA_2:HA         1:VAL_3:HN        -1.000   5.000  3.000 10.00  10.00  1000.000  0.00
1:ALA_2:HB*        1:VAL_3:HN        -1.000   6.000  3.000 10.00  10.00  1000.000  0.00
1:VAL_3:HA         1:GLU-_4:HN       -1.000   5.000  3.000 10.00  10.00  1000.000  0.00
1:VAL_3:HB         1:GLU-_4:HN       -1.000   3.400  3.000 10.00  10.00  1000.000  0.00
1:VAL_3:HG*        1:GLU-_4:HN       -1.000   3.700  2.700 10.00  10.00  1000.000  0.00
1:VAL_3:HA         1:LEU_32:HD1*     -1.000   4.400  3.000 10.00  10.00  1000.000  0.00
1:GLU-_4:HA        1:GLN_5:HN        -1.000   3.400  3.000 10.00  10.00  1000.000  0.00
1:GLU-_4:HB*       1:CYS_7:HN        -1.000   6.000  3.000 10.00  10.00  1000.000  0.00
1:GLU-_4:HN        1:GLN_5:HG*       -1.000   6.000  3.000 10.00  10.00  1000.000  0.00
1:CYS_6:HB2        1:LEU_27:HB*      -1.000   6.000  3.000 10.00  10.00  1000.000  0.00
1:CYS_6:HB2        1:LEU_27:HD1*     -1.000   6.000  3.000 10.00  10.00  1000.000  0.00
1:CYS_6:HB2        1:LEU_27:HD2*     -1.000   6.000  3.000 10.00  10.00  1000.000  0.00
1:CYS_6:HB1        1:LEU_32:HD1*     -1.000   4.400  3.000 10.00  10.00  1000.000  0.00
1:CYS_6:HB2        1:LEU_32:HD1*     -1.000   4.400  3.000 10.00  10.00  1000.000  0.00
1:CYS_6:HB1        1:LEU_32:HD2*     -1.000   4.400  3.000 10.00  10.00  1000.000  0.00
1:CYS_6:HB2        1:LEU_32:HD2*     -1.000   4.400  3.000 10.00  10.00  1000.000  0.00
1:CYS_7:HA         1:HIS_26:HB2      -1.000   5.000  3.000 10.00  10.00  1000.000  0.00
1:CYS_7:HA         1:LEU_27:HN       -1.000   5.000  3.000 10.00  10.00  1000.000  0.00
1:CYS_7:HB1        1:THR_8:HN        -1.000   5.000  3.000 10.00  10.00  1000.000  0.00
1:CYS_7:HB2        1:THR_8:HN        -1.000   5.000  3.000 10.00  10.00  1000.000  0.00
1:CYS_7:HB1        1:CYS_28:HA       -1.000   3.400  2.200 10.00  10.00  1000.000  0.00
1:CYS_7:HB1        1:THR_8:HG*       -1.000   6.000  3.000 10.00  10.00  1000.000  0.00
1:CYS_7:HB2        1:THR_8:HG*       -1.000   6.000  3.000 10.00  10.00  1000.000  0.00
1:CYS_7:HN         1:THR_8:HG*       -1.000   6.000  3.000 10.00  10.00  1000.000  0.00
1:THR_8:HA         1:SER_9:HN        -1.000   3.400  3.000 10.00  10.00  1000.000  0.00
1:THR_8:HG*        1:SER_9:HN        -1.000   6.000  3.000 10.00  10.00  1000.000  0.00
1:SER_9:HA         1:ILE_10:HN       -1.000   5.000  3.000 10.00  10.00  1000.000  0.00
1:SER_9:HB*        1:ILE_10:HN       -1.000   4.400  3.000 10.00  10.00  1000.000  0.00
1:SER_9:HN         1:ILE_10:HG1*     -1.000   6.000  3.000 10.00  10.00  1000.000  0.00
1:SER_9:HN         1:ILE_10:HG2*     -1.000   6.000  3.000 10.00  10.00  1000.000  0.00
1:SER_9:HN         1:ILE_10:HD*      -1.000   4.400  3.000 10.00  10.00  1000.000  0.00
1:ILE_10:HA        1:ILE_10:HG1*     -1.000   6.000  3.000 10.00  10.00  1000.000  0.00
1:ILE_10:HA        1:ILE_10:HG2*     -1.000   3.700  3.000 10.00  10.00  1000.000  0.00
1:ILE_10:HA        1:ILE_10:HD*      -1.000   6.000  3.000 10.00  10.00  1000.000  0.00
1:ILE_10:HB        1:ILE_10:HD*      -1.000   4.400  3.000 10.00  10.00  1000.000  0.00
1:ILE_10:HG2*      1:GLN_25:HN       -1.000   6.000  3.000 10.00  10.00  1000.000  0.00
1:ILE_10:HD*       1:GLN_25:HN       -1.000   6.000  3.000 10.00  10.00  1000.000  0.00
1:ILE_10:HG2*      1:ASN_24:HN       -1.000   6.000  3.000 10.00  10.00  1000.000  0.00
1:ILE_10:HD*       1:ASN_24:HN       -1.000   6.000  3.000 10.00  10.00  1000.000  0.00
1:ILE_10:HD*       1:ASN_24:HB2      -1.000   6.000  3.000 10.00  10.00  1000.000  0.00
1:ILE_10:HD*       1:ASN_24:HB1      -1.000   6.000  3.000 10.00  10.00  1000.000  0.00
1:ILE_10:HD*       1:HIS_26:HE1      -1.000   6.000  3.000 10.00  10.00  1000.000  0.00
1:ILE_10:HG2*      1:CYS_11:HN       -1.000   6.000  3.000 10.00  10.00  1000.000  0.00
1:ILE_10:HG2*      1:LEU_13:HN       -1.000   6.000  3.000 10.00  10.00  1000.000  0.00
1:ILE_10:HG2*      1:ASN_24:HB1      -1.000   6.000  3.000 10.00  10.00  1000.000  0.00
1:ILE_10:HG2*      1:ASN_24:HB2      -1.000   6.000  3.000 10.00  10.00  1000.000  0.00
1:ILE_10:HG2*      1:HIS_26:HA       -1.000   6.000  3.000 10.00  10.00  1000.000  0.00
1:ILE_10:HD*       1:HIS_26:HA       -1.000   6.000  3.000 10.00  10.00  1000.000  0.00
1:ILE_10:HG2*      1:GLN_25:HA       -1.000   4.000  2.700 10.00  10.00  1000.000  0.00
1:ILE_10:HD*       1:GLN_25:HA       -1.000   4.400  3.000 10.00  10.00  1000.000  0.00
1:CYS_11:HA        1:SER_12:HN       -1.000   5.000  3.000 10.00  10.00  1000.000  0.00
1:SER_12:HN        1:GLN_15:HG*      -1.000   6.000  3.000 10.00  10.00  1000.000  0.00
1:SER_12:HN        1:GLN_15:HB1      -1.000   5.000  3.000 10.00  10.00  1000.000  0.00
1:SER_12:HN        1:GLN_15:HB2      -1.000   5.000  3.000 10.00  10.00  1000.000  0.00
1:LEU_13:HA        1:LEU_13:HD1*     -1.000   3.700  2.700 10.00  10.00  1000.000  0.00
1:LEU_13:HA        1:LEU_13:HD2*     -1.000   4.400  3.000 10.00  10.00  1000.000  0.00
1:LEU_13:HB*       1:LEU_13:HD1*     -1.000   4.700  2.700 10.00  10.00  1000.000  0.00
1:LEU_13:HB*       1:LEU_13:HD2*     -1.000   4.700  2.700 10.00  10.00  1000.000  0.00
1:LEU_13:HA        1:LEU_16:HG       -1.000   3.700  2.700 10.00  10.00  1000.000  0.00
1:LEU_13:HA        1:LEU_16:HD*      -1.000   4.400  3.000 10.00  10.00  1000.000  0.00
1:LEU_13:HA        1:LEU_16:HB1      -1.000   2.700  2.700 10.00  10.00  1000.000  0.00
1:LEU_13:HA        1:LEU_16:HB2      -1.000   5.000  3.000 10.00  10.00  1000.000  0.00
1:LEU_13:HA        1:TYR_14:HN       -1.000   5.000  3.000 10.00  10.00  1000.000  0.00
1:LEU_13:HB*       1:TYR_14:HN       -1.000   4.400  3.000 10.00  10.00  1000.000  0.00
1:LEU_13:HD1*      1:TYR_14:HN       -1.000   6.000  3.000 10.00  10.00  1000.000  0.00
1:LEU_13:HD2*      1:TYR_14:HN       -1.000   6.000  3.000 10.00  10.00  1000.000  0.00
1:LEU_13:HD1*      1:LEU_16:HB1      -1.000   6.000  3.000 10.00  10.00  1000.000  0.00
1:LEU_13:HD2*      1:LEU_16:HB1      -1.000   6.000  3.000 10.00  10.00  1000.000  0.00
1:LEU_13:HD1*      1:PHEN_22:HD*     -1.000   8.000  3.000 10.00  10.00  1000.000  0.00
1:LEU_13:HD2*      1:PHEN_22:HD*     -1.000   8.000  3.000 10.00  10.00  1000.000  0.00
1:LEU_13:HD1*      1:PHEN_22:HB*     -1.000   7.000  3.000 10.00  10.00  1000.000  0.00
1:LEU_13:HD2*      1:PHEN_22:HB*     -1.000   7.000  3.000 10.00  10.00  1000.000  0.00
1:LEU_13:HD1*      1:VAL_39:HN       -1.000   6.000  3.000 10.00  10.00  1000.000  0.00
1:LEU_13:HD2*      1:VAL_39:HN       -1.000   6.000  3.000 10.00  10.00  1000.000  0.00
1:LEU_13:HN        1:TYR_14:HB*      -1.000   6.000  3.000 10.00  10.00  1000.000  0.00
1:TYR_14:HB*       1:GLN_15:HA       -1.000   6.000  3.000 10.00  10.00  1000.000  0.00
1:TYR_14:HB*       1:GLN_15:HN       -1.000   4.400  3.000 10.00  10.00  1000.000  0.00
1:TYR_14:HA        1:LEU_13:HB*      -1.000   6.000  3.000 10.00  10.00  1000.000  0.00 
1:TYR_14:HA        1:GLN_15:HN       -1.000   5.000  3.000 10.00  10.00  1000.000  0.00
1:TYR_14:HA        1:GLU-_17:HB*     -1.000   4.400  3.000 10.00  10.00  1000.000  0.00
1:TYR_14:HA        1:GLU-_17:HG*     -1.000   6.000  3.000 10.00  10.00  1000.000  0.00
1:TYR_14:HA        1:GLU-_17:HN      -1.000   5.000  3.000 10.00  10.00  1000.000  0.00
1:TYR_14:HD*       1:GLU-_17:HB*     -1.000   8.000  3.000 10.00  10.00  1000.000  0.00
1:TYR_14:HD*       1:GLU-_17:HG*     -1.000   8.000  3.000 10.00  10.00  1000.000  0.00
1:TYR_14:HE*       1:GLU-_17:HG*     -1.000   8.000  3.000 10.00  10.00  1000.000  0.00
1:GLN_15:HA        1:GLN_15:HG*      -1.000   3.700  2.700 10.00  10.00  1000.000  0.00
1:GLN_15:HA        1:LEU_16:HN       -1.000   3.400  3.000 10.00  10.00  1000.000  0.00
1:GLN_15:HA        1:ASN_18:HB*      -1.000   6.000  3.000 10.00  10.00  1000.000  0.00
1:GLN_15:HA        1:ASN_18:HN       -1.000   5.000  3.000 10.00  10.00  1000.000  0.00
1:GLN_15:HB1       1:TYR_19:HE*      -1.000   7.000  3.000 10.00  10.00  1000.000  0.00
1:GLN_15:HB2       1:TYR_19:HE*      -1.000   7.000  3.000 10.00  10.00  1000.000  0.00
1:LEU_16:HA        1:LEU_16:HG       -1.000   3.400  3.000 10.00  10.00  1000.000  0.00
1:LEU_16:HA        1:LEU_16:HD*      -1.000   3.700  2.700 10.00  10.00  1000.000  0.00
1:LEU_16:HB1       1:LEU_16:HD*      -1.000   3.700  2.700 10.00  10.00  1000.000  0.00
1:LEU_16:HB2       1:LEU_16:HD*      -1.000   3.700  2.700 10.00  10.00  1000.000  0.00
1:LEU_16:HA        1:LEU_36:HD2*     -1.000   4.400  3.000 10.00  10.00  1000.000  0.00
1:LEU_16:HA        1:LEU_36:HD1*     -1.000   6.000  3.000 10.00  10.00  1000.000  0.00
1:LEU_16:HB1       1:LEU_36:HD2*     -1.000   6.000  3.000 10.00  10.00  1000.000  0.00
1:LEU_16:HB2       1:TYR_19:HN       -1.000   5.700  3.000 10.00  10.00  1000.000  0.00
1:LEU_16:HD*       1:TYR_19:HD*      -1.000   7.000  3.000 10.00  10.00  1000.000  0.00
1:LEU_16:HD*       1:ALA_35:HN       -1.000   6.000  3.000 10.00  10.00  1000.000  0.00 
1:LEU_16:HA        1:TYR_19:HD*      -1.000   6.000  3.000 10.00  10.00  1000.000  0.00
1:LEU_16:HA        1:TYR_19:HB1      -1.000   5.000  3.000 10.00  10.00  1000.000  0.00
1:LEU_16:HA        1:TYR_19:HE*      -1.000   7.000  3.000 10.00  10.00  1000.000  0.00
1:LEU_16:HG        1:LEU_32:HD2*     -1.000   6.000  3.000 10.00  10.00  1000.000  0.00
1:LEU_16:HG        1:LEU_32:HD1*     -1.000   6.000  3.000 10.00  10.00  1000.000  0.00
1:LEU_16:HG        1:LEU_36:HD2*     -1.000   6.000  3.000 10.00  10.00  1000.000  0.00
1:LEU_16:HG        1:VAL_39:HG1*     -1.000   6.000  3.000 10.00  10.00  1000.000  0.00
1:LEU_16:HG        1:VAL_39:HG2*     -1.000   6.000  3.000 10.00  10.00  1000.000  0.00
1:LEU_16:HD*       1:TYR_19:HN       -1.000   6.000  3.000 10.00  10.00  1000.000  0.00
1:LEU_16:HD*       1:LEU_32:HA       -1.000   6.000  3.000 10.00  10.00  1000.000  0.00
1:LEU_16:HD*       1:LEU_36:HA       -1.000   6.000  3.000 10.00  10.00  1000.000  0.00
1:LEU_16:HD*       1:LEU_36:HN       -1.000   6.000  3.000 10.00  10.00  1000.000  0.00
1:LEU_16:HD*       1:LEU_36:HD2*     -1.000   5.400  3.000 10.00  10.00  1000.000  0.00
1:LEU_16:HD*       1:VAL_39:HB       -1.000   6.000  3.000 10.00  10.00  1000.000  0.00
1:LEU_16:HD*       1:VAL_39:HN       -1.000   6.000  3.000 10.00  10.00  1000.000  0.00
1:GLU-_17:HA       1:GLU-_17:HG*     -1.000   3.700  2.700 10.00  10.00  1000.000  0.00
1:GLU-_17:HA       1:ASN_18:HN       -1.000   3.400  3.000 10.00  10.00  1000.000  0.00
1:GLU-_17:HA       1:VAL_39:HG2*     -1.000   6.000  3.000 10.00  10.00  1000.000  0.00
1:GLU-_17:HA       1:VAL_39:HG1*     -1.000   3.700  2.700 10.00  10.00  1000.000  0.00
1:GLU-_17:HA       1:CYS_20:HB1      -1.000   5.000  3.000 10.00  10.00  1000.000  0.00
1:GLU-_17:HG*      1:VAL_39:HG1*     -1.000   5.400  3.000 10.00  10.00  1000.000  0.00
1:ASN_18:HA        1:TYR_19:HN       -1.000   3.400  3.000 10.00  10.00  1000.000  0.00
1:ASN_18:HB*       1:TYR_19:HN       -1.000   6.000  3.000 10.00  10.00  1000.000  0.00
1:TYR_19:HA        1:CYS_20:HB1      -1.000   6.400  3.000 10.00  10.00  1000.000  0.00
1:TYR_19:HA        1:LEU_36:HD1*     -1.000   6.000  3.000 10.00  10.00  1000.000  0.00
1:TYR_19:HA        1:LEU_36:HD2*     -1.000   6.000  3.000 10.00  10.00  1000.000  0.00
1:TYR_19:HB1       1:LEU_36:HD1*     -1.000   4.400  3.000 10.00  10.00  1000.000  0.00
1:TYR_19:HB2       1:LEU_36:HD1*     -1.000   6.000  3.000 10.00  10.00  1000.000  0.00
1:TYR_19:HB1       1:LEU_36:HD2*     -1.000   4.400  3.000 10.00  10.00  1000.000  0.00
1:TYR_19:HB2       1:LEU_36:HD2*     -1.000   6.000  3.000 10.00  10.00  1000.000  0.00
1:TYR_19:HB1       1:CYS_20:HN       -1.000   5.000  3.000 10.00  10.00  1000.000  0.00
1:TYR_19:HB2       1:CYS_20:HN       -1.000   5.000  3.000 10.00  10.00  1000.000  0.00
1:TYR_19:HD*       1:LEU_36:HD2*     -1.000   6.400  3.000 10.00  10.00  1000.000  0.00
1:TYR_19:HD*       1:LEU_36:HD1*     -1.000   7.000  3.000 10.00  10.00  1000.000  0.00
1:TYR_19:HE*       1:LEU_36:HD2*     -1.000   7.000  3.000 10.00  10.00  1000.000  0.00
1:TYR_19:HE*       1:LEU_36:HD1*     -1.000   7.000  3.000 10.00  10.00  1000.000  0.00
1:TYR_19:HN        1:CYS_20:HB1      -1.000   5.400  3.000 10.00  10.00  1000.000  0.00
1:TYR_19:HN        1:LEU_36:HD2*     -1.000   4.400  3.000 10.00  10.00  1000.000  0.00
1:TYR_19:HN        1:LEU_36:HD1*     -1.000   6.000  3.000 10.00  10.00  1000.000  0.00
1:CYS_20:HA        1:ASNC_21:HN      -1.000   2.700  2.200 10.00  10.00  1000.000  0.00
1:CYS_20:HB1       1:ASNC_21:HN      -1.000   3.400  3.000 10.00  10.00  1000.000  0.00
1:CYS_20:HB2       1:ASNC_21:HN      -1.000   3.400  2.300 10.00  10.00  1000.000  0.00
1:CYS_20:HA        1:LEU_36:HD2*     -1.000   6.000  3.000 10.00  10.00  1000.000  0.00
1:CYS_20:HA        1:CYS_40:HB1      -1.000   5.000  3.000 10.00  10.00  1000.000  0.00 
1:CYS_20:HA        1:PHE_45:HA       -1.000   3.400  2.600 10.00  10.00  1000.000  0.00
1:CYS_20:HA        1:PHE_45:HB1      -1.000   3.400  2.700 10.00  10.00  1000.000  0.00
1:CYS_20:HA        1:PHE_45:HB2      -1.000   3.400  2.700 10.00  10.00  1000.000  0.00
1:CYS_20:HB1       1:CYS_40:HA       -1.000   5.000  3.000 10.00  10.00  1000.000  0.00
1:CYS_20:HB1       1:ARG+_43:HB*     -1.000   6.000  3.000 10.00  10.00  1000.000  0.00 
1:CYS_20:HB2       1:PHE_45:HD*      -1.000   7.000  3.000 10.00  10.00  1000.000  0.00
1:CYS_20:HA        1:PHE_46:HN       -1.000   5.000  3.000 10.00  10.00  1000.000  0.00
1:CYS_20:HN        1:ASNC_21:HN      -1.000   5.000  3.000 10.00  10.00  1000.000  0.00
1:CYS_20:HN        1:CYS_20:HB1      -1.000   3.400  2.600 10.00  10.00  1000.000  0.00
1:CYS_20:HN        1:CYS_20:HB2      -1.000   5.000  3.000 10.00  10.00  1000.000  0.00
1:ASNC_21:HB2      1:ASNC_21:HD2*    -1.000   4.400  3.000 10.00  10.00  1000.000  0.00
1:ASNC_21:HB1      1:ASNC_21:HD2*    -1.000   4.400  2.000 10.00  10.00  1000.000  0.00
1:ASNC_21:HB2      1:ASNC_21:HN      -1.000   3.400  3.000 10.00  10.00  1000.000  0.00
1:ASNC_21:HB1      1:ASNC_21:HN      -1.000   3.400  1.800 10.00  10.00  1000.000  0.00
1:ASNC_21:HB1      1:ARG+_43:HA      -1.000   5.400  3.000 10.00  10.00  1000.000  0.00
1:ASNC_21:HB2      1:GLY_44:HA*      -1.000   6.000  3.000 10.00  10.00  1000.000  0.00 
1:ASNC_21:HN       1:PHE_45:HA       -1.000   5.000  3.000 10.00  10.00  1000.000  0.00
1:VAL_23:HA        1:VAL_23:HG*      -1.000   3.700  2.700 10.00  10.00  1000.000  0.00
1:VAL_23:HA        1:ASN_24:HN       -1.000   3.400  3.000 10.00  10.00  1000.000  0.00
1:VAL_23:HB        1:ASN_24:HN       -1.000   3.400  3.000 10.00  10.00  1000.000  0.00
1:VAL_23:HG*       1:ASN_24:HN       -1.000   4.400  3.000 10.00  10.00  1000.000  0.00
1:ASN_24:HA        1:GLN_25:HN       -1.000   5.000  3.000 10.00  10.00  1000.000  0.00
1:GLN_25:HA        1:GLN_25:HG*      -1.000   4.400  3.000 10.00  10.00  1000.000  0.00
1:GLN_25:HB*       1:HIS_26:HN       -1.000   4.400  3.000 10.00  10.00  1000.000  0.00
1:HIS_26:HA        1:LEU_27:HN       -1.000   3.400  3.000 10.00  10.00  1000.000  0.00
1:HIS_26:HA        1:CYS_28:HN       -1.000   6.000  3.000 10.00  10.00  1000.000  0.00
1:HIS_26:HB1       1:LEU_27:HN       -1.000   5.000  3.000 10.00  10.00  1000.000  0.00
1:HIS_26:HB2       1:LEU_27:HN       -1.000   5.000  3.000 10.00  10.00  1000.000  0.00
1:LEU_27:HA        1:LEU_27:HG       -1.000   5.000  3.000 10.00  10.00  1000.000  0.00
1:LEU_27:HA        1:LEU_27:HD2*     -1.000   6.000  3.000 10.00  10.00  1000.000  0.00
1:LEU_27:HA        1:LEU_27:HD1*     -1.000   3.700  2.700 10.00  10.00  1000.000  0.00
1:LEU_27:HB*       1:LEU_27:HD1*     -1.000   4.700  2.700 10.00  10.00  1000.000  0.00
1:LEU_27:HB*       1:LEU_27:HD2*     -1.000   4.700  2.700 10.00  10.00  1000.000  0.00
1:LEU_27:HA        1:CYS_28:HB1      -1.000   5.700  3.000 10.00  10.00  1000.000  0.00
1:LEU_27:HA        1:ASP-_31:HB1     -1.000   5.000  3.000 10.00  10.00  1000.000  0.00
1:LEU_27:HA        1:ASP-_31:HB2     -1.000   5.000  3.000 10.00  10.00  1000.000  0.00
1:LEU_27:HA        1:LEU_32:HB1      -1.000   5.700  3.000 10.00  10.00  1000.000  0.00
1:LEU_27:HA        1:LEU_32:HD1*     -1.000   6.000  3.000 10.00  10.00  1000.000  0.00
1:LEU_27:HA        1:LEU_32:HD2*     -1.000   6.000  3.000 10.00  10.00  1000.000  0.00
1:LEU_27:HB*       1:CYS_28:HN       -1.000   6.000  3.000 10.00  10.00  1000.000  0.00
1:LEU_27:HB*       1:LEU_32:HA       -1.000   4.400  3.000 10.00  10.00  1000.000  0.00
1:LEU_27:HB*       1:ASP-_31:HB2     -1.000   6.000  3.000 10.00  10.00  1000.000  0.00
1:LEU_27:HG        1:CYS_28:HN       -1.000   5.000  3.000 10.00  10.00  1000.000  0.00
1:LEU_27:HD1*      1:CYS_28:HN       -1.000   6.000  3.000 10.00  10.00  1000.000  0.00
1:LEU_27:HD2*      1:CYS_28:HN       -1.000   6.000  3.000 10.00  10.00  1000.000  0.00
1:LEU_27:HD1*      1:ASP-_31:HA      -1.000   5.000  3.000 10.00  10.00  1000.000  0.00
1:LEU_27:HD1*      1:ASP-_31:HB1     -1.000   4.400  3.000 10.00  10.00  1000.000  0.00
1:LEU_27:HD1*      1:ASP-_31:HB2     -1.000   4.400  3.000 10.00  10.00  1000.000  0.00
1:LEU_27:HD2*      1:ASP-_31:HB1     -1.000   6.000  3.000 10.00  10.00  1000.000  0.00
1:LEU_27:HD2*      1:ASP-_31:HB2     -1.000   6.000  3.000 10.00  10.00  1000.000  0.00
1:LEU_27:HN        1:CYS_28:HB2      -1.000   5.000  3.000 10.00  10.00  1000.000  0.00
1:LEU_27:HN        1:LEU_32:HD1*     -1.000   6.000  3.000 10.00  10.00  1000.000  0.00
1:LEU_27:HN        1:LEU_32:HD2*     -1.000   6.000  3.000 10.00  10.00  1000.000  0.00
1:LEU_27:HD1*      1:LEU_32:HA       -1.000   4.400  3.000 10.00  10.00  1000.000  0.00
1:LEU_27:HD2*      1:LEU_32:HA       -1.000   4.400  3.000 10.00  10.00  1000.000  0.00
1:LEU_27:HA        1:CYS_28:HN       -1.000   2.700  2.700 10.00  10.00  1000.000  0.00
1:CYS_28:HA        1:LEU_32:HB2      -1.000   5.000  3.000 10.00  10.00  1000.000  0.00
1:CYS_28:HA        1:LEU_32:HB1      -1.000   4.700  3.000 10.00  10.00  1000.000  0.00
1:CYS_28:HA        1:LEU_32:HD1*     -1.000   6.000  3.000 10.00  10.00  1000.000  0.00
1:CYS_28:HA        1:LEU_32:HD2*     -1.000   6.000  3.000 10.00  10.00  1000.000  0.00
1:CYS_28:HN        1:ASP-_31:HB1     -1.000   5.000  3.000 10.00  10.00  1000.000  0.00
1:CYS_28:HN        1:LEU_32:HD1*     -1.000   6.000  3.000 10.00  10.00  1000.000  0.00
1:CYS_28:HN        1:LEU_32:HD2*     -1.000   6.000  3.000 10.00  10.00  1000.000  0.00
1:GLY_29:HA*       1:SER_30:HN       -1.000   6.000  3.000 10.00  10.00  1000.000  0.00
1:SER_30:HA        1:VAL_33:HB       -1.000   3.400  3.000 10.00  10.00  1000.000  0.00
1:SER_30:HA        1:VAL_33:HN       -1.000   5.000  3.000 10.00  10.00  1000.000  0.00
1:SER_30:HB*       1:ASP-_31:HN      -1.000   4.400  3.000 10.00  10.00  1000.000  0.00
1:ASP-_31:HA       1:GLU-_34:HN      -1.000   3.700  3.000 10.00  10.00  1000.000  0.00
1:ASP-_31:HA       1:GLU-_34:HG*     -1.000   6.000  3.000 10.00  10.00  1000.000  0.00
1:ASP-_31:HA       1:GLU-_34:HB*     -1.000   4.400  3.000 10.00  10.00  1000.000  0.00
1:ASP-_31:HA       1:LEU_32:HN       -1.000   5.000  3.000 10.00  10.00  1000.000  0.00
1:ASP-_31:HA       1:VAL_33:HN       -1.000   4.000  3.000 10.00  10.00  1000.000  0.00
1:ASP-_31:HB2      1:LEU_32:HB1      -1.000   6.000  3.000 10.00  10.00  1000.000  0.00
1:ASP-_31:HB2      1:LEU_32:HN       -1.000   6.000  3.000 10.00  10.00  1000.000  0.00
1:ASP-_31:HB2      1:ALA_35:HB*      -1.000   6.000  3.000 10.00  10.00  1000.000  0.00
1:LEU_32:HB1       1:LEU_32:HD1*     -1.000   3.700  2.700 10.00  10.00  1000.000  0.00
1:LEU_32:HB2       1:LEU_32:HD1*     -1.000   3.700  2.700 10.00  10.00  1000.000  0.00
1:LEU_32:HB1       1:LEU_32:HD2*     -1.000   3.700  2.700 10.00  10.00  1000.000  0.00
1:LEU_32:HB2       1:LEU_32:HD2*     -1.000   3.700  2.700 10.00  10.00  1000.000  0.00
1:LEU_32:HA        1:ALA_35:HB*      -1.000   3.700  2.700 10.00  10.00  1000.000  0.00
1:LEU_32:HA        1:VAL_33:HN       -1.000   5.000  3.000 10.00  10.00  1000.000  0.00
1:LEU_32:HA        1:ALA_35:HN       -1.000   5.000  3.000 10.00  10.00  1000.000  0.00
1:LEU_32:HA        1:LEU_36:HD1*     -1.000   6.000  3.000 10.00  10.00  1000.000  0.00 
1:LEU_32:HB1       1:VAL_33:HN       -1.000   5.000  3.000 10.00  10.00  1000.000  0.00
1:LEU_32:HB2       1:VAL_33:HN       -1.000   5.000  3.000 10.00  10.00  1000.000  0.00
1:LEU_32:HG        1:VAL_33:HN       -1.000   5.000  3.000 10.00  10.00  1000.000  0.00
1:LEU_32:HB2       1:VAL_33:HA       -1.000   5.000  3.000 10.00  10.00  1000.000  0.00
1:LEU_32:HB1       1:VAL_33:HA       -1.000   5.000  3.000 10.00  10.00  1000.000  0.00
1:LEU_32:HB1       1:LEU_36:HD1*     -1.000   6.000  3.000 10.00  10.00  1000.000  0.00
1:LEU_32:HB2       1:LEU_36:HD1*     -1.000   5.000  3.000 10.00  10.00  1000.000  0.00
1:LEU_32:HD1*      1:LEU_36:HD1*     -1.000   7.000  3.000 10.00  10.00  1000.000  0.00
1:LEU_32:HD2*      1:LEU_36:HD1*     -1.000   7.000  3.000 10.00  10.00  1000.000  0.00
1:LEU_32:HD1*      1:VAL_33:HA       -1.000   7.000  3.000 10.00  10.00  1000.000  0.00
1:LEU_32:HD2*      1:VAL_33:HA       -1.000   6.000  3.000 10.00  10.00  1000.000  0.00
1:LEU_32:HN        1:VAL_33:HB       -1.000   5.000  3.000 10.00  10.00  1000.000  0.00
1:VAL_33:HA        1:VAL_33:HG*      -1.000   3.700  2.700 10.00  10.00  1000.000  0.00
1:VAL_33:HA        1:GLU-_34:HN      -1.000   3.400  3.000 10.00  10.00  1000.000  0.00
1:VAL_33:HA        1:LEU_36:HN       -1.000   3.400  3.000 10.00  10.00  1000.000  0.00
1:VAL_33:HA        1:LEU_36:HB1      -1.000   3.400  3.000 10.00  10.00  1000.000  0.00
1:VAL_33:HA        1:LEU_36:HG       -1.000   5.000  3.000 10.00  10.00  1000.000  0.00
1:VAL_33:HA        1:LEU_36:HD2*     -1.000   6.000  3.000 10.00  10.00  1000.000  0.00
1:VAL_33:HA        1:LEU_36:HD1*     -1.000   3.700  2.700 10.00  10.00  1000.000  0.00
1:VAL_33:HB        1:TYR_47:HE*      -1.000   7.000  3.000 10.00  10.00  1000.000  0.00 
1:VAL_33:HG*       1:GLU-_34:HG*     -1.000   4.700  2.700 10.00  10.00  1000.000  0.00
1:VAL_33:HG*       1:LEU_36:HD1*     -1.000   5.400  3.000 10.00  10.00  1000.000  0.00
1:VAL_33:HG*       1:PHE_45:HD*      -1.000   8.000  3.000 10.00  10.00  1000.000  0.00
1:VAL_33:HG*       1:PHE_45:HE*      -1.000   6.400  3.000 10.00  10.00  1000.000  0.00
1:VAL_33:HG*       1:TYR_47:HD*      -1.000   6.400  3.000 10.00  10.00  1000.000  0.00
1:VAL_33:HG*       1:TYR_47:HE*      -1.000   6.400  3.000 10.00  10.00  1000.000  0.00
1:GLU-_34:HA       1:GLU-_34:HG*     -1.000   4.400  3.000 10.00  10.00  1000.000  0.00
1:GLU-_34:HA       1:TYR_37:HB*      -1.000   3.700  2.700 10.00  10.00  1000.000  0.00
1:GLU-_34:HA       1:TYR_37:HD*      -1.000   5.400  3.000 10.00  10.00  1000.000  0.00
1:GLU-_34:HA       1:TYR_37:HE*      -1.000   7.000  3.000 10.00  10.00  1000.000  0.00
1:GLU-_34:HB*      1:ALA_35:HN       -1.000   4.400  3.000 10.00  10.00  1000.000  0.00
1:ALA_35:HA        1:TYR_37:HN       -1.000   5.000  3.000 10.00  10.00  1000.000  0.00
1:ALA_35:HA        1:LEU_38:HB*      -1.000   4.400  3.000 10.00  10.00  1000.000  0.00
1:ALA_35:HA        1:LEU_38:HG       -1.000   5.000  3.000 10.00  10.00  1000.000  0.00
1:ALA_35:HA        1:LEU_38:HD*      -1.000   4.400  3.000 10.00  10.00  1000.000  0.00
1:LEU_36:HA        1:LEU_36:HG       -1.000   3.400  3.000 10.00  10.00  1000.000  0.00
1:LEU_36:HA        1:LEU_36:HD1*     -1.000   4.400  3.000 10.00  10.00  1000.000  0.00
1:LEU_36:HA        1:LEU_36:HD2*     -1.000   3.700  2.700 10.00  10.00  1000.000  0.00
1:LEU_36:HB1       1:LEU_36:HD1*     -1.000   3.700  2.700 10.00  10.00  1000.000  0.00
1:LEU_36:HB1       1:LEU_36:HD2*     -1.000   4.400  3.000 10.00  10.00  1000.000  0.00
1:LEU_36:HA        1:TYR_37:HN       -1.000   5.000  3.000 10.00  10.00  1000.000  0.00
1:LEU_36:HA        1:VAL_39:HB       -1.000   2.700  2.700 10.00  10.00  1000.000  0.00
1:LEU_36:HA        1:VAL_39:HG1*     -1.000   4.400  2.700 10.00  10.00  1000.000  0.00
1:LEU_36:HA        1:VAL_39:HG2*     -1.000   4.400  2.700 10.00  10.00  1000.000  0.00
1:LEU_36:HA        1:CYS_40:HN       -1.000   5.000  3.000 10.00  10.00  1000.000  0.00
1:LEU_36:HG*       1:TYR_37:HN       -1.000   6.000  3.000 10.00  10.00  1000.000  0.00
1:LEU_36:HG*       1:VAL_39:HN       -1.000   6.000  3.000 10.00  10.00  1000.000  0.00
1:LEU_36:HB1       1:PHE_45:HD*      -1.000   7.000  3.000 10.00  10.00  1000.000  0.00
1:LEU_36:HB1       1:PHE_45:HE*      -1.000   7.000  3.000 10.00  10.00  1000.000  0.00
1:LEU_36:HD1*      1:TYR_37:HN       -1.000   6.000  3.000 10.00  10.00  1000.000  0.00
1:LEU_36:HD2*      1:TYR_37:HN       -1.000   6.000  3.000 10.00  10.00  1000.000  0.00
1:LEU_36:HD2*      1:VAL_39:HN       -1.000   6.000  3.000 10.00  10.00  1000.000  0.00
1:LEU_36:HD2*      1:VAL_39:HB       -1.000   4.400  3.000 10.00  10.00  1000.000  0.00
1:LEU_36:HD2*      1:VAL_39:HG1*     -1.000   7.000  3.000 10.00  10.00  1000.000  0.00
1:LEU_36:HD2*      1:VAL_39:HG2*     -1.000   7.000  3.000 10.00  10.00  1000.000  0.00
1:LEU_36:HD1*      1:CYS_40:HN       -1.000   7.000  3.000 10.00  10.00  1000.000  0.00
1:LEU_36:HD2*      1:CYS_40:HN       -1.000   6.000  3.000 10.00  10.00  1000.000  0.00
1:LEU_36:HD1*      1:PHE_45:HD*      -1.000   6.400  3.000 10.00  10.00  1000.000  0.00
1:LEU_36:HD2*      1:PHE_45:HD*      -1.000   6.400  3.000 10.00  10.00  1000.000  0.00
1:LEU_36:HD1*      1:PHE_45:HE*      -1.000   8.000  3.000 10.00  10.00  1000.000  0.00
1:LEU_36:HD2*      1:PHE_45:HE*      -1.000   8.000  3.000 10.00  10.00  1000.000  0.00
1:LEU_36:HD1*      1:PHE_45:HB1      -1.000   4.400  3.000 10.00  10.00  1000.000  0.00
1:LEU_36:HD2*      1:PHE_45:HB1      -1.000   4.400  3.000 10.00  10.00  1000.000  0.00
1:LEU_36:HD1*      1:PHE_45:HB2      -1.000   4.400  2.700 10.00  10.00  1000.000  0.00
1:LEU_36:HD2*      1:PHE_45:HB2      -1.000   4.400  2.700 10.00  10.00  1000.000  0.00
1:LEU_36:HD1*      1:PHE_46:HN       -1.000   6.000  3.000 10.00  10.00  1000.000  0.00
1:LEU_36:HD2*      1:PHE_46:HN       -1.000   6.000  3.000 10.00  10.00  1000.000  0.00
1:LEU_36:HD1*      1:TYR_47:HE*      -1.000   8.000  3.000 10.00  10.00  1000.000  0.00
1:LEU_36:HN        1:LEU_38:HB*      -1.000   6.000  3.000 10.00  10.00  1000.000  0.00
1:LEU_36:HN        1:VAL_39:HG1*     -1.000   6.000  3.000 10.00  10.00  1000.000  0.00
1:LEU_36:HN        1:VAL_39:HG2*     -1.000   6.000  3.000 10.00  10.00  1000.000  0.00
1:TYR_37:HA        1:CYS_40:HB2      -1.000   5.000  3.000 10.00  10.00  1000.000  0.00
1:TYR_37:HA        1:CYS_40:HB1      -1.000   3.700  3.000 10.00  10.00  1000.000  0.00
1:TYR_37:HA        1:CYS_40:HN       -1.000   5.000  3.000 10.00  10.00  1000.000  0.00
1:TYR_37:HA        1:GLY_41:HN       -1.000   5.000  3.000 10.00  10.00  1000.000  0.00 
1:TYR_37:HA        1:LEU_38:HN       -1.000   5.000  3.000 10.00  10.00  1000.000  0.00
1:TYR_37:HA        1:PHE_45:HD*      -1.000   7.000  3.000 10.00  10.00  1000.000  0.00
1:TYR_37:HA        1:PHE_45:HE*      -1.000   7.000  3.000 10.00  10.00  1000.000  0.00
1:TYR_37:HB*       1:LEU_38:HN       -1.000   4.400  3.000 10.00  10.00  1000.000  0.00
1:TYR_37:HB*       1:VAL_39:HN       -1.000   6.000  3.000 10.00  10.00  1000.000  0.00
1:TYR_37:HD*       1:LEU_38:HB*      -1.000   8.000  3.000 10.00  10.00  1000.000  0.00
1:TYR_37:HD*       1:LEU_38:HD*      -1.000   6.400  3.000 10.00  10.00  1000.000  0.00
1:TYR_37:HE*       1:LEU_38:HD*      -1.000   6.400  3.000 10.00  10.00  1000.000  0.00
1:TYR_37:HN        1:LEU_38:HB*      -1.000   6.000  3.000 10.00  10.00  1000.000  0.00
1:TYR_37:HN        1:VAL_39:HG1*     -1.000   6.000  3.000 10.00  10.00  1000.000  0.00
1:TYR_37:HN        1:VAL_39:HG2*     -1.000   6.400  3.000 10.00  10.00  1000.000  0.00
1:LEU_38:HA        1:LEU_38:HG       -1.000   3.400  3.000 10.00  10.00  1000.000  0.00
1:LEU_38:HA        1:LEU_38:HD*      -1.000   4.400  3.000 10.00  10.00  1000.000  0.00
1:LEU_38:HA        1:VAL_39:HN       -1.000   3.400  3.000 10.00  10.00  1000.000  0.00
1:LEU_38:HB*       1:VAL_39:HN       -1.000   4.400  3.000 10.00  10.00  1000.000  0.00
1:LEU_38:HN        1:VAL_39:HG1*     -1.000   6.000  3.000 10.00  10.00  1000.000  0.00
1:VAL_39:HA        1:VAL_39:HG1*     -1.000   3.700  2.700 10.00  10.00  1000.000  0.00
1:VAL_39:HA        1:VAL_39:HG2*     -1.000   3.700  2.700 10.00  10.00  1000.000  0.00
1:VAL_39:HA        1:CYS_40:HN       -1.000   3.400  3.000 10.00  10.00  1000.000  0.00
1:VAL_39:HB        1:CYS_40:HN       -1.000   3.400  3.000 10.00  10.00  1000.000  0.00
1:VAL_39:HG1*      1:CYS_40:HB2      -1.000   6.000  3.000 10.00  10.00  1000.000  0.00
1:VAL_39:HG1*      1:CYS_40:HN       -1.000   6.000  3.000 10.00  10.00  1000.000  0.00
1:VAL_39:HG2*      1:CYS_40:HN       -1.000   4.400  3.000 10.00  10.00  1000.000  0.00
1:VAL_39:HG2*      1:CYS_40:HA       -1.000   6.400  3.000 10.00  10.00  1000.000  0.00
1:VAL_39:HG1*      1:CYS_40:HA       -1.000   4.400  3.000 10.00  10.00  1000.000  0.00
1:VAL_39:HG1*      1:GLY_41:HN       -1.000   6.000  3.000 10.00  10.00  1000.000  0.00
1:VAL_39:HG2*      1:GLY_41:HN       -1.000   6.000  3.000 10.00  10.00  1000.000  0.00
1:CYS_40:HA        1:ARG+_43:HB*     -1.000   6.000  3.000 10.00  10.00  1000.000  0.00
1:CYS_40:HA        1:GLY_41:HN       -1.000   5.000  3.000 10.00  10.00  1000.000  0.00
1:CYS_40:HB1       1:PHE_45:HD*      -1.000   7.000  3.000 10.00  10.00  1000.000  0.00
1:CYS_40:HB2       1:GLY_41:HN       -1.000   5.000  3.000 10.00  10.00  1000.000  0.00
1:CYS_40:HN        1:GLY_41:HA1      -1.000   5.400  3.000 10.00  10.00  1000.000  0.00
1:CYS_40:HN        1:GLY_41:HA2      -1.000   5.000  3.000 10.00  10.00  1000.000  0.00
1:GLY_41:HA1       1:GLU-_42:HN      -1.000   5.000  3.000 10.00  10.00  1000.000  0.00
1:GLY_41:HA1       1:ARG+_43:HN      -1.000   5.000  3.000 10.00  10.00  1000.000  0.00
1:GLY_41:HA2       1:ARG+_43:HN      -1.000   5.000  3.000 10.00  10.00  1000.000  0.00
1:GLU-_42:HG*      1:ARG+_43:HN      -1.000   4.400  3.000 10.00  10.00  1000.000  0.00
1:ARG+_43:HA       1:ARG+_43:HD*     -1.000   6.000  3.000 10.00  10.00  1000.000  0.00
1:ARG+_43:HA       1:ARG+_43:HG*     -1.000   3.700  2.700 10.00  10.00  1000.000  0.00
1:ARG+_43:HD*      1:ARG+_43:HB*     -1.000   4.700  2.700 10.00  10.00  1000.000  0.00
1:ARG+_43:HA       1:GLY_44:HN       -1.000   3.400  3.000 10.00  10.00  1000.000  0.00
1:ARG+_43:HB*      1:GLY_44:HN       -1.000   4.400  3.000 10.00  10.00  1000.000  0.00
1:ARG+_43:HG*      1:GLY_44:HN       -1.000   6.000  3.000 10.00  10.00  1000.000  0.00
1:ARG+_43:HN       1:GLY_44:HA*      -1.000   6.000  3.000 10.00  10.00  1000.000  0.00
1:GLY_44:HA*       1:PHE_45:HN       -1.000   4.400  3.000 10.00  10.00  1000.000  0.00
1:GLY_44:HA*       1:PHE_45:HD*      -1.000   8.000  3.000 10.00  10.00  1000.000  0.00 
1:PHE_45:HA        1:PHE_46:HN       -1.000   2.700  2.700 10.00  10.00  1000.000  0.00
1:PHE_45:HB1       1:PHE_46:HN       -1.000   3.400  3.000 10.00  10.00  1000.000  0.00
1:PHE_45:HB2       1:PHE_46:HN       -1.000   3.400  3.000 10.00  10.00  1000.000  0.00
1:PHE_46:HA        1:TYR_47:HN       -1.000   3.400  3.000 10.00  10.00  1000.000  0.00
1:TYR_47:HA        1:THR_48:HN       -1.000   5.000  3.000 10.00  10.00  1000.000  0.00
1:TYR_47:HB*       1:THR_48:HN       -1.000   6.000  3.000 10.00  10.00  1000.000  0.00
1:TYR_47:HN        1:PHE_46:HB*      -1.000   6.000  3.000 10.00  10.00  1000.000  0.00
1:THR_48:HA        1:LYS+_49:HN      -1.000   3.400  3.000 10.00  10.00  1000.000  0.00
1:THR_48:HB        1:LYS+_49:HN      -1.000   5.000  3.000 10.00  10.00  1000.000  0.00
1:THR_48:HG*       1:LYS+_49:HN      -1.000   4.400  3.000 10.00  10.00  1000.000  0.00
1:LYS+_49:HA       1:LYS+_49:HG*     -1.000   4.400  3.000 10.00  10.00  1000.000  0.00
1:LYS+_49:HA       1:LYS+_49:HD*     -1.000   6.000  3.000 10.00  10.00  1000.000  0.00
1:LYS+_49:HA       1:PRO_50:HD*      -1.000   3.700  2.700 10.00  10.00  1000.000  0.00
1:LYS+_49:HB*      1:LYS+_49:HD*     -1.000   7.000  3.000 10.00  10.00  1000.000  0.00
1:PRO_50:HA    1:PRO_50:HD*      -1.000   6.000  3.000 10.00  10.00  1000.000  0.00
1:PRO_50:HB*    1:PRO_50:HD*      -1.000   5.400  3.000 10.00  10.00  1000.000  0.00
1:PRO_50:HA        1:THRC_51:HN      -1.000   2.700  2.700 10.00  10.00  1000.000  0.00
1:PRO_50:HB*       1:THRC_51:HN      -1.000   3.700  2.700 10.00  10.00  1000.000  0.00
!
#mixing_times
-9.990000E+02
!
#NMR_dihedral
1:SER_12:C         1:LEU_13:N         1:LEU_13:CA        1:LEU_13:C          -90.000 -40.000 30.00 30.00 1000.000
1:LEU_13:C         1:TYR_14:N         1:TYR_14:CA        1:TYR_14:C          -90.000 -40.000 30.00 30.00 1000.000
1:TYR_14:C         1:GLN_15:N         1:GLN_15:CA        1:GLN_15:C          -90.000 -40.000 30.00 30.00 1000.000
1:GLN_15:C         1:LEU_16:N         1:LEU_16:CA        1:LEU_16:C          -90.000 -40.000 30.00 30.00 1000.000
1:LEU_16:C         1:GLU-_17:N        1:GLU-_17:CA       1:GLU-_17:C         -90.000 -40.000 30.00 30.00 1000.000
1:SER_30:C         1:ASP-_31:N        1:ASP-_31:CA       1:ASP-_31:C         -90.000 -40.000 30.00 30.00 1000.000
1:ASP-_31:C        1:LEU_32:N         1:LEU_32:CA        1:LEU_32:C          -90.000 -40.000 30.00 30.00 1000.000
1:LEU_32:C         1:VAL_33:N         1:VAL_33:CA        1:VAL_33:C          -90.000 -40.000 30.00 30.00 1000.000
1:VAL_33:C         1:GLU-_34:N        1:GLU-_34:CA       1:GLU-_34:C         -90.000 -40.000 30.00 30.00 1000.000
1:GLU-_34:C        1:ALA_35:N         1:ALA_35:CA        1:ALA_35:C          -90.000 -40.000 30.00 30.00 1000.000
1:ALA_35:C         1:LEU_36:N         1:LEU_36:CA        1:LEU_36:C          -90.000 -40.000 30.00 30.00 1000.000
1:LEU_36:C         1:TYR_37:N         1:TYR_37:CA        1:TYR_37:C          -90.000 -40.000 30.00 30.00 1000.000
1:TYR_37:C         1:LEU_38:N         1:LEU_38:CA        1:LEU_38:C          -90.000 -40.000 30.00 30.00 1000.000
1:LEU_38:C         1:VAL_39:N         1:VAL_39:CA        1:VAL_39:C          -90.000 -40.000 30.00 30.00 1000.000
1:SER_9:C          1:ILE_10:N         1:ILE_10:CA        1:ILE_10:C         -160.000 -80.000 30.00 30.00 1000.000
1:CYS_11:C         1:SER_12:N         1:SER_12:CA        1:SER_12:C         -160.000 -80.000 30.00 30.00 1000.000
1:PHEN_22:C        1:VAL_23:N         1:VAL_23:CA        1:VAL_23:C         -160.000 -80.000 30.00 30.00 1000.000
1:ASN_24:C         1:GLN_25:N         1:GLN_25:CA        1:GLN_25:C         -160.000 -80.000 30.00 30.00 1000.000
1:HIS_26:C         1:LEU_27:N         1:LEU_27:CA        1:LEU_27:C         -160.000 -80.000 30.00 30.00 1000.000
1:PHE_45:C         1:PHE_46:N         1:PHE_46:CA        1:PHE_46:C         -160.000 -80.000 30.00 30.00 1000.000
1:TYR_47:C         1:THR_48:N         1:THR_48:CA        1:THR_48:C         -160.000 -80.000 30.00 30.00 1000.000
1:TYR_14:N         1:TYR_14:CA        1:TYR_14:CB        1:TYR_14:CG        -100.000 -20.000 30.00 30.00 1000.000
1:ASN_18:N         1:ASN_18:CA        1:ASN_18:CB        1:ASN_18:CG        -100.000 -20.000 30.00 30.00 1000.000
1:TYR_19:N         1:TYR_19:CA        1:TYR_19:CB        1:TYR_19:CG        -100.000 -20.000 30.00 30.00 1000.000
1:CYS_20:N         1:CYS_20:CA        1:CYS_20:CB        1:CYS_20:SG        -100.000 -20.000 30.00 30.00 1000.000
1:ASNC_21:N        1:ASNC_21:CA       1:ASNC_21:CB       1:ASNC_21:CG       -100.000 -20.000 30.00 30.00 1000.000
1:CYS_28:N         1:CYS_28:CA        1:CYS_28:CB        1:CYS_28:SG        -100.000 -20.000 30.00 30.00 1000.000
1:ASP-_31:N        1:ASP-_31:CA       1:ASP-_31:CB       1:ASP-_31:CG       -100.000 -20.000 30.00 30.00 1000.000
1:LEU_32:N         1:LEU_32:CA        1:LEU_32:CB        1:LEU_32:CG        -100.000 -20.000 30.00 30.00 1000.000
1:CYS_40:N         1:CYS_40:CA        1:CYS_40:CB        1:CYS_40:SG        -100.000 -20.000 30.00 30.00 1000.000
1:LEU_38:N         1:LEU_38:CA        1:LEU_38:CB        1:LEU_38:CG        140.000 -140.000 30.00 30.00 1000.000
1:PHE_45:N         1:PHE_45:CA        1:PHE_45:CB        1:PHE_45:CG          20.000 100.000 30.00 30.00 1000.000

  Entry H atom name         Submitted Coord H atom name
  Start of MODEL    1
    1   1H    GLY   1          1H        GLY   1  -8.495   7.275   2.261
    2   2H    GLY   1          2H        GLY   1  -9.423   5.940   2.755
    3   3H    GLY   1          3H        GLY   1  -9.954   6.918   1.471
    4   1HA   GLY   1          1HA       GLY   1  -8.347   4.692   1.249
    5   2HA   GLY   1          2HA       GLY   1  -8.882   5.752  -0.089
    6    H    ALA   2           H        ALA   2  -6.712   4.989  -0.857
    7    HA   ALA   2           HA       ALA   2  -4.350   5.722   0.767
    8   1HB   ALA   2          1HB       ALA   2  -3.373   3.605   0.815
    9   2HB   ALA   2          2HB       ALA   2  -4.343   3.016  -0.535
   10   3HB   ALA   2          3HB       ALA   2  -5.073   3.204   1.059
   11    H    VAL   3           H        VAL   3  -4.256   7.362  -0.946
   12    HA   VAL   3           HA       VAL   3  -3.191   6.236  -3.508
   13    HB   VAL   3           HB       VAL   3  -4.416   8.972  -3.375
   14   1HG1  VAL   3          1HG1      VAL   3  -5.129   8.084  -5.727
   15   2HG1  VAL   3          2HG1      VAL   3  -3.925   6.830  -5.433
   16   3HG1  VAL   3          3HG1      VAL   3  -3.441   8.527  -5.465
   17   1HG2  VAL   3          1HG2      VAL   3  -5.809   6.416  -2.944
   18   2HG2  VAL   3          2HG2      VAL   3  -6.467   7.360  -4.281
   19   3HG2  VAL   3          3HG2      VAL   3  -6.374   8.062  -2.666
   20    H    GLU   4           H        GLU   4  -3.252   9.458  -1.949
   21    HA   GLU   4           HA       GLU   4  -0.557  10.048  -2.822
   22   1HB   GLU   4          2HB       GLU   4  -0.843  11.974  -1.116
   23   2HB   GLU   4          1HB       GLU   4  -1.932  11.942  -2.503
   24   1HG   GLU   4          2HG       GLU   4  -3.737  11.124  -1.222
   25   2HG   GLU   4          1HG       GLU   4  -2.680  10.585   0.084
   26    H    GLN   5           H        GLN   5   0.566   8.132  -1.928
   27    HA   GLN   5           HA       GLN   5   1.675   8.710   0.706
   28   1HB   GLN   5          2HB       GLN   5  -0.348   6.544   0.322
   29   2HB   GLN   5          1HB       GLN   5   1.021   6.220   1.388
   30   1HG   GLN   5          2HG       GLN   5   0.432   8.590   2.377
   31   2HG   GLN   5          1HG       GLN   5  -1.151   8.271   1.669
   32   1HE2  GLN   5          1HE2      GLN   5  -1.819   5.758   2.169
   33   2HE2  GLN   5          2HE2      GLN   5  -1.658   5.331   3.804
   34    H    CYS   6           H        CYS   6   3.209   8.699  -1.393
   35    HA   CYS   6           HA       CYS   6   5.276   6.930  -1.051
   36   1HB   CYS   6          2HB       CYS   6   3.047   5.499  -2.210
   37   2HB   CYS   6          1HB       CYS   6   4.370   5.572  -3.353
   38    H    CYS   7           H        CYS   7   3.242   8.492  -3.474
   39    HA   CYS   7           HA       CYS   7   5.399   8.705  -5.418
   40   1HB   CYS   7          2HB       CYS   7   3.815  10.139  -6.663
   41   2HB   CYS   7          1HB       CYS   7   3.086   8.610  -6.162
   42    H    THR   8           H        THR   8   5.447   9.995  -2.561
   43    HA   THR   8           HA       THR   8   6.613  12.566  -3.515
   44    HB   THR   8           HB       THR   8   5.689  13.743  -1.674
   45    HG1  THR   8           HG1      THR   8   5.200  12.793   0.154
   46   1HG2  THR   8          1HG2      THR   8   3.696  11.737  -2.739
   47   2HG2  THR   8          2HG2      THR   8   3.950  13.398  -3.273
   48   3HG2  THR   8          3HG2      THR   8   3.226  13.078  -1.697
   49    H    SER   9           H        SER   9   7.538   9.739  -2.767
   50    HA   SER   9           HA       SER   9  10.066  10.203  -1.764
   51   1HB   SER   9          2HB       SER   9   9.180  11.118   0.297
   52   2HB   SER   9          1HB       SER   9   8.029   9.794   0.453
   53    HG   SER   9           HG       SER   9  10.291   9.852   1.580
   54    H    ILE  10           H        ILE  10   9.672   7.828   0.254
   55    HA   ILE  10           HA       ILE  10   8.687   5.795  -1.644
   56    HB   ILE  10           HB       ILE  10  11.219   4.911  -0.495
   57   1HG1  ILE  10          2HG1      ILE  10  11.616   7.423  -0.943
   58   2HG1  ILE  10          1HG1      ILE  10  12.722   6.294  -1.720
   59   1HG2  ILE  10          1HG2      ILE  10   9.732   4.902  -3.089
   60   2HG2  ILE  10          2HG2      ILE  10  10.393   3.550  -2.169
   61   3HG2  ILE  10          3HG2      ILE  10  11.465   4.574  -3.126
   62   1HD1  ILE  10          1HD1      ILE  10  10.432   6.687  -3.421
   63   2HD1  ILE  10          2HD1      ILE  10  12.123   7.057  -3.750
   64   3HD1  ILE  10          3HD1      ILE  10  11.095   8.258  -2.968
   65    H    CYS  11           H        CYS  11   7.311   4.641  -0.466
   66    HA   CYS  11           HA       CYS  11   7.544   4.483   2.445
   67   1HB   CYS  11          2HB       CYS  11   5.684   2.721   0.885
   68   2HB   CYS  11          1HB       CYS  11   5.406   3.562   2.408
   69    H    SER  12           H        SER  12   6.471   1.555   2.134
   70    HA   SER  12           HA       SER  12   9.122   0.286   1.610
   71   1HB   SER  12          2HB       SER  12   7.621   0.386   4.100
   72   2HB   SER  12          1HB       SER  12   7.866  -1.276   3.570
   73    HG   SER  12           HG       SER  12   9.603   0.317   4.731
   74    H    LEU  13           H        LEU  13   8.702  -0.878  -0.232
   75    HA   LEU  13           HA       LEU  13   6.358  -1.765  -1.335
   76   1HB   LEU  13          2HB       LEU  13   8.823  -2.242  -2.060
   77   2HB   LEU  13          1HB       LEU  13   8.616  -3.747  -1.159
   78    HG   LEU  13           HG       LEU  13   6.276  -3.581  -2.614
   79   1HD1  LEU  13          1HD1      LEU  13   8.377  -3.076  -4.671
   80   2HD1  LEU  13          2HD1      LEU  13   7.717  -1.679  -3.820
   81   3HD1  LEU  13          3HD1      LEU  13   6.644  -2.745  -4.727
   82   1HD2  LEU  13          1HD2      LEU  13   8.896  -5.001  -3.116
   83   2HD2  LEU  13          2HD2      LEU  13   7.468  -5.301  -4.106
   84   3HD2  LEU  13          3HD2      LEU  13   7.431  -5.648  -2.378
   85    H    TYR  14           H        TYR  14   7.858  -3.092   1.559
   86    HA   TYR  14           HA       TYR  14   6.357  -5.507   1.740
   87   1HB   TYR  14          2HB       TYR  14   7.819  -3.753   3.654
   88   2HB   TYR  14          1HB       TYR  14   6.637  -4.867   4.343
   89    HD1  TYR  14           HD1      TYR  14   9.189  -4.966   1.581
   90    HD2  TYR  14           HD2      TYR  14   7.512  -6.906   5.029
   91    HE1  TYR  14           HE1      TYR  14  10.781  -6.848   1.296
   92    HE2  TYR  14           HE2      TYR  14   9.102  -8.789   4.743
   93    HH   TYR  14           HH       TYR  14  10.836  -9.575   3.592
   94    H    GLN  15           H        GLN  15   5.707  -2.513   3.624
   95    HA   GLN  15           HA       GLN  15   3.096  -3.145   4.411
   96   1HB   GLN  15          2HB       GLN  15   4.518  -0.572   3.841
   97   2HB   GLN  15          1HB       GLN  15   2.769  -0.519   4.058
   98   1HG   GLN  15          2HG       GLN  15   2.882  -1.244   6.269
   99   2HG   GLN  15          1HG       GLN  15   4.442  -2.034   6.036
  100   1HE2  GLN  15          1HE2      GLN  15   5.086  -0.728   8.031
  101   2HE2  GLN  15          2HE2      GLN  15   5.585   0.880   7.809
  102    H    LEU  16           H        LEU  16   4.328  -2.245   1.311
  103    HA   LEU  16           HA       LEU  16   1.872  -1.508   0.025
  104   1HB   LEU  16          2HB       LEU  16   4.555  -1.661  -0.662
  105   2HB   LEU  16          1HB       LEU  16   3.817  -2.888  -1.681
  106    HG   LEU  16           HG       LEU  16   3.211   0.068  -1.550
  107   1HD1  LEU  16          1HD1      LEU  16   4.623  -1.707  -3.317
  108   2HD1  LEU  16          2HD1      LEU  16   4.440   0.042  -3.434
  109   3HD1  LEU  16          3HD1      LEU  16   3.244  -1.021  -4.175
  110   1HD2  LEU  16          1HD2      LEU  16   1.333  -0.493  -3.171
  111   2HD2  LEU  16          2HD2      LEU  16   1.027  -0.929  -1.493
  112   3HD2  LEU  16          3HD2      LEU  16   1.495  -2.171  -2.656
  113    H    GLU  17           H        GLU  17   3.474  -4.603   0.637
  114    HA   GLU  17           HA       GLU  17   1.690  -6.192  -0.987
  115   1HB   GLU  17          2HB       GLU  17   3.957  -6.661   0.652
  116   2HB   GLU  17          1HB       GLU  17   2.650  -7.635   1.326
  117   1HG   GLU  17          2HG       GLU  17   2.310  -8.070  -1.353
  118   2HG   GLU  17          1HG       GLU  17   4.063  -7.908  -1.250
  119    H    ASN  18           H        ASN  18   1.518  -4.735   2.145
  120    HA   ASN  18           HA       ASN  18  -0.762  -6.343   3.038
  121   1HB   ASN  18          2HB       ASN  18   0.929  -4.193   4.153
  122   2HB   ASN  18          1HB       ASN  18  -0.763  -4.130   4.653
  123   1HD2  ASN  18          1HD2      ASN  18   1.586  -4.912   6.328
  124   2HD2  ASN  18          2HD2      ASN  18   1.271  -6.495   6.855
  125    H    TYR  19           H        TYR  19  -0.462  -4.123   0.655
  126    HA   TYR  19           HA       TYR  19  -3.020  -2.732   1.232
  127   1HB   TYR  19          2HB       TYR  19  -0.642  -2.219  -0.438
  128   2HB   TYR  19          1HB       TYR  19  -2.173  -1.838  -1.229
  129    HD1  TYR  19           HD1      TYR  19   0.353  -0.329   0.413
  130    HD2  TYR  19           HD2      TYR  19  -3.896  -0.820   0.807
  131    HE1  TYR  19           HE1      TYR  19   0.238   1.766   1.727
  132    HE2  TYR  19           HE2      TYR  19  -4.015   1.278   2.124
  133    HH   TYR  19           HH       TYR  19  -2.855   3.167   2.689
  134    H    CYS  20           H        CYS  20  -1.865  -5.527  -0.157
  135    HA   CYS  20           HA       CYS  20  -3.568  -5.727  -2.477
  136   1HB   CYS  20          2HB       CYS  20  -2.312  -7.947  -0.855
  137   2HB   CYS  20          1HB       CYS  20  -2.785  -7.984  -2.536
  138    H    ASN  21           H        ASN  21  -4.712  -8.242  -2.102
  139    HA   ASN  21           HA       ASN  21  -7.163  -7.592  -0.775
  140   1HB   ASN  21          2HB       ASN  21  -6.003  -9.918  -2.164
  141   2HB   ASN  21          1HB       ASN  21  -7.173 -10.335  -0.915
  142   1HD2  ASN  21          1HD2      ASN  21  -7.716 -10.690  -3.735
  143   2HD2  ASN  21          2HD2      ASN  21  -8.976  -9.634  -4.157
  144   1H    PHE   1          1H        PHE   1  15.015  -1.669  -0.484
  145   2H    PHE   1          2H        PHE   1  16.218  -2.280  -1.515
  146   3H    PHE   1          3H        PHE   1  15.265  -3.343  -0.595
  147    HA   PHE   1           HA       PHE   1  14.468  -3.403  -2.828
  148   1HB   PHE   1          2HB       PHE   1  12.574  -1.618  -1.290
  149   2HB   PHE   1          1HB       PHE   1  12.176  -2.912  -2.420
  150    HD1  PHE   1           HD1      PHE   1  12.468  -2.089   0.992
  151    HD2  PHE   1           HD2      PHE   1  13.212  -5.291  -1.776
  152    HE1  PHE   1           HE1      PHE   1  12.434  -3.716   2.865
  153    HE2  PHE   1           HE2      PHE   1  13.178  -6.917   0.097
  154    HZ   PHE   1           HZ       PHE   1  12.788  -6.130   2.418
  155    H    VAL   2           H        VAL   2  13.457  -2.146  -4.626
  156    HA   VAL   2           HA       VAL   2  14.474   0.668  -4.687
  157    HB   VAL   2           HB       VAL   2  14.670   0.249  -7.214
  158   1HG1  VAL   2          1HG1      VAL   2  16.410  -0.503  -5.005
  159   2HG1  VAL   2          2HG1      VAL   2  16.817   0.290  -6.527
  160   3HG1  VAL   2          3HG1      VAL   2  16.738  -1.470  -6.443
  161   1HG2  VAL   2          1HG2      VAL   2  13.375  -1.799  -7.361
  162   2HG2  VAL   2          2HG2      VAL   2  14.420  -2.592  -6.182
  163   3HG2  VAL   2          3HG2      VAL   2  15.047  -2.175  -7.776
  164    H    ASN   3           H        ASN   3  13.082   2.200  -5.492
  165    HA   ASN   3           HA       ASN   3  10.785   1.690  -7.109
  166   1HB   ASN   3          2HB       ASN   3  10.439   1.469  -4.159
  167   2HB   ASN   3          1HB       ASN   3   9.214   2.390  -5.032
  168   1HD2  ASN   3          1HD2      ASN   3   8.965   1.010  -7.427
  169   2HD2  ASN   3          2HD2      ASN   3   8.471  -0.588  -7.138
  170    H    GLN   4           H        GLN   4  10.045   3.682  -7.871
  171    HA   GLN   4           HA       GLN   4  10.976   6.080  -6.351
  172   1HB   GLN   4          2HB       GLN   4  11.831   5.235  -8.913
  173   2HB   GLN   4          1HB       GLN   4  10.790   6.637  -9.167
  174   1HG   GLN   4          2HG       GLN   4  12.174   8.058  -7.983
  175   2HG   GLN   4          1HG       GLN   4  12.794   6.767  -6.953
  176   1HE2  GLN   4          1HE2      GLN   4  14.841   8.175  -7.839
  177   2HE2  GLN   4          2HE2      GLN   4  15.605   7.489  -9.190
  178    H    HIS   5           H        HIS   5   9.099   6.869  -5.542
  179    HA   HIS   5           HA       HIS   5   7.026   7.932  -5.523
  180   1HB   HIS   5          2HB       HIS   5   7.427   7.961  -8.527
  181   2HB   HIS   5          1HB       HIS   5   6.202   8.881  -7.654
  182    HD2  HIS   5           HD2      HIS   5   7.568  11.292  -8.466
  183    HE1  HIS   5           HE1      HIS   5  10.865  10.640  -5.900
  184    HE2  HIS   5           HE2      HIS   5   9.693  12.344  -7.394
  185    H    LEU   6           H        LEU   6   5.223   6.835  -5.018
  186    HA   LEU   6           HA       LEU   6   4.061   4.923  -6.968
  187   1HB   LEU   6          2HB       LEU   6   5.303   4.215  -4.483
  188   2HB   LEU   6          1HB       LEU   6   3.567   3.926  -4.350
  189    HG   LEU   6           HG       LEU   6   3.573   2.542  -6.320
  190   1HD1  LEU   6          1HD1      LEU   6   6.232   3.829  -6.663
  191   2HD1  LEU   6          2HD1      LEU   6   5.010   3.432  -7.872
  192   3HD1  LEU   6          3HD1      LEU   6   6.066   2.171  -7.235
  193   1HD2  LEU   6          1HD2      LEU   6   4.718   1.803  -3.999
  194   2HD2  LEU   6          2HD2      LEU   6   6.110   1.609  -5.062
  195   3HD2  LEU   6          3HD2      LEU   6   4.624   0.716  -5.384
  196    H    CYS   7           H        CYS   7   2.157   5.940  -7.409
  197    HA   CYS   7           HA       CYS   7   0.399   6.534  -5.113
  198   1HB   CYS   7          2HB       CYS   7   1.455   8.546  -6.964
  199   2HB   CYS   7          1HB       CYS   7  -0.301   8.561  -6.837
  200    H    GLY   8           H        GLY   8  -1.604   5.752  -5.441
  201   1HA   GLY   8          2HA       GLY   8  -3.142   4.291  -6.525
  202   2HA   GLY   8          1HA       GLY   8  -3.383   5.776  -7.438
  203    H    SER   9           H        SER   9  -2.401   5.952  -9.558
  204    HA   SER   9           HA       SER   9  -2.424   3.689 -11.169
  205   1HB   SER   9          2HB       SER   9  -1.117   4.994 -12.800
  206   2HB   SER   9          1HB       SER   9  -2.358   5.990 -12.048
  207    HG   SER   9           HG       SER   9  -0.255   6.978 -12.130
  208    H    ASP  10           H        ASP  10   0.588   5.223  -9.950
  209    HA   ASP  10           HA       ASP  10   2.202   2.974 -10.781
  210   1HB   ASP  10          2HB       ASP  10   3.044   4.914  -8.648
  211   2HB   ASP  10          1HB       ASP  10   4.027   4.140  -9.887
  212    H    LEU  11           H        LEU  11   0.411   3.725  -7.861
  213    HA   LEU  11           HA       LEU  11   1.832   1.759  -6.234
  214   1HB   LEU  11          2HB       LEU  11  -0.468   3.577  -5.870
  215   2HB   LEU  11          1HB       LEU  11  -0.566   2.069  -4.977
  216    HG   LEU  11           HG       LEU  11   1.777   3.967  -4.929
  217   1HD1  LEU  11          1HD1      LEU  11  -0.334   3.327  -2.852
  218   2HD1  LEU  11          2HD1      LEU  11  -0.168   4.854  -3.721
  219   3HD1  LEU  11          3HD1      LEU  11   1.078   4.348  -2.580
  220   1HD2  LEU  11          1HD2      LEU  11   2.736   1.901  -4.516
  221   2HD2  LEU  11          2HD2      LEU  11   1.253   1.242  -3.827
  222   3HD2  LEU  11          3HD2      LEU  11   2.243   2.358  -2.885
  223    H    VAL  12           H        VAL  12  -0.831   1.712  -8.472
  224    HA   VAL  12           HA       VAL  12  -1.857  -0.838  -7.509
  225    HB   VAL  12           HB       VAL  12  -2.694   1.209  -9.366
  226   1HG1  VAL  12          1HG1      VAL  12  -2.146  -0.127 -11.242
  227   2HG1  VAL  12          2HG1      VAL  12  -3.852  -0.467 -10.953
  228   3HG1  VAL  12          3HG1      VAL  12  -2.621  -1.618 -10.429
  229   1HG2  VAL  12          1HG2      VAL  12  -4.195   0.635  -7.679
  230   2HG2  VAL  12          2HG2      VAL  12  -3.910  -1.094  -7.873
  231   3HG2  VAL  12          3HG2      VAL  12  -4.875  -0.220  -9.063
  232    H    GLU  13           H        GLU  13  -0.069   0.223 -10.383
  233    HA   GLU  13           HA       GLU  13   0.319  -2.369 -11.493
  234   1HB   GLU  13          2HB       GLU  13   2.302  -0.090 -11.690
  235   2HB   GLU  13          1HB       GLU  13   2.009  -1.373 -12.865
  236   1HG   GLU  13          2HG       GLU  13  -0.489  -0.344 -12.678
  237   2HG   GLU  13          1HG       GLU  13   0.460   1.107 -12.349
  238    H    ALA  14           H        ALA  14   2.192  -0.545  -9.077
  239    HA   ALA  14           HA       ALA  14   4.246  -2.613  -8.883
  240   1HB   ALA  14          1HB       ALA  14   4.108  -1.037  -6.495
  241   2HB   ALA  14          2HB       ALA  14   3.844   0.040  -7.866
  242   3HB   ALA  14          3HB       ALA  14   5.306  -0.943  -7.786
  243    H    LEU  15           H        LEU  15   1.299  -1.685  -7.159
  244    HA   LEU  15           HA       LEU  15   1.404  -3.418  -4.958
  245   1HB   LEU  15          2HB       LEU  15  -0.715  -2.105  -6.524
  246   2HB   LEU  15          1HB       LEU  15  -1.227  -3.617  -5.778
  247    HG   LEU  15           HG       LEU  15   0.272  -1.523  -4.218
  248   1HD1  LEU  15          1HD1      LEU  15  -1.850  -0.587  -5.230
  249   2HD1  LEU  15          2HD1      LEU  15  -1.816  -0.597  -3.466
  250   3HD1  LEU  15          3HD1      LEU  15  -2.735  -1.824  -4.339
  251   1HD2  LEU  15          1HD2      LEU  15   0.112  -3.840  -3.330
  252   2HD2  LEU  15          2HD2      LEU  15  -1.646  -3.729  -3.418
  253   3HD2  LEU  15          3HD2      LEU  15  -0.750  -2.682  -2.317
  254    H    TYR  16           H        TYR  16   0.096  -4.084  -8.192
  255    HA   TYR  16           HA       TYR  16  -0.438  -6.858  -7.759
  256   1HB   TYR  16          2HB       TYR  16  -1.464  -6.071  -9.695
  257   2HB   TYR  16          1HB       TYR  16  -0.084  -5.078 -10.152
  258    HD1  TYR  16           HD1      TYR  16  -1.711  -8.306 -10.510
  259    HD2  TYR  16           HD2      TYR  16   1.981  -6.184 -11.090
  260    HE1  TYR  16           HE1      TYR  16  -0.929 -10.087 -12.050
  261    HE2  TYR  16           HE2      TYR  16   2.763  -7.965 -12.630
  262    HH   TYR  16           HH       TYR  16   0.846 -10.901 -13.170
  263    H    LEU  17           H        LEU  17   2.453  -5.154  -8.956
  264    HA   LEU  17           HA       LEU  17   4.009  -7.520  -9.501
  265   1HB   LEU  17          2HB       LEU  17   4.403  -4.799  -9.807
  266   2HB   LEU  17          1HB       LEU  17   5.471  -5.173  -8.454
  267    HG   LEU  17           HG       LEU  17   6.437  -7.046  -9.814
  268   1HD1  LEU  17          1HD1      LEU  17   5.814  -7.418 -12.024
  269   2HD1  LEU  17          2HD1      LEU  17   5.205  -5.776 -12.234
  270   3HD1  LEU  17          3HD1      LEU  17   4.264  -6.956 -11.321
  271   1HD2  LEU  17          1HD2      LEU  17   6.655  -4.472 -11.364
  272   2HD2  LEU  17          2HD2      LEU  17   7.923  -5.632 -10.970
  273   3HD2  LEU  17          3HD2      LEU  17   7.273  -4.574  -9.716
  274    H    VAL  18           H        VAL  18   3.077  -5.719  -6.759
  275    HA   VAL  18           HA       VAL  18   4.915  -6.918  -4.844
  276    HB   VAL  18           HB       VAL  18   2.871  -4.808  -5.034
  277   1HG1  VAL  18          1HG1      VAL  18   2.520  -4.742  -2.552
  278   2HG1  VAL  18          2HG1      VAL  18   3.169  -6.381  -2.481
  279   3HG1  VAL  18          3HG1      VAL  18   1.686  -6.056  -3.380
  280   1HG2  VAL  18          1HG2      VAL  18   5.456  -5.265  -3.593
  281   2HG2  VAL  18          2HG2      VAL  18   4.454  -3.853  -3.257
  282   3HG2  VAL  18          3HG2      VAL  18   5.093  -4.117  -4.880
  283    H    CYS  19           H        CYS  19   1.441  -6.836  -5.305
  284    HA   CYS  19           HA       CYS  19   0.715  -8.908  -3.497
  285   1HB   CYS  19          2HB       CYS  19  -0.731  -8.085  -6.032
  286   2HB   CYS  19          1HB       CYS  19  -1.447  -8.815  -4.604
  287    H    GLY  20           H        GLY  20   2.202  -9.039  -6.590
  288   1HA   GLY  20          2HA       GLY  20   2.838 -10.876  -7.910
  289   2HA   GLY  20          1HA       GLY  20   2.461 -11.897  -6.522
  290    H    GLU  21           H        GLU  21   0.250 -12.642  -6.268
  291    HA   GLU  21           HA       GLU  21  -1.353 -12.445  -8.789
  292   1HB   GLU  21          2HB       GLU  21  -0.429 -14.686  -8.615
  293   2HB   GLU  21          1HB       GLU  21  -0.982 -14.825  -6.945
  294   1HG   GLU  21          2HG       GLU  21  -3.142 -15.242  -7.555
  295   2HG   GLU  21          1HG       GLU  21  -3.076 -14.128  -8.921
  296    H    ARG  22           H        ARG  22  -1.285 -12.150  -5.350
  297    HA   ARG  22           HA       ARG  22  -4.103 -12.470  -4.839
  298   1HB   ARG  22          2HB       ARG  22  -2.106 -10.763  -3.321
  299   2HB   ARG  22          1HB       ARG  22  -3.640 -11.385  -2.710
  300   1HG   ARG  22          2HG       ARG  22  -2.806 -13.706  -3.074
  301   2HG   ARG  22          1HG       ARG  22  -1.249 -13.041  -3.567
  302   1HD   ARG  22          2HD       ARG  22  -0.836 -13.417  -1.316
  303   2HD   ARG  22          1HD       ARG  22  -1.437 -11.759  -1.251
  304    HE   ARG  22           HE       ARG  22  -3.345 -14.014  -0.850
  305   1HH1  ARG  22          1HH2      ARG  22  -2.738 -10.768  -0.342
  306   2HH1  ARG  22          2HH2      ARG  22  -3.229 -10.746   1.319
  307   1HH2  ARG  22          1HH1      ARG  22  -3.522 -14.194   1.553
  308   2HH2  ARG  22          2HH1      ARG  22  -3.671 -12.686   2.393
  309    H    GLY  23           H        GLY  23  -5.758 -10.974  -4.975
  310   1HA   GLY  23          2HA       GLY  23  -5.370  -8.682  -6.693
  311   2HA   GLY  23          1HA       GLY  23  -6.865  -9.099  -5.856
  312    H    PHE  24           H        PHE  24  -6.633  -6.536  -5.715
  313    HA   PHE  24           HA       PHE  24  -5.562  -5.992  -2.991
  314   1HB   PHE  24          2HB       PHE  24  -4.714  -3.773  -3.778
  315   2HB   PHE  24          1HB       PHE  24  -3.833  -5.125  -4.480
  316    HD1  PHE  24           HD1      PHE  24  -5.767  -2.175  -5.158
  317    HD2  PHE  24           HD2      PHE  24  -4.591  -5.971  -6.797
  318    HE1  PHE  24           HE1      PHE  24  -6.352  -1.376  -7.434
  319    HE2  PHE  24           HE2      PHE  24  -5.176  -5.171  -9.072
  320    HZ   PHE  24           HZ       PHE  24  -6.057  -2.874  -9.390
  321    H    PHE  25           H        PHE  25  -6.236  -3.376  -2.745
  322    HA   PHE  25           HA       PHE  25  -9.105  -3.193  -3.546
  323   1HB   PHE  25          2HB       PHE  25  -8.847  -4.042  -1.171
  324   2HB   PHE  25          1HB       PHE  25  -8.075  -2.506  -0.778
  325    HD1  PHE  25           HD1      PHE  25 -11.222  -4.088  -1.948
  326    HD2  PHE  25           HD2      PHE  25  -9.345  -0.480  -0.560
  327    HE1  PHE  25           HE1      PHE  25 -13.451  -3.026  -1.691
  328    HE2  PHE  25           HE2      PHE  25 -11.573   0.581  -0.303
  329    HZ   PHE  25           HZ       PHE  25 -13.626  -0.692  -0.868
  330    H    TYR  26           H        TYR  26  -8.780  -1.505  -4.999
  331    HA   TYR  26           HA       TYR  26  -7.390   0.920  -3.941
  332   1HB   TYR  26          2HB       TYR  26  -6.349   0.055  -5.959
  333   2HB   TYR  26          1HB       TYR  26  -7.905   0.014  -6.788
  334    HD1  TYR  26           HD1      TYR  26  -5.292   2.224  -5.371
  335    HD2  TYR  26           HD2      TYR  26  -8.910   2.017  -7.681
  336    HE1  TYR  26           HE1      TYR  26  -4.974   4.580  -6.080
  337    HE2  TYR  26           HE2      TYR  26  -8.591   4.373  -8.391
  338    HH   TYR  26           HH       TYR  26  -7.349   6.198  -8.196
  339    H    THR  27           H        THR  27 -10.121   0.057  -6.113
  340    HA   THR  27           HA       THR  27 -11.625   2.327  -4.891
  341    HB   THR  27           HB       THR  27 -10.715   3.050  -7.081
  342    HG1  THR  27           HG1      THR  27 -13.064   3.110  -8.039
  343   1HG2  THR  27          1HG2      THR  27 -10.522   1.462  -8.670
  344   2HG2  THR  27          2HG2      THR  27 -12.261   1.620  -8.916
  345   3HG2  THR  27          3HG2      THR  27 -11.634   0.388  -7.820
  346    H    LYS  28           H        LYS  28 -13.987   2.109  -5.172
  347    HA   LYS  28           HA       LYS  28 -14.804  -0.747  -5.530
  348   1HB   LYS  28          2HB       LYS  28 -16.780   0.160  -3.963
  349   2HB   LYS  28          1HB       LYS  28 -15.280  -0.483  -3.295
  350   1HG   LYS  28          2HG       LYS  28 -15.774   1.667  -2.217
  351   2HG   LYS  28          1HG       LYS  28 -14.338   1.836  -3.217
  352   1HD   LYS  28          2HD       LYS  28 -15.977   3.767  -3.417
  353   2HD   LYS  28          1HD       LYS  28 -15.601   2.990  -4.955
  354   1HE   LYS  28          2HE       LYS  28 -17.756   2.388  -5.248
  355   2HE   LYS  28          1HE       LYS  28 -17.828   1.656  -3.646
  356   1HZ   LYS  28          1HZ       LYS  28 -18.051   4.569  -4.168
  357   2HZ   LYS  28          2HZ       LYS  28 -18.263   3.782  -2.677
  358   3HZ   LYS  28          3HZ       LYS  28 -19.375   3.535  -3.939
  359    HA   PRO  29           HA       PRO  29 -17.540   0.734  -8.625
  360   1HB   PRO  29          2HB       PRO  29 -19.307  -1.371  -8.627
  361   2HB   PRO  29          1HB       PRO  29 -17.689  -1.448  -9.345
  362   1HG   PRO  29          2HG       PRO  29 -18.670  -2.640  -6.791
  363   2HG   PRO  29          1HG       PRO  29 -17.351  -3.175  -7.846
  364   1HD   PRO  29          2HD       PRO  29 -17.052  -1.751  -5.421
  365   2HD   PRO  29          1HD       PRO  29 -15.794  -1.985  -6.652
  366    H    THR  30           H        THR  30 -20.211   0.580  -8.876
  367    HA   THR  30           HA       THR  30 -21.818   0.840  -6.551
  368    HB   THR  30           HB       THR  30 -20.398   2.794  -6.052
  369    HG1  THR  30           HG1      THR  30 -22.822   3.828  -7.024
  370   1HG2  THR  30          1HG2      THR  30 -19.604   3.440  -8.205
  371   2HG2  THR  30          2HG2      THR  30 -20.621   4.772  -7.656
  372   3HG2  THR  30          3HG2      THR  30 -21.243   3.617  -8.835
  Start of MODEL    2
    1   1H    GLY   1          1H        GLY   1  -8.754   6.704   2.315
    2   2H    GLY   1          2H        GLY   1  -7.123   7.173   2.393
    3   3H    GLY   1          3H        GLY   1  -7.806   6.257   3.650
    4   1HA   GLY   1          1HA       GLY   1  -7.150   4.433   2.536
    5   2HA   GLY   1          2HA       GLY   1  -8.293   4.831   1.218
    6    H    ALA   2           H        ALA   2  -6.578   3.956  -0.178
    7    HA   ALA   2           HA       ALA   2  -3.711   4.410   0.536
    8   1HB   ALA   2          1HB       ALA   2  -4.025   2.085   0.303
    9   2HB   ALA   2          2HB       ALA   2  -3.394   2.570  -1.271
   10   3HB   ALA   2          3HB       ALA   2  -5.121   2.279  -1.066
   11    H    VAL   3           H        VAL   3  -3.070   6.274  -0.484
   12    HA   VAL   3           HA       VAL   3  -3.102   6.339  -3.402
   13    HB   VAL   3           HB       VAL   3  -4.228   8.870  -2.529
   14   1HG1  VAL   3          1HG1      VAL   3  -4.489   8.549  -4.778
   15   2HG1  VAL   3          2HG1      VAL   3  -6.011   7.819  -4.267
   16   3HG1  VAL   3          3HG1      VAL   3  -4.618   6.797  -4.618
   17   1HG2  VAL   3          1HG2      VAL   3  -5.287   7.275  -0.835
   18   2HG2  VAL   3          2HG2      VAL   3  -6.063   6.480  -2.205
   19   3HG2  VAL   3          3HG2      VAL   3  -6.419   8.170  -1.849
   20    H    GLU   4           H        GLU   4  -2.889   8.717  -0.724
   21    HA   GLU   4           HA       GLU   4  -0.303   9.629  -1.883
   22   1HB   GLU   4          2HB       GLU   4  -0.585  11.602  -0.447
   23   2HB   GLU   4          1HB       GLU   4  -2.036  11.344  -1.418
   24   1HG   GLU   4          2HG       GLU   4  -3.064  10.136   0.510
   25   2HG   GLU   4          1HG       GLU   4  -1.640  10.529   1.476
   26    H    GLN   5           H        GLN   5  -0.820   7.155  -0.144
   27    HA   GLN   5           HA       GLN   5   0.659   7.796   2.320
   28   1HB   GLN   5          2HB       GLN   5  -1.197   5.861   1.673
   29   2HB   GLN   5          1HB       GLN   5   0.318   4.958   1.620
   30   1HG   GLN   5          2HG       GLN   5   0.373   6.684   3.905
   31   2HG   GLN   5          1HG       GLN   5  -1.144   5.783   3.921
   32   1HE2  GLN   5          1HE2      GLN   5   0.438   4.989   5.930
   33   2HE2  GLN   5          2HE2      GLN   5   1.261   3.545   5.584
   34    H    CYS   6           H        CYS   6   1.165   5.734  -0.556
   35    HA   CYS   6           HA       CYS   6   4.080   5.737   0.071
   36   1HB   CYS   6          2HB       CYS   6   2.369   3.935  -1.660
   37   2HB   CYS   6          1HB       CYS   6   4.132   3.882  -1.670
   38    H    CYS   7           H        CYS   7   2.138   7.709  -1.465
   39    HA   CYS   7           HA       CYS   7   3.686   7.862  -3.998
   40   1HB   CYS   7          2HB       CYS   7   1.158   7.928  -4.025
   41   2HB   CYS   7          1HB       CYS   7   1.258   9.480  -3.212
   42    H    THR   8           H        THR   8   4.395  10.119  -4.655
   43    HA   THR   8           HA       THR   8   5.824  11.924  -4.135
   44    HB   THR   8           HB       THR   8   4.813  13.602  -2.844
   45    HG1  THR   8           HG1      THR   8   3.045  12.456  -1.311
   46   1HG2  THR   8          1HG2      THR   8   2.442  11.805  -3.382
   47   2HG2  THR   8          2HG2      THR   8   3.309  12.650  -4.665
   48   3HG2  THR   8          3HG2      THR   8   2.489  13.568  -3.403
   49    H    SER   9           H        SER   9   6.396   9.317  -2.978
   50    HA   SER   9           HA       SER   9   8.569   9.834  -1.320
   51   1HB   SER   9          2HB       SER   9   6.002   9.994   0.105
   52   2HB   SER   9          1HB       SER   9   7.112   8.825   0.814
   53    HG   SER   9           HG       SER   9   7.197  11.535   0.825
   54    H    ILE  10           H        ILE  10   9.182   7.700  -0.080
   55    HA   ILE  10           HA       ILE  10   7.903   5.421  -1.529
   56    HB   ILE  10           HB       ILE  10  10.645   4.860  -0.763
   57   1HG1  ILE  10          2HG1      ILE  10  10.707   7.405  -1.227
   58   2HG1  ILE  10          1HG1      ILE  10  11.830   6.394  -2.132
   59   1HG2  ILE  10          1HG2      ILE  10  10.701   4.354  -3.270
   60   2HG2  ILE  10          2HG2      ILE  10   9.011   4.856  -3.306
   61   3HG2  ILE  10          3HG2      ILE  10   9.498   3.474  -2.326
   62   1HD1  ILE  10          1HD1      ILE  10  10.768   7.963  -3.665
   63   2HD1  ILE  10          2HD1      ILE  10   9.168   7.456  -3.125
   64   3HD1  ILE  10          3HD1      ILE  10  10.193   6.334  -4.019
   65    H    CYS  11           H        CYS  11   6.723   4.438   0.016
   66    HA   CYS  11           HA       CYS  11   7.546   4.309   2.802
   67   1HB   CYS  11          2HB       CYS  11   5.583   2.738   2.980
   68   2HB   CYS  11          1HB       CYS  11   5.171   4.288   2.242
   69    H    SER  12           H        SER  12   6.483   1.239   2.294
   70    HA   SER  12           HA       SER  12   9.144   0.158   1.530
   71   1HB   SER  12          2HB       SER  12   7.945  -1.403   3.660
   72   2HB   SER  12          1HB       SER  12   9.559  -0.702   3.574
   73    HG   SER  12           HG       SER  12   7.381   0.143   4.929
   74    H    LEU  13           H        LEU  13   8.672  -1.105  -0.216
   75    HA   LEU  13           HA       LEU  13   6.335  -1.965  -1.270
   76   1HB   LEU  13          2HB       LEU  13   8.794  -2.628  -1.918
   77   2HB   LEU  13          1HB       LEU  13   8.423  -4.101  -1.018
   78    HG   LEU  13           HG       LEU  13   6.203  -4.055  -2.427
   79   1HD1  LEU  13          1HD1      LEU  13   6.250  -2.116  -3.680
   80   2HD1  LEU  13          2HD1      LEU  13   7.056  -3.202  -4.812
   81   3HD1  LEU  13          3HD1      LEU  13   8.009  -2.114  -3.803
   82   1HD2  LEU  13          1HD2      LEU  13   7.995  -4.939  -4.396
   83   2HD2  LEU  13          2HD2      LEU  13   7.270  -5.919  -3.122
   84   3HD2  LEU  13          3HD2      LEU  13   8.850  -5.175  -2.873
   85    H    TYR  14           H        TYR  14   7.801  -3.448   1.607
   86    HA   TYR  14           HA       TYR  14   6.082  -5.682   1.849
   87   1HB   TYR  14          2HB       TYR  14   7.740  -4.075   3.692
   88   2HB   TYR  14          1HB       TYR  14   6.380  -4.897   4.459
   89    HD1  TYR  14           HD1      TYR  14   9.604  -5.307   2.794
   90    HD2  TYR  14           HD2      TYR  14   6.137  -7.373   4.269
   91    HE1  TYR  14           HE1      TYR  14  10.840  -7.456   2.684
   92    HE2  TYR  14           HE2      TYR  14   7.373  -9.523   4.159
   93    HH   TYR  14           HH       TYR  14  10.550  -9.742   2.675
   94    H    GLN  15           H        GLN  15   5.657  -2.510   3.494
   95    HA   GLN  15           HA       GLN  15   3.007  -2.933   4.344
   96   1HB   GLN  15          2HB       GLN  15   4.353  -0.934   4.970
   97   2HB   GLN  15          1HB       GLN  15   4.177  -0.325   3.325
   98   1HG   GLN  15          2HG       GLN  15   2.410   0.766   4.366
   99   2HG   GLN  15          1HG       GLN  15   1.600  -0.699   3.809
  100   1HE2  GLN  15          1HE2      GLN  15   1.800   1.216   6.489
  101   2HE2  GLN  15          2HE2      GLN  15   1.539   0.053   7.698
  102    H    LEU  16           H        LEU  16   4.290  -2.050   1.218
  103    HA   LEU  16           HA       LEU  16   1.832  -1.380  -0.086
  104   1HB   LEU  16          2HB       LEU  16   4.523  -1.591  -0.794
  105   2HB   LEU  16          1HB       LEU  16   3.735  -2.803  -1.789
  106    HG   LEU  16           HG       LEU  16   3.357   0.178  -1.754
  107   1HD1  LEU  16          1HD1      LEU  16   3.160  -0.450  -4.290
  108   2HD1  LEU  16          2HD1      LEU  16   3.839  -1.995  -3.781
  109   3HD1  LEU  16          3HD1      LEU  16   4.744  -0.504  -3.515
  110   1HD2  LEU  16          1HD2      LEU  16   1.283  -0.322  -3.230
  111   2HD2  LEU  16          2HD2      LEU  16   1.085  -0.428  -1.482
  112   3HD2  LEU  16          3HD2      LEU  16   1.272  -1.899  -2.439
  113    H    GLU  17           H        GLU  17   3.506  -4.430   0.534
  114    HA   GLU  17           HA       GLU  17   1.715  -6.088  -0.996
  115   1HB   GLU  17          2HB       GLU  17   4.061  -6.652   0.025
  116   2HB   GLU  17          1HB       GLU  17   3.142  -7.041   1.480
  117   1HG   GLU  17          2HG       GLU  17   1.658  -8.336  -0.395
  118   2HG   GLU  17          1HG       GLU  17   3.265  -8.468  -1.112
  119    H    ASN  18           H        ASN  18   1.599  -4.574   2.103
  120    HA   ASN  18           HA       ASN  18  -0.584  -6.225   3.139
  121   1HB   ASN  18          2HB       ASN  18   0.709  -3.640   4.041
  122   2HB   ASN  18          1HB       ASN  18  -0.693  -4.327   4.863
  123   1HD2  ASN  18          1HD2      ASN  18   2.450  -5.584   3.582
  124   2HD2  ASN  18          2HD2      ASN  18   2.798  -6.518   4.955
  125    H    TYR  19           H        TYR  19  -0.440  -4.096   0.651
  126    HA   TYR  19           HA       TYR  19  -3.070  -2.835   1.234
  127   1HB   TYR  19          2HB       TYR  19  -0.739  -2.191  -0.500
  128   2HB   TYR  19          1HB       TYR  19  -2.330  -1.745  -1.119
  129    HD1  TYR  19           HD1      TYR  19   0.340  -0.378   0.389
  130    HD2  TYR  19           HD2      TYR  19  -3.850  -0.909   1.152
  131    HE1  TYR  19           HE1      TYR  19   0.372   1.593   1.879
  132    HE2  TYR  19           HE2      TYR  19  -3.827   1.064   2.648
  133    HH   TYR  19           HH       TYR  19  -1.825   2.251   4.100
  134    H    CYS  20           H        CYS  20  -1.688  -5.492  -0.277
  135    HA   CYS  20           HA       CYS  20  -3.499  -5.670  -2.546
  136   1HB   CYS  20          2HB       CYS  20  -1.672  -7.700  -1.241
  137   2HB   CYS  20          1HB       CYS  20  -2.489  -7.904  -2.770
  138    H    ASN  21           H        ASN  21  -4.310  -8.312  -2.410
  139    HA   ASN  21           HA       ASN  21  -6.611  -8.138  -0.666
  140   1HB   ASN  21          2HB       ASN  21  -5.568  -9.980  -2.715
  141   2HB   ASN  21          1HB       ASN  21  -6.490 -10.772  -1.439
  142   1HD2  ASN  21          1HD2      ASN  21  -7.042  -7.440  -2.613
  143   2HD2  ASN  21          2HD2      ASN  21  -8.592  -7.744  -3.235
  144   1H    PHE   1          1H        PHE   1   8.350  -3.449  -7.005
  145   2H    PHE   1          2H        PHE   1   9.158  -4.925  -6.786
  146   3H    PHE   1          3H        PHE   1   8.918  -4.314  -8.349
  147    HA   PHE   1           HA       PHE   1  11.114  -3.939  -6.707
  148   1HB   PHE   1          2HB       PHE   1  11.742  -2.327  -8.625
  149   2HB   PHE   1          1HB       PHE   1  11.428  -4.008  -9.044
  150    HD1  PHE   1           HD1      PHE   1   8.537  -1.987  -8.091
  151    HD2  PHE   1           HD2      PHE   1  11.006  -3.219 -11.388
  152    HE1  PHE   1           HE1      PHE   1   6.778  -1.266  -9.674
  153    HE2  PHE   1           HE2      PHE   1   9.241  -2.496 -12.973
  154    HZ   PHE   1           HZ       PHE   1   7.128  -1.520 -12.115
  155    H    VAL   2           H        VAL   2  12.052  -1.391  -7.023
  156    HA   VAL   2           HA       VAL   2  10.240   0.125  -5.206
  157    HB   VAL   2           HB       VAL   2  12.350   1.516  -4.821
  158   1HG1  VAL   2          1HG1      VAL   2  11.419  -0.697  -3.574
  159   2HG1  VAL   2          2HG1      VAL   2  12.869   0.160  -3.051
  160   3HG1  VAL   2          3HG1      VAL   2  13.011  -1.278  -4.062
  161   1HG2  VAL   2          1HG2      VAL   2  14.028  -0.738  -5.693
  162   2HG2  VAL   2          2HG2      VAL   2  14.287   0.996  -5.886
  163   3HG2  VAL   2          3HG2      VAL   2  13.260   0.126  -7.025
  164    H    ASN   3           H        ASN   3  10.404   2.576  -5.511
  165    HA   ASN   3           HA       ASN   3  10.954   3.517  -8.231
  166   1HB   ASN   3          2HB       ASN   3   8.204   2.919  -7.266
  167   2HB   ASN   3          1HB       ASN   3   8.419   4.460  -8.098
  168   1HD2  ASN   3          1HD2      ASN   3   7.387   1.482  -8.808
  169   2HD2  ASN   3          2HD2      ASN   3   8.014   1.280 -10.373
  170    H    GLN   4           H        GLN   4   9.550   5.936  -8.101
  171    HA   GLN   4           HA       GLN   4  10.725   7.131  -5.624
  172   1HB   GLN   4          2HB       GLN   4  10.921   9.233  -6.913
  173   2HB   GLN   4          1HB       GLN   4  11.794   7.921  -7.704
  174   1HG   GLN   4          2HG       GLN   4   9.407   7.605  -8.901
  175   2HG   GLN   4          1HG       GLN   4   9.313   9.332  -8.558
  176   1HE2  GLN   4          1HE2      GLN   4  11.402  10.599  -9.240
  177   2HE2  GLN   4          2HE2      GLN   4  12.129  10.124 -10.698
  178    H    HIS   5           H        HIS   5   7.924   7.233  -7.822
  179    HA   HIS   5           HA       HIS   5   6.396   8.478  -5.570
  180   1HB   HIS   5          2HB       HIS   5   5.751   8.918  -8.488
  181   2HB   HIS   5          1HB       HIS   5   5.136   9.803  -7.096
  182    HD2  HIS   5           HD2      HIS   5   7.245  10.904  -9.715
  183    HE1  HIS   5           HE1      HIS   5   9.539  11.992  -6.333
  184    HE2  HIS   5           HE2      HIS   5   9.220  12.355  -8.838
  185    H    LEU   6           H        LEU   6   5.070   6.899  -4.820
  186    HA   LEU   6           HA       LEU   6   3.929   4.969  -6.755
  187   1HB   LEU   6          2HB       LEU   6   5.148   4.561  -4.291
  188   2HB   LEU   6          1HB       LEU   6   3.425   4.420  -3.934
  189    HG   LEU   6           HG       LEU   6   3.158   2.782  -5.733
  190   1HD1  LEU   6          1HD1      LEU   6   4.701   3.329  -7.398
  191   2HD1  LEU   6          2HD1      LEU   6   5.459   1.914  -6.670
  192   3HD1  LEU   6          3HD1      LEU   6   6.021   3.531  -6.247
  193   1HD2  LEU   6          1HD2      LEU   6   5.316   1.320  -4.694
  194   2HD2  LEU   6          2HD2      LEU   6   3.662   1.332  -4.087
  195   3HD2  LEU   6          3HD2      LEU   6   4.856   2.438  -3.410
  196    H    CYS   7           H        CYS   7   2.228   6.167  -7.509
  197    HA   CYS   7           HA       CYS   7   0.155   7.025  -5.530
  198   1HB   CYS   7          2HB       CYS   7   1.191   8.153  -8.033
  199   2HB   CYS   7          1HB       CYS   7  -0.574   8.053  -8.016
  200    H    GLY   8           H        GLY   8  -2.103   6.547  -6.204
  201   1HA   GLY   8          2HA       GLY   8  -2.987   4.090  -6.542
  202   2HA   GLY   8          1HA       GLY   8  -3.724   5.336  -7.544
  203    H    SER   9           H        SER   9  -2.031   5.848  -9.523
  204    HA   SER   9           HA       SER   9  -2.181   3.588 -11.238
  205   1HB   SER   9          2HB       SER   9  -1.271   6.303 -11.420
  206   2HB   SER   9          1HB       SER   9  -0.051   5.251 -12.133
  207    HG   SER   9           HG       SER   9  -2.297   6.026 -13.215
  208    H    ASP  10           H        ASP  10   0.868   5.068 -10.050
  209    HA   ASP  10           HA       ASP  10   2.402   2.702 -10.635
  210   1HB   ASP  10          2HB       ASP  10   3.045   5.018  -8.786
  211   2HB   ASP  10          1HB       ASP  10   4.206   3.828  -9.377
  212    H    LEU  11           H        LEU  11   0.339   3.503  -8.019
  213    HA   LEU  11           HA       LEU  11   1.700   1.693  -6.130
  214   1HB   LEU  11          2HB       LEU  11  -0.474   3.680  -6.002
  215   2HB   LEU  11          1HB       LEU  11  -0.738   2.266  -5.006
  216    HG   LEU  11           HG       LEU  11   1.795   3.902  -4.983
  217   1HD1  LEU  11          1HD1      LEU  11  -0.417   3.798  -2.920
  218   2HD1  LEU  11          2HD1      LEU  11  -0.271   5.082  -4.120
  219   3HD1  LEU  11          3HD1      LEU  11   0.995   4.854  -2.913
  220   1HD2  LEU  11          1HD2      LEU  11   2.497   2.533  -3.220
  221   2HD2  LEU  11          2HD2      LEU  11   1.729   1.386  -4.318
  222   3HD2  LEU  11          3HD2      LEU  11   0.861   1.959  -2.895
  223    H    VAL  12           H        VAL  12  -0.853   1.655  -8.466
  224    HA   VAL  12           HA       VAL  12  -2.024  -0.811  -7.411
  225    HB   VAL  12           HB       VAL  12  -2.581   1.055  -9.681
  226   1HG1  VAL  12          1HG1      VAL  12  -2.980  -1.893  -9.804
  227   2HG1  VAL  12          2HG1      VAL  12  -2.766  -0.729 -11.113
  228   3HG1  VAL  12          3HG1      VAL  12  -4.336  -0.889 -10.323
  229   1HG2  VAL  12          1HG2      VAL  12  -3.695   0.696  -7.254
  230   2HG2  VAL  12          2HG2      VAL  12  -4.692  -0.415  -8.193
  231   3HG2  VAL  12          3HG2      VAL  12  -4.609   1.289  -8.641
  232    H    GLU  13           H        GLU  13  -0.284   0.167 -10.331
  233    HA   GLU  13           HA       GLU  13   0.130  -2.449 -11.374
  234   1HB   GLU  13          2HB       GLU  13   2.014  -0.101 -11.711
  235   2HB   GLU  13          1HB       GLU  13   1.737  -1.432 -12.837
  236   1HG   GLU  13          2HG       GLU  13  -0.781  -0.568 -12.674
  237   2HG   GLU  13          1HG       GLU  13   0.021   0.946 -12.260
  238    H    ALA  14           H        ALA  14   2.103  -0.454  -9.162
  239    HA   ALA  14           HA       ALA  14   4.209  -2.438  -8.935
  240   1HB   ALA  14          1HB       ALA  14   3.483  -0.367  -6.843
  241   2HB   ALA  14          2HB       ALA  14   4.357   0.061  -8.315
  242   3HB   ALA  14          3HB       ALA  14   5.066  -1.075  -7.166
  243    H    LEU  15           H        LEU  15   1.214  -1.689  -7.232
  244    HA   LEU  15           HA       LEU  15   1.468  -3.435  -5.023
  245   1HB   LEU  15          2HB       LEU  15  -0.743  -2.149  -6.491
  246   2HB   LEU  15          1HB       LEU  15  -1.184  -3.666  -5.718
  247    HG   LEU  15           HG       LEU  15   0.394  -1.635  -4.183
  248   1HD1  LEU  15          1HD1      LEU  15  -1.304  -0.159  -4.127
  249   2HD1  LEU  15          2HD1      LEU  15  -2.394  -1.426  -3.565
  250   3HD1  LEU  15          3HD1      LEU  15  -2.184  -1.147  -5.293
  251   1HD2  LEU  15          1HD2      LEU  15   0.189  -3.625  -2.980
  252   2HD2  LEU  15          2HD2      LEU  15  -1.414  -3.965  -3.628
  253   3HD2  LEU  15          3HD2      LEU  15  -1.208  -2.718  -2.399
  254    H    TYR  16           H        TYR  16  -0.123  -4.076  -8.141
  255    HA   TYR  16           HA       TYR  16  -0.513  -6.857  -7.800
  256   1HB   TYR  16          2HB       TYR  16  -1.581  -6.208  -9.726
  257   2HB   TYR  16          1HB       TYR  16  -0.390  -4.967 -10.087
  258    HD1  TYR  16           HD1      TYR  16  -1.252  -8.535 -10.451
  259    HD2  TYR  16           HD2      TYR  16   1.596  -5.464 -11.413
  260    HE1  TYR  16           HE1      TYR  16  -0.227 -10.019 -12.155
  261    HE2  TYR  16           HE2      TYR  16   2.621  -6.947 -13.117
  262    HH   TYR  16           HH       TYR  16   1.564  -9.090 -14.562
  263    H    LEU  17           H        LEU  17   2.309  -5.053  -8.963
  264    HA   LEU  17           HA       LEU  17   3.929  -7.364  -9.585
  265   1HB   LEU  17          2HB       LEU  17   4.214  -4.635  -9.885
  266   2HB   LEU  17          1HB       LEU  17   5.311  -4.962  -8.543
  267    HG   LEU  17           HG       LEU  17   5.940  -7.015 -10.205
  268   1HD1  LEU  17          1HD1      LEU  17   4.346  -5.354 -11.795
  269   2HD1  LEU  17          2HD1      LEU  17   5.432  -6.620 -12.369
  270   3HD1  LEU  17          3HD1      LEU  17   6.000  -4.954 -12.260
  271   1HD2  LEU  17          1HD2      LEU  17   7.971  -5.994 -10.180
  272   2HD2  LEU  17          2HD2      LEU  17   7.178  -4.788  -9.168
  273   3HD2  LEU  17          3HD2      LEU  17   7.335  -4.517 -10.904
  274    H    VAL  18           H        VAL  18   3.006  -5.601  -6.810
  275    HA   VAL  18           HA       VAL  18   4.921  -6.752  -4.947
  276    HB   VAL  18           HB       VAL  18   2.816  -4.703  -5.079
  277   1HG1  VAL  18          1HG1      VAL  18   2.892  -4.769  -2.417
  278   2HG1  VAL  18          2HG1      VAL  18   3.006  -6.501  -2.730
  279   3HG1  VAL  18          3HG1      VAL  18   1.636  -5.580  -3.348
  280   1HG2  VAL  18          1HG2      VAL  18   5.524  -5.097  -3.957
  281   2HG2  VAL  18          2HG2      VAL  18   4.509  -3.849  -3.232
  282   3HG2  VAL  18          3HG2      VAL  18   4.887  -3.789  -4.955
  283    H    CYS  19           H        CYS  19   1.431  -6.795  -5.321
  284    HA   CYS  19           HA       CYS  19   0.676  -8.737  -3.473
  285   1HB   CYS  19          2HB       CYS  19  -0.490  -8.563  -6.263
  286   2HB   CYS  19          1HB       CYS  19  -1.318  -9.034  -4.786
  287    H    GLY  20           H        GLY  20   2.365  -9.096  -6.485
  288   1HA   GLY  20          2HA       GLY  20   3.190 -10.978  -7.597
  289   2HA   GLY  20          1HA       GLY  20   3.376 -11.658  -5.980
  290    H    GLU  21           H        GLU  21   0.463 -10.802  -7.860
  291    HA   GLU  21           HA       GLU  21  -1.248 -12.192  -8.677
  292   1HB   GLU  21          2HB       GLU  21  -0.714 -14.331  -9.237
  293   2HB   GLU  21          1HB       GLU  21   0.908 -13.875  -8.731
  294   1HG   GLU  21          2HG       GLU  21  -0.057 -14.596  -6.333
  295   2HG   GLU  21          1HG       GLU  21  -1.099 -15.595  -7.345
  296    H    ARG  22           H        ARG  22  -0.833 -11.150  -5.824
  297    HA   ARG  22           HA       ARG  22  -2.505 -13.081  -4.313
  298   1HB   ARG  22          2HB       ARG  22  -0.542 -12.081  -3.188
  299   2HB   ARG  22          1HB       ARG  22  -1.234 -10.476  -3.424
  300   1HG   ARG  22          2HG       ARG  22  -3.033 -10.907  -1.951
  301   2HG   ARG  22          1HG       ARG  22  -2.775 -12.651  -2.013
  302   1HD   ARG  22          2HD       ARG  22  -0.503 -12.228  -0.939
  303   2HD   ARG  22          1HD       ARG  22  -1.051 -10.577  -0.648
  304    HE   ARG  22           HE       ARG  22  -2.903 -11.571   0.727
  305   1HH1  ARG  22          1HH2      ARG  22   0.246 -12.733   0.758
  306   2HH1  ARG  22          2HH2      ARG  22  -0.098 -14.150   1.694
  307   1HH2  ARG  22          1HH1      ARG  22  -3.538 -13.713   1.576
  308   2HH2  ARG  22          2HH1      ARG  22  -2.243 -14.706   2.156
  309    H    GLY  23           H        GLY  23  -2.881 -10.301  -6.242
  310   1HA   GLY  23          2HA       GLY  23  -4.976  -9.338  -6.858
  311   2HA   GLY  23          1HA       GLY  23  -5.725 -10.162  -5.490
  312    H    PHE  24           H        PHE  24  -5.823  -7.241  -6.305
  313    HA   PHE  24           HA       PHE  24  -4.879  -6.157  -3.682
  314   1HB   PHE  24          2HB       PHE  24  -4.712  -3.912  -5.021
  315   2HB   PHE  24          1HB       PHE  24  -3.391  -5.071  -5.136
  316    HD1  PHE  24           HD1      PHE  24  -5.583  -3.044  -7.005
  317    HD2  PHE  24           HD2      PHE  24  -3.734  -6.924  -7.042
  318    HE1  PHE  24           HE1      PHE  24  -5.909  -3.180  -9.459
  319    HE2  PHE  24           HE2      PHE  24  -4.065  -7.058  -9.498
  320    HZ   PHE  24           HZ       PHE  24  -5.155  -5.185 -10.704
  321    H    PHE  25           H        PHE  25  -6.042  -3.751  -3.591
  322    HA   PHE  25           HA       PHE  25  -8.885  -4.415  -3.396
  323   1HB   PHE  25          2HB       PHE  25  -7.142  -2.119  -2.588
  324   2HB   PHE  25          1HB       PHE  25  -8.876  -1.836  -2.739
  325    HD1  PHE  25           HD1      PHE  25  -6.282  -3.080  -0.627
  326    HD2  PHE  25           HD2      PHE  25 -10.450  -3.552  -1.560
  327    HE1  PHE  25           HE1      PHE  25  -6.651  -4.164   1.574
  328    HE2  PHE  25           HE2      PHE  25 -10.820  -4.636   0.641
  329    HZ   PHE  25           HZ       PHE  25  -8.921  -4.942   2.208
  330    H    TYR  26           H        TYR  26  -6.818  -2.835  -5.653
  331    HA   TYR  26           HA       TYR  26  -9.015  -1.390  -6.984
  332   1HB   TYR  26          2HB       TYR  26  -6.144  -1.264  -6.976
  333   2HB   TYR  26          1HB       TYR  26  -6.698  -1.505  -8.633
  334    HD1  TYR  26           HD1      TYR  26  -6.810   0.719  -5.693
  335    HD2  TYR  26           HD2      TYR  26  -8.088   0.147  -9.756
  336    HE1  TYR  26           HE1      TYR  26  -7.500   3.099  -5.811
  337    HE2  TYR  26           HE2      TYR  26  -8.776   2.526  -9.875
  338    HH   TYR  26           HH       TYR  26  -9.493   4.345  -7.671
  339    H    THR  27           H        THR  27  -9.685  -4.034  -6.888
  340    HA   THR  27           HA       THR  27  -8.810  -5.350  -9.376
  341    HB   THR  27           HB       THR  27  -9.190  -6.645  -7.270
  342    HG1  THR  27           HG1      THR  27 -10.017  -8.301  -8.364
  343   1HG2  THR  27          1HG2      THR  27 -11.042  -6.264  -6.064
  344   2HG2  THR  27          2HG2      THR  27 -12.027  -6.867  -7.398
  345   3HG2  THR  27          3HG2      THR  27 -11.626  -5.152  -7.303
  346    H    LYS  28           H        LYS  28 -11.173  -3.096  -8.506
  347    HA   LYS  28           HA       LYS  28 -13.090  -2.304  -9.619
  348   1HB   LYS  28          2HB       LYS  28 -12.035  -3.790 -12.035
  349   2HB   LYS  28          1HB       LYS  28 -12.989  -2.308 -12.007
  350   1HG   LYS  28          2HG       LYS  28 -10.076  -2.676 -11.247
  351   2HG   LYS  28          1HG       LYS  28 -10.756  -1.571 -12.436
  352   1HD   LYS  28          2HD       LYS  28 -10.950  -1.351  -9.404
  353   2HD   LYS  28          1HD       LYS  28 -10.128  -0.244 -10.503
  354   1HE   LYS  28          2HE       LYS  28 -12.042   0.849 -11.003
  355   2HE   LYS  28          1HE       LYS  28 -12.946  -0.648 -11.212
  356   1HZ   LYS  28          1HZ       LYS  28 -12.212  -0.069  -8.485
  357   2HZ   LYS  28          2HZ       LYS  28 -13.700  -0.582  -9.126
  358   3HZ   LYS  28          3HZ       LYS  28 -13.275   1.062  -9.169
  359    HA   PRO  29           HA       PRO  29 -15.106  -6.426  -9.243
  360   1HB   PRO  29          2HB       PRO  29 -16.790  -5.664  -7.208
  361   2HB   PRO  29          1HB       PRO  29 -15.165  -6.318  -6.943
  362   1HG   PRO  29          2HG       PRO  29 -16.119  -3.504  -6.694
  363   2HG   PRO  29          1HG       PRO  29 -14.767  -4.307  -5.879
  364   1HD   PRO  29          2HD       PRO  29 -14.566  -2.548  -8.090
  365   2HD   PRO  29          1HD       PRO  29 -13.277  -3.604  -7.474
  366    H    THR  30           H        THR  30 -17.124  -6.941 -10.173
  367    HA   THR  30           HA       THR  30 -18.796  -4.605 -11.014
  368    HB   THR  30           HB       THR  30 -17.996  -5.478 -13.031
  369    HG1  THR  30           HG1      THR  30 -19.993  -5.687 -13.615
  370   1HG2  THR  30          1HG2      THR  30 -16.802  -7.384 -12.000
  371   2HG2  THR  30          2HG2      THR  30 -17.675  -7.878 -13.450
  372   3HG2  THR  30          3HG2      THR  30 -18.330  -8.251 -11.857
  Start of MODEL    3
    1   1H    GLY   1          1H        GLY   1 -10.525   7.633  -3.413
    2   2H    GLY   1          2H        GLY   1  -9.318   7.878  -4.582
    3   3H    GLY   1          3H        GLY   1  -9.027   8.289  -2.959
    4   1HA   GLY   1          1HA       GLY   1  -9.160   5.913  -2.426
    5   2HA   GLY   1          2HA       GLY   1  -9.428   5.512  -4.149
    6    H    ALA   2           H        ALA   2  -7.285   4.498  -4.148
    7    HA   ALA   2           HA       ALA   2  -5.361   4.790  -2.016
    8   1HB   ALA   2          1HB       ALA   2  -5.783   2.974  -4.081
    9   2HB   ALA   2          2HB       ALA   2  -4.417   2.965  -2.966
   10   3HB   ALA   2          3HB       ALA   2  -4.272   3.765  -4.531
   11    H    VAL   3           H        VAL   3  -4.858   7.045  -1.925
   12    HA   VAL   3           HA       VAL   3  -3.061   7.950  -4.134
   13    HB   VAL   3           HB       VAL   3  -5.221   9.552  -2.738
   14   1HG1  VAL   3          1HG1      VAL   3  -3.361  11.027  -2.910
   15   2HG1  VAL   3          2HG1      VAL   3  -4.359  11.382  -4.320
   16   3HG1  VAL   3          3HG1      VAL   3  -2.907  10.395  -4.492
   17   1HG2  VAL   3          1HG2      VAL   3  -4.770   8.497  -5.522
   18   2HG2  VAL   3          2HG2      VAL   3  -5.754   9.940  -5.271
   19   3HG2  VAL   3          3HG2      VAL   3  -6.226   8.411  -4.529
   20    H    GLU   4           H        GLU   4  -4.173   9.052  -0.911
   21    HA   GLU   4           HA       GLU   4  -1.489  10.024  -0.263
   22   1HB   GLU   4          2HB       GLU   4  -3.974   9.752   1.454
   23   2HB   GLU   4          1HB       GLU   4  -2.504  10.611   1.917
   24   1HG   GLU   4          2HG       GLU   4  -2.782  12.162   0.046
   25   2HG   GLU   4          1HG       GLU   4  -4.205  11.276  -0.503
   26    H    GLN   5           H        GLN   5  -2.496   6.982  -0.520
   27    HA   GLN   5           HA       GLN   5  -1.829   5.840   2.044
   28   1HB   GLN   5          2HB       GLN   5  -1.642   4.445  -0.636
   29   2HB   GLN   5          1HB       GLN   5  -1.951   3.718   0.941
   30   1HG   GLN   5          2HG       GLN   5  -3.790   5.649  -0.508
   31   2HG   GLN   5          1HG       GLN   5  -4.045   3.913  -0.338
   32   1HE2  GLN   5          1HE2      GLN   5  -5.441   6.496   0.825
   33   2HE2  GLN   5          2HE2      GLN   5  -5.626   6.108   2.467
   34    H    CYS   6           H        CYS   6  -0.020   5.841  -1.055
   35    HA   CYS   6           HA       CYS   6   2.486   5.974   0.556
   36   1HB   CYS   6          2HB       CYS   6   1.718   3.945  -1.519
   37   2HB   CYS   6          1HB       CYS   6   3.408   4.419  -1.359
   38    H    CYS   7           H        CYS   7   0.656   7.545  -1.582
   39    HA   CYS   7           HA       CYS   7   2.679   8.176  -3.594
   40   1HB   CYS   7          2HB       CYS   7   0.149   8.169  -3.949
   41   2HB   CYS   7          1HB       CYS   7   0.145   9.716  -3.109
   42    H    THR   8           H        THR   8   3.586  10.328  -3.881
   43    HA   THR   8           HA       THR   8   4.700  12.226  -3.072
   44    HB   THR   8           HB       THR   8   3.433  13.720  -1.800
   45    HG1  THR   8           HG1      THR   8   2.030  11.569  -0.621
   46   1HG2  THR   8          1HG2      THR   8   1.543  13.731  -3.032
   47   2HG2  THR   8          2HG2      THR   8   0.983  12.223  -2.311
   48   3HG2  THR   8          3HG2      THR   8   2.081  12.185  -3.690
   49    H    SER   9           H        SER   9   5.659   9.749  -2.219
   50    HA   SER   9           HA       SER   9   7.427  10.293  -0.172
   51   1HB   SER   9          2HB       SER   9   4.741   9.979   0.871
   52   2HB   SER   9          1HB       SER   9   5.785   8.704   1.492
   53    HG   SER   9           HG       SER   9   5.973  10.495   2.817
   54    H    ILE  10           H        ILE  10   7.998   7.997   1.024
   55    HA   ILE  10           HA       ILE  10   7.401   5.850  -0.948
   56    HB   ILE  10           HB       ILE  10  10.138   5.740   0.112
   57   1HG1  ILE  10          2HG1      ILE  10   9.666   8.262  -0.349
   58   2HG1  ILE  10          1HG1      ILE  10  11.075   7.536  -1.117
   59   1HG2  ILE  10          1HG2      ILE  10  10.424   5.432  -2.474
   60   2HG2  ILE  10          2HG2      ILE  10   8.663   5.351  -2.480
   61   3HG2  ILE  10          3HG2      ILE  10   9.597   4.180  -1.549
   62   1HD1  ILE  10          1HD1      ILE  10   8.429   7.529  -2.544
   63   2HD1  ILE  10          2HD1      ILE  10  10.054   7.445  -3.216
   64   3HD1  ILE  10          3HD1      ILE  10   9.445   8.971  -2.578
   65    H    CYS  11           H        CYS  11   6.011   4.927   0.616
   66    HA   CYS  11           HA       CYS  11   6.732   4.342   3.310
   67   1HB   CYS  11          2HB       CYS  11   5.002   2.445   3.004
   68   2HB   CYS  11          1HB       CYS  11   4.435   4.094   2.745
   69    H    SER  12           H        SER  12   6.067   1.320   1.912
   70    HA   SER  12           HA       SER  12   8.823   0.596   1.291
   71   1HB   SER  12          2HB       SER  12   7.740   0.228   3.977
   72   2HB   SER  12          1HB       SER  12   8.244  -1.297   3.256
   73    HG   SER  12           HG       SER  12   9.804   0.364   4.388
   74    H    LEU  13           H        LEU  13   8.539  -0.756  -0.416
   75    HA   LEU  13           HA       LEU  13   6.263  -1.827  -1.476
   76   1HB   LEU  13          2HB       LEU  13   8.780  -2.175  -2.172
   77   2HB   LEU  13          1HB       LEU  13   8.608  -3.695  -1.290
   78    HG   LEU  13           HG       LEU  13   6.279  -3.511  -2.816
   79   1HD1  LEU  13          1HD1      LEU  13   8.422  -2.012  -4.074
   80   2HD1  LEU  13          2HD1      LEU  13   6.744  -2.193  -4.582
   81   3HD1  LEU  13          3HD1      LEU  13   7.946  -3.390  -5.066
   82   1HD2  LEU  13          1HD2      LEU  13   6.943  -5.634  -3.177
   83   2HD2  LEU  13          2HD2      LEU  13   8.494  -5.246  -2.436
   84   3HD2  LEU  13          3HD2      LEU  13   8.279  -5.068  -4.179
   85    H    TYR  14           H        TYR  14   7.889  -3.037   1.406
   86    HA   TYR  14           HA       TYR  14   6.488  -5.513   1.645
   87   1HB   TYR  14          2HB       TYR  14   7.993  -3.712   3.459
   88   2HB   TYR  14          1HB       TYR  14   6.823  -4.775   4.241
   89    HD1  TYR  14           HD1      TYR  14  10.099  -4.546   2.835
   90    HD2  TYR  14           HD2      TYR  14   6.866  -7.286   3.546
   91    HE1  TYR  14           HE1      TYR  14  11.661  -6.455   2.578
   92    HE2  TYR  14           HE2      TYR  14   8.428  -9.198   3.289
   93    HH   TYR  14           HH       TYR  14  11.067  -9.471   3.619
   94    H    GLN  15           H        GLN  15   5.790  -2.428   3.357
   95    HA   GLN  15           HA       GLN  15   3.235  -3.135   4.310
   96   1HB   GLN  15          2HB       GLN  15   4.770  -0.817   4.281
   97   2HB   GLN  15          1HB       GLN  15   3.351  -0.377   3.332
   98   1HG   GLN  15          2HG       GLN  15   1.954  -1.392   5.223
   99   2HG   GLN  15          1HG       GLN  15   3.441  -1.400   6.174
  100   1HE2  GLN  15          1HE2      GLN  15   3.987   0.545   7.214
  101   2HE2  GLN  15          2HE2      GLN  15   3.260   2.045   6.888
  102    H    LEU  16           H        LEU  16   4.263  -1.927   1.187
  103    HA   LEU  16           HA       LEU  16   1.761  -1.473  -0.046
  104   1HB   LEU  16          2HB       LEU  16   4.454  -1.597  -0.826
  105   2HB   LEU  16          1HB       LEU  16   3.649  -2.784  -1.839
  106    HG   LEU  16           HG       LEU  16   3.169   0.180  -1.638
  107   1HD1  LEU  16          1HD1      LEU  16   3.745  -1.837  -3.796
  108   2HD1  LEU  16          2HD1      LEU  16   4.594  -0.335  -3.428
  109   3HD1  LEU  16          3HD1      LEU  16   3.010  -0.286  -4.201
  110   1HD2  LEU  16          1HD2      LEU  16   0.937  -0.556  -1.403
  111   2HD2  LEU  16          2HD2      LEU  16   1.200  -1.959  -2.439
  112   3HD2  LEU  16          3HD2      LEU  16   1.125  -0.342  -3.141
  113    H    GLU  17           H        GLU  17   3.362  -4.408   0.884
  114    HA   GLU  17           HA       GLU  17   1.725  -6.182  -0.747
  115   1HB   GLU  17          2HB       GLU  17   4.037  -6.465   0.787
  116   2HB   GLU  17          1HB       GLU  17   2.816  -7.340   1.712
  117   1HG   GLU  17          2HG       GLU  17   3.160  -9.062   0.293
  118   2HG   GLU  17          1HG       GLU  17   2.316  -8.099  -0.919
  119    H    ASN  18           H        ASN  18   1.381  -4.459   2.204
  120    HA   ASN  18           HA       ASN  18  -0.716  -6.167   3.318
  121   1HB   ASN  18          2HB       ASN  18   0.723  -3.709   4.101
  122   2HB   ASN  18          1HB       ASN  18  -0.960  -3.780   4.628
  123   1HD2  ASN  18          1HD2      ASN  18   0.955  -3.908   6.627
  124   2HD2  ASN  18          2HD2      ASN  18   1.060  -5.485   7.247
  125    H    TYR  19           H        TYR  19  -0.563  -3.887   0.825
  126    HA   TYR  19           HA       TYR  19  -3.393  -3.046   1.177
  127   1HB   TYR  19          2HB       TYR  19  -1.125  -2.169  -0.600
  128   2HB   TYR  19          1HB       TYR  19  -2.781  -1.711  -0.975
  129    HD1  TYR  19           HD1      TYR  19  -0.546   0.193  -0.420
  130    HD2  TYR  19           HD2      TYR  19  -3.384  -1.655   2.224
  131    HE1  TYR  19           HE1      TYR  19  -0.299   2.077   1.154
  132    HE2  TYR  19           HE2      TYR  19  -3.139   0.225   3.800
  133    HH   TYR  19           HH       TYR  19  -0.883   2.098   4.102
  134    H    CYS  20           H        CYS  20  -2.103  -5.739   0.346
  135    HA   CYS  20           HA       CYS  20  -3.427  -6.115  -2.287
  136   1HB   CYS  20          2HB       CYS  20  -1.225  -7.449  -0.766
  137   2HB   CYS  20          1HB       CYS  20  -2.119  -8.380  -1.950
  138    H    ASN  21           H        ASN  21  -3.912  -8.833  -2.127
  139    HA   ASN  21           HA       ASN  21  -6.336  -8.906  -0.541
  140   1HB   ASN  21          2HB       ASN  21  -4.964 -10.654  -2.489
  141   2HB   ASN  21          1HB       ASN  21  -5.900 -11.509  -1.265
  142   1HD2  ASN  21          1HD2      ASN  21  -6.864 -11.650  -3.868
  143   2HD2  ASN  21          2HD2      ASN  21  -8.250 -10.684  -4.038
  144   1H    PHE   1          1H        PHE   1  10.650  -3.798  -8.665
  145   2H    PHE   1          2H        PHE   1   9.290  -2.984  -8.053
  146   3H    PHE   1          3H        PHE   1   9.858  -4.388  -7.286
  147    HA   PHE   1           HA       PHE   1  10.747  -2.833  -5.902
  148   1HB   PHE   1          2HB       PHE   1  12.823  -2.800  -8.106
  149   2HB   PHE   1          1HB       PHE   1  13.096  -2.683  -6.367
  150    HD1  PHE   1           HD1      PHE   1  13.174  -4.874  -9.106
  151    HD2  PHE   1           HD2      PHE   1  12.009  -4.713  -4.972
  152    HE1  PHE   1           HE1      PHE   1  13.337  -7.348  -8.963
  153    HE2  PHE   1           HE2      PHE   1  12.172  -7.185  -4.830
  154    HZ   PHE   1           HZ       PHE   1  12.835  -8.502  -6.825
  155    H    VAL   2           H        VAL   2  10.046  -0.778  -5.568
  156    HA   VAL   2           HA       VAL   2  10.889   1.322  -7.480
  157    HB   VAL   2           HB       VAL   2   8.612   2.301  -7.515
  158   1HG1  VAL   2          1HG1      VAL   2   8.730  -0.598  -8.406
  159   2HG1  VAL   2          2HG1      VAL   2   9.310   0.786  -9.331
  160   3HG1  VAL   2          3HG1      VAL   2   7.588   0.607  -8.998
  161   1HG2  VAL   2          1HG2      VAL   2   7.733  -0.295  -6.222
  162   2HG2  VAL   2          2HG2      VAL   2   6.728   1.102  -6.605
  163   3HG2  VAL   2          3HG2      VAL   2   7.937   1.210  -5.325
  164    H    ASN   3           H        ASN   3  10.882   3.458  -6.480
  165    HA   ASN   3           HA       ASN   3  10.138   3.693  -3.659
  166   1HB   ASN   3          2HB       ASN   3  13.060   3.957  -4.425
  167   2HB   ASN   3          1HB       ASN   3  12.369   4.118  -2.811
  168   1HD2  ASN   3          1HD2      ASN   3  13.802   1.887  -4.965
  169   2HD2  ASN   3          2HD2      ASN   3  13.373   0.462  -4.149
  170    H    GLN   4           H        GLN   4   9.080   5.181  -5.642
  171    HA   GLN   4           HA       GLN   4  10.061   7.855  -5.000
  172   1HB   GLN   4          2HB       GLN   4  10.224   8.409  -7.527
  173   2HB   GLN   4          1HB       GLN   4  11.583   7.573  -6.776
  174   1HG   GLN   4          2HG       GLN   4  10.666   5.408  -7.554
  175   2HG   GLN   4          1HG       GLN   4   9.335   6.263  -8.335
  176   1HE2  GLN   4          1HE2      GLN   4   9.943   7.796 -10.128
  177   2HE2  GLN   4          2HE2      GLN   4  11.367   7.515 -11.007
  178    H    HIS   5           H        HIS   5   8.002   8.383  -4.296
  179    HA   HIS   5           HA       HIS   5   5.744   8.976  -4.443
  180   1HB   HIS   5          2HB       HIS   5   5.870   9.214  -7.400
  181   2HB   HIS   5          1HB       HIS   5   5.244  10.346  -6.207
  182    HD2  HIS   5           HD2      HIS   5   7.156  12.124  -5.111
  183    HE1  HIS   5           HE1      HIS   5  10.317  10.926  -7.651
  184    HE2  HIS   5           HE2      HIS   5   9.567  12.654  -5.930
  185    H    LEU   6           H        LEU   6   4.267   7.446  -4.144
  186    HA   LEU   6           HA       LEU   6   3.753   5.489  -6.320
  187   1HB   LEU   6          2HB       LEU   6   4.629   4.912  -3.731
  188   2HB   LEU   6          1HB       LEU   6   2.891   4.614  -3.674
  189    HG   LEU   6           HG       LEU   6   3.008   3.060  -5.500
  190   1HD1  LEU   6          1HD1      LEU   6   4.505   3.391  -7.145
  191   2HD1  LEU   6          2HD1      LEU   6   5.784   2.855  -6.055
  192   3HD1  LEU   6          3HD1      LEU   6   5.371   4.568  -6.154
  193   1HD2  LEU   6          1HD2      LEU   6   3.741   2.189  -3.301
  194   2HD2  LEU   6          2HD2      LEU   6   5.404   2.620  -3.694
  195   3HD2  LEU   6          3HD2      LEU   6   4.572   1.376  -4.627
  196    H    CYS   7           H        CYS   7   2.023   6.432  -7.243
  197    HA   CYS   7           HA       CYS   7  -0.295   7.185  -5.509
  198   1HB   CYS   7          2HB       CYS   7   0.895   8.330  -7.932
  199   2HB   CYS   7          1HB       CYS   7  -0.842   8.075  -8.100
  200    H    GLY   8           H        GLY   8  -2.435   6.598  -6.437
  201   1HA   GLY   8          2HA       GLY   8  -3.087   4.042  -6.745
  202   2HA   GLY   8          1HA       GLY   8  -3.854   5.220  -7.807
  203    H    SER   9           H        SER   9  -2.174   5.836  -9.716
  204    HA   SER   9           HA       SER   9  -2.032   3.641 -11.450
  205   1HB   SER   9          2HB       SER   9  -1.773   6.012 -12.147
  206   2HB   SER   9          1HB       SER   9  -0.169   6.033 -11.420
  207    HG   SER   9           HG       SER   9  -0.826   4.015 -13.253
  208    H    ASP  10           H        ASP  10   0.957   5.106 -10.123
  209    HA   ASP  10           HA       ASP  10   2.500   2.730 -10.582
  210   1HB   ASP  10          2HB       ASP  10   3.166   4.897  -8.580
  211   2HB   ASP  10          1HB       ASP  10   4.287   3.868  -9.475
  212    H    LEU  11           H        LEU  11   0.426   3.661  -7.974
  213    HA   LEU  11           HA       LEU  11   1.645   1.862  -6.020
  214   1HB   LEU  11          2HB       LEU  11  -0.641   3.727  -6.111
  215   2HB   LEU  11          1HB       LEU  11  -0.908   2.321  -5.117
  216    HG   LEU  11           HG       LEU  11   1.519   4.091  -4.898
  217   1HD1  LEU  11          1HD1      LEU  11  -0.985   3.941  -3.193
  218   2HD1  LEU  11          2HD1      LEU  11  -0.547   5.281  -4.252
  219   3HD1  LEU  11          3HD1      LEU  11   0.436   4.920  -2.833
  220   1HD2  LEU  11          1HD2      LEU  11   1.604   1.627  -4.185
  221   2HD2  LEU  11          2HD2      LEU  11   0.445   2.069  -2.932
  222   3HD2  LEU  11          3HD2      LEU  11   2.040   2.817  -2.961
  223    H    VAL  12           H        VAL  12  -0.798   1.689  -8.504
  224    HA   VAL  12           HA       VAL  12  -1.827  -0.864  -7.512
  225    HB   VAL  12           HB       VAL  12  -2.629   1.115  -9.492
  226   1HG1  VAL  12          1HG1      VAL  12  -2.058  -0.381 -11.243
  227   2HG1  VAL  12          2HG1      VAL  12  -3.776  -0.661 -10.962
  228   3HG1  VAL  12          3HG1      VAL  12  -2.583  -1.789 -10.321
  229   1HG2  VAL  12          1HG2      VAL  12  -3.726  -0.308  -7.392
  230   2HG2  VAL  12          2HG2      VAL  12  -4.495  -1.034  -8.804
  231   3HG2  VAL  12          3HG2      VAL  12  -4.627   0.702  -8.522
  232    H    GLU  13           H        GLU  13  -0.213   0.182 -10.495
  233    HA   GLU  13           HA       GLU  13   0.391  -2.332 -11.563
  234   1HB   GLU  13          2HB       GLU  13   2.338  -0.016 -11.610
  235   2HB   GLU  13          1HB       GLU  13   2.084  -1.246 -12.851
  236   1HG   GLU  13          2HG       GLU  13  -0.448  -0.162 -12.510
  237   2HG   GLU  13          1HG       GLU  13   0.611   1.242 -12.375
  238    H    ALA  14           H        ALA  14   2.134  -0.494  -9.072
  239    HA   ALA  14           HA       ALA  14   4.204  -2.528  -8.760
  240   1HB   ALA  14          1HB       ALA  14   4.447  -0.072  -8.117
  241   2HB   ALA  14          2HB       ALA  14   4.927  -1.214  -6.861
  242   3HB   ALA  14          3HB       ALA  14   3.367  -0.396  -6.760
  243    H    LEU  15           H        LEU  15   1.174  -1.644  -7.140
  244    HA   LEU  15           HA       LEU  15   1.245  -3.491  -4.994
  245   1HB   LEU  15          2HB       LEU  15  -0.835  -2.014  -6.470
  246   2HB   LEU  15          1HB       LEU  15  -1.381  -3.520  -5.751
  247    HG   LEU  15           HG       LEU  15   0.255  -1.587  -4.149
  248   1HD1  LEU  15          1HD1      LEU  15  -1.453  -0.133  -3.887
  249   2HD1  LEU  15          2HD1      LEU  15  -2.609  -1.442  -3.648
  250   3HD1  LEU  15          3HD1      LEU  15  -2.206  -0.910  -5.281
  251   1HD2  LEU  15          1HD2      LEU  15  -1.286  -4.051  -3.735
  252   2HD2  LEU  15          2HD2      LEU  15  -1.645  -2.791  -2.554
  253   3HD2  LEU  15          3HD2      LEU  15   0.011  -3.364  -2.758
  254    H    TYR  16           H        TYR  16   0.445  -3.899  -8.389
  255    HA   TYR  16           HA       TYR  16  -0.475  -6.649  -8.090
  256   1HB   TYR  16          2HB       TYR  16  -1.340  -5.873 -10.077
  257   2HB   TYR  16          1HB       TYR  16  -0.022  -4.731 -10.319
  258    HD1  TYR  16           HD1      TYR  16  -0.403  -8.467 -10.087
  259    HD2  TYR  16           HD2      TYR  16   1.288  -5.129 -12.198
  260    HE1  TYR  16           HE1      TYR  16   0.650 -10.027 -11.705
  261    HE2  TYR  16           HE2      TYR  16   2.338  -6.685 -13.817
  262    HH   TYR  16           HH       TYR  16   2.879  -8.862 -14.188
  263    H    LEU  17           H        LEU  17   2.514  -4.974  -8.860
  264    HA   LEU  17           HA       LEU  17   4.054  -7.361  -9.451
  265   1HB   LEU  17          2HB       LEU  17   4.478  -4.631  -9.679
  266   2HB   LEU  17          1HB       LEU  17   5.496  -5.057  -8.303
  267    HG   LEU  17           HG       LEU  17   5.919  -7.101 -10.157
  268   1HD1  LEU  17          1HD1      LEU  17   6.766  -5.426 -12.060
  269   2HD1  LEU  17          2HD1      LEU  17   5.413  -4.465 -11.464
  270   3HD1  LEU  17          3HD1      LEU  17   5.134  -6.092 -12.082
  271   1HD2  LEU  17          1HD2      LEU  17   7.427  -4.691  -9.199
  272   2HD2  LEU  17          2HD2      LEU  17   8.125  -5.692 -10.474
  273   3HD2  LEU  17          3HD2      LEU  17   7.752  -6.399  -8.902
  274    H    VAL  18           H        VAL  18   2.968  -5.617  -6.722
  275    HA   VAL  18           HA       VAL  18   4.701  -6.883  -4.748
  276    HB   VAL  18           HB       VAL  18   2.726  -4.713  -4.961
  277   1HG1  VAL  18          1HG1      VAL  18   1.365  -5.591  -3.361
  278   2HG1  VAL  18          2HG1      VAL  18   2.580  -4.872  -2.308
  279   3HG1  VAL  18          3HG1      VAL  18   2.633  -6.598  -2.668
  280   1HG2  VAL  18          1HG2      VAL  18   4.576  -3.656  -4.346
  281   2HG2  VAL  18          2HG2      VAL  18   5.387  -5.196  -4.069
  282   3HG2  VAL  18          3HG2      VAL  18   4.476  -4.434  -2.766
  283    H    CYS  19           H        CYS  19   1.232  -6.771  -5.361
  284    HA   CYS  19           HA       CYS  19   0.260  -8.716  -3.624
  285   1HB   CYS  19          2HB       CYS  19  -0.515  -8.016  -6.461
  286   2HB   CYS  19          1HB       CYS  19  -1.353  -9.293  -5.593
  287    H    GLY  20           H        GLY  20   2.177  -9.112  -6.499
  288   1HA   GLY  20          2HA       GLY  20   3.019 -11.027  -7.548
  289   2HA   GLY  20          1HA       GLY  20   3.180 -11.644  -5.901
  290    H    GLU  21           H        GLU  21   0.890 -11.361  -8.604
  291    HA   GLU  21           HA       GLU  21  -0.640 -13.000  -9.371
  292   1HB   GLU  21          2HB       GLU  21   0.958 -14.635  -8.118
  293   2HB   GLU  21          1HB       GLU  21  -0.247 -14.569  -6.833
  294   1HG   GLU  21          2HG       GLU  21  -1.992 -15.302  -8.385
  295   2HG   GLU  21          1HG       GLU  21  -0.837 -15.292  -9.719
  296    H    ARG  22           H        ARG  22  -0.791 -12.685  -5.806
  297    HA   ARG  22           HA       ARG  22  -3.586 -12.853  -5.542
  298   1HB   ARG  22          2HB       ARG  22  -1.363 -11.736  -3.940
  299   2HB   ARG  22          1HB       ARG  22  -2.959 -11.074  -3.577
  300   1HG   ARG  22          2HG       ARG  22  -3.729 -13.567  -3.573
  301   2HG   ARG  22          1HG       ARG  22  -2.012 -13.926  -3.381
  302   1HD   ARG  22          2HD       ARG  22  -1.910 -12.549  -1.367
  303   2HD   ARG  22          1HD       ARG  22  -3.595 -12.072  -1.577
  304    HE   ARG  22           HE       ARG  22  -3.966 -14.693  -1.396
  305   1HH1  ARG  22          1HH2      ARG  22  -1.114 -15.106  -0.514
  306   2HH1  ARG  22          2HH2      ARG  22  -1.272 -15.081   1.211
  307   1HH2  ARG  22          1HH1      ARG  22  -4.417 -13.630   1.171
  308   2HH2  ARG  22          2HH1      ARG  22  -3.140 -14.248   2.163
  309    H    GLY  23           H        GLY  23  -4.911 -10.818  -4.721
  310   1HA   GLY  23          2HA       GLY  23  -4.440  -8.567  -6.634
  311   2HA   GLY  23          1HA       GLY  23  -6.051  -9.240  -6.379
  312    H    PHE  24           H        PHE  24  -5.596  -6.519  -5.897
  313    HA   PHE  24           HA       PHE  24  -5.481  -6.339  -2.912
  314   1HB   PHE  24          2HB       PHE  24  -5.162  -3.866  -3.354
  315   2HB   PHE  24          1HB       PHE  24  -3.852  -4.885  -3.946
  316    HD1  PHE  24           HD1      PHE  24  -7.142  -3.457  -5.069
  317    HD2  PHE  24           HD2      PHE  24  -3.163  -4.662  -6.152
  318    HE1  PHE  24           HE1      PHE  24  -7.511  -2.617  -7.378
  319    HE2  PHE  24           HE2      PHE  24  -3.530  -3.821  -8.459
  320    HZ   PHE  24           HZ       PHE  24  -5.708  -2.799  -9.071
  321    H    PHE  25           H        PHE  25  -6.823  -4.046  -2.427
  322    HA   PHE  25           HA       PHE  25  -9.598  -4.715  -3.276
  323   1HB   PHE  25          2HB       PHE  25  -9.075  -2.682  -1.156
  324   2HB   PHE  25          1HB       PHE  25 -10.357  -3.888  -1.258
  325    HD1  PHE  25           HD1      PHE  25  -6.943  -3.192  -0.148
  326    HD2  PHE  25           HD2      PHE  25  -9.916  -6.254  -0.649
  327    HE1  PHE  25           HE1      PHE  25  -5.651  -4.689   1.350
  328    HE2  PHE  25           HE2      PHE  25  -8.623  -7.754   0.846
  329    HZ   PHE  25           HZ       PHE  25  -6.491  -6.971   1.847
  330    H    TYR  26           H        TYR  26  -7.558  -1.876  -2.683
  331    HA   TYR  26           HA       TYR  26  -7.596   0.262  -3.655
  332   1HB   TYR  26          2HB       TYR  26  -6.906  -1.286  -5.560
  333   2HB   TYR  26          1HB       TYR  26  -8.581  -1.209  -6.107
  334    HD1  TYR  26           HD1      TYR  26  -5.925   1.160  -4.895
  335    HD2  TYR  26           HD2      TYR  26  -9.067   0.387  -7.725
  336    HE1  TYR  26           HE1      TYR  26  -5.465   3.333  -5.999
  337    HE2  TYR  26           HE2      TYR  26  -8.606   2.561  -8.830
  338    HH   TYR  26           HH       TYR  26  -6.904   4.191  -9.041
  339    H    THR  27           H        THR  27 -10.091  -0.622  -2.335
  340    HA   THR  27           HA       THR  27 -11.835   1.438  -3.457
  341    HB   THR  27           HB       THR  27 -13.497  -0.900  -3.251
  342    HG1  THR  27           HG1      THR  27 -12.430  -1.744  -5.310
  343   1HG2  THR  27          1HG2      THR  27 -12.744   0.582  -5.767
  344   2HG2  THR  27          2HG2      THR  27 -13.760   1.323  -4.533
  345   3HG2  THR  27          3HG2      THR  27 -14.294  -0.147  -5.345
  346    H    LYS  28           H        LYS  28 -13.318   2.167  -1.920
  347    HA   LYS  28           HA       LYS  28 -12.823   1.377   0.824
  348   1HB   LYS  28          2HB       LYS  28 -15.087   3.116  -0.197
  349   2HB   LYS  28          1HB       LYS  28 -14.407   3.100   1.425
  350   1HG   LYS  28          2HG       LYS  28 -12.901   3.911  -1.100
  351   2HG   LYS  28          1HG       LYS  28 -13.547   5.031   0.090
  352   1HD   LYS  28          2HD       LYS  28 -11.353   2.969   0.597
  353   2HD   LYS  28          1HD       LYS  28 -11.120   4.710   0.446
  354   1HE   LYS  28          2HE       LYS  28 -13.069   3.678   2.491
  355   2HE   LYS  28          1HE       LYS  28 -11.344   3.621   2.836
  356   1HZ   LYS  28          1HZ       LYS  28 -12.291   6.119   1.725
  357   2HZ   LYS  28          2HZ       LYS  28 -11.215   5.835   3.010
  358   3HZ   LYS  28          3HZ       LYS  28 -12.892   5.755   3.269
  359    HA   PRO  29           HA       PRO  29 -17.193  -0.533   0.475
  360   1HB   PRO  29          2HB       PRO  29 -18.189  -0.950  -2.052
  361   2HB   PRO  29          1HB       PRO  29 -18.485   0.526  -1.116
  362   1HG   PRO  29          2HG       PRO  29 -16.681   0.114  -3.451
  363   2HG   PRO  29          1HG       PRO  29 -17.462   1.600  -2.886
  364   1HD   PRO  29          2HD       PRO  29 -14.754   0.870  -2.476
  365   2HD   PRO  29          1HD       PRO  29 -15.613   2.203  -1.678
  366    H    THR  30           H        THR  30 -17.871  -2.825  -0.006
  367    HA   THR  30           HA       THR  30 -16.281  -4.481  -1.766
  368    HB   THR  30           HB       THR  30 -14.519  -4.295  -0.182
  369    HG1  THR  30           HG1      THR  30 -14.536  -6.390   0.791
  370   1HG2  THR  30          1HG2      THR  30 -16.773  -4.162   1.729
  371   2HG2  THR  30          2HG2      THR  30 -15.212  -3.340   1.767
  372   3HG2  THR  30          3HG2      THR  30 -15.342  -5.014   2.307
  Start of MODEL    4
    1   1H    GLY   1          1H        GLY   1  -7.247  10.710   2.293
    2   2H    GLY   1          2H        GLY   1  -6.962  11.356   0.748
    3   3H    GLY   1          3H        GLY   1  -5.929  10.161   1.373
    4   1HA   GLY   1          1HA       GLY   1  -8.200   8.850   1.401
    5   2HA   GLY   1          2HA       GLY   1  -8.583   9.953   0.046
    6    H    ALA   2           H        ALA   2  -8.169   8.158  -1.456
    7    HA   ALA   2           HA       ALA   2  -6.411   5.898  -0.601
    8   1HB   ALA   2          1HB       ALA   2  -9.004   5.919  -1.692
    9   2HB   ALA   2          2HB       ALA   2  -7.963   4.512  -1.468
   10   3HB   ALA   2          3HB       ALA   2  -7.951   5.384  -3.001
   11    H    VAL   3           H        VAL   3  -4.616   7.453  -1.277
   12    HA   VAL   3           HA       VAL   3  -3.668   6.709  -3.912
   13    HB   VAL   3           HB       VAL   3  -4.813   9.455  -3.445
   14   1HG1  VAL   3          1HG1      VAL   3  -3.477  10.279  -5.378
   15   2HG1  VAL   3          2HG1      VAL   3  -2.556   8.775  -5.356
   16   3HG1  VAL   3          3HG1      VAL   3  -2.463   9.886  -3.990
   17   1HG2  VAL   3          1HG2      VAL   3  -5.048   8.794  -6.101
   18   2HG2  VAL   3          2HG2      VAL   3  -6.269   8.457  -4.873
   19   3HG2  VAL   3          3HG2      VAL   3  -5.108   7.210  -5.328
   20    H    GLU   4           H        GLU   4  -3.319   9.340  -1.520
   21    HA   GLU   4           HA       GLU   4  -0.490   9.570  -1.736
   22   1HB   GLU   4          2HB       GLU   4  -1.938  10.044   0.862
   23   2HB   GLU   4          1HB       GLU   4  -0.605  10.958   0.154
   24   1HG   GLU   4          2HG       GLU   4  -2.268  11.505  -1.758
   25   2HG   GLU   4          1HG       GLU   4  -3.515  10.972  -0.632
   26    H    GLN   5           H        GLN   5  -0.172   9.203   1.332
   27    HA   GLN   5           HA       GLN   5   0.462   7.494   2.816
   28   1HB   GLN   5          2HB       GLN   5  -0.511   5.488   0.768
   29   2HB   GLN   5          1HB       GLN   5  -0.306   5.255   2.502
   30   1HG   GLN   5          2HG       GLN   5  -2.209   7.324   1.403
   31   2HG   GLN   5          1HG       GLN   5  -2.707   5.652   1.659
   32   1HE2  GLN   5          1HE2      GLN   5  -1.549   4.943   4.050
   33   2HE2  GLN   5          2HE2      GLN   5  -2.047   5.980   5.298
   34    H    CYS   6           H        CYS   6   0.964   5.818  -0.311
   35    HA   CYS   6           HA       CYS   6   3.873   5.814   0.341
   36   1HB   CYS   6          2HB       CYS   6   2.159   4.054  -1.419
   37   2HB   CYS   6          1HB       CYS   6   3.913   4.088  -1.582
   38    H    CYS   7           H        CYS   7   1.664   7.509  -1.518
   39    HA   CYS   7           HA       CYS   7   3.375   7.821  -3.854
   40   1HB   CYS   7          2HB       CYS   7   0.875   7.981  -3.964
   41   2HB   CYS   7          1HB       CYS   7   0.997   9.511  -3.099
   42    H    THR   8           H        THR   8   4.659   9.615  -4.353
   43    HA   THR   8           HA       THR   8   5.955  11.529  -3.926
   44    HB   THR   8           HB       THR   8   4.963  13.283  -2.786
   45    HG1  THR   8           HG1      THR   8   3.455  11.702  -1.062
   46   1HG2  THR   8          1HG2      THR   8   3.293  11.947  -4.332
   47   2HG2  THR   8          2HG2      THR   8   2.706  13.283  -3.340
   48   3HG2  THR   8          3HG2      THR   8   2.470  11.619  -2.807
   49    H    SER   9           H        SER   9   6.833   9.110  -2.926
   50    HA   SER   9           HA       SER   9   8.846   9.648  -1.145
   51   1HB   SER   9          2HB       SER   9   6.222   9.479   0.242
   52   2HB   SER   9          1HB       SER   9   7.542   8.573   0.978
   53    HG   SER   9           HG       SER   9   8.383  10.391   1.590
   54    H    ILE  10           H        ILE  10   9.342   7.503   0.280
   55    HA   ILE  10           HA       ILE  10   8.416   5.180  -1.354
   56    HB   ILE  10           HB       ILE  10  11.023   4.652  -0.283
   57   1HG1  ILE  10          2HG1      ILE  10  11.066   7.255  -0.443
   58   2HG1  ILE  10          1HG1      ILE  10  12.380   6.358  -1.200
   59   1HG2  ILE  10          1HG2      ILE  10   9.596   4.710  -2.891
   60   2HG2  ILE  10          2HG2      ILE  10  10.541   3.416  -2.153
   61   3HG2  ILE  10          3HG2      ILE  10  11.358   4.754  -2.961
   62   1HD1  ILE  10          1HD1      ILE  10  11.319   8.205  -2.621
   63   2HD1  ILE  10          2HD1      ILE  10   9.897   7.165  -2.725
   64   3HD1  ILE  10          3HD1      ILE  10  11.440   6.615  -3.372
   65    H    CYS  11           H        CYS  11   6.890   4.636   0.276
   66    HA   CYS  11           HA       CYS  11   7.519   4.353   3.049
   67   1HB   CYS  11          2HB       CYS  11   5.525   2.739   3.002
   68   2HB   CYS  11          1HB       CYS  11   5.206   4.371   2.416
   69    H    SER  12           H        SER  12   6.418   1.291   2.226
   70    HA   SER  12           HA       SER  12   9.122   0.164   1.818
   71   1HB   SER  12          2HB       SER  12   8.844   0.228   4.268
   72   2HB   SER  12          1HB       SER  12   7.307  -0.621   4.122
   73    HG   SER  12           HG       SER  12   9.909  -1.545   3.475
   74    H    LEU  13           H        LEU  13   8.690  -0.923  -0.065
   75    HA   LEU  13           HA       LEU  13   6.376  -1.826  -1.182
   76   1HB   LEU  13          2HB       LEU  13   8.880  -2.260  -1.872
   77   2HB   LEU  13          1HB       LEU  13   8.613  -3.822  -1.092
   78    HG   LEU  13           HG       LEU  13   6.402  -3.825  -2.496
   79   1HD1  LEU  13          1HD1      LEU  13   6.893  -1.429  -3.260
   80   2HD1  LEU  13          2HD1      LEU  13   6.450  -2.576  -4.524
   81   3HD1  LEU  13          3HD1      LEU  13   8.140  -2.128  -4.293
   82   1HD2  LEU  13          1HD2      LEU  13   7.449  -5.373  -3.797
   83   2HD2  LEU  13          2HD2      LEU  13   8.849  -5.031  -2.779
   84   3HD2  LEU  13          3HD2      LEU  13   8.672  -4.224  -4.339
   85    H    TYR  14           H        TYR  14   7.922  -3.298   1.632
   86    HA   TYR  14           HA       TYR  14   6.373  -5.692   1.713
   87   1HB   TYR  14          2HB       TYR  14   7.944  -4.095   3.671
   88   2HB   TYR  14          1HB       TYR  14   6.729  -5.182   4.347
   89    HD1  TYR  14           HD1      TYR  14  10.055  -4.964   3.160
   90    HD2  TYR  14           HD2      TYR  14   6.664  -7.601   3.273
   91    HE1  TYR  14           HE1      TYR  14  11.549  -6.902   2.746
   92    HE2  TYR  14           HE2      TYR  14   8.156  -9.538   2.857
   93    HH   TYR  14           HH       TYR  14  11.096  -9.741   3.392
   94    H    GLN  15           H        GLN  15   5.829  -2.607   3.471
   95    HA   GLN  15           HA       GLN  15   3.244  -3.240   4.439
   96   1HB   GLN  15          2HB       GLN  15   4.627  -1.194   5.039
   97   2HB   GLN  15          1HB       GLN  15   4.128  -0.498   3.499
   98   1HG   GLN  15          2HG       GLN  15   2.001  -0.101   4.218
   99   2HG   GLN  15          1HG       GLN  15   1.935  -1.591   5.160
  100   1HE2  GLN  15          1HE2      GLN  15   3.889   1.456   5.262
  101   2HE2  GLN  15          2HE2      GLN  15   3.734   1.664   6.940
  102    H    LEU  16           H        LEU  16   4.369  -2.160   1.328
  103    HA   LEU  16           HA       LEU  16   1.898  -1.443   0.119
  104   1HB   LEU  16          2HB       LEU  16   4.543  -1.635  -0.656
  105   2HB   LEU  16          1HB       LEU  16   3.778  -2.863  -1.644
  106    HG   LEU  16           HG       LEU  16   3.295   0.107  -1.584
  107   1HD1  LEU  16          1HD1      LEU  16   3.374  -0.219  -4.045
  108   2HD1  LEU  16          2HD1      LEU  16   3.584  -1.954  -3.795
  109   3HD1  LEU  16          3HD1      LEU  16   4.833  -0.829  -3.261
  110   1HD2  LEU  16          1HD2      LEU  16   1.054  -0.709  -1.315
  111   2HD2  LEU  16          2HD2      LEU  16   1.337  -2.040  -2.436
  112   3HD2  LEU  16          3HD2      LEU  16   1.256  -0.383  -3.033
  113    H    GLU  17           H        GLU  17   3.280  -4.506   0.988
  114    HA   GLU  17           HA       GLU  17   1.551  -6.124  -0.707
  115   1HB   GLU  17          2HB       GLU  17   3.817  -6.610   0.837
  116   2HB   GLU  17          1HB       GLU  17   2.529  -7.418   1.730
  117   1HG   GLU  17          2HG       GLU  17   2.532  -7.802  -1.218
  118   2HG   GLU  17          1HG       GLU  17   3.828  -8.594  -0.320
  119    H    ASN  18           H        ASN  18   1.355  -4.619   2.412
  120    HA   ASN  18           HA       ASN  18  -0.910  -6.189   3.349
  121   1HB   ASN  18          2HB       ASN  18   0.333  -3.584   4.258
  122   2HB   ASN  18          1HB       ASN  18  -1.095  -4.273   5.030
  123   1HD2  ASN  18          1HD2      ASN  18   1.208  -4.031   6.591
  124   2HD2  ASN  18          2HD2      ASN  18   1.887  -5.562   6.864
  125    H    TYR  19           H        TYR  19  -0.573  -3.908   0.927
  126    HA   TYR  19           HA       TYR  19  -3.240  -2.678   1.344
  127   1HB   TYR  19          2HB       TYR  19  -0.925  -2.240  -0.503
  128   2HB   TYR  19          1HB       TYR  19  -2.514  -1.651  -0.981
  129    HD1  TYR  19           HD1      TYR  19   0.031  -1.566   1.730
  130    HD2  TYR  19           HD2      TYR  19  -3.376   0.349  -0.050
  131    HE1  TYR  19           HE1      TYR  19   0.384   0.401   3.188
  132    HE2  TYR  19           HE2      TYR  19  -3.030   2.318   1.408
  133    HH   TYR  19           HH       TYR  19  -1.680   2.497   3.979
  134    H    CYS  20           H        CYS  20  -2.672  -5.602   0.718
  135    HA   CYS  20           HA       CYS  20  -4.376  -5.787  -1.725
  136   1HB   CYS  20          2HB       CYS  20  -1.765  -6.942  -1.120
  137   2HB   CYS  20          1HB       CYS  20  -2.944  -8.105  -1.700
  138    H    ASN  21           H        ASN  21  -4.768  -8.485  -1.744
  139    HA   ASN  21           HA       ASN  21  -6.737  -8.850   0.348
  140   1HB   ASN  21          2HB       ASN  21  -5.824 -10.287  -2.067
  141   2HB   ASN  21          1HB       ASN  21  -6.441 -11.325  -0.783
  142   1HD2  ASN  21          1HD2      ASN  21  -7.581 -10.141  -3.510
  143   2HD2  ASN  21          2HD2      ASN  21  -9.145  -9.658  -3.062
  144   1H    PHE   1          1H        PHE   1   7.921  -0.601 -11.736
  145   2H    PHE   1          2H        PHE   1   6.923   0.426 -10.821
  146   3H    PHE   1          3H        PHE   1   6.625  -1.247 -10.852
  147    HA   PHE   1           HA       PHE   1   7.670  -0.663  -8.778
  148   1HB   PHE   1          2HB       PHE   1   8.261  -2.842  -9.583
  149   2HB   PHE   1          1HB       PHE   1   9.375  -2.172 -10.772
  150    HD1  PHE   1           HD1      PHE   1   8.835  -1.544  -7.107
  151    HD2  PHE   1           HD2      PHE   1  11.581  -2.685 -10.210
  152    HE1  PHE   1           HE1      PHE   1  10.675  -1.635  -5.446
  153    HE2  PHE   1           HE2      PHE   1  13.421  -2.776  -8.548
  154    HZ   PHE   1           HZ       PHE   1  12.968  -2.251  -6.166
  155    H    VAL   2           H        VAL   2   8.667   1.062  -7.887
  156    HA   VAL   2           HA       VAL   2  11.251   1.977  -8.909
  157    HB   VAL   2           HB       VAL   2  10.305   4.407  -8.986
  158   1HG1  VAL   2          1HG1      VAL   2   9.960   4.206 -11.355
  159   2HG1  VAL   2          2HG1      VAL   2   9.476   2.516 -11.204
  160   3HG1  VAL   2          3HG1      VAL   2  11.153   2.983 -10.918
  161   1HG2  VAL   2          1HG2      VAL   2   7.945   2.943  -8.421
  162   2HG2  VAL   2          2HG2      VAL   2   7.801   3.485 -10.093
  163   3HG2  VAL   2          3HG2      VAL   2   8.071   4.660  -8.806
  164    H    ASN   3           H        ASN   3  12.268   3.478  -7.381
  165    HA   ASN   3           HA       ASN   3  10.999   3.332  -4.680
  166   1HB   ASN   3          2HB       ASN   3  13.128   2.097  -4.847
  167   2HB   ASN   3          1HB       ASN   3  13.932   3.555  -5.430
  168   1HD2  ASN   3          1HD2      ASN   3  12.489   2.034  -2.569
  169   2HD2  ASN   3          2HD2      ASN   3  13.094   3.158  -1.451
  170    H    GLN   4           H        GLN   4   9.978   5.358  -5.986
  171    HA   GLN   4           HA       GLN   4  11.347   7.708  -4.823
  172   1HB   GLN   4          2HB       GLN   4  10.892   7.217  -7.736
  173   2HB   GLN   4          1HB       GLN   4  10.655   8.858  -7.132
  174   1HG   GLN   4          2HG       GLN   4  13.123   7.393  -6.290
  175   2HG   GLN   4          1HG       GLN   4  13.052   8.028  -7.935
  176   1HE2  GLN   4          1HE2      GLN   4  14.907   9.423  -6.849
  177   2HE2  GLN   4          2HE2      GLN   4  14.406  10.880  -6.135
  178    H    HIS   5           H        HIS   5   8.657   7.294  -7.137
  179    HA   HIS   5           HA       HIS   5   6.855   8.406  -5.024
  180   1HB   HIS   5          2HB       HIS   5   6.173   8.916  -7.871
  181   2HB   HIS   5          1HB       HIS   5   5.957   9.949  -6.460
  182    HD2  HIS   5           HD2      HIS   5   8.378   9.545  -9.398
  183    HE1  HIS   5           HE1      HIS   5  10.291  12.057  -6.584
  184    HE2  HIS   5           HE2      HIS   5  10.376  11.157  -8.970
  185    H    LEU   6           H        LEU   6   4.816   7.483  -4.905
  186    HA   LEU   6           HA       LEU   6   4.107   5.376  -6.849
  187   1HB   LEU   6          2HB       LEU   6   5.150   4.831  -4.285
  188   2HB   LEU   6          1HB       LEU   6   3.419   4.559  -4.151
  189    HG   LEU   6           HG       LEU   6   3.966   2.482  -4.909
  190   1HD1  LEU   6          1HD1      LEU   6   2.789   3.727  -6.853
  191   2HD1  LEU   6          2HD1      LEU   6   3.573   2.187  -7.201
  192   3HD1  LEU   6          3HD1      LEU   6   4.372   3.698  -7.630
  193   1HD2  LEU   6          1HD2      LEU   6   6.057   2.432  -6.637
  194   2HD2  LEU   6          2HD2      LEU   6   6.227   2.307  -4.887
  195   3HD2  LEU   6          3HD2      LEU   6   6.455   3.862  -5.686
  196    H    CYS   7           H        CYS   7   2.264   6.397  -7.600
  197    HA   CYS   7           HA       CYS   7   0.215   7.147  -5.548
  198   1HB   CYS   7          2HB       CYS   7   1.033   8.375  -8.101
  199   2HB   CYS   7          1HB       CYS   7  -0.710   8.162  -7.953
  200    H    GLY   8           H        GLY   8  -2.005   6.529  -6.074
  201   1HA   GLY   8          2HA       GLY   8  -2.702   4.000  -6.436
  202   2HA   GLY   8          1HA       GLY   8  -3.644   5.227  -7.275
  203    H    SER   9           H        SER   9  -2.381   5.964  -9.422
  204    HA   SER   9           HA       SER   9  -2.540   3.908 -11.289
  205   1HB   SER   9          2HB       SER   9  -0.777   5.376 -12.578
  206   2HB   SER   9          1HB       SER   9  -2.382   6.022 -12.245
  207    HG   SER   9           HG       SER   9  -0.884   7.531 -11.590
  208    H    ASP  10           H        ASP  10   0.625   5.182 -10.145
  209    HA   ASP  10           HA       ASP  10   1.992   2.790 -11.073
  210   1HB   ASP  10          2HB       ASP  10   3.063   4.890  -9.170
  211   2HB   ASP  10          1HB       ASP  10   3.994   3.803 -10.199
  212    H    LEU  11           H        LEU  11   0.533   3.778  -8.069
  213    HA   LEU  11           HA       LEU  11   1.936   1.912  -6.353
  214   1HB   LEU  11          2HB       LEU  11  -0.369   3.741  -6.151
  215   2HB   LEU  11          1HB       LEU  11  -0.479   2.327  -5.132
  216    HG   LEU  11           HG       LEU  11   1.937   4.116  -5.239
  217   1HD1  LEU  11          1HD1      LEU  11  -0.002   5.329  -4.334
  218   2HD1  LEU  11          2HD1      LEU  11   1.133   4.943  -3.040
  219   3HD1  LEU  11          3HD1      LEU  11  -0.337   3.988  -3.237
  220   1HD2  LEU  11          1HD2      LEU  11   2.783   2.817  -3.493
  221   2HD2  LEU  11          2HD2      LEU  11   1.998   1.608  -4.509
  222   3HD2  LEU  11          3HD2      LEU  11   1.190   2.199  -3.057
  223    H    VAL  12           H        VAL  12  -0.755   1.712  -8.535
  224    HA   VAL  12           HA       VAL  12  -1.726  -0.804  -7.448
  225    HB   VAL  12           HB       VAL  12  -2.437   1.033  -9.673
  226   1HG1  VAL  12          1HG1      VAL  12  -4.016  -0.936 -10.481
  227   2HG1  VAL  12          2HG1      VAL  12  -2.703  -1.945  -9.873
  228   3HG1  VAL  12          3HG1      VAL  12  -2.390  -0.762 -11.143
  229   1HG2  VAL  12          1HG2      VAL  12  -3.567   0.880  -7.419
  230   2HG2  VAL  12          2HG2      VAL  12  -4.152  -0.715  -7.896
  231   3HG2  VAL  12          3HG2      VAL  12  -4.654   0.715  -8.798
  232    H    GLU  13           H        GLU  13  -0.216   0.137 -10.508
  233    HA   GLU  13           HA       GLU  13   0.311  -2.413 -11.540
  234   1HB   GLU  13          2HB       GLU  13   2.206  -0.069 -11.785
  235   2HB   GLU  13          1HB       GLU  13   1.931  -1.364 -12.954
  236   1HG   GLU  13          2HG       GLU  13  -0.589  -0.480 -12.753
  237   2HG   GLU  13          1HG       GLU  13   0.244   1.017 -12.333
  238    H    ALA  14           H        ALA  14   2.096  -0.593  -9.076
  239    HA   ALA  14           HA       ALA  14   4.236  -2.601  -8.980
  240   1HB   ALA  14          1HB       ALA  14   3.837  -0.785  -6.666
  241   2HB   ALA  14          2HB       ALA  14   4.114   0.025  -8.209
  242   3HB   ALA  14          3HB       ALA  14   5.302  -1.122  -7.589
  243    H    LEU  15           H        LEU  15   1.275  -1.754  -7.294
  244    HA   LEU  15           HA       LEU  15   1.482  -3.518  -5.078
  245   1HB   LEU  15          2HB       LEU  15  -0.633  -2.008  -6.454
  246   2HB   LEU  15          1HB       LEU  15  -1.207  -3.496  -5.697
  247    HG   LEU  15           HG       LEU  15   0.612  -1.626  -4.216
  248   1HD1  LEU  15          1HD1      LEU  15  -1.073  -0.194  -3.623
  249   2HD1  LEU  15          2HD1      LEU  15  -2.307  -1.452  -3.707
  250   3HD1  LEU  15          3HD1      LEU  15  -1.731  -0.681  -5.185
  251   1HD2  LEU  15          1HD2      LEU  15  -1.522  -3.595  -3.351
  252   2HD2  LEU  15          2HD2      LEU  15  -0.444  -2.699  -2.278
  253   3HD2  LEU  15          3HD2      LEU  15   0.212  -3.918  -3.370
  254    H    TYR  16           H        TYR  16   0.543  -4.039  -8.420
  255    HA   TYR  16           HA       TYR  16  -0.333  -6.794  -7.921
  256   1HB   TYR  16          2HB       TYR  16  -1.400  -6.239  -9.863
  257   2HB   TYR  16          1HB       TYR  16  -0.292  -4.912 -10.187
  258    HD1  TYR  16           HD1      TYR  16  -1.106  -8.403 -10.878
  259    HD2  TYR  16           HD2      TYR  16   1.879  -5.347 -11.351
  260    HE1  TYR  16           HE1      TYR  16  -0.002  -9.754 -12.643
  261    HE2  TYR  16           HE2      TYR  16   2.982  -6.698 -13.116
  262    HH   TYR  16           HH       TYR  16   2.761  -9.692 -13.543
  263    H    LEU  17           H        LEU  17   2.533  -5.074  -9.016
  264    HA   LEU  17           HA       LEU  17   4.081  -7.427  -9.704
  265   1HB   LEU  17          2HB       LEU  17   4.439  -4.693  -9.963
  266   2HB   LEU  17          1HB       LEU  17   5.545  -5.089  -8.649
  267    HG   LEU  17           HG       LEU  17   5.957  -7.133 -10.474
  268   1HD1  LEU  17          1HD1      LEU  17   5.427  -6.416 -12.539
  269   2HD1  LEU  17          2HD1      LEU  17   6.476  -5.016 -12.318
  270   3HD1  LEU  17          3HD1      LEU  17   4.777  -4.927 -11.853
  271   1HD2  LEU  17          1HD2      LEU  17   7.690  -4.757 -10.773
  272   2HD2  LEU  17          2HD2      LEU  17   8.111  -6.402 -10.296
  273   3HD2  LEU  17          3HD2      LEU  17   7.442  -5.284  -9.108
  274    H    VAL  18           H        VAL  18   3.308  -5.564  -6.919
  275    HA   VAL  18           HA       VAL  18   5.135  -6.839  -5.056
  276    HB   VAL  18           HB       VAL  18   3.086  -4.719  -5.127
  277   1HG1  VAL  18          1HG1      VAL  18   3.415  -6.380  -2.636
  278   2HG1  VAL  18          2HG1      VAL  18   1.925  -6.051  -3.521
  279   3HG1  VAL  18          3HG1      VAL  18   2.742  -4.750  -2.657
  280   1HG2  VAL  18          1HG2      VAL  18   4.661  -3.664  -3.571
  281   2HG2  VAL  18          2HG2      VAL  18   5.484  -4.295  -4.998
  282   3HG2  VAL  18          3HG2      VAL  18   5.565  -5.175  -3.472
  283    H    CYS  19           H        CYS  19   1.674  -6.754  -5.512
  284    HA   CYS  19           HA       CYS  19   1.082  -8.989  -3.774
  285   1HB   CYS  19          2HB       CYS  19  -0.568  -7.554  -5.874
  286   2HB   CYS  19          1HB       CYS  19  -1.223  -8.669  -4.679
  287    H    GLY  20           H        GLY  20   2.439  -8.894  -6.821
  288   1HA   GLY  20          2HA       GLY  20   2.708 -10.511  -8.500
  289   2HA   GLY  20          1HA       GLY  20   2.348 -11.689  -7.239
  290    H    GLU  21           H        GLU  21   0.330 -12.660  -7.226
  291    HA   GLU  21           HA       GLU  21  -1.664 -11.621  -9.197
  292   1HB   GLU  21          2HB       GLU  21  -2.249 -13.970  -9.719
  293   2HB   GLU  21          1HB       GLU  21  -0.564 -13.623 -10.110
  294   1HG   GLU  21          2HG       GLU  21   0.146 -14.614  -7.970
  295   2HG   GLU  21          1HG       GLU  21  -1.537 -14.954  -7.565
  296    H    ARG  22           H        ARG  22  -1.971 -10.759  -6.679
  297    HA   ARG  22           HA       ARG  22  -3.926 -12.633  -5.414
  298   1HB   ARG  22          2HB       ARG  22  -2.316 -10.343  -4.267
  299   2HB   ARG  22          1HB       ARG  22  -3.612 -11.151  -3.386
  300   1HG   ARG  22          2HG       ARG  22  -1.770 -13.068  -4.575
  301   2HG   ARG  22          1HG       ARG  22  -0.941 -11.957  -3.485
  302   1HD   ARG  22          2HD       ARG  22  -3.542 -13.096  -2.568
  303   2HD   ARG  22          1HD       ARG  22  -2.143 -14.170  -2.581
  304    HE   ARG  22           HE       ARG  22  -1.361 -11.742  -1.330
  305   1HH1  ARG  22          1HH2      ARG  22  -4.168 -12.148  -0.218
  306   2HH1  ARG  22          2HH2      ARG  22  -3.834 -13.071   1.210
  307   1HH2  ARG  22          1HH1      ARG  22  -0.617 -13.919   0.226
  308   2HH2  ARG  22          2HH1      ARG  22  -1.821 -14.074   1.461
  309    H    GLY  23           H        GLY  23  -3.971  -9.294  -4.516
  310   1HA   GLY  23          2HA       GLY  23  -5.699  -8.142  -6.393
  311   2HA   GLY  23          1HA       GLY  23  -6.741  -9.028  -5.278
  312    H    PHE  24           H        PHE  24  -6.470  -6.087  -5.660
  313    HA   PHE  24           HA       PHE  24  -5.807  -5.419  -2.825
  314   1HB   PHE  24          2HB       PHE  24  -4.958  -3.209  -3.656
  315   2HB   PHE  24          1HB       PHE  24  -3.973  -4.575  -4.175
  316    HD1  PHE  24           HD1      PHE  24  -6.059  -1.817  -5.232
  317    HD2  PHE  24           HD2      PHE  24  -4.330  -5.544  -6.494
  318    HE1  PHE  24           HE1      PHE  24  -6.439  -1.190  -7.604
  319    HE2  PHE  24           HE2      PHE  24  -4.710  -4.918  -8.867
  320    HZ   PHE  24           HZ       PHE  24  -5.765  -2.741  -9.421
  321    H    PHE  25           H        PHE  25  -6.575  -2.807  -2.789
  322    HA   PHE  25           HA       PHE  25  -9.426  -2.889  -3.702
  323   1HB   PHE  25          2HB       PHE  25  -8.605  -1.441  -1.199
  324   2HB   PHE  25          1HB       PHE  25 -10.183  -2.096  -1.638
  325    HD1  PHE  25           HD1      PHE  25  -7.413  -2.601   0.425
  326    HD2  PHE  25           HD2      PHE  25 -10.104  -4.762  -2.135
  327    HE1  PHE  25           HE1      PHE  25  -6.880  -4.701   1.636
  328    HE2  PHE  25           HE2      PHE  25  -9.572  -6.861  -0.925
  329    HZ   PHE  25           HZ       PHE  25  -7.959  -6.830   0.961
  330    H    TYR  26           H        TYR  26 -10.056  -1.109  -4.842
  331    HA   TYR  26           HA       TYR  26  -8.095   1.031  -5.304
  332   1HB   TYR  26          2HB       TYR  26 -10.675   0.161  -6.518
  333   2HB   TYR  26          1HB       TYR  26 -10.265   1.868  -6.663
  334    HD1  TYR  26           HD1      TYR  26  -9.749  -1.393  -8.010
  335    HD2  TYR  26           HD2      TYR  26  -7.842   2.421  -7.480
  336    HE1  TYR  26           HE1      TYR  26  -8.167  -1.930  -9.842
  337    HE2  TYR  26           HE2      TYR  26  -6.258   1.885  -9.314
  338    HH   TYR  26           HH       TYR  26  -5.923   0.467 -11.100
  339    H    THR  27           H        THR  27 -11.232   0.618  -3.711
  340    HA   THR  27           HA       THR  27 -10.741   3.107  -2.196
  341    HB   THR  27           HB       THR  27 -13.386   3.460  -2.774
  342    HG1  THR  27           HG1      THR  27 -13.734   2.994  -4.873
  343   1HG2  THR  27          1HG2      THR  27 -12.437   5.446  -3.209
  344   2HG2  THR  27          2HG2      THR  27 -11.966   4.835  -4.796
  345   3HG2  THR  27          3HG2      THR  27 -10.863   4.682  -3.428
  346    H    LYS  28           H        LYS  28 -12.809   3.346  -0.618
  347    HA   LYS  28           HA       LYS  28 -14.234   0.967   0.072
  348   1HB   LYS  28          2HB       LYS  28 -13.078   0.226   2.046
  349   2HB   LYS  28          1HB       LYS  28 -11.937   0.217   0.706
  350   1HG   LYS  28          2HG       LYS  28 -12.117   2.226   2.990
  351   2HG   LYS  28          1HG       LYS  28 -10.772   1.181   2.593
  352   1HD   LYS  28          2HD       LYS  28  -9.871   3.065   1.640
  353   2HD   LYS  28          1HD       LYS  28 -10.951   2.739   0.292
  354   1HE   LYS  28          2HE       LYS  28 -12.601   4.057   2.078
  355   2HE   LYS  28          1HE       LYS  28 -11.052   4.852   2.323
  356   1HZ   LYS  28          1HZ       LYS  28 -12.841   5.066   0.136
  357   2HZ   LYS  28          2HZ       LYS  28 -11.313   4.549  -0.400
  358   3HZ   LYS  28          3HZ       LYS  28 -11.462   5.989   0.488
  359    HA   PRO  29           HA       PRO  29 -15.361   4.996   2.162
  360   1HB   PRO  29          2HB       PRO  29 -17.541   5.587   0.597
  361   2HB   PRO  29          1HB       PRO  29 -15.904   6.175   0.259
  362   1HG   PRO  29          2HG       PRO  29 -17.443   4.015  -1.109
  363   2HG   PRO  29          1HG       PRO  29 -16.165   5.061  -1.750
  364   1HD   PRO  29          2HD       PRO  29 -15.837   2.375  -0.941
  365   2HD   PRO  29          1HD       PRO  29 -14.531   3.542  -1.230
  366    H    THR  30           H        THR  30 -17.501   5.376   3.300
  367    HA   THR  30           HA       THR  30 -18.852   2.761   3.794
  368    HB   THR  30           HB       THR  30 -19.378   4.994   5.653
  369    HG1  THR  30           HG1      THR  30 -16.883   3.783   5.920
  370   1HG2  THR  30          1HG2      THR  30 -20.078   3.058   6.621
  371   2HG2  THR  30          2HG2      THR  30 -18.385   2.891   7.084
  372   3HG2  THR  30          3HG2      THR  30 -18.992   2.066   5.648
  Start of MODEL    5
    1   1H    GLY   1          1H        GLY   1  -8.112   4.369  -2.528
    2   2H    GLY   1          2H        GLY   1  -8.990   4.262  -1.077
    3   3H    GLY   1          3H        GLY   1  -8.816   2.894  -2.068
    4   1HA   GLY   1          1HA       GLY   1  -7.272   2.975  -0.109
    5   2HA   GLY   1          2HA       GLY   1  -6.464   2.666  -1.673
    6    H    ALA   2           H        ALA   2  -7.689   5.804  -0.624
    7    HA   ALA   2           HA       ALA   2  -6.690   7.617   0.489
    8   1HB   ALA   2          1HB       ALA   2  -6.095   7.209   2.765
    9   2HB   ALA   2          2HB       ALA   2  -5.685   5.527   2.431
   10   3HB   ALA   2          3HB       ALA   2  -7.369   6.049   2.394
   11    H    VAL   3           H        VAL   3  -5.118   7.926  -1.231
   12    HA   VAL   3           HA       VAL   3  -2.443   6.726  -0.781
   13    HB   VAL   3           HB       VAL   3  -2.962   8.656  -3.005
   14   1HG1  VAL   3          1HG1      VAL   3  -1.004   7.749  -3.644
   15   2HG1  VAL   3          2HG1      VAL   3  -1.796   6.181  -3.795
   16   3HG1  VAL   3          3HG1      VAL   3  -1.050   6.647  -2.268
   17   1HG2  VAL   3          1HG2      VAL   3  -4.953   7.468  -3.341
   18   2HG2  VAL   3          2HG2      VAL   3  -4.298   5.984  -2.652
   19   3HG2  VAL   3          3HG2      VAL   3  -3.810   6.496  -4.267
   20    H    GLU   4           H        GLU   4  -1.219   9.130  -2.122
   21    HA   GLU   4           HA       GLU   4  -0.433  11.279  -1.571
   22   1HB   GLU   4          2HB       GLU   4  -1.723  12.669  -0.301
   23   2HB   GLU   4          1HB       GLU   4  -2.904  11.373  -0.449
   24   1HG   GLU   4          2HG       GLU   4  -2.932  11.564   1.839
   25   2HG   GLU   4          1HG       GLU   4  -1.548  10.481   1.715
   26    H    GLN   5           H        GLN   5   0.090   8.446  -0.144
   27    HA   GLN   5           HA       GLN   5   2.025   9.583   1.834
   28   1HB   GLN   5          2HB       GLN   5   0.383   7.063   1.844
   29   2HB   GLN   5          1HB       GLN   5   1.905   7.126   2.735
   30   1HG   GLN   5          2HG       GLN   5   1.033   9.293   3.782
   31   2HG   GLN   5          1HG       GLN   5  -0.542   8.859   3.115
   32   1HE2  GLN   5          1HE2      GLN   5   0.151   5.897   3.507
   33   2HE2  GLN   5          2HE2      GLN   5  -0.084   5.629   5.166
   34    H    CYS   6           H        CYS   6   1.519   7.000  -0.569
   35    HA   CYS   6           HA       CYS   6   4.453   6.549  -0.651
   36   1HB   CYS   6          2HB       CYS   6   2.633   5.041  -2.468
   37   2HB   CYS   6          1HB       CYS   6   4.020   4.473  -1.543
   38    H    CYS   7           H        CYS   7   2.042   8.337  -2.238
   39    HA   CYS   7           HA       CYS   7   3.365   8.318  -4.852
   40   1HB   CYS   7          2HB       CYS   7   0.901   8.547  -4.627
   41   2HB   CYS   7          1HB       CYS   7   1.151  10.115  -3.872
   42    H    THR   8           H        THR   8   3.359  10.264  -1.957
   43    HA   THR   8           HA       THR   8   5.086  12.277  -3.327
   44    HB   THR   8           HB       THR   8   4.691  13.652  -1.272
   45    HG1  THR   8           HG1      THR   8   2.821  11.620  -0.642
   46   1HG2  THR   8          1HG2      THR   8   3.180  13.604  -3.377
   47   2HG2  THR   8          2HG2      THR   8   2.533  14.357  -1.919
   48   3HG2  THR   8          3HG2      THR   8   2.038  12.723  -2.362
   49    H    SER   9           H        SER   9   6.067   9.665  -2.716
   50    HA   SER   9           HA       SER   9   8.570  10.089  -1.653
   51   1HB   SER   9          2HB       SER   9   7.671  10.778   0.484
   52   2HB   SER   9          1HB       SER   9   6.547   9.423   0.514
   53    HG   SER   9           HG       SER   9   8.691   9.340   1.719
   54    H    ILE  10           H        ILE  10   8.186   7.517   0.143
   55    HA   ILE  10           HA       ILE  10   7.339   5.646  -1.977
   56    HB   ILE  10           HB       ILE  10   9.858   4.729  -0.848
   57   1HG1  ILE  10          2HG1      ILE  10  10.185   7.293  -0.957
   58   2HG1  ILE  10          1HG1      ILE  10  11.365   6.300  -1.809
   59   1HG2  ILE  10          1HG2      ILE  10  10.000   5.051  -3.636
   60   2HG2  ILE  10          2HG2      ILE  10   8.304   4.711  -3.291
   61   3HG2  ILE  10          3HG2      ILE  10   9.555   3.585  -2.761
   62   1HD1  ILE  10          1HD1      ILE  10   9.161   6.831  -3.579
   63   2HD1  ILE  10          2HD1      ILE  10  10.846   7.316  -3.751
   64   3HD1  ILE  10          3HD1      ILE  10   9.715   8.354  -2.884
   65    H    CYS  11           H        CYS  11   5.761   4.702  -0.734
   66    HA   CYS  11           HA       CYS  11   5.833   4.205   2.039
   67   1HB   CYS  11          2HB       CYS  11   4.399   2.947  -0.272
   68   2HB   CYS  11          1HB       CYS  11   4.365   2.113   1.281
   69    H    SER  12           H        SER  12   5.707   1.594   2.661
   70    HA   SER  12           HA       SER  12   8.453   0.645   2.030
   71   1HB   SER  12          2HB       SER  12   6.590  -0.547   4.082
   72   2HB   SER  12          1HB       SER  12   8.349  -0.619   4.031
   73    HG   SER  12           HG       SER  12   6.771   1.717   4.405
   74    H    LEU  13           H        LEU  13   8.365  -0.554   0.153
   75    HA   LEU  13           HA       LEU  13   6.444  -1.898  -1.172
   76   1HB   LEU  13          2HB       LEU  13   9.076  -2.048  -1.384
   77   2HB   LEU  13          1HB       LEU  13   8.850  -3.568  -0.520
   78    HG   LEU  13           HG       LEU  13   8.802  -3.835  -3.011
   79   1HD1  LEU  13          1HD1      LEU  13   6.099  -4.400  -1.778
   80   2HD1  LEU  13          2HD1      LEU  13   7.543  -5.329  -1.377
   81   3HD1  LEU  13          3HD1      LEU  13   6.926  -5.325  -3.030
   82   1HD2  LEU  13          1HD2      LEU  13   7.272  -1.525  -2.922
   83   2HD2  LEU  13          2HD2      LEU  13   6.078  -2.779  -3.252
   84   3HD2  LEU  13          3HD2      LEU  13   7.459  -2.572  -4.329
   85    H    TYR  14           H        TYR  14   7.979  -3.270   1.754
   86    HA   TYR  14           HA       TYR  14   6.534  -5.682   1.889
   87   1HB   TYR  14          2HB       TYR  14   7.923  -3.934   3.827
   88   2HB   TYR  14          1HB       TYR  14   6.677  -4.968   4.527
   89    HD1  TYR  14           HD1      TYR  14  10.035  -4.820   3.256
   90    HD2  TYR  14           HD2      TYR  14   6.726  -7.480   3.930
   91    HE1  TYR  14           HE1      TYR  14  11.568  -6.766   3.116
   92    HE2  TYR  14           HE2      TYR  14   8.261  -9.424   3.789
   93    HH   TYR  14           HH       TYR  14  10.493  -9.929   2.740
   94    H    GLN  15           H        GLN  15   5.650  -2.575   3.481
   95    HA   GLN  15           HA       GLN  15   3.046  -3.447   4.266
   96   1HB   GLN  15          2HB       GLN  15   4.263  -0.730   3.794
   97   2HB   GLN  15          1HB       GLN  15   2.552  -0.895   4.188
   98   1HG   GLN  15          2HG       GLN  15   2.970  -1.634   6.330
   99   2HG   GLN  15          1HG       GLN  15   4.502  -2.385   5.886
  100   1HE2  GLN  15          1HE2      GLN  15   5.629  -1.259   7.645
  101   2HE2  GLN  15          2HE2      GLN  15   5.964   0.402   7.546
  102    H    LEU  16           H        LEU  16   4.322  -2.122   1.300
  103    HA   LEU  16           HA       LEU  16   1.906  -1.484  -0.046
  104   1HB   LEU  16          2HB       LEU  16   4.616  -1.603  -0.694
  105   2HB   LEU  16          1HB       LEU  16   3.882  -2.779  -1.775
  106    HG   LEU  16           HG       LEU  16   3.410   0.183  -1.577
  107   1HD1  LEU  16          1HD1      LEU  16   3.220  -1.186  -4.163
  108   2HD1  LEU  16          2HD1      LEU  16   4.757  -1.466  -3.347
  109   3HD1  LEU  16          3HD1      LEU  16   4.228   0.181  -3.687
  110   1HD2  LEU  16          1HD2      LEU  16   1.422  -1.919  -2.431
  111   2HD2  LEU  16          2HD2      LEU  16   1.400  -0.310  -3.152
  112   3HD2  LEU  16          3HD2      LEU  16   1.156  -0.501  -1.417
  113    H    GLU  17           H        GLU  17   3.362  -4.531   0.796
  114    HA   GLU  17           HA       GLU  17   1.704  -6.118  -1.009
  115   1HB   GLU  17          2HB       GLU  17   3.823  -6.609   0.948
  116   2HB   GLU  17          1HB       GLU  17   2.512  -7.783   1.083
  117   1HG   GLU  17          2HG       GLU  17   2.737  -7.775  -1.578
  118   2HG   GLU  17          1HG       GLU  17   4.385  -7.285  -1.189
  119    H    ASN  18           H        ASN  18   1.460  -4.706   2.130
  120    HA   ASN  18           HA       ASN  18  -0.798  -6.342   3.002
  121   1HB   ASN  18          2HB       ASN  18   0.496  -3.822   4.066
  122   2HB   ASN  18          1HB       ASN  18  -0.950  -4.520   4.797
  123   1HD2  ASN  18          1HD2      ASN  18   0.361  -5.001   6.766
  124   2HD2  ASN  18          2HD2      ASN  18   1.415  -6.331   6.773
  125    H    TYR  19           H        TYR  19  -0.426  -3.894   0.736
  126    HA   TYR  19           HA       TYR  19  -3.048  -2.629   1.203
  127   1HB   TYR  19          2HB       TYR  19  -0.677  -2.142  -0.476
  128   2HB   TYR  19          1HB       TYR  19  -2.211  -1.814  -1.288
  129    HD1  TYR  19           HD1      TYR  19   0.246  -0.591   0.992
  130    HD2  TYR  19           HD2      TYR  19  -3.934  -0.372   0.024
  131    HE1  TYR  19           HE1      TYR  19   0.071   1.542   2.240
  132    HE2  TYR  19           HE2      TYR  19  -4.111   1.763   1.270
  133    HH   TYR  19           HH       TYR  19  -2.424   3.659   1.922
  134    H    CYS  20           H        CYS  20  -2.249  -5.570   0.307
  135    HA   CYS  20           HA       CYS  20  -4.334  -5.763  -1.813
  136   1HB   CYS  20          2HB       CYS  20  -1.564  -6.741  -1.710
  137   2HB   CYS  20          1HB       CYS  20  -2.733  -7.975  -2.141
  138    H    ASN  21           H        ASN  21  -4.495  -8.507  -1.894
  139    HA   ASN  21           HA       ASN  21  -5.841  -9.090   0.654
  140   1HB   ASN  21          2HB       ASN  21  -5.868 -10.149  -2.098
  141   2HB   ASN  21          1HB       ASN  21  -6.024 -11.382  -0.850
  142   1HD2  ASN  21          1HD2      ASN  21  -7.472  -9.935   1.122
  143   2HD2  ASN  21          2HD2      ASN  21  -8.999  -9.529   0.499
  144   1H    PHE   1          1H        PHE   1  12.408  -4.254  -2.244
  145   2H    PHE   1          2H        PHE   1  14.051  -3.841  -2.126
  146   3H    PHE   1          3H        PHE   1  13.571  -5.173  -3.066
  147    HA   PHE   1           HA       PHE   1  14.117  -3.283  -4.473
  148   1HB   PHE   1          2HB       PHE   1  11.150  -3.921  -4.348
  149   2HB   PHE   1          1HB       PHE   1  11.996  -3.241  -5.739
  150    HD1  PHE   1           HD1      PHE   1  11.406  -6.257  -3.733
  151    HD2  PHE   1           HD2      PHE   1  13.636  -4.583  -7.005
  152    HE1  PHE   1           HE1      PHE   1  12.047  -8.540  -4.465
  153    HE2  PHE   1           HE2      PHE   1  14.276  -6.866  -7.735
  154    HZ   PHE   1           HZ       PHE   1  13.481  -8.844  -6.466
  155    H    VAL   2           H        VAL   2  12.957  -1.187  -5.324
  156    HA   VAL   2           HA       VAL   2  11.829   0.383  -3.068
  157    HB   VAL   2           HB       VAL   2  14.416   0.634  -3.419
  158   1HG1  VAL   2          1HG1      VAL   2  15.174   1.632  -5.294
  159   2HG1  VAL   2          2HG1      VAL   2  13.901   2.852  -5.251
  160   3HG1  VAL   2          3HG1      VAL   2  13.591   1.280  -5.988
  161   1HG2  VAL   2          1HG2      VAL   2  12.303   2.468  -2.675
  162   2HG2  VAL   2          2HG2      VAL   2  13.678   3.344  -3.345
  163   3HG2  VAL   2          3HG2      VAL   2  13.905   2.270  -1.964
  164    H    ASN   3           H        ASN   3  12.093   2.853  -4.750
  165    HA   ASN   3           HA       ASN   3  10.966   2.599  -7.307
  166   1HB   ASN   3          2HB       ASN   3   9.128   1.812  -5.257
  167   2HB   ASN   3          1HB       ASN   3   8.553   3.320  -5.967
  168   1HD2  ASN   3          1HD2      ASN   3   9.192  -0.084  -6.633
  169   2HD2  ASN   3          2HD2      ASN   3   8.502  -0.098  -8.184
  170    H    GLN   4           H        GLN   4   9.251   4.647  -7.573
  171    HA   GLN   4           HA       GLN   4  10.512   6.943  -6.130
  172   1HB   GLN   4          2HB       GLN   4   9.645   6.967  -9.036
  173   2HB   GLN   4          1HB       GLN   4  10.535   8.223  -8.175
  174   1HG   GLN   4          2HG       GLN   4  12.381   6.549  -7.798
  175   2HG   GLN   4          1HG       GLN   4  11.515   5.443  -8.865
  176   1HE2  GLN   4          1HE2      GLN   4  10.660   8.178 -10.313
  177   2HE2  GLN   4          2HE2      GLN   4  11.982   8.445 -11.342
  178    H    HIS   5           H        HIS   5   8.635   8.639  -7.920
  179    HA   HIS   5           HA       HIS   5   6.548   9.024  -6.083
  180   1HB   HIS   5          2HB       HIS   5   6.022   9.338  -9.031
  181   2HB   HIS   5          1HB       HIS   5   5.500  10.367  -7.700
  182    HD2  HIS   5           HD2      HIS   5   7.621  11.158 -10.406
  183    HE1  HIS   5           HE1      HIS   5  10.104  12.208  -7.148
  184    HE2  HIS   5           HE2      HIS   5   9.739  12.475  -9.660
  185    H    LEU   6           H        LEU   6   4.958   7.686  -5.477
  186    HA   LEU   6           HA       LEU   6   3.975   5.639  -7.403
  187   1HB   LEU   6          2HB       LEU   6   5.276   5.257  -4.924
  188   2HB   LEU   6          1HB       LEU   6   3.580   4.857  -4.660
  189    HG   LEU   6           HG       LEU   6   3.596   3.231  -6.415
  190   1HD1  LEU   6          1HD1      LEU   6   4.814   3.684  -8.256
  191   2HD1  LEU   6          2HD1      LEU   6   6.243   3.164  -7.362
  192   3HD1  LEU   6          3HD1      LEU   6   5.785   4.868  -7.380
  193   1HD2  LEU   6          1HD2      LEU   6   6.256   2.462  -5.575
  194   2HD2  LEU   6          2HD2      LEU   6   4.704   1.741  -5.146
  195   3HD2  LEU   6          3HD2      LEU   6   5.337   3.096  -4.210
  196    H    CYS   7           H        CYS   7   2.112   6.535  -8.035
  197    HA   CYS   7           HA       CYS   7   0.152   7.417  -5.952
  198   1HB   CYS   7          2HB       CYS   7   0.871   8.390  -8.617
  199   2HB   CYS   7          1HB       CYS   7  -0.867   8.116  -8.467
  200    H    GLY   8           H        GLY   8  -2.095   6.743  -6.347
  201   1HA   GLY   8          2HA       GLY   8  -2.794   4.196  -6.363
  202   2HA   GLY   8          1HA       GLY   8  -3.752   5.299  -7.346
  203    H    SER   9           H        SER   9  -2.386   5.758  -9.576
  204    HA   SER   9           HA       SER   9  -2.571   3.351 -11.071
  205   1HB   SER   9          2HB       SER   9  -2.578   5.759 -11.946
  206   2HB   SER   9          1HB       SER   9  -0.822   5.696 -11.840
  207    HG   SER   9           HG       SER   9  -1.901   5.045 -13.900
  208    H    ASP  10           H        ASP  10   0.492   5.132 -10.493
  209    HA   ASP  10           HA       ASP  10   2.132   2.867 -11.122
  210   1HB   ASP  10          2HB       ASP  10   3.076   5.004  -9.237
  211   2HB   ASP  10          1HB       ASP  10   3.952   4.208 -10.543
  212    H    LEU  11           H        LEU  11   0.358   3.704  -8.312
  213    HA   LEU  11           HA       LEU  11   1.979   2.060  -6.487
  214   1HB   LEU  11          2HB       LEU  11  -0.309   3.908  -6.281
  215   2HB   LEU  11          1HB       LEU  11  -0.397   2.551  -5.198
  216    HG   LEU  11           HG       LEU  11   1.952   4.414  -5.448
  217   1HD1  LEU  11          1HD1      LEU  11   0.340   4.063  -2.958
  218   2HD1  LEU  11          2HD1      LEU  11  -0.362   5.033  -4.253
  219   3HD1  LEU  11          3HD1      LEU  11   1.187   5.493  -3.546
  220   1HD2  LEU  11          1HD2      LEU  11   1.502   1.797  -4.148
  221   2HD2  LEU  11          2HD2      LEU  11   2.287   3.015  -3.142
  222   3HD2  LEU  11          3HD2      LEU  11   3.006   2.542  -4.681
  223    H    VAL  12           H        VAL  12  -0.782   1.742  -8.570
  224    HA   VAL  12           HA       VAL  12  -1.626  -0.759  -7.293
  225    HB   VAL  12           HB       VAL  12  -3.089   1.065  -8.558
  226   1HG1  VAL  12          1HG1      VAL  12  -2.690  -0.911 -10.794
  227   2HG1  VAL  12          2HG1      VAL  12  -1.710   0.552 -10.695
  228   3HG1  VAL  12          3HG1      VAL  12  -3.463   0.673 -10.844
  229   1HG2  VAL  12          1HG2      VAL  12  -3.362  -1.731  -7.909
  230   2HG2  VAL  12          2HG2      VAL  12  -4.299  -1.360  -9.356
  231   3HG2  VAL  12          3HG2      VAL  12  -4.584  -0.461  -7.866
  232    H    GLU  13           H        GLU  13   0.116   0.328 -10.128
  233    HA   GLU  13           HA       GLU  13   0.351  -2.247 -11.401
  234   1HB   GLU  13          2HB       GLU  13   2.427  -0.063 -11.614
  235   2HB   GLU  13          1HB       GLU  13   1.900  -1.204 -12.853
  236   1HG   GLU  13          2HG       GLU  13  -0.420   0.198 -12.073
  237   2HG   GLU  13          1HG       GLU  13   0.845   1.417 -12.240
  238    H    ALA  14           H        ALA  14   2.337  -0.451  -9.069
  239    HA   ALA  14           HA       ALA  14   4.398  -2.512  -8.908
  240   1HB   ALA  14          1HB       ALA  14   4.175  -0.890  -6.512
  241   2HB   ALA  14          2HB       ALA  14   4.022   0.141  -7.934
  242   3HB   ALA  14          3HB       ALA  14   5.449  -0.873  -7.729
  243    H    LEU  15           H        LEU  15   1.423  -1.661  -7.244
  244    HA   LEU  15           HA       LEU  15   1.578  -3.406  -5.020
  245   1HB   LEU  15          2HB       LEU  15  -0.519  -1.978  -6.494
  246   2HB   LEU  15          1HB       LEU  15  -1.085  -3.491  -5.788
  247    HG   LEU  15           HG       LEU  15   0.600  -1.662  -4.136
  248   1HD1  LEU  15          1HD1      LEU  15  -0.908   0.007  -4.504
  249   2HD1  LEU  15          2HD1      LEU  15  -1.921  -0.929  -3.404
  250   3HD1  LEU  15          3HD1      LEU  15  -2.120  -1.102  -5.148
  251   1HD2  LEU  15          1HD2      LEU  15  -1.686  -3.571  -3.582
  252   2HD2  LEU  15          2HD2      LEU  15  -0.835  -2.643  -2.350
  253   3HD2  LEU  15          3HD2      LEU  15   0.024  -3.873  -3.275
  254    H    TYR  16           H        TYR  16  -0.140  -3.993  -8.075
  255    HA   TYR  16           HA       TYR  16  -0.647  -6.732  -7.766
  256   1HB   TYR  16          2HB       TYR  16  -1.627  -5.944  -9.712
  257   2HB   TYR  16          1HB       TYR  16  -0.265  -4.895 -10.098
  258    HD1  TYR  16           HD1      TYR  16  -1.711  -8.238 -10.489
  259    HD2  TYR  16           HD2      TYR  16   1.763  -5.809 -11.193
  260    HE1  TYR  16           HE1      TYR  16  -0.853  -9.932 -12.088
  261    HE2  TYR  16           HE2      TYR  16   2.621  -7.501 -12.790
  262    HH   TYR  16           HH       TYR  16   2.074  -9.342 -13.989
  263    H    LEU  17           H        LEU  17   2.285  -5.130  -8.983
  264    HA   LEU  17           HA       LEU  17   3.772  -7.527  -9.546
  265   1HB   LEU  17          2HB       LEU  17   4.205  -4.820  -9.864
  266   2HB   LEU  17          1HB       LEU  17   5.294  -5.202  -8.530
  267    HG   LEU  17           HG       LEU  17   5.738  -7.297 -10.226
  268   1HD1  LEU  17          1HD1      LEU  17   4.275  -5.627 -11.803
  269   2HD1  LEU  17          2HD1      LEU  17   5.496  -6.737 -12.425
  270   3HD1  LEU  17          3HD1      LEU  17   5.907  -5.048 -12.136
  271   1HD2  LEU  17          1HD2      LEU  17   7.376  -4.916 -10.801
  272   2HD2  LEU  17          2HD2      LEU  17   7.861  -6.482 -10.152
  273   3HD2  LEU  17          3HD2      LEU  17   7.171  -5.260  -9.084
  274    H    VAL  18           H        VAL  18   3.134  -5.560  -6.803
  275    HA   VAL  18           HA       VAL  18   4.933  -6.815  -4.926
  276    HB   VAL  18           HB       VAL  18   2.870  -4.721  -5.075
  277   1HG1  VAL  18          1HG1      VAL  18   1.789  -6.123  -3.387
  278   2HG1  VAL  18          2HG1      VAL  18   2.419  -4.637  -2.675
  279   3HG1  VAL  18          3HG1      VAL  18   3.287  -6.158  -2.458
  280   1HG2  VAL  18          1HG2      VAL  18   4.722  -3.599  -4.651
  281   2HG2  VAL  18          2HG2      VAL  18   5.593  -5.098  -4.322
  282   3HG2  VAL  18          3HG2      VAL  18   4.724  -4.277  -3.024
  283    H    CYS  19           H        CYS  19   1.482  -6.802  -5.409
  284    HA   CYS  19           HA       CYS  19   0.765  -8.881  -3.583
  285   1HB   CYS  19          2HB       CYS  19  -0.741  -8.154  -6.104
  286   2HB   CYS  19          1HB       CYS  19  -1.405  -8.696  -4.570
  287    H    GLY  20           H        GLY  20   2.108  -8.921  -6.773
  288   1HA   GLY  20          2HA       GLY  20   2.662 -10.708  -8.198
  289   2HA   GLY  20          1HA       GLY  20   2.634 -11.714  -6.749
  290    H    GLU  21           H        GLU  21   0.069  -9.938  -8.516
  291    HA   GLU  21           HA       GLU  21  -1.888 -10.759  -9.544
  292   1HB   GLU  21          2HB       GLU  21  -1.103 -13.590  -8.955
  293   2HB   GLU  21          1HB       GLU  21  -1.919 -12.929 -10.373
  294   1HG   GLU  21          2HG       GLU  21   0.401 -11.614 -10.603
  295   2HG   GLU  21          1HG       GLU  21   0.988 -13.031  -9.733
  296    H    ARG  22           H        ARG  22  -1.246 -10.648  -6.478
  297    HA   ARG  22           HA       ARG  22  -3.191 -12.516  -5.349
  298   1HB   ARG  22          2HB       ARG  22  -1.279 -10.520  -4.332
  299   2HB   ARG  22          1HB       ARG  22  -2.760 -10.653  -3.386
  300   1HG   ARG  22          2HG       ARG  22  -2.125 -13.295  -3.895
  301   2HG   ARG  22          1HG       ARG  22  -0.542 -12.552  -3.655
  302   1HD   ARG  22          2HD       ARG  22  -0.896 -12.507  -1.436
  303   2HD   ARG  22          1HD       ARG  22  -2.316 -11.490  -1.684
  304    HE   ARG  22           HE       ARG  22  -3.529 -13.753  -2.086
  305   1HH1  ARG  22          1HH2      ARG  22  -2.518 -12.785   0.772
  306   2HH1  ARG  22          2HH2      ARG  22  -2.112 -14.329   1.443
  307   1HH2  ARG  22          1HH1      ARG  22  -2.252 -15.984  -1.598
  308   2HH2  ARG  22          2HH1      ARG  22  -1.961 -16.139   0.102
  309    H    GLY  23           H        GLY  23  -3.303  -9.323  -6.668
  310   1HA   GLY  23          2HA       GLY  23  -5.317  -8.147  -7.214
  311   2HA   GLY  23          1HA       GLY  23  -6.211  -9.243  -6.158
  312    H    PHE  24           H        PHE  24  -6.080  -6.189  -6.247
  313    HA   PHE  24           HA       PHE  24  -5.149  -5.797  -3.435
  314   1HB   PHE  24          2HB       PHE  24  -5.142  -3.312  -4.125
  315   2HB   PHE  24          1HB       PHE  24  -3.860  -4.329  -4.764
  316    HD1  PHE  24           HD1      PHE  24  -7.401  -3.425  -5.651
  317    HD2  PHE  24           HD2      PHE  24  -3.390  -4.130  -7.019
  318    HE1  PHE  24           HE1      PHE  24  -8.101  -2.901  -7.974
  319    HE2  PHE  24           HE2      PHE  24  -4.089  -3.607  -9.341
  320    HZ   PHE  24           HZ       PHE  24  -6.444  -2.992  -9.819
  321    H    PHE  25           H        PHE  25  -6.371  -3.682  -2.548
  322    HA   PHE  25           HA       PHE  25  -9.259  -4.375  -2.683
  323   1HB   PHE  25          2HB       PHE  25  -8.303  -4.338  -0.448
  324   2HB   PHE  25          1HB       PHE  25  -7.641  -2.726  -0.719
  325    HD1  PHE  25           HD1      PHE  25 -10.952  -4.493  -0.989
  326    HD2  PHE  25           HD2      PHE  25  -8.833  -0.935   0.161
  327    HE1  PHE  25           HE1      PHE  25 -13.075  -3.486  -0.190
  328    HE2  PHE  25           HE2      PHE  25 -10.955   0.071   0.960
  329    HZ   PHE  25           HZ       PHE  25 -13.076  -1.204   0.784
  330    H    TYR  26           H        TYR  26  -7.187  -2.273  -4.177
  331    HA   TYR  26           HA       TYR  26  -8.244   0.290  -4.028
  332   1HB   TYR  26          2HB       TYR  26  -6.380  -0.705  -5.583
  333   2HB   TYR  26          1HB       TYR  26  -7.700  -0.899  -6.737
  334    HD1  TYR  26           HD1      TYR  26  -5.955   1.588  -4.580
  335    HD2  TYR  26           HD2      TYR  26  -8.567   0.965  -7.936
  336    HE1  TYR  26           HE1      TYR  26  -5.812   4.001  -5.138
  337    HE2  TYR  26           HE2      TYR  26  -8.425   3.380  -8.494
  338    HH   TYR  26           HH       TYR  26  -7.911   5.497  -7.378
  339    H    THR  27           H        THR  27 -10.293   1.024  -4.219
  340    HA   THR  27           HA       THR  27 -12.052  -0.219  -6.270
  341    HB   THR  27           HB       THR  27 -12.914   0.335  -3.412
  342    HG1  THR  27           HG1      THR  27 -12.419  -1.659  -3.035
  343   1HG2  THR  27          1HG2      THR  27 -14.307  -0.587  -5.910
  344   2HG2  THR  27          2HG2      THR  27 -14.832   0.603  -4.718
  345   3HG2  THR  27          3HG2      THR  27 -14.891  -1.118  -4.332
  346    H    LYS  28           H        LYS  28 -13.956   1.194  -6.728
  347    HA   LYS  28           HA       LYS  28 -13.114   4.009  -6.745
  348   1HB   LYS  28          2HB       LYS  28 -14.716   4.356  -8.425
  349   2HB   LYS  28          1HB       LYS  28 -14.206   2.695  -8.720
  350   1HG   LYS  28          2HG       LYS  28 -16.669   3.515  -7.116
  351   2HG   LYS  28          1HG       LYS  28 -16.695   2.910  -8.768
  352   1HD   LYS  28          2HD       LYS  28 -15.762   1.355  -6.313
  353   2HD   LYS  28          1HD       LYS  28 -17.266   1.093  -7.197
  354   1HE   LYS  28          2HE       LYS  28 -14.518   0.867  -8.467
  355   2HE   LYS  28          1HE       LYS  28 -15.419  -0.504  -7.822
  356   1HZ   LYS  28          1HZ       LYS  28 -16.035   1.191 -10.146
  357   2HZ   LYS  28          2HZ       LYS  28 -17.294   0.398  -9.325
  358   3HZ   LYS  28          3HZ       LYS  28 -16.031  -0.501 -10.024
  359    HA   PRO  29           HA       PRO  29 -15.681   5.150  -3.366
  360   1HB   PRO  29          2HB       PRO  29 -15.821   7.842  -3.897
  361   2HB   PRO  29          1HB       PRO  29 -14.384   7.052  -3.223
  362   1HG   PRO  29          2HG       PRO  29 -14.849   8.063  -5.989
  363   2HG   PRO  29          1HG       PRO  29 -13.324   7.859  -5.110
  364   1HD   PRO  29          2HD       PRO  29 -14.342   6.116  -7.098
  365   2HD   PRO  29          1HD       PRO  29 -12.995   5.770  -5.992
  366    H    THR  30           H        THR  30 -17.673   6.913  -3.155
  367    HA   THR  30           HA       THR  30 -19.877   5.773  -4.530
  368    HB   THR  30           HB       THR  30 -20.113   7.046  -2.430
  369    HG1  THR  30           HG1      THR  30 -21.481   8.272  -4.590
  370   1HG2  THR  30          1HG2      THR  30 -19.841   9.431  -2.354
  371   2HG2  THR  30          2HG2      THR  30 -19.628   9.522  -4.102
  372   3HG2  THR  30          3HG2      THR  30 -18.384   8.775  -3.099
  Start of MODEL    6
    1   1H    GLY   1          1H        GLY   1  -9.548   3.369   3.034
    2   2H    GLY   1          2H        GLY   1  -8.775   2.411   1.863
    3   3H    GLY   1          3H        GLY   1 -10.169   3.293   1.457
    4   1HA   GLY   1          1HA       GLY   1  -8.128   4.412   0.702
    5   2HA   GLY   1          2HA       GLY   1  -9.056   5.447   1.828
    6    H    ALA   2           H        ALA   2  -6.778   6.398   1.588
    7    HA   ALA   2           HA       ALA   2  -4.529   6.635   2.240
    8   1HB   ALA   2          1HB       ALA   2  -3.683   5.257   3.907
    9   2HB   ALA   2          2HB       ALA   2  -4.438   3.810   3.237
   10   3HB   ALA   2          3HB       ALA   2  -5.414   4.987   4.117
   11    H    VAL   3           H        VAL   3  -3.978   6.646  -0.015
   12    HA   VAL   3           HA       VAL   3  -2.465   4.226  -0.830
   13    HB   VAL   3           HB       VAL   3  -3.481   4.816  -3.232
   14   1HG1  VAL   3          1HG1      VAL   3  -3.583   2.637  -1.987
   15   2HG1  VAL   3          2HG1      VAL   3  -5.037   2.979  -2.923
   16   3HG1  VAL   3          3HG1      VAL   3  -5.037   3.220  -1.176
   17   1HG2  VAL   3          1HG2      VAL   3  -4.894   6.615  -1.817
   18   2HG2  VAL   3          2HG2      VAL   3  -5.960   5.223  -1.622
   19   3HG2  VAL   3          3HG2      VAL   3  -5.562   5.808  -3.237
   20    H    GLU   4           H        GLU   4  -3.299   7.621  -1.500
   21    HA   GLU   4           HA       GLU   4  -0.894   8.037  -3.108
   22   1HB   GLU   4          2HB       GLU   4  -1.573  10.400  -3.110
   23   2HB   GLU   4          1HB       GLU   4  -2.954   9.370  -3.487
   24   1HG   GLU   4          2HG       GLU   4  -4.075  10.142  -1.695
   25   2HG   GLU   4          1HG       GLU   4  -2.741   9.698  -0.628
   26    H    GLN   5           H        GLN   5   0.537   7.136  -1.341
   27    HA   GLN   5           HA       GLN   5   1.574   9.378   0.273
   28   1HB   GLN   5          2HB       GLN   5   0.201   6.989   1.401
   29   2HB   GLN   5          1HB       GLN   5   1.678   7.512   2.209
   30   1HG   GLN   5          2HG       GLN   5   0.188   9.858   1.658
   31   2HG   GLN   5          1HG       GLN   5  -0.945   8.687   2.335
   32   1HE2  GLN   5          1HE2      GLN   5  -1.087   9.640   4.447
   33   2HE2  GLN   5          2HE2      GLN   5   0.231   9.700   5.513
   34    H    CYS   6           H        CYS   6   2.297   7.246  -1.930
   35    HA   CYS   6           HA       CYS   6   4.897   6.481  -0.663
   36   1HB   CYS   6          2HB       CYS   6   3.178   4.979  -2.645
   37   2HB   CYS   6          1HB       CYS   6   4.882   4.591  -2.395
   38    H    CYS   7           H        CYS   7   3.397   8.336  -3.069
   39    HA   CYS   7           HA       CYS   7   5.736   8.241  -4.874
   40   1HB   CYS   7          2HB       CYS   7   4.426   9.787  -6.297
   41   2HB   CYS   7          1HB       CYS   7   3.521   8.317  -5.919
   42    H    THR   8           H        THR   8   4.309  10.267  -2.416
   43    HA   THR   8           HA       THR   8   6.244  12.445  -2.985
   44    HB   THR   8           HB       THR   8   5.032  13.718  -1.331
   45    HG1  THR   8           HG1      THR   8   3.194  12.414  -0.328
   46   1HG2  THR   8          1HG2      THR   8   3.351  12.061  -3.194
   47   2HG2  THR   8          2HG2      THR   8   3.768  13.771  -3.302
   48   3HG2  THR   8          3HG2      THR   8   2.583  13.225  -2.114
   49    H    SER   9           H        SER   9   7.249   9.878  -2.244
   50    HA   SER   9           HA       SER   9   9.283  10.316  -0.489
   51   1HB   SER   9          2HB       SER   9   6.690   9.935   0.962
   52   2HB   SER   9          1HB       SER   9   8.094   9.090   1.601
   53    HG   SER   9           HG       SER   9   8.701  10.931   2.385
   54    H    ILE  10           H        ILE  10   9.165   7.768   0.982
   55    HA   ILE  10           HA       ILE  10   8.369   5.905  -1.168
   56    HB   ILE  10           HB       ILE  10  11.054   5.398   0.005
   57   1HG1  ILE  10          2HG1      ILE  10  10.830   7.902  -0.831
   58   2HG1  ILE  10          1HG1      ILE  10  12.209   6.933  -1.338
   59   1HG2  ILE  10          1HG2      ILE  10  11.370   4.432  -2.240
   60   2HG2  ILE  10          2HG2      ILE  10   9.806   5.076  -2.742
   61   3HG2  ILE  10          3HG2      ILE  10   9.889   3.824  -1.503
   62   1HD1  ILE  10          1HD1      ILE  10  11.370   6.612  -3.485
   63   2HD1  ILE  10          2HD1      ILE  10  10.847   8.260  -3.145
   64   3HD1  ILE  10          3HD1      ILE  10   9.705   6.922  -2.999
   65    H    CYS  11           H        CYS  11   6.836   4.946   0.116
   66    HA   CYS  11           HA       CYS  11   7.221   4.203   2.854
   67   1HB   CYS  11          2HB       CYS  11   5.295   2.593   2.342
   68   2HB   CYS  11          1HB       CYS  11   4.978   4.287   1.992
   69    H    SER  12           H        SER  12   6.447   1.265   2.295
   70    HA   SER  12           HA       SER  12   9.084   0.322   1.284
   71   1HB   SER  12          2HB       SER  12   8.338  -1.424   3.375
   72   2HB   SER  12          1HB       SER  12   9.701  -0.309   3.355
   73    HG   SER  12           HG       SER  12   8.660   0.878   4.726
   74    H    LEU  13           H        LEU  13   8.758  -1.213  -0.250
   75    HA   LEU  13           HA       LEU  13   6.419  -2.131  -1.313
   76   1HB   LEU  13          2HB       LEU  13   8.933  -2.863  -1.772
   77   2HB   LEU  13          1HB       LEU  13   8.444  -4.276  -0.833
   78    HG   LEU  13           HG       LEU  13   6.303  -3.797  -2.577
   79   1HD1  LEU  13          1HD1      LEU  13   8.043  -4.140  -4.694
   80   2HD1  LEU  13          2HD1      LEU  13   8.848  -2.903  -3.728
   81   3HD1  LEU  13          3HD1      LEU  13   7.200  -2.641  -4.302
   82   1HD2  LEU  13          1HD2      LEU  13   7.679  -5.833  -3.771
   83   2HD2  LEU  13          2HD2      LEU  13   6.684  -6.033  -2.329
   84   3HD2  LEU  13          3HD2      LEU  13   8.428  -5.816  -2.175
   85    H    TYR  14           H        TYR  14   7.785  -3.219   1.750
   86    HA   TYR  14           HA       TYR  14   6.172  -5.497   2.233
   87   1HB   TYR  14          2HB       TYR  14   7.493  -3.445   3.978
   88   2HB   TYR  14          1HB       TYR  14   6.343  -4.560   4.713
   89    HD1  TYR  14           HD1      TYR  14   9.652  -4.187   3.229
   90    HD2  TYR  14           HD2      TYR  14   6.723  -7.022   4.585
   91    HE1  TYR  14           HE1      TYR  14  11.387  -5.962   3.265
   92    HE2  TYR  14           HE2      TYR  14   8.457  -8.797   4.623
   93    HH   TYR  14           HH       TYR  14  10.660  -9.211   4.494
   94    H    GLN  15           H        GLN  15   5.553  -2.248   3.612
   95    HA   GLN  15           HA       GLN  15   2.875  -2.699   4.346
   96   1HB   GLN  15          2HB       GLN  15   3.700  -0.035   3.210
   97   2HB   GLN  15          1HB       GLN  15   2.669  -0.372   4.599
   98   1HG   GLN  15          2HG       GLN  15   4.925  -1.496   5.510
   99   2HG   GLN  15          1HG       GLN  15   5.647  -0.313   4.417
  100   1HE2  GLN  15          1HE2      GLN  15   6.090   0.073   7.142
  101   2HE2  GLN  15          2HE2      GLN  15   5.173   1.386   7.703
  102    H    LEU  16           H        LEU  16   4.295  -2.196   1.245
  103    HA   LEU  16           HA       LEU  16   1.904  -1.465  -0.208
  104   1HB   LEU  16          2HB       LEU  16   4.652  -1.832  -0.746
  105   2HB   LEU  16          1HB       LEU  16   3.799  -2.934  -1.818
  106    HG   LEU  16           HG       LEU  16   3.501   0.061  -1.581
  107   1HD1  LEU  16          1HD1      LEU  16   4.317   0.126  -3.747
  108   2HD1  LEU  16          2HD1      LEU  16   3.685  -1.471  -4.146
  109   3HD1  LEU  16          3HD1      LEU  16   5.146  -1.319  -3.169
  110   1HD2  LEU  16          1HD2      LEU  16   1.249  -0.472  -1.752
  111   2HD2  LEU  16          2HD2      LEU  16   1.568  -2.003  -2.567
  112   3HD2  LEU  16          3HD2      LEU  16   1.695  -0.486  -3.459
  113    H    GLU  17           H        GLU  17   3.535  -4.541   0.518
  114    HA   GLU  17           HA       GLU  17   1.728  -6.177  -1.016
  115   1HB   GLU  17          2HB       GLU  17   3.558  -6.758   1.325
  116   2HB   GLU  17          1HB       GLU  17   2.571  -8.009   0.568
  117   1HG   GLU  17          2HG       GLU  17   3.742  -7.908  -1.444
  118   2HG   GLU  17          1HG       GLU  17   4.296  -6.259  -1.155
  119    H    ASN  18           H        ASN  18   1.602  -4.677   2.103
  120    HA   ASN  18           HA       ASN  18  -0.618  -6.288   3.100
  121   1HB   ASN  18          2HB       ASN  18   0.547  -3.642   4.017
  122   2HB   ASN  18          1HB       ASN  18  -0.728  -4.512   4.870
  123   1HD2  ASN  18          1HD2      ASN  18  -0.111  -6.276   6.198
  124   2HD2  ASN  18          2HD2      ASN  18   1.488  -6.824   6.346
  125    H    TYR  19           H        TYR  19  -0.417  -4.084   0.647
  126    HA   TYR  19           HA       TYR  19  -3.032  -2.800   1.199
  127   1HB   TYR  19          2HB       TYR  19  -0.695  -2.247  -0.508
  128   2HB   TYR  19          1HB       TYR  19  -2.243  -1.960  -1.303
  129    HD1  TYR  19           HD1      TYR  19   0.240  -0.507   0.677
  130    HD2  TYR  19           HD2      TYR  19  -4.033  -0.734   0.303
  131    HE1  TYR  19           HE1      TYR  19   0.022   1.624   1.920
  132    HE2  TYR  19           HE2      TYR  19  -4.255   1.398   1.548
  133    HH   TYR  19           HH       TYR  19  -2.443   3.536   1.882
  134    H    CYS  20           H        CYS  20  -2.251  -5.735   0.309
  135    HA   CYS  20           HA       CYS  20  -4.315  -5.887  -1.841
  136   1HB   CYS  20          2HB       CYS  20  -1.563  -6.894  -1.736
  137   2HB   CYS  20          1HB       CYS  20  -2.742  -8.115  -2.189
  138    H    ASN  21           H        ASN  21  -4.509  -8.635  -1.965
  139    HA   ASN  21           HA       ASN  21  -5.814  -9.228   0.628
  140   1HB   ASN  21          2HB       ASN  21  -6.164 -10.057  -2.183
  141   2HB   ASN  21          1HB       ASN  21  -6.374 -11.353  -1.006
  142   1HD2  ASN  21          1HD2      ASN  21  -7.531  -8.061  -1.834
  143   2HD2  ASN  21          2HD2      ASN  21  -9.023  -8.215  -1.040
  144   1H    PHE   1          1H        PHE   1  15.744  -1.382  -3.245
  145   2H    PHE   1          2H        PHE   1  15.718  -2.924  -3.953
  146   3H    PHE   1          3H        PHE   1  14.886  -2.638  -2.500
  147    HA   PHE   1           HA       PHE   1  14.233  -1.240  -5.028
  148   1HB   PHE   1          2HB       PHE   1  12.204  -3.110  -4.293
  149   2HB   PHE   1          1HB       PHE   1  13.156  -3.071  -5.772
  150    HD1  PHE   1           HD1      PHE   1  13.467  -4.105  -2.173
  151    HD2  PHE   1           HD2      PHE   1  14.525  -4.889  -6.263
  152    HE1  PHE   1           HE1      PHE   1  14.637  -6.179  -1.473
  153    HE2  PHE   1           HE2      PHE   1  15.693  -6.962  -5.564
  154    HZ   PHE   1           HZ       PHE   1  15.749  -7.607  -3.169
  155    H    VAL   2           H        VAL   2  13.795   0.679  -3.862
  156    HA   VAL   2           HA       VAL   2  11.660   0.443  -1.785
  157    HB   VAL   2           HB       VAL   2  12.706   3.073  -1.764
  158   1HG1  VAL   2          1HG1      VAL   2  13.081   0.670   0.041
  159   2HG1  VAL   2          2HG1      VAL   2  11.882   1.955   0.204
  160   3HG1  VAL   2          3HG1      VAL   2  13.590   2.301   0.478
  161   1HG2  VAL   2          1HG2      VAL   2  14.708   2.444  -2.914
  162   2HG2  VAL   2          2HG2      VAL   2  14.836   0.932  -2.015
  163   3HG2  VAL   2          3HG2      VAL   2  15.134   2.471  -1.204
  164    H    ASN   3           H        ASN   3  12.483   1.703  -4.879
  165    HA   ASN   3           HA       ASN   3  11.006   2.535  -6.521
  166   1HB   ASN   3          2HB       ASN   3   8.764   2.372  -6.175
  167   2HB   ASN   3          1HB       ASN   3   9.207   1.600  -4.659
  168   1HD2  ASN   3          1HD2      ASN   3   8.577   4.882  -6.008
  169   2HD2  ASN   3          2HD2      ASN   3   7.908   5.507  -4.580
  170    H    GLN   4           H        GLN   4  10.282   4.761  -7.113
  171    HA   GLN   4           HA       GLN   4  11.556   6.760  -5.294
  172   1HB   GLN   4          2HB       GLN   4  11.522   6.446  -8.263
  173   2HB   GLN   4          1HB       GLN   4  11.515   8.088  -7.616
  174   1HG   GLN   4          2HG       GLN   4  13.416   6.441  -6.181
  175   2HG   GLN   4          1HG       GLN   4  13.749   6.406  -7.912
  176   1HE2  GLN   4          1HE2      GLN   4  15.622   7.719  -6.358
  177   2HE2  GLN   4          2HE2      GLN   4  15.491   9.400  -6.558
  178    H    HIS   5           H        HIS   5   8.759   6.119  -7.389
  179    HA   HIS   5           HA       HIS   5   7.251   8.088  -5.794
  180   1HB   HIS   5          2HB       HIS   5   7.335   8.261  -8.814
  181   2HB   HIS   5          1HB       HIS   5   6.452   9.327  -7.720
  182    HD2  HIS   5           HD2      HIS   5   9.741   9.358  -9.507
  183    HE1  HIS   5           HE1      HIS   5  10.388  11.634  -6.002
  184    HE2  HIS   5           HE2      HIS   5  11.337  11.013  -8.288
  185    H    LEU   6           H        LEU   6   5.947   6.358  -5.052
  186    HA   LEU   6           HA       LEU   6   4.369   4.927  -7.148
  187   1HB   LEU   6          2HB       LEU   6   5.798   3.983  -4.891
  188   2HB   LEU   6          1HB       LEU   6   4.084   3.785  -4.523
  189    HG   LEU   6           HG       LEU   6   3.726   2.529  -6.553
  190   1HD1  LEU   6          1HD1      LEU   6   4.991   2.965  -8.361
  191   2HD1  LEU   6          2HD1      LEU   6   6.371   2.215  -7.560
  192   3HD1  LEU   6          3HD1      LEU   6   6.077   3.945  -7.376
  193   1HD2  LEU   6          1HD2      LEU   6   5.538   1.725  -4.503
  194   2HD2  LEU   6          2HD2      LEU   6   6.159   1.096  -6.030
  195   3HD2  LEU   6          3HD2      LEU   6   4.522   0.695  -5.510
  196    H    CYS   7           H        CYS   7   2.361   5.760  -7.385
  197    HA   CYS   7           HA       CYS   7   0.779   6.362  -4.973
  198   1HB   CYS   7          2HB       CYS   7   1.764   8.419  -6.803
  199   2HB   CYS   7          1HB       CYS   7   0.011   8.451  -6.604
  200    H    GLY   8           H        GLY   8  -1.234   5.591  -5.187
  201   1HA   GLY   8          2HA       GLY   8  -2.883   4.214  -6.214
  202   2HA   GLY   8          1HA       GLY   8  -3.155   5.741  -7.047
  203    H    SER   9           H        SER   9  -2.323   5.992  -9.217
  204    HA   SER   9           HA       SER   9  -2.486   3.803 -10.920
  205   1HB   SER   9          2HB       SER   9  -0.638   5.368 -12.215
  206   2HB   SER   9          1HB       SER   9  -2.376   5.646 -12.237
  207    HG   SER   9           HG       SER   9  -1.242   7.508 -11.570
  208    H    ASP  10           H        ASP  10   0.652   5.297 -10.069
  209    HA   ASP  10           HA       ASP  10   2.165   3.045 -10.960
  210   1HB   ASP  10          2HB       ASP  10   3.163   4.908  -8.820
  211   2HB   ASP  10          1HB       ASP  10   4.053   4.168 -10.149
  212    H    LEU  11           H        LEU  11   0.599   3.739  -7.888
  213    HA   LEU  11           HA       LEU  11   2.083   1.668  -6.471
  214   1HB   LEU  11          2HB       LEU  11  -0.065   3.573  -5.814
  215   2HB   LEU  11          1HB       LEU  11  -0.178   2.032  -4.984
  216    HG   LEU  11           HG       LEU  11   2.303   3.755  -5.059
  217   1HD1  LEU  11          1HD1      LEU  11   1.357   3.508  -2.438
  218   2HD1  LEU  11          2HD1      LEU  11  -0.089   3.814  -3.397
  219   3HD1  LEU  11          3HD1      LEU  11   1.258   4.950  -3.449
  220   1HD2  LEU  11          1HD2      LEU  11   2.512   1.209  -4.799
  221   2HD2  LEU  11          2HD2      LEU  11   1.669   1.408  -3.267
  222   3HD2  LEU  11          3HD2      LEU  11   3.228   2.188  -3.522
  223    H    VAL  12           H        VAL  12  -0.754   1.765  -8.480
  224    HA   VAL  12           HA       VAL  12  -1.771  -0.766  -7.434
  225    HB   VAL  12           HB       VAL  12  -2.918   1.312  -8.844
  226   1HG1  VAL  12          1HG1      VAL  12  -1.962   0.523 -10.971
  227   2HG1  VAL  12          2HG1      VAL  12  -3.717   0.335 -10.966
  228   3HG1  VAL  12          3HG1      VAL  12  -2.678  -1.068 -10.709
  229   1HG2  VAL  12          1HG2      VAL  12  -4.783  -0.598  -9.137
  230   2HG2  VAL  12          2HG2      VAL  12  -4.392   0.107  -7.568
  231   3HG2  VAL  12          3HG2      VAL  12  -3.695  -1.444  -8.036
  232    H    GLU  13           H        GLU  13   0.103   0.330 -10.197
  233    HA   GLU  13           HA       GLU  13   0.214  -2.260 -11.483
  234   1HB   GLU  13          2HB       GLU  13   2.249  -0.020 -11.717
  235   2HB   GLU  13          1HB       GLU  13   1.925  -1.299 -12.888
  236   1HG   GLU  13          2HG       GLU  13  -0.569  -0.164 -12.545
  237   2HG   GLU  13          1HG       GLU  13   0.503   1.232 -12.451
  238    H    ALA  14           H        ALA  14   2.284  -0.524  -9.162
  239    HA   ALA  14           HA       ALA  14   4.262  -2.663  -9.067
  240   1HB   ALA  14          1HB       ALA  14   4.748  -0.268  -8.431
  241   2HB   ALA  14          2HB       ALA  14   5.200  -1.432  -7.186
  242   3HB   ALA  14          3HB       ALA  14   3.720  -0.487  -7.015
  243    H    LEU  15           H        LEU  15   1.392  -1.694  -7.233
  244    HA   LEU  15           HA       LEU  15   1.529  -3.480  -5.065
  245   1HB   LEU  15          2HB       LEU  15  -0.609  -2.105  -6.549
  246   2HB   LEU  15          1HB       LEU  15  -1.128  -3.633  -5.843
  247    HG   LEU  15           HG       LEU  15   0.457  -1.681  -4.202
  248   1HD1  LEU  15          1HD1      LEU  15  -2.497  -1.604  -4.834
  249   2HD1  LEU  15          2HD1      LEU  15  -1.328  -0.288  -4.944
  250   3HD1  LEU  15          3HD1      LEU  15  -1.831  -0.891  -3.365
  251   1HD2  LEU  15          1HD2      LEU  15  -1.791  -3.464  -3.305
  252   2HD2  LEU  15          2HD2      LEU  15  -0.403  -2.885  -2.385
  253   3HD2  LEU  15          3HD2      LEU  15  -0.192  -4.146  -3.599
  254    H    TYR  16           H        TYR  16  -0.110  -4.066  -8.152
  255    HA   TYR  16           HA       TYR  16  -0.599  -6.814  -7.883
  256   1HB   TYR  16          2HB       TYR  16  -1.575  -6.097  -9.831
  257   2HB   TYR  16          1HB       TYR  16  -0.333  -4.886 -10.120
  258    HD1  TYR  16           HD1      TYR  16  -0.928  -8.586 -10.253
  259    HD2  TYR  16           HD2      TYR  16   1.297  -5.236 -11.767
  260    HE1  TYR  16           HE1      TYR  16   0.112 -10.049 -11.966
  261    HE2  TYR  16           HE2      TYR  16   2.335  -6.700 -13.479
  262    HH   TYR  16           HH       TYR  16   2.811  -9.315 -13.613
  263    H    LEU  17           H        LEU  17   2.353  -5.166  -8.971
  264    HA   LEU  17           HA       LEU  17   3.837  -7.575  -9.576
  265   1HB   LEU  17          2HB       LEU  17   4.259  -4.852  -9.882
  266   2HB   LEU  17          1HB       LEU  17   5.369  -5.258  -8.574
  267    HG   LEU  17           HG       LEU  17   5.693  -7.329 -10.409
  268   1HD1  LEU  17          1HD1      LEU  17   5.888  -6.384 -12.563
  269   2HD1  LEU  17          2HD1      LEU  17   5.851  -4.737 -11.936
  270   3HD1  LEU  17          3HD1      LEU  17   4.379  -5.708 -11.950
  271   1HD2  LEU  17          1HD2      LEU  17   7.401  -6.081  -9.020
  272   2HD2  LEU  17          2HD2      LEU  17   7.344  -4.795 -10.224
  273   3HD2  LEU  17          3HD2      LEU  17   7.910  -6.401 -10.678
  274    H    VAL  18           H        VAL  18   3.152  -5.631  -6.837
  275    HA   VAL  18           HA       VAL  18   4.963  -6.841  -4.933
  276    HB   VAL  18           HB       VAL  18   2.871  -4.772  -5.117
  277   1HG1  VAL  18          1HG1      VAL  18   2.827  -4.757  -2.492
  278   2HG1  VAL  18          2HG1      VAL  18   3.091  -6.490  -2.688
  279   3HG1  VAL  18          3HG1      VAL  18   1.670  -5.726  -3.404
  280   1HG2  VAL  18          1HG2      VAL  18   5.010  -3.948  -5.014
  281   2HG2  VAL  18          2HG2      VAL  18   5.532  -5.161  -3.846
  282   3HG2  VAL  18          3HG2      VAL  18   4.507  -3.823  -3.329
  283    H    CYS  19           H        CYS  19   1.514  -6.826  -5.398
  284    HA   CYS  19           HA       CYS  19   0.742  -8.784  -3.509
  285   1HB   CYS  19          2HB       CYS  19  -0.611  -8.146  -6.141
  286   2HB   CYS  19          1HB       CYS  19  -1.374  -8.717  -4.667
  287    H    GLY  20           H        GLY  20   2.241  -9.098  -6.597
  288   1HA   GLY  20          2HA       GLY  20   3.079 -11.069  -7.594
  289   2HA   GLY  20          1HA       GLY  20   2.347 -12.003  -6.290
  290    H    GLU  21           H        GLU  21  -0.044 -12.355  -6.434
  291    HA   GLU  21           HA       GLU  21  -1.206 -11.927  -9.122
  292   1HB   GLU  21          2HB       GLU  21  -1.825 -14.365  -9.268
  293   2HB   GLU  21          1HB       GLU  21  -0.096 -14.047  -9.428
  294   1HG   GLU  21          2HG       GLU  21   0.410 -15.027  -7.420
  295   2HG   GLU  21          1HG       GLU  21  -1.094 -14.498  -6.665
  296    H    ARG  22           H        ARG  22  -1.737 -11.288  -6.110
  297    HA   ARG  22           HA       ARG  22  -4.444 -12.520  -5.920
  298   1HB   ARG  22          2HB       ARG  22  -4.469 -11.879  -3.616
  299   2HB   ARG  22          1HB       ARG  22  -2.863 -12.537  -3.926
  300   1HG   ARG  22          2HG       ARG  22  -2.816  -9.753  -4.547
  301   2HG   ARG  22          1HG       ARG  22  -3.539  -9.945  -2.951
  302   1HD   ARG  22          2HD       ARG  22  -1.153 -11.624  -3.488
  303   2HD   ARG  22          1HD       ARG  22  -0.853  -9.891  -3.357
  304    HE   ARG  22           HE       ARG  22  -2.350 -10.296  -1.144
  305   1HH1  ARG  22          1HH2      ARG  22   0.790 -10.391  -1.433
  306   2HH1  ARG  22          2HH2      ARG  22   1.121 -11.755  -0.417
  307   1HH2  ARG  22          1HH1      ARG  22  -2.181 -12.802  -0.294
  308   2HH2  ARG  22          2HH1      ARG  22  -0.560 -13.119   0.227
  309    H    GLY  23           H        GLY  23  -5.947 -10.673  -4.651
  310   1HA   GLY  23          2HA       GLY  23  -6.124  -8.521  -6.694
  311   2HA   GLY  23          1HA       GLY  23  -7.435  -9.029  -5.631
  312    H    PHE  24           H        PHE  24  -6.796  -6.308  -5.878
  313    HA   PHE  24           HA       PHE  24  -5.513  -5.751  -3.232
  314   1HB   PHE  24          2HB       PHE  24  -5.068  -3.441  -4.192
  315   2HB   PHE  24          1HB       PHE  24  -4.129  -4.736  -4.911
  316    HD1  PHE  24           HD1      PHE  24  -7.460  -3.062  -5.377
  317    HD2  PHE  24           HD2      PHE  24  -4.017  -4.848  -7.229
  318    HE1  PHE  24           HE1      PHE  24  -8.379  -2.515  -7.616
  319    HE2  PHE  24           HE2      PHE  24  -4.936  -4.300  -9.467
  320    HZ   PHE  24           HZ       PHE  24  -7.118  -3.133  -9.660
  321    H    PHE  25           H        PHE  25  -6.282  -3.330  -2.617
  322    HA   PHE  25           HA       PHE  25  -9.273  -3.395  -2.731
  323   1HB   PHE  25          2HB       PHE  25  -7.511  -2.124  -0.612
  324   2HB   PHE  25          1HB       PHE  25  -9.267  -2.281  -0.565
  325    HD1  PHE  25           HD1      PHE  25  -6.185  -3.773   0.383
  326    HD2  PHE  25           HD2      PHE  25 -10.207  -4.727  -0.792
  327    HE1  PHE  25           HE1      PHE  25  -5.959  -6.012   1.427
  328    HE2  PHE  25           HE2      PHE  25  -9.981  -6.967   0.251
  329    HZ   PHE  25           HZ       PHE  25  -7.856  -7.610   1.360
  330    H    TYR  26           H        TYR  26  -9.549  -2.037  -4.539
  331    HA   TYR  26           HA       TYR  26  -9.223   0.807  -4.072
  332   1HB   TYR  26          2HB       TYR  26  -6.899   0.219  -4.688
  333   2HB   TYR  26          1HB       TYR  26  -7.483  -0.501  -6.187
  334    HD1  TYR  26           HD1      TYR  26  -8.963   2.544  -4.704
  335    HD2  TYR  26           HD2      TYR  26  -6.274   0.984  -7.670
  336    HE1  TYR  26           HE1      TYR  26  -8.881   4.768  -5.801
  337    HE2  TYR  26           HE2      TYR  26  -6.192   3.205  -8.768
  338    HH   TYR  26           HH       TYR  26  -6.857   5.912  -7.492
  339    H    THR  27           H        THR  27 -11.569   0.012  -4.530
  340    HA   THR  27           HA       THR  27 -12.052  -0.039  -7.481
  341    HB   THR  27           HB       THR  27 -12.976  -1.995  -6.390
  342    HG1  THR  27           HG1      THR  27 -14.622  -1.663  -7.619
  343   1HG2  THR  27          1HG2      THR  27 -14.171   0.024  -4.479
  344   2HG2  THR  27          2HG2      THR  27 -13.050  -1.284  -4.100
  345   3HG2  THR  27          3HG2      THR  27 -14.710  -1.653  -4.568
  346    H    LYS  28           H        LYS  28 -13.231   1.618  -8.386
  347    HA   LYS  28           HA       LYS  28 -14.422   3.638  -8.531
  348   1HB   LYS  28          2HB       LYS  28 -15.276   3.318  -5.660
  349   2HB   LYS  28          1HB       LYS  28 -16.188   3.977  -7.021
  350   1HG   LYS  28          2HG       LYS  28 -15.495   1.055  -6.529
  351   2HG   LYS  28          1HG       LYS  28 -17.100   1.776  -6.526
  352   1HD   LYS  28          2HD       LYS  28 -15.269   1.388  -8.930
  353   2HD   LYS  28          1HD       LYS  28 -16.835   0.626  -8.647
  354   1HE   LYS  28          2HE       LYS  28 -17.493   3.278  -8.434
  355   2HE   LYS  28          1HE       LYS  28 -16.220   3.335  -9.654
  356   1HZ   LYS  28          1HZ       LYS  28 -17.489   1.365 -10.677
  357   2HZ   LYS  28          2HZ       LYS  28 -18.113   2.931 -10.890
  358   3HZ   LYS  28          3HZ       LYS  28 -18.791   1.895  -9.728
  359    HA   PRO  29           HA       PRO  29 -11.066   5.764  -6.259
  360   1HB   PRO  29          2HB       PRO  29 -10.180   7.146  -8.467
  361   2HB   PRO  29          1HB       PRO  29  -9.617   5.521  -8.040
  362   1HG   PRO  29          2HG       PRO  29 -11.500   6.345 -10.202
  363   2HG   PRO  29          1HG       PRO  29 -10.442   4.927 -10.117
  364   1HD   PRO  29          2HD       PRO  29 -13.230   4.946  -9.626
  365   2HD   PRO  29          1HD       PRO  29 -12.108   3.630  -9.224
  366    H    THR  30           H        THR  30 -10.764   8.194  -6.033
  367    HA   THR  30           HA       THR  30 -13.309   9.520  -5.816
  368    HB   THR  30           HB       THR  30 -10.522  10.719  -5.734
  369    HG1  THR  30           HG1      THR  30 -10.437   9.540  -4.001
  370   1HG2  THR  30          1HG2      THR  30 -13.019  11.966  -5.781
  371   2HG2  THR  30          2HG2      THR  30 -11.505  12.684  -5.231
  372   3HG2  THR  30          3HG2      THR  30 -12.590  11.915  -4.071
  Start of MODEL    7
    1   1H    GLY   1          1H        GLY   1  -8.711   5.296   3.644
    2   2H    GLY   1          2H        GLY   1  -8.529   6.410   4.912
    3   3H    GLY   1          3H        GLY   1  -7.877   4.848   5.053
    4   1HA   GLY   1          1HA       GLY   1  -6.924   6.596   2.942
    5   2HA   GLY   1          2HA       GLY   1  -6.234   6.774   4.585
    6    H    ALA   2           H        ALA   2  -7.532   4.866   1.726
    7    HA   ALA   2           HA       ALA   2  -4.904   3.470   1.438
    8   1HB   ALA   2          1HB       ALA   2  -6.054   1.666   0.414
    9   2HB   ALA   2          2HB       ALA   2  -7.486   2.647   0.105
   10   3HB   ALA   2          3HB       ALA   2  -7.102   2.143   1.751
   11    H    VAL   3           H        VAL   3  -3.706   4.706   0.029
   12    HA   VAL   3           HA       VAL   3  -4.199   4.750  -2.717
   13    HB   VAL   3           HB       VAL   3  -6.099   6.093  -2.580
   14   1HG1  VAL   3          1HG1      VAL   3  -6.553   6.917  -0.536
   15   2HG1  VAL   3          2HG1      VAL   3  -5.597   8.322  -1.005
   16   3HG1  VAL   3          3HG1      VAL   3  -4.844   7.003  -0.110
   17   1HG2  VAL   3          1HG2      VAL   3  -4.495   8.531  -2.664
   18   2HG2  VAL   3          2HG2      VAL   3  -5.450   7.774  -3.939
   19   3HG2  VAL   3          3HG2      VAL   3  -3.796   7.242  -3.644
   20    H    GLU   4           H        GLU   4  -3.412   7.860  -1.274
   21    HA   GLU   4           HA       GLU   4  -0.780   7.825  -2.450
   22   1HB   GLU   4          2HB       GLU   4  -1.709   9.674  -0.243
   23   2HB   GLU   4          1HB       GLU   4  -0.502   9.994  -1.491
   24   1HG   GLU   4          2HG       GLU   4  -2.581   9.431  -3.087
   25   2HG   GLU   4          1HG       GLU   4  -3.478  10.011  -1.684
   26    H    GLN   5           H        GLN   5   0.592   9.074  -0.153
   27    HA   GLN   5           HA       GLN   5   1.783   8.477   1.795
   28   1HB   GLN   5          2HB       GLN   5   0.301   5.844   1.836
   29   2HB   GLN   5          1HB       GLN   5   1.041   6.707   3.183
   30   1HG   GLN   5          2HG       GLN   5  -0.643   8.576   2.734
   31   2HG   GLN   5          1HG       GLN   5  -1.478   7.439   1.677
   32   1HE2  GLN   5          1HE2      GLN   5   0.160   6.801   4.821
   33   2HE2  GLN   5          2HE2      GLN   5  -1.228   6.197   5.587
   34    H    CYS   6           H        CYS   6   2.684   7.933  -0.888
   35    HA   CYS   6           HA       CYS   6   4.752   5.973  -0.252
   36   1HB   CYS   6          2HB       CYS   6   2.513   5.316  -2.133
   37   2HB   CYS   6          1HB       CYS   6   4.133   4.736  -2.510
   38    H    CYS   7           H        CYS   7   3.186   7.649  -3.009
   39    HA   CYS   7           HA       CYS   7   5.686   7.998  -4.418
   40   1HB   CYS   7          2HB       CYS   7   4.433   9.374  -5.951
   41   2HB   CYS   7          1HB       CYS   7   3.391   8.027  -5.481
   42    H    THR   8           H        THR   8   6.102  10.537  -5.071
   43    HA   THR   8           HA       THR   8   7.306  12.373  -4.193
   44    HB   THR   8           HB       THR   8   4.964  13.195  -4.179
   45    HG1  THR   8           HG1      THR   8   5.343  14.602  -2.208
   46   1HG2  THR   8          1HG2      THR   8   4.974  12.006  -1.396
   47   2HG2  THR   8          2HG2      THR   8   3.909  11.581  -2.736
   48   3HG2  THR   8          3HG2      THR   8   3.763  13.157  -1.959
   49    H    SER   9           H        SER   9   7.704   9.770  -2.877
   50    HA   SER   9           HA       SER   9   9.394  10.467  -0.755
   51   1HB   SER   9          2HB       SER   9   6.631  10.626  -0.004
   52   2HB   SER   9          1HB       SER   9   7.335   9.233   0.810
   53    HG   SER   9           HG       SER   9   8.926  10.577   1.646
   54    H    ILE  10           H        ILE  10   8.813   8.119   0.929
   55    HA   ILE  10           HA       ILE  10   8.655   5.906  -1.008
   56    HB   ILE  10           HB       ILE  10  11.000   5.552   0.707
   57   1HG1  ILE  10          2HG1      ILE  10  10.991   8.097   0.021
   58   2HG1  ILE  10          1HG1      ILE  10  12.455   7.149  -0.213
   59   1HG2  ILE  10          1HG2      ILE  10  10.972   3.983  -0.937
   60   2HG2  ILE  10          2HG2      ILE  10  11.761   5.237  -1.896
   61   3HG2  ILE  10          3HG2      ILE  10  10.018   4.996  -2.020
   62   1HD1  ILE  10          1HD1      ILE  10  12.358   7.359  -2.460
   63   2HD1  ILE  10          2HD1      ILE  10  11.156   8.619  -2.179
   64   3HD1  ILE  10          3HD1      ILE  10  10.639   6.965  -2.502
   65    H    CYS  11           H        CYS  11   6.921   5.045   0.092
   66    HA   CYS  11           HA       CYS  11   6.834   4.777   2.968
   67   1HB   CYS  11          2HB       CYS  11   4.939   3.135   2.413
   68   2HB   CYS  11          1HB       CYS  11   4.731   4.789   1.845
   69    H    SER  12           H        SER  12   6.013   1.726   1.781
   70    HA   SER  12           HA       SER  12   8.720   0.597   1.969
   71   1HB   SER  12          2HB       SER  12   7.212   0.851   4.305
   72   2HB   SER  12          1HB       SER  12   6.956  -0.820   3.809
   73    HG   SER  12           HG       SER  12   8.820  -0.764   5.009
   74    H    LEU  13           H        LEU  13   8.563  -0.547   0.070
   75    HA   LEU  13           HA       LEU  13   6.365  -1.636  -1.208
   76   1HB   LEU  13          2HB       LEU  13   8.908  -1.749  -1.815
   77   2HB   LEU  13          1HB       LEU  13   8.876  -3.289  -0.958
   78    HG   LEU  13           HG       LEU  13   8.469  -3.493  -3.434
   79   1HD1  LEU  13          1HD1      LEU  13   7.068  -5.277  -3.089
   80   2HD1  LEU  13          2HD1      LEU  13   5.913  -4.323  -2.160
   81   3HD1  LEU  13          3HD1      LEU  13   7.392  -4.902  -1.397
   82   1HD2  LEU  13          1HD2      LEU  13   5.678  -2.590  -3.136
   83   2HD2  LEU  13          2HD2      LEU  13   6.796  -2.355  -4.480
   84   3HD2  LEU  13          3HD2      LEU  13   6.867  -1.291  -3.075
   85    H    TYR  14           H        TYR  14   7.946  -2.852   1.697
   86    HA   TYR  14           HA       TYR  14   6.668  -5.424   1.750
   87   1HB   TYR  14          2HB       TYR  14   7.688  -3.663   4.001
   88   2HB   TYR  14          1HB       TYR  14   7.141  -5.326   4.218
   89    HD1  TYR  14           HD1      TYR  14  10.020  -3.562   4.111
   90    HD2  TYR  14           HD2      TYR  14   8.152  -6.808   2.000
   91    HE1  TYR  14           HE1      TYR  14  12.251  -4.394   3.414
   92    HE2  TYR  14           HE2      TYR  14  10.385  -7.639   1.305
   93    HH   TYR  14           HH       TYR  14  12.718  -7.483   2.051
   94    H    GLN  15           H        GLN  15   5.841  -2.345   3.376
   95    HA   GLN  15           HA       GLN  15   3.318  -3.238   4.398
   96   1HB   GLN  15          2HB       GLN  15   4.167  -0.431   3.605
   97   2HB   GLN  15          1HB       GLN  15   2.810  -0.836   4.654
   98   1HG   GLN  15          2HG       GLN  15   4.306  -1.805   6.304
   99   2HG   GLN  15          1HG       GLN  15   5.690  -1.585   5.233
  100   1HE2  GLN  15          1HE2      GLN  15   6.370  -0.301   7.341
  101   2HE2  GLN  15          2HE2      GLN  15   5.968   1.349   7.357
  102    H    LEU  16           H        LEU  16   4.411  -2.266   1.284
  103    HA   LEU  16           HA       LEU  16   1.913  -1.507   0.091
  104   1HB   LEU  16          2HB       LEU  16   4.523  -1.551  -0.693
  105   2HB   LEU  16          1HB       LEU  16   3.887  -2.898  -1.621
  106    HG   LEU  16           HG       LEU  16   3.017  -0.009  -1.661
  107   1HD1  LEU  16          1HD1      LEU  16   4.014  -2.010  -3.695
  108   2HD1  LEU  16          2HD1      LEU  16   4.750  -0.474  -3.231
  109   3HD1  LEU  16          3HD1      LEU  16   3.253  -0.491  -4.163
  110   1HD2  LEU  16          1HD2      LEU  16   1.058  -0.580  -2.889
  111   2HD2  LEU  16          2HD2      LEU  16   1.048  -1.667  -1.503
  112   3HD2  LEU  16          3HD2      LEU  16   1.572  -2.254  -3.079
  113    H    GLU  17           H        GLU  17   3.496  -4.617   0.651
  114    HA   GLU  17           HA       GLU  17   1.709  -6.187  -0.967
  115   1HB   GLU  17          2HB       GLU  17   3.318  -6.914   1.504
  116   2HB   GLU  17          1HB       GLU  17   2.472  -8.083   0.492
  117   1HG   GLU  17          2HG       GLU  17   4.058  -6.366  -1.183
  118   2HG   GLU  17          1HG       GLU  17   5.076  -7.019   0.100
  119    H    ASN  18           H        ASN  18   1.469  -4.661   2.121
  120    HA   ASN  18           HA       ASN  18  -0.814  -6.235   3.044
  121   1HB   ASN  18          2HB       ASN  18   0.226  -3.553   4.012
  122   2HB   ASN  18          1HB       ASN  18  -0.932  -4.582   4.857
  123   1HD2  ASN  18          1HD2      ASN  18   0.259  -7.124   4.471
  124   2HD2  ASN  18          2HD2      ASN  18   1.759  -7.160   5.265
  125    H    TYR  19           H        TYR  19  -0.503  -4.111   0.553
  126    HA   TYR  19           HA       TYR  19  -3.150  -2.829   1.029
  127   1HB   TYR  19          2HB       TYR  19  -0.693  -2.095  -0.419
  128   2HB   TYR  19          1HB       TYR  19  -2.177  -1.773  -1.321
  129    HD1  TYR  19           HD1      TYR  19   0.001  -0.703   1.321
  130    HD2  TYR  19           HD2      TYR  19  -4.041  -0.463  -0.114
  131    HE1  TYR  19           HE1      TYR  19  -0.375   1.303   2.726
  132    HE2  TYR  19           HE2      TYR  19  -4.419   1.545   1.290
  133    HH   TYR  19           HH       TYR  19  -2.113   2.576   3.686
  134    H    CYS  20           H        CYS  20  -2.057  -5.630  -0.120
  135    HA   CYS  20           HA       CYS  20  -3.629  -5.708  -2.617
  136   1HB   CYS  20          2HB       CYS  20  -1.833  -7.716  -1.237
  137   2HB   CYS  20          1HB       CYS  20  -2.629  -7.977  -2.770
  138    H    ASN  21           H        ASN  21  -4.446  -8.360  -2.522
  139    HA   ASN  21           HA       ASN  21  -6.853  -8.197  -0.959
  140   1HB   ASN  21          2HB       ASN  21  -5.562 -10.168  -2.760
  141   2HB   ASN  21          1HB       ASN  21  -6.666 -10.841  -1.568
  142   1HD2  ASN  21          1HD2      ASN  21  -8.627 -11.156  -2.665
  143   2HD2  ASN  21          2HD2      ASN  21  -9.390  -9.984  -3.626
  144   1H    PHE   1          1H        PHE   1  12.794  -3.073  -6.259
  145   2H    PHE   1          2H        PHE   1  13.113  -2.188  -7.673
  146   3H    PHE   1          3H        PHE   1  12.506  -3.771  -7.777
  147    HA   PHE   1           HA       PHE   1  10.981  -1.600  -7.979
  148   1HB   PHE   1          2HB       PHE   1  10.385  -4.354  -6.880
  149   2HB   PHE   1          1HB       PHE   1   9.108  -3.181  -7.211
  150    HD1  PHE   1           HD1      PHE   1  10.839  -5.873  -8.578
  151    HD2  PHE   1           HD2      PHE   1   9.463  -1.935  -9.610
  152    HE1  PHE   1           HE1      PHE   1  10.910  -6.480 -10.982
  153    HE2  PHE   1           HE2      PHE   1   9.532  -2.541 -12.015
  154    HZ   PHE   1           HZ       PHE   1  10.256  -4.815 -12.701
  155    H    VAL   2           H        VAL   2  12.605  -0.909  -5.745
  156    HA   VAL   2           HA       VAL   2  10.473  -0.182  -3.824
  157    HB   VAL   2           HB       VAL   2  11.878  -0.893  -1.890
  158   1HG1  VAL   2          1HG1      VAL   2  11.144  -3.119  -1.930
  159   2HG1  VAL   2          2HG1      VAL   2  11.486  -3.302  -3.650
  160   3HG1  VAL   2          3HG1      VAL   2  10.092  -2.360  -3.124
  161   1HG2  VAL   2          1HG2      VAL   2  13.492  -2.734  -3.532
  162   2HG2  VAL   2          2HG2      VAL   2  13.970  -1.752  -2.147
  163   3HG2  VAL   2          3HG2      VAL   2  13.898  -1.033  -3.756
  164    H    ASN   3           H        ASN   3  11.217   1.565  -2.343
  165    HA   ASN   3           HA       ASN   3  12.528   3.439  -1.784
  166   1HB   ASN   3          2HB       ASN   3  14.484   2.715  -3.953
  167   2HB   ASN   3          1HB       ASN   3  14.775   3.593  -2.453
  168   1HD2  ASN   3          1HD2      ASN   3  13.614   1.925  -0.537
  169   2HD2  ASN   3          2HD2      ASN   3  14.395   0.417  -0.532
  170    H    GLN   4           H        GLN   4  10.526   3.118  -4.077
  171    HA   GLN   4           HA       GLN   4  11.378   5.556  -5.583
  172   1HB   GLN   4          2HB       GLN   4  10.140   4.743  -7.501
  173   2HB   GLN   4          1HB       GLN   4  11.222   3.458  -6.962
  174   1HG   GLN   4          2HG       GLN   4   9.383   2.392  -5.735
  175   2HG   GLN   4          1HG       GLN   4   8.293   3.692  -6.219
  176   1HE2  GLN   4          1HE2      GLN   4   9.248   3.961  -8.954
  177   2HE2  GLN   4          2HE2      GLN   4   8.784   2.560  -9.794
  178    H    HIS   5           H        HIS   5   9.002   6.225  -6.776
  179    HA   HIS   5           HA       HIS   5   7.366   7.025  -4.422
  180   1HB   HIS   5          2HB       HIS   5   7.246   8.132  -7.239
  181   2HB   HIS   5          1HB       HIS   5   6.587   8.859  -5.773
  182    HD2  HIS   5           HD2      HIS   5  10.110   8.248  -7.440
  183    HE1  HIS   5           HE1      HIS   5  10.552  10.999  -4.259
  184    HE2  HIS   5           HE2      HIS   5  11.741   9.856  -6.207
  185    H    LEU   6           H        LEU   6   5.378   6.122  -4.133
  186    HA   LEU   6           HA       LEU   6   4.089   4.780  -6.480
  187   1HB   LEU   6          2HB       LEU   6   4.922   3.715  -3.932
  188   2HB   LEU   6          1HB       LEU   6   3.173   3.575  -4.096
  189    HG   LEU   6           HG       LEU   6   3.362   2.344  -6.128
  190   1HD1  LEU   6          1HD1      LEU   6   6.018   3.632  -6.180
  191   2HD1  LEU   6          2HD1      LEU   6   4.956   3.185  -7.514
  192   3HD1  LEU   6          3HD1      LEU   6   5.989   1.968  -6.765
  193   1HD2  LEU   6          1HD2      LEU   6   4.161   1.280  -3.847
  194   2HD2  LEU   6          2HD2      LEU   6   5.735   1.258  -4.643
  195   3HD2  LEU   6          3HD2      LEU   6   4.374   0.392  -5.356
  196    H    CYS   7           H        CYS   7   2.099   5.563  -6.938
  197    HA   CYS   7           HA       CYS   7   0.352   6.484  -4.762
  198   1HB   CYS   7          2HB       CYS   7   1.723   8.341  -6.576
  199   2HB   CYS   7          1HB       CYS   7  -0.027   8.561  -6.522
  200    H    GLY   8           H        GLY   8  -1.707   5.920  -5.199
  201   1HA   GLY   8          2HA       GLY   8  -3.362   4.670  -6.357
  202   2HA   GLY   8          1HA       GLY   8  -3.329   6.132  -7.337
  203    H    SER   9           H        SER   9  -2.156   6.085  -9.367
  204    HA   SER   9           HA       SER   9  -2.310   3.683 -10.829
  205   1HB   SER   9          2HB       SER   9  -2.142   5.883 -11.902
  206   2HB   SER   9          1HB       SER   9  -0.498   6.071 -11.297
  207    HG   SER   9           HG       SER   9  -1.206   4.991 -13.544
  208    H    ASP  10           H        ASP  10   0.860   5.213 -10.288
  209    HA   ASP  10           HA       ASP  10   2.428   2.953 -10.651
  210   1HB   ASP  10          2HB       ASP  10   2.948   5.067  -8.539
  211   2HB   ASP  10          1HB       ASP  10   4.152   4.047  -9.328
  212    H    LEU  11           H        LEU  11   0.368   3.669  -7.929
  213    HA   LEU  11           HA       LEU  11   1.627   1.696  -6.182
  214   1HB   LEU  11          2HB       LEU  11  -0.605   3.598  -5.999
  215   2HB   LEU  11          1HB       LEU  11  -0.877   2.085  -5.145
  216    HG   LEU  11           HG       LEU  11   1.534   3.872  -4.841
  217   1HD1  LEU  11          1HD1      LEU  11  -0.555   3.174  -2.777
  218   2HD1  LEU  11          2HD1      LEU  11  -0.698   4.594  -3.812
  219   3HD1  LEU  11          3HD1      LEU  11   0.663   4.447  -2.701
  220   1HD2  LEU  11          1HD2      LEU  11   0.860   1.108  -3.957
  221   2HD2  LEU  11          2HD2      LEU  11   1.692   2.142  -2.795
  222   3HD2  LEU  11          3HD2      LEU  11   2.429   1.803  -4.361
  223    H    VAL  12           H        VAL  12  -0.763   1.639  -8.680
  224    HA   VAL  12           HA       VAL  12  -1.955  -0.881  -7.764
  225    HB   VAL  12           HB       VAL  12  -2.267   0.843 -10.225
  226   1HG1  VAL  12          1HG1      VAL  12  -3.944  -0.732 -11.049
  227   2HG1  VAL  12          2HG1      VAL  12  -3.643  -1.804  -9.680
  228   3HG1  VAL  12          3HG1      VAL  12  -2.388  -1.548 -10.894
  229   1HG2  VAL  12          1HG2      VAL  12  -3.676   0.413  -7.684
  230   2HG2  VAL  12          2HG2      VAL  12  -4.736   0.370  -9.093
  231   3HG2  VAL  12          3HG2      VAL  12  -3.735   1.788  -8.784
  232    H    GLU  13           H        GLU  13  -0.049   0.137 -10.578
  233    HA   GLU  13           HA       GLU  13   0.414  -2.484 -11.585
  234   1HB   GLU  13          2HB       GLU  13   2.368  -0.197 -11.856
  235   2HB   GLU  13          1HB       GLU  13   2.014  -1.479 -13.018
  236   1HG   GLU  13          2HG       GLU  13  -0.442  -0.498 -12.867
  237   2HG   GLU  13          1HG       GLU  13   0.402   0.958 -12.338
  238    H    ALA  14           H        ALA  14   2.064  -0.607  -9.089
  239    HA   ALA  14           HA       ALA  14   4.237  -2.571  -8.856
  240   1HB   ALA  14          1HB       ALA  14   3.404  -0.346  -6.952
  241   2HB   ALA  14          2HB       ALA  14   4.576  -0.163  -8.257
  242   3HB   ALA  14          3HB       ALA  14   4.922  -1.240  -6.905
  243    H    LEU  15           H        LEU  15   1.226  -1.712  -7.200
  244    HA   LEU  15           HA       LEU  15   1.349  -3.469  -5.000
  245   1HB   LEU  15          2HB       LEU  15  -0.795  -2.163  -6.568
  246   2HB   LEU  15          1HB       LEU  15  -1.284  -3.632  -5.737
  247    HG   LEU  15           HG       LEU  15   0.285  -1.495  -4.315
  248   1HD1  LEU  15          1HD1      LEU  15  -1.562  -0.231  -3.883
  249   2HD1  LEU  15          2HD1      LEU  15  -2.640  -1.626  -3.891
  250   3HD1  LEU  15          3HD1      LEU  15  -2.119  -0.906  -5.415
  251   1HD2  LEU  15          1HD2      LEU  15  -0.005  -3.847  -3.390
  252   2HD2  LEU  15          2HD2      LEU  15  -1.730  -3.499  -3.278
  253   3HD2  LEU  15          3HD2      LEU  15  -0.576  -2.552  -2.338
  254    H    TYR  16           H        TYR  16  -0.156  -4.103  -8.164
  255    HA   TYR  16           HA       TYR  16  -0.624  -6.872  -7.803
  256   1HB   TYR  16          2HB       TYR  16  -1.631  -6.023  -9.738
  257   2HB   TYR  16          1HB       TYR  16  -0.207  -5.095 -10.197
  258    HD1  TYR  16           HD1      TYR  16  -0.939  -8.720  -9.478
  259    HD2  TYR  16           HD2      TYR  16   0.794  -5.837 -12.152
  260    HE1  TYR  16           HE1      TYR  16  -0.214 -10.553 -10.987
  261    HE2  TYR  16           HE2      TYR  16   1.517  -7.668 -13.660
  262    HH   TYR  16           HH       TYR  16   1.253  -9.873 -14.131
  263    H    LEU  17           H        LEU  17   2.273  -5.152  -8.939
  264    HA   LEU  17           HA       LEU  17   3.828  -7.532  -9.482
  265   1HB   LEU  17          2HB       LEU  17   4.212  -4.827  -9.868
  266   2HB   LEU  17          1HB       LEU  17   5.281  -5.145  -8.502
  267    HG   LEU  17           HG       LEU  17   6.237  -7.077  -9.816
  268   1HD1  LEU  17          1HD1      LEU  17   5.293  -5.905 -12.351
  269   2HD1  LEU  17          2HD1      LEU  17   4.033  -6.708 -11.414
  270   3HD1  LEU  17          3HD1      LEU  17   5.476  -7.599 -11.895
  271   1HD2  LEU  17          1HD2      LEU  17   6.427  -4.315 -11.063
  272   2HD2  LEU  17          2HD2      LEU  17   7.595  -5.617 -11.288
  273   3HD2  LEU  17          3HD2      LEU  17   7.378  -4.894  -9.695
  274    H    VAL  18           H        VAL  18   2.900  -5.692  -6.761
  275    HA   VAL  18           HA       VAL  18   4.782  -6.825  -4.851
  276    HB   VAL  18           HB       VAL  18   2.686  -4.766  -5.033
  277   1HG1  VAL  18          1HG1      VAL  18   2.703  -4.804  -2.381
  278   2HG1  VAL  18          2HG1      VAL  18   2.860  -6.539  -2.658
  279   3HG1  VAL  18          3HG1      VAL  18   1.484  -5.660  -3.320
  280   1HG2  VAL  18          1HG2      VAL  18   4.732  -3.820  -4.851
  281   2HG2  VAL  18          2HG2      VAL  18   5.383  -5.158  -3.903
  282   3HG2  VAL  18          3HG2      VAL  18   4.364  -3.942  -3.131
  283    H    CYS  19           H        CYS  19   1.298  -6.866  -5.285
  284    HA   CYS  19           HA       CYS  19   0.491  -8.778  -3.428
  285   1HB   CYS  19          2HB       CYS  19  -0.588  -8.643  -6.259
  286   2HB   CYS  19          1HB       CYS  19  -1.459  -9.111  -4.807
  287    H    GLY  20           H        GLY  20   2.271  -9.201  -6.381
  288   1HA   GLY  20          2HA       GLY  20   3.213 -11.097  -7.365
  289   2HA   GLY  20          1HA       GLY  20   3.170 -11.811  -5.752
  290    H    GLU  21           H        GLU  21   0.908 -11.006  -8.403
  291    HA   GLU  21           HA       GLU  21  -0.628 -12.439  -9.480
  292   1HB   GLU  21          2HB       GLU  21  -0.376 -14.685  -9.271
  293   2HB   GLU  21          1HB       GLU  21   1.008 -14.288  -8.259
  294   1HG   GLU  21          2HG       GLU  21  -0.628 -14.250  -6.285
  295   2HG   GLU  21          1HG       GLU  21  -1.798 -14.993  -7.375
  296    H    ARG  22           H        ARG  22  -0.643 -12.274  -5.928
  297    HA   ARG  22           HA       ARG  22  -3.419 -12.702  -5.515
  298   1HB   ARG  22          2HB       ARG  22  -1.212 -11.395  -4.021
  299   2HB   ARG  22          1HB       ARG  22  -2.845 -10.898  -3.575
  300   1HG   ARG  22          2HG       ARG  22  -2.452 -13.814  -3.932
  301   2HG   ARG  22          1HG       ARG  22  -1.624 -13.097  -2.549
  302   1HD   ARG  22          2HD       ARG  22  -4.494 -12.390  -3.060
  303   2HD   ARG  22          1HD       ARG  22  -4.111 -13.933  -2.297
  304    HE   ARG  22           HE       ARG  22  -3.381 -11.268  -1.158
  305   1HH1  ARG  22          1HH2      ARG  22  -5.223 -13.955  -0.584
  306   2HH1  ARG  22          2HH2      ARG  22  -4.572 -14.313   0.982
  307   1HH2  ARG  22          1HH1      ARG  22  -1.980 -12.026   0.718
  308   2HH2  ARG  22          2HH1      ARG  22  -2.737 -13.220   1.718
  309    H    GLY  23           H        GLY  23  -5.174 -11.221  -5.404
  310   1HA   GLY  23          2HA       GLY  23  -4.848  -8.877  -7.170
  311   2HA   GLY  23          1HA       GLY  23  -6.383  -9.541  -6.606
  312    H    PHE  24           H        PHE  24  -5.673  -6.738  -6.482
  313    HA   PHE  24           HA       PHE  24  -5.282  -6.334  -3.548
  314   1HB   PHE  24          2HB       PHE  24  -4.989  -3.894  -4.250
  315   2HB   PHE  24          1HB       PHE  24  -3.732  -5.002  -4.795
  316    HD1  PHE  24           HD1      PHE  24  -7.108  -3.794  -5.937
  317    HD2  PHE  24           HD2      PHE  24  -3.088  -4.864  -7.016
  318    HE1  PHE  24           HE1      PHE  24  -7.585  -3.206  -8.299
  319    HE2  PHE  24           HE2      PHE  24  -3.565  -4.275  -9.379
  320    HZ   PHE  24           HZ       PHE  24  -5.813  -3.446 -10.021
  321    H    PHE  25           H        PHE  25  -6.546  -3.959  -3.139
  322    HA   PHE  25           HA       PHE  25  -9.263  -4.075  -4.260
  323   1HB   PHE  25          2HB       PHE  25  -9.331  -5.757  -2.436
  324   2HB   PHE  25          1HB       PHE  25  -8.797  -4.520  -1.295
  325    HD1  PHE  25           HD1      PHE  25 -11.598  -5.814  -3.257
  326    HD2  PHE  25           HD2      PHE  25 -10.251  -2.565  -0.789
  327    HE1  PHE  25           HE1      PHE  25 -13.944  -5.052  -2.979
  328    HE2  PHE  25           HE2      PHE  25 -12.595  -1.803  -0.511
  329    HZ   PHE  25           HZ       PHE  25 -14.442  -3.047  -1.606
  330    H    TYR  26           H        TYR  26  -9.319  -1.930  -4.819
  331    HA   TYR  26           HA       TYR  26  -9.024   0.036  -2.601
  332   1HB   TYR  26          2HB       TYR  26  -7.762   1.555  -4.020
  333   2HB   TYR  26          1HB       TYR  26  -6.923   0.004  -3.974
  334    HD1  TYR  26           HD1      TYR  26  -9.442   1.925  -5.978
  335    HD2  TYR  26           HD2      TYR  26  -6.400  -1.112  -5.973
  336    HE1  TYR  26           HE1      TYR  26  -9.597   1.765  -8.450
  337    HE2  TYR  26           HE2      TYR  26  -6.556  -1.269  -8.444
  338    HH   TYR  26           HH       TYR  26  -8.109  -0.777 -10.224
  339    H    THR  27           H        THR  27 -10.151   2.112  -3.125
  340    HA   THR  27           HA       THR  27 -12.249   1.771  -5.224
  341    HB   THR  27           HB       THR  27 -13.318   3.246  -3.012
  342    HG1  THR  27           HG1      THR  27 -12.487   0.637  -2.317
  343   1HG2  THR  27          1HG2      THR  27 -14.428   1.807  -4.835
  344   2HG2  THR  27          2HG2      THR  27 -15.090   1.686  -3.204
  345   3HG2  THR  27          3HG2      THR  27 -14.021   0.425  -3.819
  346    H    LYS  28           H        LYS  28 -13.429   3.999  -5.507
  347    HA   LYS  28           HA       LYS  28 -13.188   6.213  -6.259
  348   1HB   LYS  28          2HB       LYS  28 -11.256   6.477  -3.936
  349   2HB   LYS  28          1HB       LYS  28 -12.233   7.752  -4.666
  350   1HG   LYS  28          2HG       LYS  28 -13.327   5.325  -3.176
  351   2HG   LYS  28          1HG       LYS  28 -13.246   6.959  -2.531
  352   1HD   LYS  28          2HD       LYS  28 -14.928   6.044  -4.907
  353   2HD   LYS  28          1HD       LYS  28 -15.531   6.515  -3.318
  354   1HE   LYS  28          2HE       LYS  28 -13.921   8.378  -5.087
  355   2HE   LYS  28          1HE       LYS  28 -15.682   8.322  -5.085
  356   1HZ   LYS  28          1HZ       LYS  28 -13.864   9.107  -2.895
  357   2HZ   LYS  28          2HZ       LYS  28 -15.459   8.616  -2.577
  358   3HZ   LYS  28          3HZ       LYS  28 -15.163   9.973  -3.556
  359    HA   PRO  29           HA       PRO  29  -9.119   5.210  -8.199
  360   1HB   PRO  29          2HB       PRO  29 -10.125   4.962 -10.745
  361   2HB   PRO  29          1HB       PRO  29 -10.011   3.613  -9.601
  362   1HG   PRO  29          2HG       PRO  29 -12.421   5.142 -10.467
  363   2HG   PRO  29          1HG       PRO  29 -12.303   3.478  -9.874
  364   1HD   PRO  29          2HD       PRO  29 -13.166   5.716  -8.371
  365   2HD   PRO  29          1HD       PRO  29 -12.728   4.124  -7.715
  366    H    THR  30           H        THR  30  -7.854   6.859  -9.053
  367    HA   THR  30           HA       THR  30  -9.078   9.007 -10.647
  368    HB   THR  30           HB       THR  30  -7.821   9.545  -7.939
  369    HG1  THR  30           HG1      THR  30 -10.403   9.852  -9.046
  370   1HG2  THR  30          1HG2      THR  30  -7.277  11.590  -8.689
  371   2HG2  THR  30          2HG2      THR  30  -8.945  11.861  -9.194
  372   3HG2  THR  30          3HG2      THR  30  -7.796  11.120 -10.308
  Start of MODEL    8
    1   1H    GLY   1          1H        GLY   1  -5.643   4.475   4.693
    2   2H    GLY   1          2H        GLY   1  -4.155   3.978   4.043
    3   3H    GLY   1          3H        GLY   1  -5.526   2.989   3.878
    4   1HA   GLY   1          1HA       GLY   1  -6.485   4.643   2.410
    5   2HA   GLY   1          2HA       GLY   1  -5.106   5.755   2.661
    6    H    ALA   2           H        ALA   2  -6.302   5.365   0.286
    7    HA   ALA   2           HA       ALA   2  -5.480   2.751  -0.912
    8   1HB   ALA   2          1HB       ALA   2  -7.876   3.073  -1.081
    9   2HB   ALA   2          2HB       ALA   2  -7.177   3.294  -2.686
   10   3HB   ALA   2          3HB       ALA   2  -7.654   4.697  -1.728
   11    H    VAL   3           H        VAL   3  -5.460   6.272  -1.339
   12    HA   VAL   3           HA       VAL   3  -3.243   5.897  -3.301
   13    HB   VAL   3           HB       VAL   3  -4.134   7.796  -4.623
   14   1HG1  VAL   3          1HG1      VAL   3  -6.429   5.891  -4.401
   15   2HG1  VAL   3          2HG1      VAL   3  -4.847   5.241  -4.832
   16   3HG1  VAL   3          3HG1      VAL   3  -5.595   6.480  -5.840
   17   1HG2  VAL   3          1HG2      VAL   3  -6.498   8.503  -4.160
   18   2HG2  VAL   3          2HG2      VAL   3  -5.372   8.953  -2.878
   19   3HG2  VAL   3          3HG2      VAL   3  -6.441   7.565  -2.666
   20    H    GLU   4           H        GLU   4  -2.325   8.304  -3.702
   21    HA   GLU   4           HA       GLU   4  -0.846   9.815  -2.623
   22   1HB   GLU   4          2HB       GLU   4  -3.502  10.620  -2.528
   23   2HB   GLU   4          1HB       GLU   4  -2.953  10.839  -0.867
   24   1HG   GLU   4          2HG       GLU   4  -0.898  11.755  -2.654
   25   2HG   GLU   4          1HG       GLU   4  -2.427  12.513  -3.102
   26    H    GLN   5           H        GLN   5  -0.779   7.265  -1.333
   27    HA   GLN   5           HA       GLN   5  -0.490   8.121   1.519
   28   1HB   GLN   5          2HB       GLN   5  -1.626   5.654   0.298
   29   2HB   GLN   5          1HB       GLN   5  -0.668   5.448   1.765
   30   1HG   GLN   5          2HG       GLN   5  -2.376   7.712   2.132
   31   2HG   GLN   5          1HG       GLN   5  -3.360   6.371   1.545
   32   1HE2  GLN   5          1HE2      GLN   5  -2.798   7.673   4.378
   33   2HE2  GLN   5          2HE2      GLN   5  -2.567   6.309   5.364
   34    H    CYS   6           H        CYS   6   1.203   7.265  -1.234
   35    HA   CYS   6           HA       CYS   6   3.623   6.813   0.373
   36   1HB   CYS   6          2HB       CYS   6   2.450   4.701  -1.427
   37   2HB   CYS   6          1HB       CYS   6   4.182   4.773  -1.116
   38    H    CYS   7           H        CYS   7   2.356   8.620  -1.814
   39    HA   CYS   7           HA       CYS   7   4.483   8.370  -3.864
   40   1HB   CYS   7          2HB       CYS   7   2.710  10.663  -4.185
   41   2HB   CYS   7          1HB       CYS   7   3.063   9.353  -5.308
   42    H    THR   8           H        THR   8   5.397  10.724  -4.501
   43    HA   THR   8           HA       THR   8   6.953  12.319  -3.721
   44    HB   THR   8           HB       THR   8   5.996  13.989  -2.271
   45    HG1  THR   8           HG1      THR   8   4.165  13.508  -1.025
   46   1HG2  THR   8          1HG2      THR   8   3.970  14.490  -3.399
   47   2HG2  THR   8          2HG2      THR   8   3.596  12.785  -3.650
   48   3HG2  THR   8          3HG2      THR   8   4.906  13.543  -4.556
   49    H    SER   9           H        SER   9   7.031   9.587  -2.644
   50    HA   SER   9           HA       SER   9   9.093   9.515  -0.884
   51   1HB   SER   9          2HB       SER   9   6.653  10.473   0.501
   52   2HB   SER   9          1HB       SER   9   7.514   9.172   1.320
   53    HG   SER   9           HG       SER   9   8.876  11.409   0.270
   54    H    ILE  10           H        ILE  10   9.527   7.355  -1.132
   55    HA   ILE  10           HA       ILE  10   7.305   5.474  -1.566
   56    HB   ILE  10           HB       ILE  10   9.471   3.842  -1.463
   57   1HG1  ILE  10          2HG1      ILE  10  10.830   6.023  -0.979
   58   2HG1  ILE  10          1HG1      ILE  10  11.459   4.874  -2.160
   59   1HG2  ILE  10          1HG2      ILE  10   9.621   4.223  -3.970
   60   2HG2  ILE  10          2HG2      ILE  10   8.475   5.547  -3.757
   61   3HG2  ILE  10          3HG2      ILE  10   8.000   3.897  -3.354
   62   1HD1  ILE  10          1HD1      ILE  10  10.983   6.248  -3.957
   63   2HD1  ILE  10          2HD1      ILE  10  11.252   7.481  -2.726
   64   3HD1  ILE  10          3HD1      ILE  10   9.609   7.002  -3.151
   65    H    CYS  11           H        CYS  11   6.261   4.677   0.182
   66    HA   CYS  11           HA       CYS  11   7.283   4.713   2.842
   67   1HB   CYS  11          2HB       CYS  11   5.199   2.792   1.752
   68   2HB   CYS  11          1HB       CYS  11   5.383   3.322   3.420
   69    H    SER  12           H        SER  12   6.339   1.544   1.694
   70    HA   SER  12           HA       SER  12   9.051   0.536   1.436
   71   1HB   SER  12          2HB       SER  12   7.633  -0.853   3.634
   72   2HB   SER  12          1HB       SER  12   9.345  -0.477   3.462
   73    HG   SER  12           HG       SER  12   7.227   1.153   4.372
   74    H    LEU  13           H        LEU  13   8.568  -0.637  -0.402
   75    HA   LEU  13           HA       LEU  13   6.245  -1.682  -1.355
   76   1HB   LEU  13          2HB       LEU  13   8.647  -2.036  -2.254
   77   2HB   LEU  13          1HB       LEU  13   8.639  -3.512  -1.284
   78    HG   LEU  13           HG       LEU  13   6.246  -3.780  -2.474
   79   1HD1  LEU  13          1HD1      LEU  13   6.400  -3.059  -4.817
   80   2HD1  LEU  13          2HD1      LEU  13   7.964  -2.309  -4.494
   81   3HD1  LEU  13          3HD1      LEU  13   6.506  -1.668  -3.737
   82   1HD2  LEU  13          1HD2      LEU  13   8.842  -4.476  -3.877
   83   2HD2  LEU  13          2HD2      LEU  13   7.306  -5.334  -4.000
   84   3HD2  LEU  13          3HD2      LEU  13   8.213  -5.361  -2.487
   85    H    TYR  14           H        TYR  14   8.002  -2.976   1.415
   86    HA   TYR  14           HA       TYR  14   6.670  -5.452   1.712
   87   1HB   TYR  14          2HB       TYR  14   8.131  -3.589   3.479
   88   2HB   TYR  14          1HB       TYR  14   6.969  -4.626   4.306
   89    HD1  TYR  14           HD1      TYR  14  10.294  -4.464   3.554
   90    HD2  TYR  14           HD2      TYR  14   6.966  -7.134   3.038
   91    HE1  TYR  14           HE1      TYR  14  11.860  -6.381   3.371
   92    HE2  TYR  14           HE2      TYR  14   8.530  -9.050   2.855
   93    HH   TYR  14           HH       TYR  14  10.772  -9.654   3.455
   94    H    GLN  15           H        GLN  15   5.827  -2.433   3.486
   95    HA   GLN  15           HA       GLN  15   3.299  -3.292   4.388
   96   1HB   GLN  15          2HB       GLN  15   4.248  -1.184   5.175
   97   2HB   GLN  15          1HB       GLN  15   4.171  -0.511   3.548
   98   1HG   GLN  15          2HG       GLN  15   1.820  -0.382   3.580
   99   2HG   GLN  15          1HG       GLN  15   1.684  -1.539   4.905
  100   1HE2  GLN  15          1HE2      GLN  15   0.975  -0.439   6.742
  101   2HE2  GLN  15          2HE2      GLN  15   1.533   1.085   7.240
  102    H    LEU  16           H        LEU  16   4.312  -2.023   1.297
  103    HA   LEU  16           HA       LEU  16   1.832  -1.522   0.059
  104   1HB   LEU  16          2HB       LEU  16   4.471  -1.608  -0.727
  105   2HB   LEU  16          1HB       LEU  16   3.768  -2.923  -1.657
  106    HG   LEU  16           HG       LEU  16   2.904  -0.028  -1.596
  107   1HD1  LEU  16          1HD1      LEU  16   3.934   0.147  -3.603
  108   2HD1  LEU  16          2HD1      LEU  16   3.274  -1.389  -4.164
  109   3HD1  LEU  16          3HD1      LEU  16   4.741  -1.364  -3.185
  110   1HD2  LEU  16          1HD2      LEU  16   0.992  -0.597  -2.895
  111   2HD2  LEU  16          2HD2      LEU  16   0.991  -1.750  -1.565
  112   3HD2  LEU  16          3HD2      LEU  16   1.563  -2.244  -3.156
  113    H    GLU  17           H        GLU  17   3.398  -4.550   0.877
  114    HA   GLU  17           HA       GLU  17   1.697  -6.242  -0.734
  115   1HB   GLU  17          2HB       GLU  17   3.778  -6.583   1.285
  116   2HB   GLU  17          1HB       GLU  17   2.458  -7.730   1.513
  117   1HG   GLU  17          2HG       GLU  17   2.642  -8.424  -0.840
  118   2HG   GLU  17          1HG       GLU  17   3.947  -7.264  -1.086
  119    H    ASN  18           H        ASN  18   1.359  -4.545   2.245
  120    HA   ASN  18           HA       ASN  18  -0.907  -6.131   3.207
  121   1HB   ASN  18          2HB       ASN  18   0.137  -3.423   4.096
  122   2HB   ASN  18          1HB       ASN  18  -1.085  -4.375   4.940
  123   1HD2  ASN  18          1HD2      ASN  18  -0.080  -6.939   4.921
  124   2HD2  ASN  18          2HD2      ASN  18   1.435  -7.000   5.686
  125    H    TYR  19           H        TYR  19  -0.540  -3.984   0.699
  126    HA   TYR  19           HA       TYR  19  -3.235  -2.781   1.043
  127   1HB   TYR  19          2HB       TYR  19  -0.808  -2.182  -0.605
  128   2HB   TYR  19          1HB       TYR  19  -2.381  -1.666  -1.218
  129    HD1  TYR  19           HD1      TYR  19   0.285  -0.296   0.143
  130    HD2  TYR  19           HD2      TYR  19  -3.812  -0.959   1.248
  131    HE1  TYR  19           HE1      TYR  19   0.394   1.640   1.680
  132    HE2  TYR  19           HE2      TYR  19  -3.708   0.978   2.786
  133    HH   TYR  19           HH       TYR  19  -2.458   2.937   3.201
  134    H    CYS  20           H        CYS  20  -2.103  -5.614   0.146
  135    HA   CYS  20           HA       CYS  20  -3.556  -5.909  -2.418
  136   1HB   CYS  20          2HB       CYS  20  -1.554  -7.543  -0.870
  137   2HB   CYS  20          1HB       CYS  20  -2.485  -8.250  -2.171
  138    H    ASN  21           H        ASN  21  -4.316  -8.563  -2.185
  139    HA   ASN  21           HA       ASN  21  -6.650  -8.344  -0.435
  140   1HB   ASN  21          2HB       ASN  21  -5.743 -10.103  -2.623
  141   2HB   ASN  21          1HB       ASN  21  -6.669 -10.923  -1.368
  142   1HD2  ASN  21          1HD2      ASN  21  -6.856  -7.787  -3.160
  143   2HD2  ASN  21          2HD2      ASN  21  -8.533  -7.864  -3.407
  144   1H    PHE   1          1H        PHE   1  10.035  -1.598  -4.356
  145   2H    PHE   1          2H        PHE   1   9.334  -0.052  -4.409
  146   3H    PHE   1          3H        PHE   1  10.938  -0.243  -3.882
  147    HA   PHE   1           HA       PHE   1  10.773  -1.390  -6.412
  148   1HB   PHE   1          2HB       PHE   1   8.777   0.527  -6.153
  149   2HB   PHE   1          1HB       PHE   1  10.107   1.419  -6.890
  150    HD1  PHE   1           HD1      PHE   1   7.265   0.034  -7.889
  151    HD2  PHE   1           HD2      PHE   1  11.470  -0.620  -8.486
  152    HE1  PHE   1           HE1      PHE   1   6.787  -1.063 -10.063
  153    HE2  PHE   1           HE2      PHE   1  10.992  -1.715 -10.660
  154    HZ   PHE   1           HZ       PHE   1   8.651  -1.936 -11.449
  155    H    VAL   2           H        VAL   2  11.740   1.152  -7.677
  156    HA   VAL   2           HA       VAL   2  14.268   1.450  -6.099
  157    HB   VAL   2           HB       VAL   2  14.048   1.628  -9.107
  158   1HG1  VAL   2          1HG1      VAL   2  16.375   1.114  -7.231
  159   2HG1  VAL   2          2HG1      VAL   2  16.020   2.654  -8.014
  160   3HG1  VAL   2          3HG1      VAL   2  16.470   1.254  -8.987
  161   1HG2  VAL   2          1HG2      VAL   2  13.333  -0.602  -8.543
  162   2HG2  VAL   2          2HG2      VAL   2  14.607  -0.764  -7.335
  163   3HG2  VAL   2          3HG2      VAL   2  15.018  -0.713  -9.049
  164    H    ASN   3           H        ASN   3  11.629   3.018  -7.581
  165    HA   ASN   3           HA       ASN   3  13.063   5.645  -7.456
  166   1HB   ASN   3          2HB       ASN   3  10.675   4.762  -9.073
  167   2HB   ASN   3          1HB       ASN   3  11.221   6.428  -8.977
  168   1HD2  ASN   3          1HD2      ASN   3  13.546   6.831  -9.712
  169   2HD2  ASN   3          2HD2      ASN   3  14.186   5.839 -10.932
  170    H    GLN   4           H        GLN   4  10.913   7.341  -7.443
  171    HA   GLN   4           HA       GLN   4   9.434   6.609  -4.959
  172   1HB   GLN   4          2HB       GLN   4   9.933   9.483  -5.536
  173   2HB   GLN   4          1HB       GLN   4   9.918   8.642  -3.989
  174   1HG   GLN   4          2HG       GLN   4  12.127   7.681  -4.461
  175   2HG   GLN   4          1HG       GLN   4  12.132   8.437  -6.053
  176   1HE2  GLN   4          1HE2      GLN   4  11.040  10.995  -5.321
  177   2HE2  GLN   4          2HE2      GLN   4  12.171  11.789  -4.336
  178    H    HIS   5           H        HIS   5   7.585   8.429  -4.748
  179    HA   HIS   5           HA       HIS   5   5.679   9.422  -5.668
  180   1HB   HIS   5          2HB       HIS   5   6.715   8.722  -8.407
  181   2HB   HIS   5          1HB       HIS   5   5.570   9.988  -7.973
  182    HD2  HIS   5           HD2      HIS   5   8.296  10.979  -9.465
  183    HE1  HIS   5           HE1      HIS   5   9.549  12.173  -5.606
  184    HE2  HIS   5           HE2      HIS   5   9.959  12.452  -8.109
  185    H    LEU   6           H        LEU   6   5.351   6.964  -4.695
  186    HA   LEU   6           HA       LEU   6   4.137   5.262  -6.746
  187   1HB   LEU   6          2HB       LEU   6   5.431   4.727  -4.339
  188   2HB   LEU   6          1HB       LEU   6   3.736   4.496  -3.938
  189    HG   LEU   6           HG       LEU   6   3.966   2.414  -4.775
  190   1HD1  LEU   6          1HD1      LEU   6   4.483   3.597  -7.502
  191   2HD1  LEU   6          2HD1      LEU   6   2.888   3.629  -6.745
  192   3HD1  LEU   6          3HD1      LEU   6   3.663   2.086  -7.107
  193   1HD2  LEU   6          1HD2      LEU   6   6.092   1.761  -4.963
  194   2HD2  LEU   6          2HD2      LEU   6   6.594   3.438  -5.182
  195   3HD2  LEU   6          3HD2      LEU   6   6.159   2.457  -6.582
  196    H    CYS   7           H        CYS   7   2.320   6.418  -7.370
  197    HA   CYS   7           HA       CYS   7   0.300   6.909  -5.240
  198   1HB   CYS   7          2HB       CYS   7   1.225   8.545  -7.429
  199   2HB   CYS   7          1HB       CYS   7  -0.520   8.290  -7.544
  200    H    GLY   8           H        GLY   8  -1.715   6.007  -5.490
  201   1HA   GLY   8          2HA       GLY   8  -2.650   3.792  -6.273
  202   2HA   GLY   8          1HA       GLY   8  -3.515   5.143  -6.991
  203    H    SER   9           H        SER   9  -2.458   5.942  -9.138
  204    HA   SER   9           HA       SER   9  -2.611   3.976 -11.098
  205   1HB   SER   9          2HB       SER   9  -1.526   5.522 -12.598
  206   2HB   SER   9          1HB       SER   9  -2.476   6.479 -11.462
  207    HG   SER   9           HG       SER   9   0.312   6.044 -11.558
  208    H    ASP  10           H        ASP  10   0.485   5.280  -9.825
  209    HA   ASP  10           HA       ASP  10   1.962   3.039 -10.980
  210   1HB   ASP  10          2HB       ASP  10   3.214   4.713  -8.860
  211   2HB   ASP  10          1HB       ASP  10   3.862   4.200 -10.417
  212    H    LEU  11           H        LEU  11   0.537   3.831  -7.884
  213    HA   LEU  11           HA       LEU  11   1.962   1.843  -6.335
  214   1HB   LEU  11          2HB       LEU  11  -0.355   3.640  -5.957
  215   2HB   LEU  11          1HB       LEU  11  -0.430   2.151  -5.041
  216    HG   LEU  11           HG       LEU  11   1.991   3.938  -5.068
  217   1HD1  LEU  11          1HD1      LEU  11   0.270   5.240  -4.046
  218   2HD1  LEU  11          2HD1      LEU  11   1.153   4.498  -2.713
  219   3HD1  LEU  11          3HD1      LEU  11  -0.398   3.833  -3.220
  220   1HD2  LEU  11          1HD2      LEU  11   2.116   1.442  -4.479
  221   2HD2  LEU  11          2HD2      LEU  11   1.173   1.860  -3.047
  222   3HD2  LEU  11          3HD2      LEU  11   2.765   2.577  -3.295
  223    H    VAL  12           H        VAL  12  -0.833   1.780  -8.440
  224    HA   VAL  12           HA       VAL  12  -1.776  -0.774  -7.471
  225    HB   VAL  12           HB       VAL  12  -2.822   1.220  -9.088
  226   1HG1  VAL  12          1HG1      VAL  12  -1.642   0.280 -11.057
  227   2HG1  VAL  12          2HG1      VAL  12  -3.393   0.147 -11.216
  228   3HG1  VAL  12          3HG1      VAL  12  -2.438  -1.269 -10.779
  229   1HG2  VAL  12          1HG2      VAL  12  -4.340  -1.206  -9.384
  230   2HG2  VAL  12          2HG2      VAL  12  -4.662   0.176  -8.336
  231   3HG2  VAL  12          3HG2      VAL  12  -3.644  -1.146  -7.765
  232    H    GLU  13           H        GLU  13   0.116   0.270 -10.272
  233    HA   GLU  13           HA       GLU  13   0.512  -2.265 -11.473
  234   1HB   GLU  13          2HB       GLU  13   2.509   0.018 -11.319
  235   2HB   GLU  13          1HB       GLU  13   2.505  -1.286 -12.508
  236   1HG   GLU  13          2HG       GLU  13  -0.011  -0.416 -12.855
  237   2HG   GLU  13          1HG       GLU  13   0.719   1.090 -12.295
  238    H    ALA  14           H        ALA  14   2.581  -0.572  -9.086
  239    HA   ALA  14           HA       ALA  14   4.361  -2.790  -8.677
  240   1HB   ALA  14          1HB       ALA  14   5.016  -1.600  -6.621
  241   2HB   ALA  14          2HB       ALA  14   3.578  -0.584  -6.727
  242   3HB   ALA  14          3HB       ALA  14   4.847  -0.445  -7.943
  243    H    LEU  15           H        LEU  15   1.343  -1.751  -7.137
  244    HA   LEU  15           HA       LEU  15   1.196  -3.604  -5.020
  245   1HB   LEU  15          2HB       LEU  15  -0.720  -2.035  -6.634
  246   2HB   LEU  15          1HB       LEU  15  -1.396  -3.475  -5.877
  247    HG   LEU  15           HG       LEU  15   0.257  -1.446  -4.373
  248   1HD1  LEU  15          1HD1      LEU  15  -2.761  -1.689  -4.521
  249   2HD1  LEU  15          2HD1      LEU  15  -1.810  -0.393  -5.247
  250   3HD1  LEU  15          3HD1      LEU  15  -1.861  -0.573  -3.494
  251   1HD2  LEU  15          1HD2      LEU  15  -0.528  -2.587  -2.428
  252   2HD2  LEU  15          2HD2      LEU  15  -0.035  -3.854  -3.552
  253   3HD2  LEU  15          3HD2      LEU  15  -1.744  -3.468  -3.353
  254    H    TYR  16           H        TYR  16   0.728  -4.012  -8.449
  255    HA   TYR  16           HA       TYR  16  -0.384  -6.717  -8.210
  256   1HB   TYR  16          2HB       TYR  16  -1.135  -5.672 -10.176
  257   2HB   TYR  16          1HB       TYR  16   0.424  -4.908 -10.482
  258    HD1  TYR  16           HD1      TYR  16  -0.131  -8.482  -9.607
  259    HD2  TYR  16           HD2      TYR  16   0.843  -5.670 -12.707
  260    HE1  TYR  16           HE1      TYR  16   0.509 -10.353 -11.106
  261    HE2  TYR  16           HE2      TYR  16   1.483  -7.540 -14.205
  262    HH   TYR  16           HH       TYR  16   1.933 -10.721 -13.084
  263    H    LEU  17           H        LEU  17   2.694  -5.150  -8.862
  264    HA   LEU  17           HA       LEU  17   4.162  -7.593  -9.423
  265   1HB   LEU  17          2HB       LEU  17   4.696  -4.880  -9.618
  266   2HB   LEU  17          1HB       LEU  17   5.645  -5.350  -8.208
  267    HG   LEU  17           HG       LEU  17   6.669  -7.179  -9.529
  268   1HD1  LEU  17          1HD1      LEU  17   6.182  -6.505 -12.159
  269   2HD1  LEU  17          2HD1      LEU  17   4.594  -6.299 -11.419
  270   3HD1  LEU  17          3HD1      LEU  17   5.425  -7.851 -11.309
  271   1HD2  LEU  17          1HD2      LEU  17   6.996  -4.330  -9.939
  272   2HD2  LEU  17          2HD2      LEU  17   7.427  -5.214 -11.403
  273   3HD2  LEU  17          3HD2      LEU  17   8.231  -5.589  -9.879
  274    H    VAL  18           H        VAL  18   3.087  -5.791  -6.718
  275    HA   VAL  18           HA       VAL  18   4.704  -7.169  -4.716
  276    HB   VAL  18           HB       VAL  18   2.893  -4.864  -4.938
  277   1HG1  VAL  18          1HG1      VAL  18   1.461  -6.056  -3.446
  278   2HG1  VAL  18          2HG1      VAL  18   2.367  -4.895  -2.474
  279   3HG1  VAL  18          3HG1      VAL  18   2.824  -6.599  -2.471
  280   1HG2  VAL  18          1HG2      VAL  18   5.260  -4.610  -4.591
  281   2HG2  VAL  18          2HG2      VAL  18   5.199  -5.622  -3.148
  282   3HG2  VAL  18          3HG2      VAL  18   4.418  -4.040  -3.151
  283    H    CYS  19           H        CYS  19   1.258  -6.814  -5.393
  284    HA   CYS  19           HA       CYS  19   0.152  -8.708  -3.683
  285   1HB   CYS  19          2HB       CYS  19  -0.553  -7.998  -6.537
  286   2HB   CYS  19          1HB       CYS  19  -1.485  -9.186  -5.639
  287    H    GLY  20           H        GLY  20   2.099  -9.202  -6.526
  288   1HA   GLY  20          2HA       GLY  20   3.142 -11.128  -7.333
  289   2HA   GLY  20          1HA       GLY  20   2.691 -11.931  -5.826
  290    H    GLU  21           H        GLU  21   0.823 -13.196  -5.781
  291    HA   GLU  21           HA       GLU  21  -0.498 -13.598  -8.428
  292   1HB   GLU  21          2HB       GLU  21   0.535 -15.634  -7.637
  293   2HB   GLU  21          1HB       GLU  21  -0.185 -15.437  -6.038
  294   1HG   GLU  21          2HG       GLU  21  -2.347 -15.952  -6.809
  295   2HG   GLU  21          1HG       GLU  21  -1.928 -15.609  -8.488
  296    H    ARG  22           H        ARG  22  -0.980 -12.692  -5.110
  297    HA   ARG  22           HA       ARG  22  -3.857 -13.051  -5.075
  298   1HB   ARG  22          2HB       ARG  22  -1.974 -11.392  -3.376
  299   2HB   ARG  22          1HB       ARG  22  -3.708 -11.501  -3.073
  300   1HG   ARG  22          2HG       ARG  22  -3.280 -14.090  -3.161
  301   2HG   ARG  22          1HG       ARG  22  -1.608 -13.634  -2.828
  302   1HD   ARG  22          2HD       ARG  22  -2.257 -12.482  -0.803
  303   2HD   ARG  22          1HD       ARG  22  -3.967 -12.700  -1.173
  304    HE   ARG  22           HE       ARG  22  -2.373 -15.169  -0.890
  305   1HH1  ARG  22          1HH2      ARG  22  -2.956 -13.173   1.542
  306   2HH1  ARG  22          2HH2      ARG  22  -4.220 -14.073   2.311
  307   1HH2  ARG  22          1HH1      ARG  22  -4.703 -16.204  -0.381
  308   2HH2  ARG  22          2HH1      ARG  22  -5.211 -15.788   1.222
  309    H    GLY  23           H        GLY  23  -4.830 -10.575  -4.232
  310   1HA   GLY  23          2HA       GLY  23  -4.250  -8.770  -6.536
  311   2HA   GLY  23          1HA       GLY  23  -5.916  -9.181  -6.124
  312    H    PHE  24           H        PHE  24  -6.360  -6.903  -5.662
  313    HA   PHE  24           HA       PHE  24  -5.573  -6.177  -2.899
  314   1HB   PHE  24          2HB       PHE  24  -5.101  -3.814  -3.599
  315   2HB   PHE  24          1HB       PHE  24  -3.907  -4.962  -4.194
  316    HD1  PHE  24           HD1      PHE  24  -6.134  -2.343  -5.106
  317    HD2  PHE  24           HD2      PHE  24  -4.397  -5.993  -6.556
  318    HE1  PHE  24           HE1      PHE  24  -6.616  -1.650  -7.441
  319    HE2  PHE  24           HE2      PHE  24  -4.879  -5.303  -8.889
  320    HZ   PHE  24           HZ       PHE  24  -5.988  -3.130  -9.332
  321    H    PHE  25           H        PHE  25  -6.768  -3.758  -2.664
  322    HA   PHE  25           HA       PHE  25  -9.586  -4.352  -3.456
  323   1HB   PHE  25          2HB       PHE  25  -8.872  -2.423  -1.266
  324   2HB   PHE  25          1HB       PHE  25 -10.341  -3.378  -1.468
  325    HD1  PHE  25           HD1      PHE  25  -7.256  -3.159   0.253
  326    HD2  PHE  25           HD2      PHE  25  -9.988  -6.005  -1.455
  327    HE1  PHE  25           HE1      PHE  25  -6.303  -4.941   1.694
  328    HE2  PHE  25           HE2      PHE  25  -9.033  -7.785  -0.013
  329    HZ   PHE  25           HZ       PHE  25  -7.191  -7.253   1.561
  330    H    TYR  26           H        TYR  26  -7.415  -1.616  -2.843
  331    HA   TYR  26           HA       TYR  26  -7.318   0.508  -3.807
  332   1HB   TYR  26          2HB       TYR  26  -6.534  -0.644  -5.736
  333   2HB   TYR  26          1HB       TYR  26  -8.151  -1.217  -6.144
  334    HD1  TYR  26           HD1      TYR  26  -6.319   1.997  -5.519
  335    HD2  TYR  26           HD2      TYR  26  -9.352  -0.049  -7.774
  336    HE1  TYR  26           HE1      TYR  26  -6.669   4.032  -6.892
  337    HE2  TYR  26           HE2      TYR  26  -9.702   1.987  -9.146
  338    HH   TYR  26           HH       TYR  26  -9.334   4.515  -8.814
  339    H    THR  27           H        THR  27 -10.182  -0.653  -5.656
  340    HA   THR  27           HA       THR  27 -11.603   1.764  -4.697
  341    HB   THR  27           HB       THR  27 -11.628   1.350  -7.112
  342    HG1  THR  27           HG1      THR  27 -13.485   2.260  -6.282
  343   1HG2  THR  27          1HG2      THR  27 -13.347  -0.900  -7.304
  344   2HG2  THR  27          2HG2      THR  27 -12.011  -1.361  -6.250
  345   3HG2  THR  27          3HG2      THR  27 -11.684  -0.759  -7.875
  346    H    LYS  28           H        LYS  28 -14.221   0.378  -5.265
  347    HA   LYS  28           HA       LYS  28 -14.346  -1.554  -3.018
  348   1HB   LYS  28          2HB       LYS  28 -16.404  -0.326  -2.160
  349   2HB   LYS  28          1HB       LYS  28 -14.859   0.467  -1.853
  350   1HG   LYS  28          2HG       LYS  28 -16.478   1.114  -4.339
  351   2HG   LYS  28          1HG       LYS  28 -16.811   1.922  -2.815
  352   1HD   LYS  28          2HD       LYS  28 -14.296   2.077  -4.509
  353   2HD   LYS  28          1HD       LYS  28 -15.313   3.397  -3.938
  354   1HE   LYS  28          2HE       LYS  28 -14.597   2.294  -1.559
  355   2HE   LYS  28          1HE       LYS  28 -13.163   1.927  -2.518
  356   1HZ   LYS  28          1HZ       LYS  28 -14.068   4.570  -3.012
  357   2HZ   LYS  28          2HZ       LYS  28 -12.551   4.041  -2.456
  358   3HZ   LYS  28          3HZ       LYS  28 -13.808   4.338  -1.353
  359    HA   PRO  29           HA       PRO  29 -16.973  -2.980  -6.436
  360   1HB   PRO  29          2HB       PRO  29 -16.434  -5.639  -5.985
  361   2HB   PRO  29          1HB       PRO  29 -15.404  -4.585  -6.969
  362   1HG   PRO  29          2HG       PRO  29 -14.935  -5.625  -4.216
  363   2HG   PRO  29          1HG       PRO  29 -13.759  -5.123  -5.442
  364   1HD   PRO  29          2HD       PRO  29 -14.574  -3.600  -3.195
  365   2HD   PRO  29          1HD       PRO  29 -13.646  -3.001  -4.586
  366    H    THR  30           H        THR  30 -19.094  -3.816  -6.295
  367    HA   THR  30           HA       THR  30 -19.967  -4.720  -3.579
  368    HB   THR  30           HB       THR  30 -22.142  -3.630  -4.039
  369    HG1  THR  30           HG1      THR  30 -20.873  -3.226  -6.476
  370   1HG2  THR  30          1HG2      THR  30 -20.188  -2.419  -2.941
  371   2HG2  THR  30          2HG2      THR  30 -21.421  -1.383  -3.660
  372   3HG2  THR  30          3HG2      THR  30 -19.898  -1.658  -4.507
  Start of MODEL    9
    1   1H    GLY   1          1H        GLY   1  -7.577   6.804   4.176
    2   2H    GLY   1          2H        GLY   1  -6.122   7.513   4.696
    3   3H    GLY   1          3H        GLY   1  -6.104   5.996   3.932
    4   1HA   GLY   1          1HA       GLY   1  -7.255   8.009   2.310
    5   2HA   GLY   1          2HA       GLY   1  -5.553   8.393   2.712
    6    H    ALA   2           H        ALA   2  -6.165   8.381   0.207
    7    HA   ALA   2           HA       ALA   2  -6.206   5.644  -0.907
    8   1HB   ALA   2          1HB       ALA   2  -7.981   6.446  -2.595
    9   2HB   ALA   2          2HB       ALA   2  -8.320   7.736  -1.441
   10   3HB   ALA   2          3HB       ALA   2  -8.546   6.050  -0.972
   11    H    VAL   3           H        VAL   3  -5.155   5.545  -2.924
   12    HA   VAL   3           HA       VAL   3  -3.782   6.282  -4.679
   13    HB   VAL   3           HB       VAL   3  -4.837   9.073  -4.230
   14   1HG1  VAL   3          1HG1      VAL   3  -4.551   9.242  -6.627
   15   2HG1  VAL   3          2HG1      VAL   3  -4.226   7.513  -6.757
   16   3HG1  VAL   3          3HG1      VAL   3  -3.066   8.571  -5.952
   17   1HG2  VAL   3          1HG2      VAL   3  -6.844   7.791  -4.156
   18   2HG2  VAL   3          2HG2      VAL   3  -6.263   6.669  -5.386
   19   3HG2  VAL   3          3HG2      VAL   3  -6.701   8.316  -5.834
   20    H    GLU   4           H        GLU   4  -3.899   9.213  -2.625
   21    HA   GLU   4           HA       GLU   4  -0.969   9.306  -2.615
   22   1HB   GLU   4          2HB       GLU   4  -1.375  11.319  -1.110
   23   2HB   GLU   4          1HB       GLU   4  -2.073  11.432  -2.726
   24   1HG   GLU   4          2HG       GLU   4  -4.233  11.255  -1.955
   25   2HG   GLU   4          1HG       GLU   4  -3.776  10.223  -0.600
   26    H    GLN   5           H        GLN   5  -0.536   7.299  -1.481
   27    HA   GLN   5           HA       GLN   5  -0.807   7.610   1.466
   28   1HB   GLN   5          2HB       GLN   5  -1.755   5.298  -0.210
   29   2HB   GLN   5          1HB       GLN   5  -1.206   5.021   1.443
   30   1HG   GLN   5          2HG       GLN   5  -3.001   7.320   1.235
   31   2HG   GLN   5          1HG       GLN   5  -3.759   5.819   0.701
   32   1HE2  GLN   5          1HE2      GLN   5  -1.468   6.708   3.359
   33   2HE2  GLN   5          2HE2      GLN   5  -2.331   5.887   4.568
   34    H    CYS   6           H        CYS   6   1.292   7.482  -0.936
   35    HA   CYS   6           HA       CYS   6   3.396   6.326   0.738
   36   1HB   CYS   6          2HB       CYS   6   2.253   4.854  -1.578
   37   2HB   CYS   6          1HB       CYS   6   4.011   4.901  -1.479
   38    H    CYS   7           H        CYS   7   2.642   7.284  -2.621
   39    HA   CYS   7           HA       CYS   7   5.208   8.164  -3.353
   40   1HB   CYS   7          2HB       CYS   7   3.785   9.972  -4.720
   41   2HB   CYS   7          1HB       CYS   7   3.839   8.278  -5.192
   42    H    THR   8           H        THR   8   5.451  10.767  -3.873
   43    HA   THR   8           HA       THR   8   6.071  12.784  -2.831
   44    HB   THR   8           HB       THR   8   4.487  13.799  -1.447
   45    HG1  THR   8           HG1      THR   8   4.710  12.371   0.280
   46   1HG2  THR   8          1HG2      THR   8   2.810  11.523  -2.518
   47   2HG2  THR   8          2HG2      THR   8   3.440  12.808  -3.548
   48   3HG2  THR   8          3HG2      THR   8   2.317  13.193  -2.245
   49    H    SER   9           H        SER   9   6.958  10.009  -2.073
   50    HA   SER   9           HA       SER   9   9.026  10.411  -0.324
   51   1HB   SER   9          2HB       SER   9   6.525  10.562   1.118
   52   2HB   SER   9          1HB       SER   9   7.410   9.130   1.635
   53    HG   SER   9           HG       SER   9   8.920  10.358   2.471
   54    H    ILE  10           H        ILE  10   9.031   7.978   1.166
   55    HA   ILE  10           HA       ILE  10   8.089   5.975  -0.815
   56    HB   ILE  10           HB       ILE  10  10.687   5.217   0.233
   57   1HG1  ILE  10          2HG1      ILE  10  10.871   7.800  -0.010
   58   2HG1  ILE  10          1HG1      ILE  10  12.091   6.810  -0.804
   59   1HG2  ILE  10          1HG2      ILE  10  10.693   4.113  -1.739
   60   2HG2  ILE  10          2HG2      ILE  10  10.326   5.564  -2.662
   61   3HG2  ILE  10          3HG2      ILE  10   9.028   4.658  -1.900
   62   1HD1  ILE  10          1HD1      ILE  10   9.666   7.404  -2.405
   63   2HD1  ILE  10          2HD1      ILE  10  11.357   7.347  -2.899
   64   3HD1  ILE  10          3HD1      ILE  10  10.728   8.773  -2.074
   65    H    CYS  11           H        CYS  11   6.614   5.044   0.542
   66    HA   CYS  11           HA       CYS  11   7.056   4.519   3.326
   67   1HB   CYS  11          2HB       CYS  11   5.181   2.786   2.948
   68   2HB   CYS  11          1HB       CYS  11   4.789   4.469   2.600
   69    H    SER  12           H        SER  12   6.199   1.524   1.987
   70    HA   SER  12           HA       SER  12   8.939   0.554   1.609
   71   1HB   SER  12          2HB       SER  12   7.549   0.309   4.163
   72   2HB   SER  12          1HB       SER  12   7.978  -1.263   3.497
   73    HG   SER  12           HG       SER  12  10.099  -0.630   3.410
   74    H    LEU  13           H        LEU  13   8.708  -0.785  -0.127
   75    HA   LEU  13           HA       LEU  13   6.384  -1.669  -1.315
   76   1HB   LEU  13          2HB       LEU  13   8.889  -2.089  -1.984
   77   2HB   LEU  13          1HB       LEU  13   8.650  -3.628  -1.153
   78    HG   LEU  13           HG       LEU  13   6.386  -3.575  -2.613
   79   1HD1  LEU  13          1HD1      LEU  13   6.441  -2.227  -4.425
   80   2HD1  LEU  13          2HD1      LEU  13   8.114  -2.652  -4.783
   81   3HD1  LEU  13          3HD1      LEU  13   7.758  -1.377  -3.618
   82   1HD2  LEU  13          1HD2      LEU  13   7.555  -5.034  -4.228
   83   2HD2  LEU  13          2HD2      LEU  13   8.060  -5.387  -2.576
   84   3HD2  LEU  13          3HD2      LEU  13   9.108  -4.444  -3.635
   85    H    TYR  14           H        TYR  14   7.828  -2.929   1.617
   86    HA   TYR  14           HA       TYR  14   6.421  -5.411   1.745
   87   1HB   TYR  14          2HB       TYR  14   7.760  -3.612   3.716
   88   2HB   TYR  14          1HB       TYR  14   6.641  -4.819   4.350
   89    HD1  TYR  14           HD1      TYR  14   9.975  -4.339   3.848
   90    HD2  TYR  14           HD2      TYR  14   6.905  -7.153   2.782
   91    HE1  TYR  14           HE1      TYR  14  11.696  -6.101   3.540
   92    HE2  TYR  14           HE2      TYR  14   8.626  -8.914   2.474
   93    HH   TYR  14           HH       TYR  14  11.602  -8.503   1.937
   94    H    GLN  15           H        GLN  15   5.625  -2.409   3.575
   95    HA   GLN  15           HA       GLN  15   3.018  -3.147   4.314
   96   1HB   GLN  15          2HB       GLN  15   4.484  -0.628   4.018
   97   2HB   GLN  15          1HB       GLN  15   2.765  -0.447   3.678
   98   1HG   GLN  15          2HG       GLN  15   2.130  -1.123   5.820
   99   2HG   GLN  15          1HG       GLN  15   3.643  -1.984   6.105
  100   1HE2  GLN  15          1HE2      GLN  15   3.582  -0.595   8.184
  101   2HE2  GLN  15          2HE2      GLN  15   4.247   0.965   8.096
  102    H    LEU  16           H        LEU  16   4.311  -2.146   1.266
  103    HA   LEU  16           HA       LEU  16   1.902  -1.525  -0.136
  104   1HB   LEU  16          2HB       LEU  16   4.612  -1.653  -0.708
  105   2HB   LEU  16          1HB       LEU  16   3.939  -2.918  -1.726
  106    HG   LEU  16           HG       LEU  16   3.100  -0.005  -1.637
  107   1HD1  LEU  16          1HD1      LEU  16   4.789  -1.679  -3.414
  108   2HD1  LEU  16          2HD1      LEU  16   4.859   0.055  -3.101
  109   3HD1  LEU  16          3HD1      LEU  16   3.664  -0.589  -4.227
  110   1HD2  LEU  16          1HD2      LEU  16   2.007  -1.863  -3.676
  111   2HD2  LEU  16          2HD2      LEU  16   1.233  -0.504  -2.862
  112   3HD2  LEU  16          3HD2      LEU  16   1.379  -2.056  -2.040
  113    H    GLU  17           H        GLU  17   3.460  -4.550   0.742
  114    HA   GLU  17           HA       GLU  17   1.777  -6.228  -0.928
  115   1HB   GLU  17          2HB       GLU  17   3.839  -6.608   1.148
  116   2HB   GLU  17          1HB       GLU  17   2.577  -7.840   1.152
  117   1HG   GLU  17          2HG       GLU  17   2.952  -7.953  -1.406
  118   2HG   GLU  17          1HG       GLU  17   4.461  -7.097  -1.081
  119    H    ASN  18           H        ASN  18   1.504  -4.654   2.127
  120    HA   ASN  18           HA       ASN  18  -0.751  -6.277   3.056
  121   1HB   ASN  18          2HB       ASN  18   0.563  -3.738   4.040
  122   2HB   ASN  18          1HB       ASN  18  -0.909  -4.374   4.777
  123   1HD2  ASN  18          1HD2      ASN  18   1.080  -4.384   6.556
  124   2HD2  ASN  18          2HD2      ASN  18   1.807  -5.909   6.726
  125    H    TYR  19           H        TYR  19  -0.411  -4.041   0.643
  126    HA   TYR  19           HA       TYR  19  -3.072  -2.796   1.080
  127   1HB   TYR  19          2HB       TYR  19  -0.627  -2.154  -0.481
  128   2HB   TYR  19          1HB       TYR  19  -2.157  -1.758  -1.269
  129    HD1  TYR  19           HD1      TYR  19   0.300  -0.214   0.362
  130    HD2  TYR  19           HD2      TYR  19  -3.895  -0.954   0.916
  131    HE1  TYR  19           HE1      TYR  19   0.139   1.804   1.788
  132    HE2  TYR  19           HE2      TYR  19  -4.060   1.065   2.345
  133    HH   TYR  19           HH       TYR  19  -1.437   2.602   3.676
  134    H    CYS  20           H        CYS  20  -2.080  -5.641   0.152
  135    HA   CYS  20           HA       CYS  20  -3.575  -5.866  -2.398
  136   1HB   CYS  20          2HB       CYS  20  -1.593  -7.585  -0.913
  137   2HB   CYS  20          1HB       CYS  20  -2.524  -8.198  -2.263
  138    H    ASN  21           H        ASN  21  -4.357  -8.510  -2.198
  139    HA   ASN  21           HA       ASN  21  -6.746  -8.347  -0.616
  140   1HB   ASN  21          2HB       ASN  21  -5.435 -10.331  -2.364
  141   2HB   ASN  21          1HB       ASN  21  -6.427 -11.031  -1.088
  142   1HD2  ASN  21          1HD2      ASN  21  -7.489 -11.488  -3.516
  143   2HD2  ASN  21          2HD2      ASN  21  -8.769 -10.431  -3.872
  144   1H    PHE   1          1H        PHE   1  12.242  -3.684  -7.381
  145   2H    PHE   1          2H        PHE   1  11.201  -3.487  -6.052
  146   3H    PHE   1          3H        PHE   1  12.848  -3.820  -5.802
  147    HA   PHE   1           HA       PHE   1  13.423  -1.686  -6.848
  148   1HB   PHE   1          2HB       PHE   1  10.472  -1.712  -7.199
  149   2HB   PHE   1          1HB       PHE   1  11.182  -0.169  -6.727
  150    HD1  PHE   1           HD1      PHE   1   9.978  -1.487  -9.492
  151    HD2  PHE   1           HD2      PHE   1  13.831  -0.285  -8.018
  152    HE1  PHE   1           HE1      PHE   1  10.758  -1.138 -11.821
  153    HE2  PHE   1           HE2      PHE   1  14.614   0.066 -10.348
  154    HZ   PHE   1           HZ       PHE   1  13.077  -0.361 -12.249
  155    H    VAL   2           H        VAL   2  13.408   0.316  -5.463
  156    HA   VAL   2           HA       VAL   2  12.132   0.122  -2.838
  157    HB   VAL   2           HB       VAL   2  14.462   0.270  -1.705
  158   1HG1  VAL   2          1HG1      VAL   2  14.207  -1.935  -1.156
  159   2HG1  VAL   2          2HG1      VAL   2  14.161  -2.453  -2.841
  160   3HG1  VAL   2          3HG1      VAL   2  12.717  -1.779  -2.085
  161   1HG2  VAL   2          1HG2      VAL   2  16.316  -0.632  -2.894
  162   2HG2  VAL   2          2HG2      VAL   2  15.571   0.506  -4.018
  163   3HG2  VAL   2          3HG2      VAL   2  15.288  -1.226  -4.199
  164    H    ASN   3           H        ASN   3  12.264   2.121  -1.697
  165    HA   ASN   3           HA       ASN   3  12.505   4.445  -1.493
  166   1HB   ASN   3          2HB       ASN   3  14.978   3.665  -1.891
  167   2HB   ASN   3          1HB       ASN   3  14.754   4.395  -3.480
  168   1HD2  ASN   3          1HD2      ASN   3  14.227   6.743  -3.536
  169   2HD2  ASN   3          2HD2      ASN   3  14.616   7.733  -2.213
  170    H    GLN   4           H        GLN   4  11.305   2.939  -4.028
  171    HA   GLN   4           HA       GLN   4  11.304   5.199  -5.926
  172   1HB   GLN   4          2HB       GLN   4  11.341   2.618  -6.469
  173   2HB   GLN   4          1HB       GLN   4   9.597   2.753  -6.251
  174   1HG   GLN   4          2HG       GLN   4  10.218   3.088  -8.615
  175   2HG   GLN   4          1HG       GLN   4   9.524   4.557  -7.931
  176   1HE2  GLN   4          1HE2      GLN   4  10.799   5.640  -9.758
  177   2HE2  GLN   4          2HE2      GLN   4  12.435   5.999  -9.482
  178    H    HIS   5           H        HIS   5   9.551   6.541  -6.278
  179    HA   HIS   5           HA       HIS   5   7.641   6.914  -4.185
  180   1HB   HIS   5          2HB       HIS   5   7.758   7.896  -7.046
  181   2HB   HIS   5          1HB       HIS   5   6.474   8.375  -5.935
  182    HD2  HIS   5           HD2      HIS   5   7.234  10.202  -3.947
  183    HE1  HIS   5           HE1      HIS   5  11.262  10.559  -5.183
  184    HE2  HIS   5           HE2      HIS   5   9.466  11.505  -3.637
  185    H    LEU   6           H        LEU   6   5.264   6.654  -4.384
  186    HA   LEU   6           HA       LEU   6   4.334   4.707  -6.369
  187   1HB   LEU   6          2HB       LEU   6   5.048   3.982  -3.692
  188   2HB   LEU   6          1HB       LEU   6   3.302   3.864  -3.836
  189    HG   LEU   6           HG       LEU   6   3.845   1.759  -4.580
  190   1HD1  LEU   6          1HD1      LEU   6   3.536   1.607  -6.867
  191   2HD1  LEU   6          2HD1      LEU   6   4.616   2.957  -7.215
  192   3HD1  LEU   6          3HD1      LEU   6   2.995   3.261  -6.585
  193   1HD2  LEU   6          1HD2      LEU   6   6.318   2.594  -6.036
  194   2HD2  LEU   6          2HD2      LEU   6   5.955   1.072  -5.224
  195   3HD2  LEU   6          3HD2      LEU   6   6.351   2.505  -4.275
  196    H    CYS   7           H        CYS   7   2.584   5.711  -7.169
  197    HA   CYS   7           HA       CYS   7   0.630   6.901  -5.249
  198   1HB   CYS   7          2HB       CYS   7   1.822   8.035  -7.695
  199   2HB   CYS   7          1HB       CYS   7   0.066   8.094  -7.690
  200    H    GLY   8           H        GLY   8  -1.552   6.431  -5.686
  201   1HA   GLY   8          2HA       GLY   8  -2.662   4.162  -6.250
  202   2HA   GLY   8          1HA       GLY   8  -3.333   5.536  -7.121
  203    H    SER   9           H        SER   9  -2.024   6.049  -9.234
  204    HA   SER   9           HA       SER   9  -2.293   3.956 -11.062
  205   1HB   SER   9          2HB       SER   9  -0.825   5.247 -12.551
  206   2HB   SER   9          1HB       SER   9  -1.927   6.324 -11.699
  207    HG   SER   9           HG       SER   9   0.118   7.177 -11.535
  208    H    ASP  10           H        ASP  10   0.941   5.098  -9.998
  209    HA   ASP  10           HA       ASP  10   2.207   2.636 -10.780
  210   1HB   ASP  10          2HB       ASP  10   3.247   4.702  -8.814
  211   2HB   ASP  10          1HB       ASP  10   4.201   3.523  -9.713
  212    H    LEU  11           H        LEU  11   0.660   3.706  -7.829
  213    HA   LEU  11           HA       LEU  11   1.805   1.727  -6.070
  214   1HB   LEU  11          2HB       LEU  11  -0.446   3.639  -6.016
  215   2HB   LEU  11          1HB       LEU  11  -0.689   2.202  -5.048
  216    HG   LEU  11           HG       LEU  11   1.809   3.863  -4.910
  217   1HD1  LEU  11          1HD1      LEU  11  -0.137   5.195  -4.185
  218   2HD1  LEU  11          2HD1      LEU  11   0.864   4.758  -2.802
  219   3HD1  LEU  11          3HD1      LEU  11  -0.635   3.885  -3.115
  220   1HD2  LEU  11          1HD2      LEU  11   2.029   1.531  -4.190
  221   2HD2  LEU  11          2HD2      LEU  11   0.625   1.714  -3.138
  222   3HD2  LEU  11          3HD2      LEU  11   2.108   2.606  -2.793
  223    H    VAL  12           H        VAL  12  -0.879   1.771  -8.328
  224    HA   VAL  12           HA       VAL  12  -1.987  -0.757  -7.486
  225    HB   VAL  12           HB       VAL  12  -2.236   0.909  -9.997
  226   1HG1  VAL  12          1HG1      VAL  12  -2.691  -1.099 -11.009
  227   2HG1  VAL  12          2HG1      VAL  12  -4.264  -0.848 -10.254
  228   3HG1  VAL  12          3HG1      VAL  12  -3.074  -1.900  -9.486
  229   1HG2  VAL  12          1HG2      VAL  12  -3.882   1.891  -8.821
  230   2HG2  VAL  12          2HG2      VAL  12  -3.530   0.841  -7.448
  231   3HG2  VAL  12          3HG2      VAL  12  -4.697   0.333  -8.668
  232    H    GLU  13           H        GLU  13  -0.429   0.050 -10.547
  233    HA   GLU  13           HA       GLU  13   0.189  -2.464 -11.497
  234   1HB   GLU  13          2HB       GLU  13   2.259  -0.270 -11.593
  235   2HB   GLU  13          1HB       GLU  13   1.867  -1.465 -12.831
  236   1HG   GLU  13          2HG       GLU  13  -0.498  -0.366 -12.811
  237   2HG   GLU  13          1HG       GLU  13   0.312   0.986 -12.021
  238    H    ALA  14           H        ALA  14   2.230  -0.575  -9.222
  239    HA   ALA  14           HA       ALA  14   4.134  -2.710  -8.837
  240   1HB   ALA  14          1HB       ALA  14   4.940  -0.633  -8.097
  241   2HB   ALA  14          2HB       ALA  14   4.463  -1.386  -6.576
  242   3HB   ALA  14          3HB       ALA  14   3.408  -0.197  -7.339
  243    H    LEU  15           H        LEU  15   1.141  -1.709  -7.204
  244    HA   LEU  15           HA       LEU  15   1.176  -3.534  -5.047
  245   1HB   LEU  15          2HB       LEU  15  -0.889  -2.040  -6.551
  246   2HB   LEU  15          1HB       LEU  15  -1.469  -3.522  -5.791
  247    HG   LEU  15           HG       LEU  15   0.210  -1.541  -4.272
  248   1HD1  LEU  15          1HD1      LEU  15  -1.757  -0.451  -3.459
  249   2HD1  LEU  15          2HD1      LEU  15  -2.809  -1.617  -4.264
  250   3HD1  LEU  15          3HD1      LEU  15  -1.883  -0.459  -5.218
  251   1HD2  LEU  15          1HD2      LEU  15  -0.255  -2.851  -2.468
  252   2HD2  LEU  15          2HD2      LEU  15  -0.595  -4.081  -3.685
  253   3HD2  LEU  15          3HD2      LEU  15  -1.915  -3.140  -2.992
  254    H    TYR  16           H        TYR  16   0.604  -3.969  -8.445
  255    HA   TYR  16           HA       TYR  16  -0.403  -6.707  -8.205
  256   1HB   TYR  16          2HB       TYR  16  -1.173  -5.800 -10.198
  257   2HB   TYR  16          1HB       TYR  16   0.273  -4.822 -10.433
  258    HD1  TYR  16           HD1      TYR  16  -1.057  -8.303 -10.622
  259    HD2  TYR  16           HD2      TYR  16   2.089  -5.602 -11.755
  260    HE1  TYR  16           HE1      TYR  16  -0.141 -10.016 -12.168
  261    HE2  TYR  16           HE2      TYR  16   3.003  -7.314 -13.300
  262    HH   TYR  16           HH       TYR  16   1.959 -10.579 -13.251
  263    H    LEU  17           H        LEU  17   2.645  -5.068  -8.855
  264    HA   LEU  17           HA       LEU  17   4.174  -7.481  -9.381
  265   1HB   LEU  17          2HB       LEU  17   4.653  -4.777  -9.636
  266   2HB   LEU  17          1HB       LEU  17   5.577  -5.167  -8.185
  267    HG   LEU  17           HG       LEU  17   6.524  -7.137  -9.521
  268   1HD1  LEU  17          1HD1      LEU  17   6.294  -5.842 -12.064
  269   2HD1  LEU  17          2HD1      LEU  17   4.672  -6.089 -11.418
  270   3HD1  LEU  17          3HD1      LEU  17   5.762  -7.461 -11.612
  271   1HD2  LEU  17          1HD2      LEU  17   8.072  -5.444  -9.140
  272   2HD2  LEU  17          2HD2      LEU  17   7.095  -4.228  -9.961
  273   3HD2  LEU  17          3HD2      LEU  17   7.992  -5.422 -10.901
  274    H    VAL  18           H        VAL  18   3.169  -5.583  -6.704
  275    HA   VAL  18           HA       VAL  18   4.765  -6.908  -4.672
  276    HB   VAL  18           HB       VAL  18   2.847  -4.688  -4.947
  277   1HG1  VAL  18          1HG1      VAL  18   1.446  -5.631  -3.381
  278   2HG1  VAL  18          2HG1      VAL  18   2.585  -4.781  -2.336
  279   3HG1  VAL  18          3HG1      VAL  18   2.750  -6.518  -2.594
  280   1HG2  VAL  18          1HG2      VAL  18   4.505  -3.542  -3.921
  281   2HG2  VAL  18          2HG2      VAL  18   5.469  -4.945  -4.382
  282   3HG2  VAL  18          3HG2      VAL  18   4.810  -4.826  -2.750
  283    H    CYS  19           H        CYS  19   1.311  -6.690  -5.357
  284    HA   CYS  19           HA       CYS  19   0.254  -8.589  -3.621
  285   1HB   CYS  19          2HB       CYS  19  -0.462  -7.976  -6.501
  286   2HB   CYS  19          1HB       CYS  19  -1.367  -9.151  -5.560
  287    H    GLY  20           H        GLY  20   2.225  -9.079  -6.448
  288   1HA   GLY  20          2HA       GLY  20   3.390 -11.000  -7.115
  289   2HA   GLY  20          1HA       GLY  20   2.770 -11.827  -5.684
  290    H    GLU  21           H        GLU  21   0.647 -12.792  -5.801
  291    HA   GLU  21           HA       GLU  21  -0.387 -13.114  -8.590
  292   1HB   GLU  21          2HB       GLU  21  -0.858 -15.453  -8.116
  293   2HB   GLU  21          1HB       GLU  21   0.845 -15.138  -7.784
  294   1HG   GLU  21          2HG       GLU  21  -0.571 -14.549  -5.397
  295   2HG   GLU  21          1HG       GLU  21  -1.183 -16.097  -5.982
  296    H    ARG  22           H        ARG  22  -1.067 -12.349  -5.322
  297    HA   ARG  22           HA       ARG  22  -3.920 -13.022  -5.470
  298   1HB   ARG  22          2HB       ARG  22  -4.016 -11.829  -3.264
  299   2HB   ARG  22          1HB       ARG  22  -2.843 -13.145  -3.299
  300   1HG   ARG  22          2HG       ARG  22  -1.438 -10.889  -4.212
  301   2HG   ARG  22          1HG       ARG  22  -2.394 -10.318  -2.844
  302   1HD   ARG  22          2HD       ARG  22  -1.416 -12.800  -2.012
  303   2HD   ARG  22          1HD       ARG  22  -0.058 -12.056  -2.857
  304    HE   ARG  22           HE       ARG  22  -0.376 -10.080  -1.318
  305   1HH1  ARG  22          1HH2      ARG  22  -2.941 -11.854  -0.431
  306   2HH1  ARG  22          2HH2      ARG  22  -2.470 -12.142   1.210
  307   1HH2  ARG  22          1HH1      ARG  22   0.775 -11.007   0.758
  308   2HH2  ARG  22          2HH1      ARG  22  -0.367 -11.659   1.885
  309    H    GLY  23           H        GLY  23  -5.486 -11.132  -4.881
  310   1HA   GLY  23          2HA       GLY  23  -4.840  -8.864  -6.710
  311   2HA   GLY  23          1HA       GLY  23  -6.474  -9.417  -6.338
  312    H    PHE  24           H        PHE  24  -5.684  -6.691  -5.998
  313    HA   PHE  24           HA       PHE  24  -5.322  -6.395  -3.061
  314   1HB   PHE  24          2HB       PHE  24  -5.228  -3.909  -3.684
  315   2HB   PHE  24          1HB       PHE  24  -3.901  -4.910  -4.271
  316    HD1  PHE  24           HD1      PHE  24  -7.038  -3.185  -5.215
  317    HD2  PHE  24           HD2      PHE  24  -3.628  -5.393  -6.614
  318    HE1  PHE  24           HE1      PHE  24  -7.590  -2.559  -7.553
  319    HE2  PHE  24           HE2      PHE  24  -4.178  -4.768  -8.952
  320    HZ   PHE  24           HZ       PHE  24  -6.159  -3.350  -9.421
  321    H    PHE  25           H        PHE  25  -6.691  -4.110  -2.512
  322    HA   PHE  25           HA       PHE  25  -9.506  -4.588  -3.366
  323   1HB   PHE  25          2HB       PHE  25  -9.176  -5.778  -1.225
  324   2HB   PHE  25          1HB       PHE  25  -8.567  -4.295  -0.493
  325    HD1  PHE  25           HD1      PHE  25 -11.556  -5.896  -2.012
  326    HD2  PHE  25           HD2      PHE  25 -10.047  -2.567   0.249
  327    HE1  PHE  25           HE1      PHE  25 -13.879  -5.204  -1.483
  328    HE2  PHE  25           HE2      PHE  25 -12.371  -1.873   0.778
  329    HZ   PHE  25           HZ       PHE  25 -14.287  -3.191  -0.088
  330    H    TYR  26           H        TYR  26  -8.952  -2.581  -4.618
  331    HA   TYR  26           HA       TYR  26  -9.411  -0.187  -2.912
  332   1HB   TYR  26          2HB       TYR  26  -7.241   0.403  -3.212
  333   2HB   TYR  26          1HB       TYR  26  -7.001  -0.805  -4.468
  334    HD1  TYR  26           HD1      TYR  26  -7.723   2.697  -3.748
  335    HD2  TYR  26           HD2      TYR  26  -7.627  -0.289  -6.839
  336    HE1  TYR  26           HE1      TYR  26  -7.788   4.479  -5.474
  337    HE2  TYR  26           HE2      TYR  26  -7.694   1.494  -8.563
  338    HH   TYR  26           HH       TYR  26  -8.176   4.874  -7.695
  339    H    THR  27           H        THR  27 -10.480  -2.010  -5.469
  340    HA   THR  27           HA       THR  27 -12.100   0.242  -6.452
  341    HB   THR  27           HB       THR  27 -10.047   0.347  -7.846
  342    HG1  THR  27           HG1      THR  27 -11.496   0.971  -9.213
  343   1HG2  THR  27          1HG2      THR  27 -10.513  -1.996  -9.438
  344   2HG2  THR  27          2HG2      THR  27 -10.310  -2.476  -7.753
  345   3HG2  THR  27          3HG2      THR  27  -9.055  -1.535  -8.559
  346    H    LYS  28           H        LYS  28 -12.516  -2.425  -5.117
  347    HA   LYS  28           HA       LYS  28 -13.681  -4.179  -7.090
  348   1HB   LYS  28          2HB       LYS  28 -14.272  -4.036  -4.113
  349   2HB   LYS  28          1HB       LYS  28 -14.661  -5.379  -5.183
  350   1HG   LYS  28          2HG       LYS  28 -11.858  -4.361  -4.561
  351   2HG   LYS  28          1HG       LYS  28 -12.570  -5.846  -3.942
  352   1HD   LYS  28          2HD       LYS  28 -11.627  -5.227  -6.748
  353   2HD   LYS  28          1HD       LYS  28 -11.275  -6.637  -5.749
  354   1HE   LYS  28          2HE       LYS  28 -13.561  -7.447  -6.000
  355   2HE   LYS  28          1HE       LYS  28 -14.016  -5.993  -6.887
  356   1HZ   LYS  28          1HZ       LYS  28 -12.307  -8.229  -7.736
  357   2HZ   LYS  28          2HZ       LYS  28 -12.063  -6.690  -8.414
  358   3HZ   LYS  28          3HZ       LYS  28 -13.569  -7.464  -8.573
  359    HA   PRO  29           HA       PRO  29 -17.768  -2.041  -5.854
  360   1HB   PRO  29          2HB       PRO  29 -17.595   0.311  -4.444
  361   2HB   PRO  29          1HB       PRO  29 -17.720  -1.280  -3.674
  362   1HG   PRO  29          2HG       PRO  29 -15.356   0.510  -3.895
  363   2HG   PRO  29          1HG       PRO  29 -15.697  -0.753  -2.702
  364   1HD   PRO  29          2HD       PRO  29 -13.952  -0.963  -4.941
  365   2HD   PRO  29          1HD       PRO  29 -14.475  -2.284  -3.879
  366    H    THR  30           H        THR  30 -18.751   0.389  -6.344
  367    HA   THR  30           HA       THR  30 -17.000   1.719  -8.357
  368    HB   THR  30           HB       THR  30 -18.431   0.173  -9.618
  369    HG1  THR  30           HG1      THR  30 -19.169   2.903  -9.717
  370   1HG2  THR  30          1HG2      THR  30 -20.984   0.858  -9.489
  371   2HG2  THR  30          2HG2      THR  30 -20.532   1.393  -7.870
  372   3HG2  THR  30          3HG2      THR  30 -20.307  -0.293  -8.337
  Start of MODEL   10
    1   1H    GLY   1          1H        GLY   1  -9.522   6.016  -0.339
    2   2H    GLY   1          2H        GLY   1  -9.175   5.372   1.193
    3   3H    GLY   1          3H        GLY   1 -10.373   4.660   0.222
    4   1HA   GLY   1          1HA       GLY   1  -8.363   3.362   0.051
    5   2HA   GLY   1          2HA       GLY   1  -8.660   4.128  -1.539
    6    H    ALA   2           H        ALA   2  -7.338   6.032   1.001
    7    HA   ALA   2           HA       ALA   2  -5.201   6.377   1.915
    8   1HB   ALA   2          1HB       ALA   2  -5.659   3.717   2.299
    9   2HB   ALA   2          2HB       ALA   2  -4.179   4.536   2.802
   10   3HB   ALA   2          3HB       ALA   2  -4.224   3.655   1.274
   11    H    VAL   3           H        VAL   3  -3.943   7.650   0.640
   12    HA   VAL   3           HA       VAL   3  -2.303   6.413  -1.457
   13    HB   VAL   3           HB       VAL   3  -3.072   8.000  -3.217
   14   1HG1  VAL   3          1HG1      VAL   3  -5.425   6.430  -2.148
   15   2HG1  VAL   3          2HG1      VAL   3  -4.021   5.641  -2.867
   16   3HG1  VAL   3          3HG1      VAL   3  -5.002   6.747  -3.830
   17   1HG2  VAL   3          1HG2      VAL   3  -5.643   8.600  -2.024
   18   2HG2  VAL   3          2HG2      VAL   3  -4.461   9.708  -2.720
   19   3HG2  VAL   3          3HG2      VAL   3  -4.339   9.241  -1.023
   20    H    GLU   4           H        GLU   4  -1.252   8.609  -2.670
   21    HA   GLU   4           HA       GLU   4   0.394  10.246  -2.270
   22   1HB   GLU   4          2HB       GLU   4  -1.808  11.083  -0.370
   23   2HB   GLU   4          1HB       GLU   4  -0.376  12.064  -0.686
   24   1HG   GLU   4          2HG       GLU   4  -0.924  12.050  -3.108
   25   2HG   GLU   4          1HG       GLU   4  -2.387  11.131  -2.756
   26    H    GLN   5           H        GLN   5   0.825   7.803  -0.917
   27    HA   GLN   5           HA       GLN   5   2.185   8.805   1.546
   28   1HB   GLN   5          2HB       GLN   5   0.599   6.249   1.204
   29   2HB   GLN   5          1HB       GLN   5   1.701   6.528   2.553
   30   1HG   GLN   5          2HG       GLN   5   0.229   8.838   2.579
   31   2HG   GLN   5          1HG       GLN   5  -0.975   7.666   2.043
   32   1HE2  GLN   5          1HE2      GLN   5  -1.394   8.729   4.555
   33   2HE2  GLN   5          2HE2      GLN   5  -1.016   7.594   5.759
   34    H    CYS   6           H        CYS   6   2.362   6.944  -1.373
   35    HA   CYS   6           HA       CYS   6   5.068   5.992  -0.530
   36   1HB   CYS   6          2HB       CYS   6   2.963   4.712  -2.259
   37   2HB   CYS   6          1HB       CYS   6   4.662   4.280  -2.450
   38    H    CYS   7           H        CYS   7   3.460   8.173  -2.507
   39    HA   CYS   7           HA       CYS   7   5.596   8.098  -4.589
   40   1HB   CYS   7          2HB       CYS   7   4.140   9.712  -5.812
   41   2HB   CYS   7          1HB       CYS   7   3.317   8.185  -5.473
   42    H    THR   8           H        THR   8   6.431  10.380  -5.216
   43    HA   THR   8           HA       THR   8   7.642  12.267  -4.485
   44    HB   THR   8           HB       THR   8   6.391  13.861  -3.336
   45    HG1  THR   8           HG1      THR   8   5.083  11.787  -1.919
   46   1HG2  THR   8          1HG2      THR   8   4.209  11.867  -3.987
   47   2HG2  THR   8          2HG2      THR   8   5.032  12.842  -5.204
   48   3HG2  THR   8          3HG2      THR   8   4.071  13.625  -3.949
   49    H    SER   9           H        SER   9   7.941   9.538  -3.316
   50    HA   SER   9           HA       SER   9  10.031   9.771  -1.569
   51   1HB   SER   9          2HB       SER   9   9.105  10.845   0.237
   52   2HB   SER   9          1HB       SER   9   7.462  10.431  -0.240
   53    HG   SER   9           HG       SER   9   8.490   9.387   1.717
   54    H    ILE  10           H        ILE  10  10.633   7.617  -0.910
   55    HA   ILE  10           HA       ILE  10   8.754   5.581  -1.969
   56    HB   ILE  10           HB       ILE  10  11.378   4.606  -1.082
   57   1HG1  ILE  10          2HG1      ILE  10  11.941   6.940  -1.923
   58   2HG1  ILE  10          1HG1      ILE  10  12.667   5.637  -2.857
   59   1HG2  ILE  10          1HG2      ILE  10  11.232   3.489  -3.236
   60   2HG2  ILE  10          2HG2      ILE  10   9.920   4.553  -3.738
   61   3HG2  ILE  10          3HG2      ILE  10   9.663   3.389  -2.439
   62   1HD1  ILE  10          1HD1      ILE  10  10.021   6.883  -3.614
   63   2HD1  ILE  10          2HD1      ILE  10  11.053   5.846  -4.599
   64   3HD1  ILE  10          3HD1      ILE  10  11.562   7.491  -4.220
   65    H    CYS  11           H        CYS  11   7.643   4.291  -0.663
   66    HA   CYS  11           HA       CYS  11   8.099   4.454   2.246
   67   1HB   CYS  11          2HB       CYS  11   5.982   3.042   2.306
   68   2HB   CYS  11          1HB       CYS  11   5.803   4.631   1.565
   69    H    SER  12           H        SER  12   6.750   1.449   1.703
   70    HA   SER  12           HA       SER  12   9.345   0.066   1.344
   71   1HB   SER  12          2HB       SER  12   7.595  -0.553   3.730
   72   2HB   SER  12          1HB       SER  12   9.218  -1.148   3.398
   73    HG   SER  12           HG       SER  12   9.652   0.497   4.694
   74    H    LEU  13           H        LEU  13   8.883  -1.369  -0.238
   75    HA   LEU  13           HA       LEU  13   6.516  -2.225  -1.300
   76   1HB   LEU  13          2HB       LEU  13   9.040  -3.025  -1.682
   77   2HB   LEU  13          1HB       LEU  13   8.466  -4.419  -0.761
   78    HG   LEU  13           HG       LEU  13   6.399  -3.913  -2.537
   79   1HD1  LEU  13          1HD1      LEU  13   7.227  -2.811  -4.311
   80   2HD1  LEU  13          2HD1      LEU  13   8.316  -4.171  -4.589
   81   3HD1  LEU  13          3HD1      LEU  13   8.841  -2.807  -3.601
   82   1HD2  LEU  13          1HD2      LEU  13   8.400  -5.948  -2.018
   83   2HD2  LEU  13          2HD2      LEU  13   8.020  -5.865  -3.739
   84   3HD2  LEU  13          3HD2      LEU  13   6.735  -6.142  -2.564
   85    H    TYR  14           H        TYR  14   7.834  -3.315   1.797
   86    HA   TYR  14           HA       TYR  14   6.106  -5.521   2.246
   87   1HB   TYR  14          2HB       TYR  14   7.611  -3.622   3.993
   88   2HB   TYR  14          1HB       TYR  14   6.351  -4.602   4.747
   89    HD1  TYR  14           HD1      TYR  14   9.746  -4.535   4.082
   90    HD2  TYR  14           HD2      TYR  14   6.363  -7.166   3.742
   91    HE1  TYR  14           HE1      TYR  14  11.270  -6.494   4.080
   92    HE2  TYR  14           HE2      TYR  14   7.887  -9.124   3.741
   93    HH   TYR  14           HH       TYR  14  11.247  -8.837   3.308
   94    H    GLN  15           H        GLN  15   5.658  -2.239   3.642
   95    HA   GLN  15           HA       GLN  15   2.981  -2.546   4.420
   96   1HB   GLN  15          2HB       GLN  15   4.794  -0.395   4.169
   97   2HB   GLN  15          1HB       GLN  15   3.369   0.074   3.243
   98   1HG   GLN  15          2HG       GLN  15   2.118   0.331   5.106
   99   2HG   GLN  15          1HG       GLN  15   2.688  -1.191   5.790
  100   1HE2  GLN  15          1HE2      GLN  15   4.991  -1.094   6.752
  101   2HE2  GLN  15          2HE2      GLN  15   5.460   0.351   7.510
  102    H    LEU  16           H        LEU  16   4.369  -2.214   1.281
  103    HA   LEU  16           HA       LEU  16   2.030  -1.451  -0.207
  104   1HB   LEU  16          2HB       LEU  16   4.711  -1.944  -0.723
  105   2HB   LEU  16          1HB       LEU  16   3.894  -3.215  -1.618
  106    HG   LEU  16           HG       LEU  16   3.446  -0.233  -1.825
  107   1HD1  LEU  16          1HD1      LEU  16   4.748  -2.342  -3.483
  108   2HD1  LEU  16          2HD1      LEU  16   5.181  -0.643  -3.283
  109   3HD1  LEU  16          3HD1      LEU  16   3.844  -1.094  -4.340
  110   1HD2  LEU  16          1HD2      LEU  16   2.010  -1.875  -3.749
  111   2HD2  LEU  16          2HD2      LEU  16   1.391  -0.598  -2.700
  112   3HD2  LEU  16          3HD2      LEU  16   1.513  -2.252  -2.099
  113    H    GLU  17           H        GLU  17   3.413  -4.585   0.735
  114    HA   GLU  17           HA       GLU  17   1.423  -6.149  -0.670
  115   1HB   GLU  17          2HB       GLU  17   3.549  -6.673   1.363
  116   2HB   GLU  17          1HB       GLU  17   2.252  -7.861   1.220
  117   1HG   GLU  17          2HG       GLU  17   3.643  -6.842  -1.247
  118   2HG   GLU  17          1HG       GLU  17   4.371  -8.129  -0.286
  119    H    ASN  18           H        ASN  18   1.437  -4.305   2.205
  120    HA   ASN  18           HA       ASN  18  -0.646  -5.793   3.595
  121   1HB   ASN  18          2HB       ASN  18   0.543  -3.032   3.957
  122   2HB   ASN  18          1HB       ASN  18  -0.765  -3.643   4.971
  123   1HD2  ASN  18          1HD2      ASN  18   1.548  -3.113   6.336
  124   2HD2  ASN  18          2HD2      ASN  18   2.377  -4.542   6.722
  125    H    TYR  19           H        TYR  19  -0.576  -3.691   0.919
  126    HA   TYR  19           HA       TYR  19  -3.360  -2.742   1.366
  127   1HB   TYR  19          2HB       TYR  19  -1.337  -2.202  -0.814
  128   2HB   TYR  19          1HB       TYR  19  -2.966  -1.546  -0.820
  129    HD1  TYR  19           HD1      TYR  19  -0.010  -0.293  -0.573
  130    HD2  TYR  19           HD2      TYR  19  -3.275  -1.004   2.123
  131    HE1  TYR  19           HE1      TYR  19   0.775   1.567   0.854
  132    HE2  TYR  19           HE2      TYR  19  -2.494   0.859   3.557
  133    HH   TYR  19           HH       TYR  19  -0.624   3.201   2.677
  134    H    CYS  20           H        CYS  20  -2.558  -5.603   0.893
  135    HA   CYS  20           HA       CYS  20  -4.262  -6.065  -1.510
  136   1HB   CYS  20          2HB       CYS  20  -1.516  -6.892  -0.961
  137   2HB   CYS  20          1HB       CYS  20  -2.570  -8.206  -1.456
  138    H    ASN  21           H        ASN  21  -4.331  -8.796  -1.426
  139    HA   ASN  21           HA       ASN  21  -6.144  -9.293   0.798
  140   1HB   ASN  21          2HB       ASN  21  -5.323 -10.645  -1.693
  141   2HB   ASN  21          1HB       ASN  21  -5.718 -11.741  -0.370
  142   1HD2  ASN  21          1HD2      ASN  21  -7.928 -11.710   0.463
  143   2HD2  ASN  21          2HD2      ASN  21  -9.184 -10.953  -0.394
  144   1H    PHE   1          1H        PHE   1  10.336  -5.688  -7.383
  145   2H    PHE   1          2H        PHE   1  11.044  -4.403  -8.239
  146   3H    PHE   1          3H        PHE   1   9.767  -4.106  -7.158
  147    HA   PHE   1           HA       PHE   1  11.072  -4.489  -5.283
  148   1HB   PHE   1          2HB       PHE   1  12.860  -5.877  -7.269
  149   2HB   PHE   1          1HB       PHE   1  13.515  -5.304  -5.736
  150    HD1  PHE   1           HD1      PHE   1  12.333  -8.141  -7.244
  151    HD2  PHE   1           HD2      PHE   1  11.650  -5.794  -3.709
  152    HE1  PHE   1           HE1      PHE   1  11.407 -10.137  -6.098
  153    HE2  PHE   1           HE2      PHE   1  10.724  -7.790  -2.563
  154    HZ   PHE   1           HZ       PHE   1  10.603  -9.962  -3.757
  155    H    VAL   2           H        VAL   2  10.772  -2.347  -7.374
  156    HA   VAL   2           HA       VAL   2  13.406  -1.037  -7.394
  157    HB   VAL   2           HB       VAL   2  11.509  -0.961  -9.222
  158   1HG1  VAL   2          1HG1      VAL   2   9.766   0.473  -8.936
  159   2HG1  VAL   2          2HG1      VAL   2  10.738   1.630  -8.026
  160   3HG1  VAL   2          3HG1      VAL   2  10.081   0.205  -7.221
  161   1HG2  VAL   2          1HG2      VAL   2  13.074   0.394 -10.091
  162   2HG2  VAL   2          2HG2      VAL   2  13.677   0.765  -8.476
  163   3HG2  VAL   2          3HG2      VAL   2  12.385   1.737  -9.179
  164    H    ASN   3           H        ASN   3  12.324   1.666  -7.069
  165    HA   ASN   3           HA       ASN   3  11.132   1.880  -4.433
  166   1HB   ASN   3          2HB       ASN   3  13.176   3.015  -3.430
  167   2HB   ASN   3          1HB       ASN   3  13.321   1.268  -3.634
  168   1HD2  ASN   3          1HD2      ASN   3  14.530   0.520  -5.625
  169   2HD2  ASN   3          2HD2      ASN   3  15.741   1.520  -6.272
  170    H    GLN   4           H        GLN   4  10.010   3.085  -6.395
  171    HA   GLN   4           HA       GLN   4  11.138   5.852  -6.502
  172   1HB   GLN   4          2HB       GLN   4   9.939   6.050  -8.699
  173   2HB   GLN   4          1HB       GLN   4  11.216   4.834  -8.706
  174   1HG   GLN   4          2HG       GLN   4   9.742   3.089  -8.875
  175   2HG   GLN   4          1HG       GLN   4   8.515   3.895  -7.897
  176   1HE2  GLN   4          1HE2      GLN   4   9.618   3.340 -11.166
  177   2HE2  GLN   4          2HE2      GLN   4   8.410   4.248 -11.939
  178    H    HIS   5           H        HIS   5   8.911   7.119  -7.594
  179    HA   HIS   5           HA       HIS   5   7.258   7.490  -5.258
  180   1HB   HIS   5          2HB       HIS   5   6.588   8.387  -8.065
  181   2HB   HIS   5          1HB       HIS   5   6.127   9.150  -6.545
  182    HD2  HIS   5           HD2      HIS   5   8.205  10.438  -9.037
  183    HE1  HIS   5           HE1      HIS   5  10.879  10.540  -5.763
  184    HE2  HIS   5           HE2      HIS   5  10.428  11.425  -8.112
  185    H    LEU   6           H        LEU   6   5.586   6.183  -4.658
  186    HA   LEU   6           HA       LEU   6   4.136   4.721  -6.822
  187   1HB   LEU   6          2HB       LEU   6   5.472   3.730  -4.506
  188   2HB   LEU   6          1HB       LEU   6   3.742   3.484  -4.275
  189    HG   LEU   6           HG       LEU   6   3.560   2.310  -6.372
  190   1HD1  LEU   6          1HD1      LEU   6   5.956   3.785  -6.938
  191   2HD1  LEU   6          2HD1      LEU   6   4.937   2.873  -8.051
  192   3HD1  LEU   6          3HD1      LEU   6   6.260   2.069  -7.205
  193   1HD2  LEU   6          1HD2      LEU   6   4.432   0.387  -5.536
  194   2HD2  LEU   6          2HD2      LEU   6   5.005   1.383  -4.196
  195   3HD2  LEU   6          3HD2      LEU   6   6.074   1.031  -5.554
  196    H    CYS   7           H        CYS   7   2.221   5.745  -7.106
  197    HA   CYS   7           HA       CYS   7   0.532   6.166  -4.725
  198   1HB   CYS   7          2HB       CYS   7   1.639   8.336  -6.346
  199   2HB   CYS   7          1HB       CYS   7  -0.119   8.396  -6.203
  200    H    GLY   8           H        GLY   8  -1.553   5.619  -5.101
  201   1HA   GLY   8          2HA       GLY   8  -3.206   4.377  -6.272
  202   2HA   GLY   8          1HA       GLY   8  -3.280   5.907  -7.142
  203    H    SER   9           H        SER   9  -2.219   6.059  -9.220
  204    HA   SER   9           HA       SER   9  -2.374   3.807 -10.873
  205   1HB   SER   9          2HB       SER   9  -0.683   6.300 -11.142
  206   2HB   SER   9          1HB       SER   9  -0.860   5.109 -12.425
  207    HG   SER   9           HG       SER   9  -3.138   5.464 -12.280
  208    H    ASP  10           H        ASP  10   0.772   5.280  -9.993
  209    HA   ASP  10           HA       ASP  10   2.284   3.001 -10.734
  210   1HB   ASP  10          2HB       ASP  10   3.089   4.932  -8.548
  211   2HB   ASP  10          1HB       ASP  10   4.140   4.039  -9.646
  212    H    LEU  11           H        LEU  11   0.501   3.664  -7.782
  213    HA   LEU  11           HA       LEU  11   1.861   1.576  -6.265
  214   1HB   LEU  11          2HB       LEU  11  -0.351   3.452  -5.785
  215   2HB   LEU  11          1HB       LEU  11  -0.554   1.887  -5.011
  216    HG   LEU  11           HG       LEU  11   1.907   3.621  -4.796
  217   1HD1  LEU  11          1HD1      LEU  11  -0.591   3.664  -3.384
  218   2HD1  LEU  11          2HD1      LEU  11   0.837   4.662  -3.112
  219   3HD1  LEU  11          3HD1      LEU  11   0.677   3.110  -2.291
  220   1HD2  LEU  11          1HD2      LEU  11   2.828   1.599  -4.355
  221   2HD2  LEU  11          2HD2      LEU  11   1.256   0.838  -4.108
  222   3HD2  LEU  11          3HD2      LEU  11   2.005   1.759  -2.804
  223    H    VAL  12           H        VAL  12  -0.805   1.718  -8.492
  224    HA   VAL  12           HA       VAL  12  -1.942  -0.834  -7.696
  225    HB   VAL  12           HB       VAL  12  -2.304   1.007 -10.054
  226   1HG1  VAL  12          1HG1      VAL  12  -3.215  -1.847  -9.743
  227   2HG1  VAL  12          2HG1      VAL  12  -2.565  -1.040 -11.171
  228   3HG1  VAL  12          3HG1      VAL  12  -4.206  -0.692 -10.633
  229   1HG2  VAL  12          1HG2      VAL  12  -3.504   1.675  -8.102
  230   2HG2  VAL  12          2HG2      VAL  12  -4.009   0.020  -7.760
  231   3HG2  VAL  12          3HG2      VAL  12  -4.688   0.883  -9.141
  232    H    GLU  13           H        GLU  13  -0.197   0.205 -10.596
  233    HA   GLU  13           HA       GLU  13   0.238  -2.347 -11.705
  234   1HB   GLU  13          2HB       GLU  13   2.255  -0.101 -11.856
  235   2HB   GLU  13          1HB       GLU  13   1.861  -1.303 -13.091
  236   1HG   GLU  13          2HG       GLU  13  -0.588  -0.216 -12.722
  237   2HG   GLU  13          1HG       GLU  13   0.414   1.184 -12.340
  238    H    ALA  14           H        ALA  14   2.086  -0.631  -9.196
  239    HA   ALA  14           HA       ALA  14   4.129  -2.733  -9.089
  240   1HB   ALA  14          1HB       ALA  14   5.212  -1.050  -8.033
  241   2HB   ALA  14          2HB       ALA  14   4.126  -1.274  -6.664
  242   3HB   ALA  14          3HB       ALA  14   3.726  -0.108  -7.925
  243    H    LEU  15           H        LEU  15   1.211  -1.791  -7.324
  244    HA   LEU  15           HA       LEU  15   1.320  -3.590  -5.170
  245   1HB   LEU  15          2HB       LEU  15  -0.803  -2.159  -6.635
  246   2HB   LEU  15          1HB       LEU  15  -1.338  -3.643  -5.855
  247    HG   LEU  15           HG       LEU  15   0.315  -1.567  -4.416
  248   1HD1  LEU  15          1HD1      LEU  15  -2.669  -1.796  -4.765
  249   2HD1  LEU  15          2HD1      LEU  15  -1.653  -0.358  -4.872
  250   3HD1  LEU  15          3HD1      LEU  15  -1.984  -1.090  -3.302
  251   1HD2  LEU  15          1HD2      LEU  15   0.158  -4.005  -3.651
  252   2HD2  LEU  15          2HD2      LEU  15  -1.548  -3.686  -3.333
  253   3HD2  LEU  15          3HD2      LEU  15  -0.305  -2.788  -2.461
  254    H    TYR  16           H        TYR  16   0.667  -4.152  -8.552
  255    HA   TYR  16           HA       TYR  16  -0.226  -6.920  -8.068
  256   1HB   TYR  16          2HB       TYR  16  -1.288  -6.237 -10.002
  257   2HB   TYR  16          1HB       TYR  16  -0.032  -5.069 -10.402
  258    HD1  TYR  16           HD1      TYR  16  -0.943  -8.678 -10.523
  259    HD2  TYR  16           HD2      TYR  16   1.786  -5.633 -11.846
  260    HE1  TYR  16           HE1      TYR  16   0.020 -10.258 -12.179
  261    HE2  TYR  16           HE2      TYR  16   2.746  -7.210 -13.500
  262    HH   TYR  16           HH       TYR  16   1.316 -10.373 -14.071
  263    H    LEU  17           H        LEU  17   2.643  -5.150  -9.149
  264    HA   LEU  17           HA       LEU  17   4.234  -7.475  -9.803
  265   1HB   LEU  17          2HB       LEU  17   4.613  -4.739  -9.986
  266   2HB   LEU  17          1HB       LEU  17   5.655  -5.163  -8.626
  267    HG   LEU  17           HG       LEU  17   6.444  -7.108 -10.185
  268   1HD1  LEU  17          1HD1      LEU  17   6.299  -6.635 -12.550
  269   2HD1  LEU  17          2HD1      LEU  17   5.516  -5.086 -12.240
  270   3HD1  LEU  17          3HD1      LEU  17   4.663  -6.591 -11.893
  271   1HD2  LEU  17          1HD2      LEU  17   7.659  -4.948  -9.406
  272   2HD2  LEU  17          2HD2      LEU  17   7.299  -4.340 -11.022
  273   3HD2  LEU  17          3HD2      LEU  17   8.292  -5.785 -10.823
  274    H    VAL  18           H        VAL  18   3.400  -5.645  -7.018
  275    HA   VAL  18           HA       VAL  18   5.099  -7.019  -5.109
  276    HB   VAL  18           HB       VAL  18   3.125  -4.832  -5.224
  277   1HG1  VAL  18          1HG1      VAL  18   3.042  -5.099  -2.562
  278   2HG1  VAL  18          2HG1      VAL  18   3.023  -6.803  -3.011
  279   3HG1  VAL  18          3HG1      VAL  18   1.780  -5.714  -3.623
  280   1HG2  VAL  18          1HG2      VAL  18   5.728  -5.491  -4.009
  281   2HG2  VAL  18          2HG2      VAL  18   4.744  -4.284  -3.178
  282   3HG2  VAL  18          3HG2      VAL  18   5.210  -4.038  -4.862
  283    H    CYS  19           H        CYS  19   1.656  -6.812  -5.724
  284    HA   CYS  19           HA       CYS  19   1.059  -9.243  -4.197
  285   1HB   CYS  19          2HB       CYS  19  -0.724  -7.513  -5.945
  286   2HB   CYS  19          1HB       CYS  19  -1.278  -8.731  -4.806
  287    H    GLY  20           H        GLY  20   2.841  -9.822  -6.240
  288   1HA   GLY  20          2HA       GLY  20   2.144 -10.507  -8.770
  289   2HA   GLY  20          1HA       GLY  20   3.032 -11.642  -7.757
  290    H    GLU  21           H        GLU  21  -0.014 -10.921  -9.218
  291    HA   GLU  21           HA       GLU  21  -1.806 -12.399  -9.644
  292   1HB   GLU  21          2HB       GLU  21   0.078 -14.192  -9.227
  293   2HB   GLU  21          1HB       GLU  21  -0.730 -14.389  -7.671
  294   1HG   GLU  21          2HG       GLU  21  -2.904 -14.462  -9.202
  295   2HG   GLU  21          1HG       GLU  21  -1.744 -14.989 -10.422
  296    H    ARG  22           H        ARG  22  -0.886 -13.099  -6.270
  297    HA   ARG  22           HA       ARG  22  -2.830 -13.388  -4.663
  298   1HB   ARG  22          2HB       ARG  22  -1.286 -10.795  -4.567
  299   2HB   ARG  22          1HB       ARG  22  -2.331 -11.347  -3.257
  300   1HG   ARG  22          2HG       ARG  22  -0.963 -13.575  -3.463
  301   2HG   ARG  22          1HG       ARG  22   0.231 -12.554  -4.266
  302   1HD   ARG  22          2HD       ARG  22   0.952 -11.871  -2.248
  303   2HD   ARG  22          1HD       ARG  22  -0.627 -11.137  -1.964
  304    HE   ARG  22           HE       ARG  22  -0.350 -14.032  -1.385
  305   1HH1  ARG  22          1HH2      ARG  22   0.750 -11.351   0.181
  306   2HH1  ARG  22          2HH2      ARG  22  -0.268 -11.493   1.577
  307   1HH2  ARG  22          1HH1      ARG  22  -2.252 -13.982   0.202
  308   2HH2  ARG  22          2HH1      ARG  22  -1.967 -12.984   1.588
  309    H    GLY  23           H        GLY  23  -2.899  -9.929  -5.183
  310   1HA   GLY  23          2HA       GLY  23  -4.924  -9.125  -6.627
  311   2HA   GLY  23          1HA       GLY  23  -5.855 -10.125  -5.509
  312    H    PHE  24           H        PHE  24  -5.583  -7.065  -6.002
  313    HA   PHE  24           HA       PHE  24  -4.923  -6.317  -3.192
  314   1HB   PHE  24          2HB       PHE  24  -4.897  -3.953  -4.156
  315   2HB   PHE  24          1HB       PHE  24  -3.612  -5.023  -4.699
  316    HD1  PHE  24           HD1      PHE  24  -7.177  -4.281  -5.667
  317    HD2  PHE  24           HD2      PHE  24  -3.139  -4.979  -6.965
  318    HE1  PHE  24           HE1      PHE  24  -7.880  -3.967  -8.025
  319    HE2  PHE  24           HE2      PHE  24  -3.843  -4.664  -9.323
  320    HZ   PHE  24           HZ       PHE  24  -6.213  -4.158  -9.853
  321    H    PHE  25           H        PHE  25  -6.327  -4.009  -2.877
  322    HA   PHE  25           HA       PHE  25  -9.169  -4.804  -3.364
  323   1HB   PHE  25          2HB       PHE  25  -7.867  -4.765  -0.881
  324   2HB   PHE  25          1HB       PHE  25  -8.820  -3.281  -0.916
  325    HD1  PHE  25           HD1      PHE  25  -8.972  -6.532   0.151
  326    HD2  PHE  25           HD2      PHE  25 -11.225  -3.773  -2.254
  327    HE1  PHE  25           HE1      PHE  25 -11.034  -7.844   0.578
  328    HE2  PHE  25           HE2      PHE  25 -13.288  -5.085  -1.827
  329    HZ   PHE  25           HZ       PHE  25 -13.192  -7.120  -0.411
  330    H    TYR  26           H        TYR  26  -7.199  -2.767  -4.570
  331    HA   TYR  26           HA       TYR  26  -7.807  -0.126  -3.886
  332   1HB   TYR  26          2HB       TYR  26  -6.274  -1.082  -5.766
  333   2HB   TYR  26          1HB       TYR  26  -7.717  -0.982  -6.773
  334    HD1  TYR  26           HD1      TYR  26  -5.953   1.141  -4.218
  335    HD2  TYR  26           HD2      TYR  26  -7.967   0.969  -8.010
  336    HE1  TYR  26           HE1      TYR  26  -5.563   3.571  -4.536
  337    HE2  TYR  26           HE2      TYR  26  -7.578   3.398  -8.327
  338    HH   TYR  26           HH       TYR  26  -6.108   5.139  -7.553
  339    H    THR  27           H        THR  27  -9.848   0.649  -3.503
  340    HA   THR  27           HA       THR  27 -11.912   0.141  -5.597
  341    HB   THR  27           HB       THR  27 -12.240  -0.120  -2.598
  342    HG1  THR  27           HG1      THR  27 -12.489  -1.791  -4.849
  343   1HG2  THR  27          1HG2      THR  27 -14.700  -0.649  -3.529
  344   2HG2  THR  27          2HG2      THR  27 -14.208   0.537  -4.738
  345   3HG2  THR  27          3HG2      THR  27 -14.216   0.971  -3.028
  346    H    LYS  28           H        LYS  28 -13.049   1.964  -6.160
  347    HA   LYS  28           HA       LYS  28 -12.464   4.448  -4.600
  348   1HB   LYS  28          2HB       LYS  28 -13.553   4.396  -7.417
  349   2HB   LYS  28          1HB       LYS  28 -12.655   5.682  -6.611
  350   1HG   LYS  28          2HG       LYS  28 -11.567   3.003  -7.565
  351   2HG   LYS  28          1HG       LYS  28 -11.131   4.599  -8.167
  352   1HD   LYS  28          2HD       LYS  28 -10.521   3.520  -5.379
  353   2HD   LYS  28          1HD       LYS  28  -9.353   3.742  -6.682
  354   1HE   LYS  28          2HE       LYS  28 -10.967   6.139  -6.017
  355   2HE   LYS  28          1HE       LYS  28  -9.839   5.611  -4.769
  356   1HZ   LYS  28          1HZ       LYS  28  -8.038   5.934  -6.124
  357   2HZ   LYS  28          2HZ       LYS  28  -9.051   7.191  -6.655
  358   3HZ   LYS  28          3HZ       LYS  28  -8.928   5.757  -7.557
  359    HA   PRO  29           HA       PRO  29 -16.889   3.779  -3.817
  360   1HB   PRO  29          2HB       PRO  29 -16.827   4.968  -1.340
  361   2HB   PRO  29          1HB       PRO  29 -16.426   3.265  -1.620
  362   1HG   PRO  29          2HG       PRO  29 -14.601   5.550  -1.040
  363   2HG   PRO  29          1HG       PRO  29 -14.371   3.823  -0.724
  364   1HD   PRO  29          2HD       PRO  29 -13.221   5.291  -2.859
  365   2HD   PRO  29          1HD       PRO  29 -13.260   3.522  -2.705
  366    H    THR  30           H        THR  30 -18.374   5.240  -4.560
  367    HA   THR  30           HA       THR  30 -19.150   7.295  -5.435
  368    HB   THR  30           HB       THR  30 -19.825   7.315  -3.026
  369    HG1  THR  30           HG1      THR  30 -20.608   9.207  -3.433
  370   1HG2  THR  30          1HG2      THR  30 -18.422   8.938  -1.597
  371   2HG2  THR  30          2HG2      THR  30 -17.146   8.682  -2.786
  372   3HG2  THR  30          3HG2      THR  30 -17.770   7.320  -1.855
  Start of MODEL   11
    1   1H    GLY   1          1H        GLY   1  -6.020   3.635   1.691
    2   2H    GLY   1          2H        GLY   1  -7.519   3.572   0.893
    3   3H    GLY   1          3H        GLY   1  -7.361   4.447   2.341
    4   1HA   GLY   1          1HA       GLY   1  -6.218   5.193  -0.238
    5   2HA   GLY   1          2HA       GLY   1  -7.445   6.120   0.678
    6    H    ALA   2           H        ALA   2  -5.837   7.709   1.501
    7    HA   ALA   2           HA       ALA   2  -3.802   8.877   1.640
    8   1HB   ALA   2          1HB       ALA   2  -3.546   6.356   2.963
    9   2HB   ALA   2          2HB       ALA   2  -2.688   7.858   3.307
   10   3HB   ALA   2          3HB       ALA   2  -2.018   6.703   2.155
   11    H    VAL   3           H        VAL   3  -4.073   8.981  -0.836
   12    HA   VAL   3           HA       VAL   3  -2.580   7.265  -2.563
   13    HB   VAL   3           HB       VAL   3  -3.384  10.174  -2.861
   14   1HG1  VAL   3          1HG1      VAL   3  -2.120   8.229  -4.799
   15   2HG1  VAL   3          2HG1      VAL   3  -1.571   9.851  -4.374
   16   3HG1  VAL   3          3HG1      VAL   3  -3.031   9.638  -5.339
   17   1HG2  VAL   3          1HG2      VAL   3  -4.647   7.531  -3.404
   18   2HG2  VAL   3          2HG2      VAL   3  -4.897   8.793  -4.610
   19   3HG2  VAL   3          3HG2      VAL   3  -5.395   9.059  -2.939
   20    H    GLU   4           H        GLU   4  -1.701  10.629  -1.667
   21    HA   GLU   4           HA       GLU   4   1.031  10.338  -2.458
   22   1HB   GLU   4          2HB       GLU   4  -0.602  12.335  -1.075
   23   2HB   GLU   4          1HB       GLU   4   1.051  12.271  -0.464
   24   1HG   GLU   4          2HG       GLU   4   1.459  12.114  -3.174
   25   2HG   GLU   4          1HG       GLU   4   0.055  13.177  -3.086
   26    H    GLN   5           H        GLN   5   1.683   8.308  -1.516
   27    HA   GLN   5           HA       GLN   5   2.659   8.621   1.258
   28   1HB   GLN   5          2HB       GLN   5   0.370   7.018   0.577
   29   2HB   GLN   5          1HB       GLN   5   1.685   5.956   1.083
   30   1HG   GLN   5          2HG       GLN   5   1.700   8.176   2.851
   31   2HG   GLN   5          1HG       GLN   5   0.024   7.647   2.712
   32   1HE2  GLN   5          1HE2      GLN   5   1.139   7.192   5.170
   33   2HE2  GLN   5          2HE2      GLN   5   1.532   5.553   5.374
   34    H    CYS   6           H        CYS   6   2.516   6.653  -1.695
   35    HA   CYS   6           HA       CYS   6   5.186   5.532  -1.003
   36   1HB   CYS   6          2HB       CYS   6   2.981   4.665  -2.860
   37   2HB   CYS   6          1HB       CYS   6   4.627   4.076  -3.096
   38    H    CYS   7           H        CYS   7   3.683   7.891  -3.002
   39    HA   CYS   7           HA       CYS   7   6.008   7.896  -4.865
   40   1HB   CYS   7          2HB       CYS   7   4.706   9.377  -6.274
   41   2HB   CYS   7          1HB       CYS   7   3.693   8.002  -5.829
   42    H    THR   8           H        THR   8   6.721  10.283  -5.436
   43    HA   THR   8           HA       THR   8   7.947  12.098  -4.550
   44    HB   THR   8           HB       THR   8   6.621  13.654  -3.253
   45    HG1  THR   8           HG1      THR   8   4.422  12.569  -2.669
   46   1HG2  THR   8          1HG2      THR   8   4.323  13.351  -4.506
   47   2HG2  THR   8          2HG2      THR   8   5.187  12.072  -5.358
   48   3HG2  THR   8          3HG2      THR   8   5.781  13.732  -5.420
   49    H    SER   9           H        SER   9   8.131   9.407  -3.319
   50    HA   SER   9           HA       SER   9   9.970   9.768  -1.289
   51   1HB   SER   9          2HB       SER   9   7.312  10.421  -0.365
   52   2HB   SER   9          1HB       SER   9   7.881   8.976   0.469
   53    HG   SER   9           HG       SER   9   8.820  10.494   1.641
   54    H    ILE  10           H        ILE  10  10.061   7.601   0.109
   55    HA   ILE  10           HA       ILE  10   8.893   5.456  -1.614
   56    HB   ILE  10           HB       ILE  10  11.277   4.618  -0.165
   57   1HG1  ILE  10          2HG1      ILE  10  11.863   7.035  -0.561
   58   2HG1  ILE  10          1HG1      ILE  10  12.903   5.912  -1.438
   59   1HG2  ILE  10          1HG2      ILE  10  11.393   4.640  -3.065
   60   2HG2  ILE  10          2HG2      ILE  10   9.836   4.038  -2.499
   61   3HG2  ILE  10          3HG2      ILE  10  11.328   3.264  -1.965
   62   1HD1  ILE  10          1HD1      ILE  10  11.619   8.028  -2.599
   63   2HD1  ILE  10          2HD1      ILE  10  10.467   6.726  -2.896
   64   3HD1  ILE  10          3HD1      ILE  10  12.128   6.582  -3.470
   65    H    CYS  11           H        CYS  11   7.230   4.689  -0.439
   66    HA   CYS  11           HA       CYS  11   7.141   4.590   2.425
   67   1HB   CYS  11          2HB       CYS  11   5.239   2.933   1.974
   68   2HB   CYS  11          1HB       CYS  11   5.060   4.526   1.239
   69    H    SER  12           H        SER  12   6.306   1.467   1.523
   70    HA   SER  12           HA       SER  12   9.000   0.321   1.724
   71   1HB   SER  12          2HB       SER  12   7.067   0.382   3.998
   72   2HB   SER  12          1HB       SER  12   7.949  -1.118   3.728
   73    HG   SER  12           HG       SER  12   9.529  -0.143   4.699
   74    H    LEU  13           H        LEU  13   8.829  -1.132   0.072
   75    HA   LEU  13           HA       LEU  13   6.655  -2.202  -1.200
   76   1HB   LEU  13          2HB       LEU  13   9.257  -2.753  -1.378
   77   2HB   LEU  13          1HB       LEU  13   8.780  -4.176  -0.454
   78    HG   LEU  13           HG       LEU  13   8.713  -4.532  -2.939
   79   1HD1  LEU  13          1HD1      LEU  13   6.720  -5.795  -2.885
   80   2HD1  LEU  13          2HD1      LEU  13   5.913  -4.637  -1.829
   81   3HD1  LEU  13          3HD1      LEU  13   7.182  -5.678  -1.187
   82   1HD2  LEU  13          1HD2      LEU  13   6.181  -3.023  -3.174
   83   2HD2  LEU  13          2HD2      LEU  13   7.498  -3.201  -4.334
   84   3HD2  LEU  13          3HD2      LEU  13   7.627  -2.023  -3.028
   85    H    TYR  14           H        TYR  14   7.787  -3.094   2.012
   86    HA   TYR  14           HA       TYR  14   6.205  -5.449   2.367
   87   1HB   TYR  14          2HB       TYR  14   7.556  -3.481   4.146
   88   2HB   TYR  14          1HB       TYR  14   6.253  -4.423   4.872
   89    HD1  TYR  14           HD1      TYR  14   8.801  -5.272   2.252
   90    HD2  TYR  14           HD2      TYR  14   7.195  -6.147   6.141
   91    HE1  TYR  14           HE1      TYR  14  10.313  -7.231   2.436
   92    HE2  TYR  14           HE2      TYR  14   8.706  -8.105   6.325
   93    HH   TYR  14           HH       TYR  14  10.475  -9.153   5.416
   94    H    GLN  15           H        GLN  15   5.507  -2.220   3.766
   95    HA   GLN  15           HA       GLN  15   2.804  -2.643   4.359
   96   1HB   GLN  15          2HB       GLN  15   3.856  -0.058   3.179
   97   2HB   GLN  15          1HB       GLN  15   2.526  -0.254   4.319
   98   1HG   GLN  15          2HG       GLN  15   4.203  -1.207   5.962
   99   2HG   GLN  15          1HG       GLN  15   5.474  -0.711   4.844
  100   1HE2  GLN  15          1HE2      GLN  15   2.585   0.708   6.487
  101   2HE2  GLN  15          2HE2      GLN  15   3.299   2.227   6.739
  102    H    LEU  16           H        LEU  16   4.371  -2.154   1.315
  103    HA   LEU  16           HA       LEU  16   2.091  -1.506  -0.298
  104   1HB   LEU  16          2HB       LEU  16   4.832  -1.873  -0.666
  105   2HB   LEU  16          1HB       LEU  16   4.099  -3.126  -1.655
  106    HG   LEU  16           HG       LEU  16   3.593  -0.145  -1.778
  107   1HD1  LEU  16          1HD1      LEU  16   5.585  -1.245  -2.976
  108   2HD1  LEU  16          2HD1      LEU  16   4.497  -0.282  -3.975
  109   3HD1  LEU  16          3HD1      LEU  16   4.385  -2.041  -3.995
  110   1HD2  LEU  16          1HD2      LEU  16   1.778  -2.297  -2.295
  111   2HD2  LEU  16          2HD2      LEU  16   2.232  -1.578  -3.840
  112   3HD2  LEU  16          3HD2      LEU  16   1.530  -0.573  -2.573
  113    H    GLU  17           H        GLU  17   3.660  -4.611   0.512
  114    HA   GLU  17           HA       GLU  17   1.839  -6.237  -1.000
  115   1HB   GLU  17          2HB       GLU  17   3.649  -6.796   1.355
  116   2HB   GLU  17          1HB       GLU  17   2.617  -8.047   0.661
  117   1HG   GLU  17          2HG       GLU  17   3.724  -7.962  -1.430
  118   2HG   GLU  17          1HG       GLU  17   4.473  -6.408  -1.063
  119    H    ASN  18           H        ASN  18   1.667  -4.666   2.077
  120    HA   ASN  18           HA       ASN  18  -0.580  -6.240   3.072
  121   1HB   ASN  18          2HB       ASN  18   0.500  -3.545   3.960
  122   2HB   ASN  18          1HB       ASN  18  -0.696  -4.502   4.835
  123   1HD2  ASN  18          1HD2      ASN  18   0.056  -6.738   5.547
  124   2HD2  ASN  18          2HD2      ASN  18   1.698  -6.954   5.920
  125    H    TYR  19           H        TYR  19  -0.347  -4.155   0.538
  126    HA   TYR  19           HA       TYR  19  -3.034  -2.947   1.023
  127   1HB   TYR  19          2HB       TYR  19  -0.606  -2.095  -0.412
  128   2HB   TYR  19          1HB       TYR  19  -2.098  -1.847  -1.324
  129    HD1  TYR  19           HD1      TYR  19  -0.174  -0.919   1.664
  130    HD2  TYR  19           HD2      TYR  19  -3.866  -0.379  -0.465
  131    HE1  TYR  19           HE1      TYR  19  -0.683   1.070   3.053
  132    HE2  TYR  19           HE2      TYR  19  -4.377   1.609   0.923
  133    HH   TYR  19           HH       TYR  19  -2.334   3.315   2.517
  134    H    CYS  20           H        CYS  20  -2.095  -5.746   0.064
  135    HA   CYS  20           HA       CYS  20  -3.476  -5.847  -2.557
  136   1HB   CYS  20          2HB       CYS  20  -1.690  -7.750  -1.039
  137   2HB   CYS  20          1HB       CYS  20  -2.519  -8.191  -2.513
  138    H    ASN  21           H        ASN  21  -4.411  -8.423  -2.530
  139    HA   ASN  21           HA       ASN  21  -6.805  -8.201  -0.907
  140   1HB   ASN  21          2HB       ASN  21  -5.754 -10.013  -2.989
  141   2HB   ASN  21          1HB       ASN  21  -6.803 -10.786  -1.803
  142   1HD2  ASN  21          1HD2      ASN  21  -7.688 -10.489  -4.482
  143   2HD2  ASN  21          2HD2      ASN  21  -8.949  -9.354  -4.524
  144   1H    PHE   1          1H        PHE   1  13.819  -6.507  -5.329
  145   2H    PHE   1          2H        PHE   1  14.237  -5.213  -4.310
  146   3H    PHE   1          3H        PHE   1  14.593  -5.141  -5.970
  147    HA   PHE   1           HA       PHE   1  12.439  -4.723  -6.582
  148   1HB   PHE   1          2HB       PHE   1  10.562  -5.167  -4.865
  149   2HB   PHE   1          1HB       PHE   1  11.313  -6.574  -5.616
  150    HD1  PHE   1           HD1      PHE   1  10.907  -4.653  -2.522
  151    HD2  PHE   1           HD2      PHE   1  12.952  -7.948  -4.374
  152    HE1  PHE   1           HE1      PHE   1  11.584  -5.491  -0.286
  153    HE2  PHE   1           HE2      PHE   1  13.629  -8.784  -2.139
  154    HZ   PHE   1           HZ       PHE   1  12.945  -7.557  -0.095
  155    H    VAL   2           H        VAL   2  13.078  -2.542  -6.503
  156    HA   VAL   2           HA       VAL   2  12.525  -1.144  -3.912
  157    HB   VAL   2           HB       VAL   2  14.050   0.663  -5.146
  158   1HG1  VAL   2          1HG1      VAL   2  14.368  -1.017  -3.033
  159   2HG1  VAL   2          2HG1      VAL   2  15.615   0.105  -3.580
  160   3HG1  VAL   2          3HG1      VAL   2  15.664  -1.585  -4.085
  161   1HG2  VAL   2          1HG2      VAL   2  14.251  -0.725  -7.205
  162   2HG2  VAL   2          2HG2      VAL   2  15.040  -1.984  -6.255
  163   3HG2  VAL   2          3HG2      VAL   2  15.818  -0.416  -6.459
  164    H    ASN   3           H        ASN   3  12.116   1.350  -4.516
  165    HA   ASN   3           HA       ASN   3  10.534   1.640  -6.984
  166   1HB   ASN   3          2HB       ASN   3   9.342   1.609  -4.216
  167   2HB   ASN   3          1HB       ASN   3   8.601   2.565  -5.501
  168   1HD2  ASN   3          1HD2      ASN   3   8.682  -0.551  -4.136
  169   2HD2  ASN   3          2HD2      ASN   3   7.965  -1.397  -5.421
  170    H    GLN   4           H        GLN   4   9.975   3.915  -7.371
  171    HA   GLN   4           HA       GLN   4  11.669   5.773  -5.747
  172   1HB   GLN   4          2HB       GLN   4  11.451   7.100  -8.081
  173   2HB   GLN   4          1HB       GLN   4  12.745   5.944  -7.768
  174   1HG   GLN   4          2HG       GLN   4  11.574   4.193  -8.924
  175   2HG   GLN   4          1HG       GLN   4  10.103   5.162  -9.024
  176   1HE2  GLN   4          1HE2      GLN   4   9.990   6.814 -10.667
  177   2HE2  GLN   4          2HE2      GLN   4  11.175   6.980 -11.870
  178    H    HIS   5           H        HIS   5   8.718   5.560  -7.753
  179    HA   HIS   5           HA       HIS   5   7.452   7.519  -5.921
  180   1HB   HIS   5          2HB       HIS   5   7.713   7.850  -8.918
  181   2HB   HIS   5          1HB       HIS   5   6.517   8.724  -7.959
  182    HD2  HIS   5           HD2      HIS   5   7.502  11.119  -7.077
  183    HE1  HIS   5           HE1      HIS   5  11.607  10.103  -7.065
  184    HE2  HIS   5           HE2      HIS   5   9.922  11.970  -6.637
  185    H    LEU   6           H        LEU   6   5.905   6.023  -5.191
  186    HA   LEU   6           HA       LEU   6   4.205   4.769  -7.302
  187   1HB   LEU   6          2HB       LEU   6   5.581   3.639  -5.050
  188   2HB   LEU   6          1HB       LEU   6   3.844   3.447  -4.817
  189    HG   LEU   6           HG       LEU   6   3.604   2.365  -6.958
  190   1HD1  LEU   6          1HD1      LEU   6   6.000   3.815  -7.521
  191   2HD1  LEU   6          2HD1      LEU   6   4.983   2.909  -8.642
  192   3HD1  LEU   6          3HD1      LEU   6   6.313   2.104  -7.810
  193   1HD2  LEU   6          1HD2      LEU   6   5.660   1.421  -5.040
  194   2HD2  LEU   6          2HD2      LEU   6   5.689   0.638  -6.620
  195   3HD2  LEU   6          3HD2      LEU   6   4.222   0.597  -5.642
  196    H    CYS   7           H        CYS   7   2.248   5.685  -7.410
  197    HA   CYS   7           HA       CYS   7   0.797   6.339  -4.935
  198   1HB   CYS   7          2HB       CYS   7   1.860   8.370  -6.762
  199   2HB   CYS   7          1HB       CYS   7   0.125   8.519  -6.481
  200    H    GLY   8           H        GLY   8  -1.297   5.739  -5.131
  201   1HA   GLY   8          2HA       GLY   8  -3.062   4.525  -6.154
  202   2HA   GLY   8          1HA       GLY   8  -3.175   6.038  -7.049
  203    H    SER   9           H        SER   9  -2.256   6.126  -9.205
  204    HA   SER   9           HA       SER   9  -2.541   3.831 -10.787
  205   1HB   SER   9          2HB       SER   9  -0.474   5.636 -11.801
  206   2HB   SER   9          1HB       SER   9  -2.050   5.241 -12.481
  207    HG   SER   9           HG       SER   9  -1.496   7.487 -11.531
  208    H    ASP  10           H        ASP  10   0.682   5.296 -10.214
  209    HA   ASP  10           HA       ASP  10   2.111   2.969 -10.943
  210   1HB   ASP  10          2HB       ASP  10   3.059   5.009  -8.913
  211   2HB   ASP  10          1HB       ASP  10   4.051   3.996  -9.956
  212    H    LEU  11           H        LEU  11   0.577   3.792  -7.876
  213    HA   LEU  11           HA       LEU  11   1.971   1.742  -6.365
  214   1HB   LEU  11          2HB       LEU  11  -0.246   3.610  -5.874
  215   2HB   LEU  11          1HB       LEU  11  -0.416   2.063  -5.055
  216    HG   LEU  11           HG       LEU  11   2.057   3.790  -4.957
  217   1HD1  LEU  11          1HD1      LEU  11  -0.417   3.873  -3.451
  218   2HD1  LEU  11          2HD1      LEU  11   0.967   4.965  -3.374
  219   3HD1  LEU  11          3HD1      LEU  11   0.947   3.495  -2.399
  220   1HD2  LEU  11          1HD2      LEU  11   2.023   1.966  -2.850
  221   2HD2  LEU  11          2HD2      LEU  11   3.006   1.849  -4.310
  222   3HD2  LEU  11          3HD2      LEU  11   1.442   1.039  -4.232
  223    H    VAL  12           H        VAL  12  -0.824   1.814  -8.446
  224    HA   VAL  12           HA       VAL  12  -1.924  -0.709  -7.589
  225    HB   VAL  12           HB       VAL  12  -2.236   1.016 -10.039
  226   1HG1  VAL  12          1HG1      VAL  12  -3.009  -1.840  -9.678
  227   2HG1  VAL  12          2HG1      VAL  12  -2.614  -0.959 -11.154
  228   3HG1  VAL  12          3HG1      VAL  12  -4.204  -0.770 -10.413
  229   1HG2  VAL  12          1HG2      VAL  12  -4.646   0.922  -9.152
  230   2HG2  VAL  12          2HG2      VAL  12  -3.475   1.810  -8.177
  231   3HG2  VAL  12          3HG2      VAL  12  -3.961   0.181  -7.706
  232    H    GLU  13           H        GLU  13  -0.280   0.125 -10.609
  233    HA   GLU  13           HA       GLU  13   0.212  -2.462 -11.539
  234   1HB   GLU  13          2HB       GLU  13   2.191  -0.193 -11.826
  235   2HB   GLU  13          1HB       GLU  13   1.869  -1.504 -12.965
  236   1HG   GLU  13          2HG       GLU  13  -0.631  -0.441 -12.690
  237   2HG   GLU  13          1HG       GLU  13   0.366   1.004 -12.510
  238    H    ALA  14           H        ALA  14   2.130  -0.583  -9.187
  239    HA   ALA  14           HA       ALA  14   4.160  -2.673  -8.970
  240   1HB   ALA  14          1HB       ALA  14   4.654  -0.290  -8.424
  241   2HB   ALA  14          2HB       ALA  14   4.981  -1.356  -7.059
  242   3HB   ALA  14          3HB       ALA  14   3.514  -0.377  -7.081
  243    H    LEU  15           H        LEU  15   1.234  -1.692  -7.242
  244    HA   LEU  15           HA       LEU  15   1.386  -3.396  -5.000
  245   1HB   LEU  15          2HB       LEU  15  -0.734  -1.997  -6.471
  246   2HB   LEU  15          1HB       LEU  15  -1.278  -3.505  -5.750
  247    HG   LEU  15           HG       LEU  15   0.346  -1.545  -4.153
  248   1HD1  LEU  15          1HD1      LEU  15  -2.273  -1.182  -3.353
  249   2HD1  LEU  15          2HD1      LEU  15  -2.405  -1.249  -5.110
  250   3HD1  LEU  15          3HD1      LEU  15  -1.347  -0.060  -4.351
  251   1HD2  LEU  15          1HD2      LEU  15  -0.486  -2.740  -2.298
  252   2HD2  LEU  15          2HD2      LEU  15  -0.207  -4.004  -3.498
  253   3HD2  LEU  15          3HD2      LEU  15  -1.840  -3.397  -3.218
  254    H    TYR  16           H        TYR  16   0.076  -4.030  -8.243
  255    HA   TYR  16           HA       TYR  16  -0.601  -6.780  -7.756
  256   1HB   TYR  16          2HB       TYR  16  -1.646  -5.978  -9.671
  257   2HB   TYR  16          1HB       TYR  16  -0.241  -5.042 -10.174
  258    HD1  TYR  16           HD1      TYR  16  -1.388  -8.586  -9.726
  259    HD2  TYR  16           HD2      TYR  16   1.155  -5.861 -11.865
  260    HE1  TYR  16           HE1      TYR  16  -0.714 -10.417 -11.260
  261    HE2  TYR  16           HE2      TYR  16   1.829  -7.692 -13.398
  262    HH   TYR  16           HH       TYR  16   0.665 -11.020 -12.908
  263    H    LEU  17           H        LEU  17   2.308  -5.168  -8.985
  264    HA   LEU  17           HA       LEU  17   3.794  -7.579  -9.548
  265   1HB   LEU  17          2HB       LEU  17   4.252  -4.880  -9.896
  266   2HB   LEU  17          1HB       LEU  17   5.311  -5.248  -8.535
  267    HG   LEU  17           HG       LEU  17   6.266  -7.144  -9.850
  268   1HD1  LEU  17          1HD1      LEU  17   4.463  -7.639 -11.360
  269   2HD1  LEU  17          2HD1      LEU  17   5.799  -7.048 -12.348
  270   3HD1  LEU  17          3HD1      LEU  17   4.442  -5.985 -11.972
  271   1HD2  LEU  17          1HD2      LEU  17   7.133  -4.702  -9.837
  272   2HD2  LEU  17          2HD2      LEU  17   6.451  -4.597 -11.459
  273   3HD2  LEU  17          3HD2      LEU  17   7.723  -5.769 -11.111
  274    H    VAL  18           H        VAL  18   2.995  -5.678  -6.814
  275    HA   VAL  18           HA       VAL  18   4.810  -6.895  -4.915
  276    HB   VAL  18           HB       VAL  18   2.777  -4.781  -5.084
  277   1HG1  VAL  18          1HG1      VAL  18   1.516  -5.741  -3.413
  278   2HG1  VAL  18          2HG1      VAL  18   2.681  -4.824  -2.458
  279   3HG1  VAL  18          3HG1      VAL  18   2.899  -6.559  -2.688
  280   1HG2  VAL  18          1HG2      VAL  18   4.709  -3.747  -4.700
  281   2HG2  VAL  18          2HG2      VAL  18   5.483  -5.243  -4.177
  282   3HG2  VAL  18          3HG2      VAL  18   4.560  -4.277  -3.026
  283    H    CYS  19           H        CYS  19   1.317  -6.872  -5.338
  284    HA   CYS  19           HA       CYS  19   0.478  -8.758  -3.488
  285   1HB   CYS  19          2HB       CYS  19  -0.493  -8.531  -6.359
  286   2HB   CYS  19          1HB       CYS  19  -1.383  -9.271  -5.035
  287    H    GLY  20           H        GLY  20   2.180  -9.232  -6.495
  288   1HA   GLY  20          2HA       GLY  20   2.961 -11.179  -7.539
  289   2HA   GLY  20          1HA       GLY  20   3.366 -11.664  -5.892
  290    H    GLU  21           H        GLU  21   1.082 -12.044  -8.501
  291    HA   GLU  21           HA       GLU  21  -0.522 -13.703  -8.888
  292   1HB   GLU  21          2HB       GLU  21   0.988 -15.390  -8.206
  293   2HB   GLU  21          1HB       GLU  21   0.936 -14.886  -6.522
  294   1HG   GLU  21          2HG       GLU  21  -1.325 -15.688  -6.274
  295   2HG   GLU  21          1HG       GLU  21  -1.453 -16.002  -8.005
  296    H    ARG  22           H        ARG  22  -0.658 -11.536  -6.429
  297    HA   ARG  22           HA       ARG  22  -3.311 -12.565  -5.503
  298   1HB   ARG  22          2HB       ARG  22  -1.106 -11.151  -4.095
  299   2HB   ARG  22          1HB       ARG  22  -2.748 -10.683  -3.658
  300   1HG   ARG  22          2HG       ARG  22  -3.299 -13.084  -3.283
  301   2HG   ARG  22          1HG       ARG  22  -1.617 -13.494  -3.620
  302   1HD   ARG  22          2HD       ARG  22  -2.353 -11.480  -1.496
  303   2HD   ARG  22          1HD       ARG  22  -2.279 -13.207  -1.145
  304    HE   ARG  22           HE       ARG  22   0.147 -12.621  -2.397
  305   1HH1  ARG  22          1HH2      ARG  22  -1.311 -10.474  -0.290
  306   2HH1  ARG  22          2HH2      ARG  22  -0.056 -10.509   0.904
  307   1HH2  ARG  22          1HH1      ARG  22   1.650 -13.137  -0.583
  308   2HH2  ARG  22          2HH1      ARG  22   1.617 -12.021   0.741
  309    H    GLY  23           H        GLY  23  -4.548 -10.406  -4.570
  310   1HA   GLY  23          2HA       GLY  23  -4.500  -8.439  -6.825
  311   2HA   GLY  23          1HA       GLY  23  -6.003  -9.014  -6.103
  312    H    PHE  24           H        PHE  24  -6.432  -6.675  -5.630
  313    HA   PHE  24           HA       PHE  24  -5.422  -6.000  -2.947
  314   1HB   PHE  24          2HB       PHE  24  -4.778  -3.695  -3.592
  315   2HB   PHE  24          1HB       PHE  24  -3.752  -4.900  -4.358
  316    HD1  PHE  24           HD1      PHE  24  -6.879  -2.905  -4.966
  317    HD2  PHE  24           HD2      PHE  24  -3.460  -4.871  -6.674
  318    HE1  PHE  24           HE1      PHE  24  -7.482  -2.016  -7.202
  319    HE2  PHE  24           HE2      PHE  24  -4.063  -3.980  -8.910
  320    HZ   PHE  24           HZ       PHE  24  -6.075  -2.552  -9.173
  321    H    PHE  25           H        PHE  25  -6.409  -3.493  -2.644
  322    HA   PHE  25           HA       PHE  25  -9.229  -3.579  -3.606
  323   1HB   PHE  25          2HB       PHE  25  -8.447  -4.272  -0.990
  324   2HB   PHE  25          1HB       PHE  25  -9.099  -2.637  -0.870
  325    HD1  PHE  25           HD1      PHE  25  -9.836  -6.005  -2.322
  326    HD2  PHE  25           HD2      PHE  25 -11.425  -2.282  -0.881
  327    HE1  PHE  25           HE1      PHE  25 -12.138  -6.908  -2.528
  328    HE2  PHE  25           HE2      PHE  25 -13.727  -3.184  -1.086
  329    HZ   PHE  25           HZ       PHE  25 -14.084  -5.497  -1.910
  330    H    TYR  26           H        TYR  26  -9.176  -1.718  -4.824
  331    HA   TYR  26           HA       TYR  26  -7.950   0.710  -3.600
  332   1HB   TYR  26          2HB       TYR  26  -7.331  -0.125  -5.971
  333   2HB   TYR  26          1HB       TYR  26  -8.920   0.468  -6.450
  334    HD1  TYR  26           HD1      TYR  26  -6.888   1.748  -7.865
  335    HD2  TYR  26           HD2      TYR  26  -8.113   2.542  -3.821
  336    HE1  TYR  26           HE1      TYR  26  -5.982   4.050  -8.040
  337    HE2  TYR  26           HE2      TYR  26  -7.206   4.842  -3.998
  338    HH   TYR  26           HH       TYR  26  -6.041   6.129  -7.054
  339    H    THR  27           H        THR  27 -10.928  -0.442  -5.190
  340    HA   THR  27           HA       THR  27 -12.319   1.956  -4.061
  341    HB   THR  27           HB       THR  27 -13.719   2.019  -5.929
  342    HG1  THR  27           HG1      THR  27 -13.134  -0.711  -6.021
  343   1HG2  THR  27          1HG2      THR  27 -12.286   2.206  -7.745
  344   2HG2  THR  27          2HG2      THR  27 -11.411   0.729  -7.337
  345   3HG2  THR  27          3HG2      THR  27 -11.129   2.205  -6.415
  346    H    LYS  28           H        LYS  28 -14.940   1.054  -4.350
  347    HA   LYS  28           HA       LYS  28 -14.984  -1.281  -2.478
  348   1HB   LYS  28          2HB       LYS  28 -17.457  -0.071  -2.218
  349   2HB   LYS  28          1HB       LYS  28 -16.103   0.150  -1.112
  350   1HG   LYS  28          2HG       LYS  28 -16.466   1.863  -3.601
  351   2HG   LYS  28          1HG       LYS  28 -17.164   2.307  -2.050
  352   1HD   LYS  28          2HD       LYS  28 -14.257   2.235  -2.869
  353   2HD   LYS  28          1HD       LYS  28 -15.135   3.494  -2.006
  354   1HE   LYS  28          2HE       LYS  28 -15.358   1.870  -0.064
  355   2HE   LYS  28          1HE       LYS  28 -14.232   0.813  -0.917
  356   1HZ   LYS  28          1HZ       LYS  28 -13.740   3.574   0.042
  357   2HZ   LYS  28          2HZ       LYS  28 -12.689   2.751  -1.009
  358   3HZ   LYS  28          3HZ       LYS  28 -12.973   2.152   0.555
  359    HA   PRO  29           HA       PRO  29 -17.128  -2.622  -6.301
  360   1HB   PRO  29          2HB       PRO  29 -15.905  -5.084  -6.373
  361   2HB   PRO  29          1HB       PRO  29 -15.225  -3.629  -7.124
  362   1HG   PRO  29          2HG       PRO  29 -14.387  -5.014  -4.619
  363   2HG   PRO  29          1HG       PRO  29 -13.431  -4.006  -5.716
  364   1HD   PRO  29          2HD       PRO  29 -14.505  -3.191  -3.225
  365   2HD   PRO  29          1HD       PRO  29 -13.833  -2.122  -4.475
  366    H    THR  30           H        THR  30 -19.015  -3.860  -6.270
  367    HA   THR  30           HA       THR  30 -19.739  -5.105  -3.688
  368    HB   THR  30           HB       THR  30 -21.998  -5.358  -4.889
  369    HG1  THR  30           HG1      THR  30 -22.141  -4.627  -6.856
  370   1HG2  THR  30          1HG2      THR  30 -21.548  -2.489  -4.989
  371   2HG2  THR  30          2HG2      THR  30 -20.789  -3.207  -3.569
  372   3HG2  THR  30          3HG2      THR  30 -22.516  -3.427  -3.853
  Start of MODEL   12
    1   1H    GLY   1          1H        GLY   1  -8.271   4.022   4.466
    2   2H    GLY   1          2H        GLY   1  -9.489   5.046   3.871
    3   3H    GLY   1          3H        GLY   1  -8.372   5.626   5.013
    4   1HA   GLY   1          1HA       GLY   1  -7.924   6.230   2.605
    5   2HA   GLY   1          2HA       GLY   1  -6.520   5.620   3.534
    6    H    ALA   2           H        ALA   2  -5.865   5.365   1.204
    7    HA   ALA   2           HA       ALA   2  -6.605   3.215  -0.362
    8   1HB   ALA   2          1HB       ALA   2  -8.437   5.555  -0.748
    9   2HB   ALA   2          2HB       ALA   2  -8.804   3.831  -0.792
   10   3HB   ALA   2          3HB       ALA   2  -7.990   4.594  -2.157
   11    H    VAL   3           H        VAL   3  -5.991   6.710  -0.669
   12    HA   VAL   3           HA       VAL   3  -3.649   6.038  -2.384
   13    HB   VAL   3           HB       VAL   3  -4.212   7.995  -3.838
   14   1HG1  VAL   3          1HG1      VAL   3  -6.310   5.814  -3.632
   15   2HG1  VAL   3          2HG1      VAL   3  -4.814   5.736  -4.561
   16   3HG1  VAL   3          3HG1      VAL   3  -6.087   6.864  -5.031
   17   1HG2  VAL   3          1HG2      VAL   3  -6.600   8.800  -3.714
   18   2HG2  VAL   3          2HG2      VAL   3  -5.616   9.266  -2.327
   19   3HG2  VAL   3          3HG2      VAL   3  -6.757   7.929  -2.188
   20    H    GLU   4           H        GLU   4  -2.776   8.659  -2.815
   21    HA   GLU   4           HA       GLU   4  -1.576  10.367  -1.739
   22   1HB   GLU   4          2HB       GLU   4  -3.497  10.005   0.569
   23   2HB   GLU   4          1HB       GLU   4  -2.618  11.464   0.109
   24   1HG   GLU   4          2HG       GLU   4  -4.008  10.860  -2.197
   25   2HG   GLU   4          1HG       GLU   4  -5.150  10.402  -0.932
   26    H    GLN   5           H        GLN   5  -1.378   7.302  -1.034
   27    HA   GLN   5           HA       GLN   5   0.356   7.699   1.370
   28   1HB   GLN   5          2HB       GLN   5  -1.235   5.274   0.484
   29   2HB   GLN   5          1HB       GLN   5  -0.048   5.245   1.789
   30   1HG   GLN   5          2HG       GLN   5  -2.472   7.065   1.699
   31   2HG   GLN   5          1HG       GLN   5  -2.365   5.575   2.637
   32   1HE2  GLN   5          1HE2      GLN   5   0.213   5.715   3.701
   33   2HE2  GLN   5          2HE2      GLN   5   0.357   7.084   4.695
   34    H    CYS   6           H        CYS   6   2.485   7.312   1.018
   35    HA   CYS   6           HA       CYS   6   4.443   6.495   0.023
   36   1HB   CYS   6          2HB       CYS   6   2.616   4.596  -1.480
   37   2HB   CYS   6          1HB       CYS   6   4.348   4.423  -1.227
   38    H    CYS   7           H        CYS   7   2.168   8.288  -1.445
   39    HA   CYS   7           HA       CYS   7   2.858   8.035  -4.221
   40   1HB   CYS   7          2HB       CYS   7   1.726  10.360  -2.661
   41   2HB   CYS   7          1HB       CYS   7   2.015  10.387  -4.396
   42    H    THR   8           H        THR   8   3.530  11.147  -2.758
   43    HA   THR   8           HA       THR   8   6.090  11.289  -4.098
   44    HB   THR   8           HB       THR   8   4.723  13.304  -3.579
   45    HG1  THR   8           HG1      THR   8   6.620  14.342  -2.344
   46   1HG2  THR   8          1HG2      THR   8   5.623  13.096  -0.724
   47   2HG2  THR   8          2HG2      THR   8   4.154  12.264  -1.234
   48   3HG2  THR   8          3HG2      THR   8   4.280  14.015  -1.405
   49    H    SER   9           H        SER   9   6.498   9.035  -2.909
   50    HA   SER   9           HA       SER   9   8.758   9.183  -1.327
   51   1HB   SER   9          2HB       SER   9   6.329   9.772   0.217
   52   2HB   SER   9          1HB       SER   9   7.271   8.447   0.892
   53    HG   SER   9           HG       SER   9   9.064   9.800   0.931
   54    H    ILE  10           H        ILE  10   9.452   7.049  -0.738
   55    HA   ILE  10           HA       ILE  10   7.613   4.925  -1.745
   56    HB   ILE  10           HB       ILE  10  10.305   3.981  -1.311
   57   1HG1  ILE  10          2HG1      ILE  10  10.960   6.350  -1.608
   58   2HG1  ILE  10          1HG1      ILE  10  11.461   5.378  -2.992
   59   1HG2  ILE  10          1HG2      ILE  10   8.396   3.209  -2.877
   60   2HG2  ILE  10          2HG2      ILE  10  10.044   3.161  -3.505
   61   3HG2  ILE  10          3HG2      ILE  10   8.963   4.476  -3.963
   62   1HD1  ILE  10          1HD1      ILE  10  10.311   6.765  -4.339
   63   2HD1  ILE  10          2HD1      ILE  10   9.723   7.669  -2.946
   64   3HD1  ILE  10          3HD1      ILE  10   8.821   6.273  -3.535
   65    H    CYS  11           H        CYS  11   6.462   4.419   0.124
   66    HA   CYS  11           HA       CYS  11   7.461   4.235   2.749
   67   1HB   CYS  11          2HB       CYS  11   5.357   2.422   1.522
   68   2HB   CYS  11          1HB       CYS  11   5.538   2.822   3.229
   69    H    SER  12           H        SER  12   6.457   1.090   1.667
   70    HA   SER  12           HA       SER  12   9.145   0.044   1.283
   71   1HB   SER  12          2HB       SER  12   7.846  -0.022   3.926
   72   2HB   SER  12          1HB       SER  12   8.372  -1.603   3.354
   73    HG   SER  12           HG       SER  12  10.229  -0.905   4.098
   74    H    LEU  13           H        LEU  13   8.823  -1.513  -0.248
   75    HA   LEU  13           HA       LEU  13   6.454  -2.405  -1.309
   76   1HB   LEU  13          2HB       LEU  13   9.012  -3.112  -1.754
   77   2HB   LEU  13          1HB       LEU  13   8.466  -4.565  -0.912
   78    HG   LEU  13           HG       LEU  13   6.367  -4.170  -2.567
   79   1HD1  LEU  13          1HD1      LEU  13   8.715  -2.765  -3.734
   80   2HD1  LEU  13          2HD1      LEU  13   6.993  -2.455  -3.959
   81   3HD1  LEU  13          3HD1      LEU  13   7.774  -3.776  -4.830
   82   1HD2  LEU  13          1HD2      LEU  13   7.457  -5.865  -4.069
   83   2HD2  LEU  13          2HD2      LEU  13   7.544  -6.281  -2.358
   84   3HD2  LEU  13          3HD2      LEU  13   8.959  -5.619  -3.178
   85    H    TYR  14           H        TYR  14   7.821  -3.396   1.769
   86    HA   TYR  14           HA       TYR  14   6.242  -5.727   2.221
   87   1HB   TYR  14          2HB       TYR  14   7.331  -3.664   4.159
   88   2HB   TYR  14          1HB       TYR  14   6.594  -5.188   4.656
   89    HD1  TYR  14           HD1      TYR  14   9.659  -3.678   4.108
   90    HD2  TYR  14           HD2      TYR  14   7.516  -7.268   3.112
   91    HE1  TYR  14           HE1      TYR  14  11.808  -4.851   3.706
   92    HE2  TYR  14           HE2      TYR  14   9.664  -8.440   2.710
   93    HH   TYR  14           HH       TYR  14  12.306  -7.845   3.758
   94    H    GLN  15           H        GLN  15   5.643  -2.381   3.387
   95    HA   GLN  15           HA       GLN  15   2.985  -2.876   4.276
   96   1HB   GLN  15          2HB       GLN  15   4.140  -0.299   3.166
   97   2HB   GLN  15          1HB       GLN  15   2.682  -0.433   4.151
   98   1HG   GLN  15          2HG       GLN  15   4.523  -1.774   5.690
   99   2HG   GLN  15          1HG       GLN  15   5.510  -0.501   4.969
  100   1HE2  GLN  15          1HE2      GLN  15   4.159   1.756   4.961
  101   2HE2  GLN  15          2HE2      GLN  15   3.446   2.136   6.453
  102    H    LEU  16           H        LEU  16   4.330  -2.091   1.152
  103    HA   LEU  16           HA       LEU  16   1.945  -1.498  -0.280
  104   1HB   LEU  16          2HB       LEU  16   4.670  -1.920  -0.856
  105   2HB   LEU  16          1HB       LEU  16   3.799  -3.055  -1.871
  106    HG   LEU  16           HG       LEU  16   3.590  -0.049  -1.787
  107   1HD1  LEU  16          1HD1      LEU  16   3.902  -0.286  -4.208
  108   2HD1  LEU  16          2HD1      LEU  16   3.855  -2.042  -4.059
  109   3HD1  LEU  16          3HD1      LEU  16   5.189  -1.132  -3.349
  110   1HD2  LEU  16          1HD2      LEU  16   1.296  -0.581  -1.759
  111   2HD2  LEU  16          2HD2      LEU  16   1.534  -2.062  -2.687
  112   3HD2  LEU  16          3HD2      LEU  16   1.656  -0.492  -3.483
  113    H    GLU  17           H        GLU  17   3.467  -4.570   0.607
  114    HA   GLU  17           HA       GLU  17   1.670  -6.243  -0.904
  115   1HB   GLU  17          2HB       GLU  17   3.529  -6.683   1.424
  116   2HB   GLU  17          1HB       GLU  17   2.412  -7.958   0.935
  117   1HG   GLU  17          2HG       GLU  17   3.329  -7.599  -1.447
  118   2HG   GLU  17          1HG       GLU  17   4.638  -6.704  -0.673
  119    H    ASN  18           H        ASN  18   1.487  -4.566   2.117
  120    HA   ASN  18           HA       ASN  18  -0.799  -6.092   3.119
  121   1HB   ASN  18          2HB       ASN  18   0.686  -3.632   4.010
  122   2HB   ASN  18          1HB       ASN  18  -0.888  -4.012   4.713
  123   1HD2  ASN  18          1HD2      ASN  18   0.206  -4.477   6.804
  124   2HD2  ASN  18          2HD2      ASN  18   1.045  -5.937   7.018
  125    H    TYR  19           H        TYR  19  -0.493  -4.019   0.584
  126    HA   TYR  19           HA       TYR  19  -3.073  -2.629   1.065
  127   1HB   TYR  19          2HB       TYR  19  -0.695  -2.165  -0.609
  128   2HB   TYR  19          1HB       TYR  19  -2.222  -1.875  -1.444
  129    HD1  TYR  19           HD1      TYR  19   0.193  -0.568   0.837
  130    HD2  TYR  19           HD2      TYR  19  -3.972  -0.417  -0.200
  131    HE1  TYR  19           HE1      TYR  19  -0.019   1.601   2.015
  132    HE2  TYR  19           HE2      TYR  19  -4.189   1.751   0.977
  133    HH   TYR  19           HH       TYR  19  -1.971   3.723   1.626
  134    H    CYS  20           H        CYS  20  -1.851  -5.462  -0.240
  135    HA   CYS  20           HA       CYS  20  -3.821  -5.700  -2.392
  136   1HB   CYS  20          2HB       CYS  20  -1.973  -7.832  -1.326
  137   2HB   CYS  20          1HB       CYS  20  -2.667  -7.686  -2.927
  138    H    ASN  21           H        ASN  21  -4.601  -8.316  -2.203
  139    HA   ASN  21           HA       ASN  21  -6.620  -8.215  -0.126
  140   1HB   ASN  21          2HB       ASN  21  -5.921  -9.976  -2.390
  141   2HB   ASN  21          1HB       ASN  21  -6.670 -10.799  -1.025
  142   1HD2  ASN  21          1HD2      ASN  21  -7.270  -7.433  -2.103
  143   2HD2  ASN  21          2HD2      ASN  21  -8.914  -7.674  -2.453
  144   1H    PHE   1          1H        PHE   1  14.053  -3.991  -7.362
  145   2H    PHE   1          2H        PHE   1  12.488  -3.872  -8.011
  146   3H    PHE   1          3H        PHE   1  13.117  -5.389  -7.576
  147    HA   PHE   1           HA       PHE   1  11.484  -4.477  -5.963
  148   1HB   PHE   1          2HB       PHE   1  12.967  -4.921  -3.977
  149   2HB   PHE   1          1HB       PHE   1  13.065  -6.162  -5.226
  150    HD1  PHE   1           HD1      PHE   1  14.805  -3.341  -3.615
  151    HD2  PHE   1           HD2      PHE   1  15.045  -6.386  -6.639
  152    HE1  PHE   1           HE1      PHE   1  17.245  -2.943  -3.822
  153    HE2  PHE   1           HE2      PHE   1  17.486  -5.988  -6.846
  154    HZ   PHE   1           HZ       PHE   1  18.586  -4.266  -5.437
  155    H    VAL   2           H        VAL   2  12.800  -2.117  -7.389
  156    HA   VAL   2           HA       VAL   2  12.752  -0.298  -5.021
  157    HB   VAL   2           HB       VAL   2  14.464   1.099  -6.347
  158   1HG1  VAL   2          1HG1      VAL   2  16.258   0.025  -5.246
  159   2HG1  VAL   2          2HG1      VAL   2  15.535  -1.572  -5.441
  160   3HG1  VAL   2          3HG1      VAL   2  14.847  -0.428  -4.289
  161   1HG2  VAL   2          1HG2      VAL   2  15.939  -0.449  -7.780
  162   2HG2  VAL   2          2HG2      VAL   2  14.405   0.056  -8.490
  163   3HG2  VAL   2          3HG2      VAL   2  14.566  -1.557  -7.794
  164    H    ASN   3           H        ASN   3  11.676   1.663  -5.383
  165    HA   ASN   3           HA       ASN   3  10.790   2.333  -8.119
  166   1HB   ASN   3          2HB       ASN   3   8.938   1.453  -5.905
  167   2HB   ASN   3          1HB       ASN   3   8.382   2.540  -7.178
  168   1HD2  ASN   3          1HD2      ASN   3   7.756  -0.425  -6.601
  169   2HD2  ASN   3          2HD2      ASN   3   8.056  -1.201  -8.080
  170    H    GLN   4           H        GLN   4   9.698   4.492  -8.143
  171    HA   GLN   4           HA       GLN   4  10.852   6.209  -6.010
  172   1HB   GLN   4          2HB       GLN   4  10.999   6.520  -8.679
  173   2HB   GLN   4          1HB       GLN   4   9.498   7.398  -8.384
  174   1HG   GLN   4          2HG       GLN   4  10.990   9.118  -8.020
  175   2HG   GLN   4          1HG       GLN   4  10.950   8.441  -6.391
  176   1HE2  GLN   4          1HE2      GLN   4  13.110   9.513  -8.653
  177   2HE2  GLN   4          2HE2      GLN   4  14.447   8.544  -8.262
  178    H    HIS   5           H        HIS   5   8.815   8.330  -6.843
  179    HA   HIS   5           HA       HIS   5   7.016   8.168  -4.739
  180   1HB   HIS   5          2HB       HIS   5   6.082   9.154  -7.435
  181   2HB   HIS   5          1HB       HIS   5   5.698   9.796  -5.837
  182    HD2  HIS   5           HD2      HIS   5   8.502  10.060  -8.538
  183    HE1  HIS   5           HE1      HIS   5   9.522  12.617  -5.328
  184    HE2  HIS   5           HE2      HIS   5  10.124  11.917  -7.707
  185    H    LEU   6           H        LEU   6   4.692   7.450  -4.679
  186    HA   LEU   6           HA       LEU   6   3.975   5.486  -6.755
  187   1HB   LEU   6          2HB       LEU   6   5.170   4.704  -4.337
  188   2HB   LEU   6          1HB       LEU   6   3.458   4.374  -4.126
  189    HG   LEU   6           HG       LEU   6   4.018   2.405  -5.137
  190   1HD1  LEU   6          1HD1      LEU   6   4.168   3.897  -7.738
  191   2HD1  LEU   6          2HD1      LEU   6   2.657   3.840  -6.832
  192   3HD1  LEU   6          3HD1      LEU   6   3.407   2.345  -7.391
  193   1HD2  LEU   6          1HD2      LEU   6   6.388   3.962  -5.953
  194   2HD2  LEU   6          2HD2      LEU   6   5.959   2.624  -7.018
  195   3HD2  LEU   6          3HD2      LEU   6   6.280   2.323  -5.310
  196    H    CYS   7           H        CYS   7   2.091   6.563  -7.308
  197    HA   CYS   7           HA       CYS   7   0.153   7.030  -5.101
  198   1HB   CYS   7          2HB       CYS   7   0.704   8.462  -7.595
  199   2HB   CYS   7          1HB       CYS   7  -1.004   8.094  -7.390
  200    H    GLY   8           H        GLY   8  -2.115   6.357  -5.575
  201   1HA   GLY   8          2HA       GLY   8  -2.634   3.776  -6.038
  202   2HA   GLY   8          1HA       GLY   8  -3.728   4.984  -6.705
  203    H    SER   9           H        SER   9  -2.555   6.013  -8.842
  204    HA   SER   9           HA       SER   9  -2.794   4.188 -10.916
  205   1HB   SER   9          2HB       SER   9  -1.454   6.794 -10.580
  206   2HB   SER   9          1HB       SER   9  -0.824   5.816 -11.903
  207    HG   SER   9           HG       SER   9  -2.585   7.072 -12.590
  208    H    ASP  10           H        ASP  10   0.465   5.313  -9.934
  209    HA   ASP  10           HA       ASP  10   1.704   2.950 -11.061
  210   1HB   ASP  10          2HB       ASP  10   2.931   4.923  -9.114
  211   2HB   ASP  10          1HB       ASP  10   3.781   3.870 -10.243
  212    H    LEU  11           H        LEU  11   0.457   3.787  -7.914
  213    HA   LEU  11           HA       LEU  11   1.932   1.825  -6.399
  214   1HB   LEU  11          2HB       LEU  11  -0.366   3.617  -5.958
  215   2HB   LEU  11          1HB       LEU  11  -0.430   2.141  -5.035
  216    HG   LEU  11           HG       LEU  11   1.941   3.991  -5.115
  217   1HD1  LEU  11          1HD1      LEU  11  -0.306   3.618  -3.126
  218   2HD1  LEU  11          2HD1      LEU  11   0.185   5.110  -3.928
  219   3HD1  LEU  11          3HD1      LEU  11   1.222   4.386  -2.699
  220   1HD2  LEU  11          1HD2      LEU  11   2.110   1.406  -4.638
  221   2HD2  LEU  11          2HD2      LEU  11   1.436   1.861  -3.076
  222   3HD2  LEU  11          3HD2      LEU  11   2.969   2.550  -3.608
  223    H    VAL  12           H        VAL  12  -0.778   1.684  -8.536
  224    HA   VAL  12           HA       VAL  12  -1.784  -0.834  -7.512
  225    HB   VAL  12           HB       VAL  12  -2.490   1.082  -9.612
  226   1HG1  VAL  12          1HG1      VAL  12  -1.960  -0.652 -11.199
  227   2HG1  VAL  12          2HG1      VAL  12  -3.713  -0.648 -11.006
  228   3HG1  VAL  12          3HG1      VAL  12  -2.740  -1.881 -10.203
  229   1HG2  VAL  12          1HG2      VAL  12  -4.449   0.914  -8.521
  230   2HG2  VAL  12          2HG2      VAL  12  -3.662  -0.218  -7.421
  231   3HG2  VAL  12          3HG2      VAL  12  -4.535  -0.820  -8.829
  232    H    GLU  13           H        GLU  13  -0.169   0.055 -10.544
  233    HA   GLU  13           HA       GLU  13   0.392  -2.508 -11.513
  234   1HB   GLU  13          2HB       GLU  13   2.264  -0.128 -11.678
  235   2HB   GLU  13          1HB       GLU  13   2.195  -1.494 -12.792
  236   1HG   GLU  13          2HG       GLU  13  -0.258  -0.846 -13.186
  237   2HG   GLU  13          1HG       GLU  13   0.126   0.670 -12.370
  238    H    ALA  14           H        ALA  14   2.431  -0.537  -9.308
  239    HA   ALA  14           HA       ALA  14   4.407  -2.608  -8.946
  240   1HB   ALA  14          1HB       ALA  14   5.417  -1.091  -7.561
  241   2HB   ALA  14          2HB       ALA  14   3.927  -0.768  -6.675
  242   3HB   ALA  14          3HB       ALA  14   4.230   0.036  -8.215
  243    H    LEU  15           H        LEU  15   1.397  -1.712  -7.329
  244    HA   LEU  15           HA       LEU  15   1.522  -3.422  -5.088
  245   1HB   LEU  15          2HB       LEU  15  -0.586  -2.093  -6.643
  246   2HB   LEU  15          1HB       LEU  15  -1.115  -3.621  -5.938
  247    HG   LEU  15           HG       LEU  15   0.397  -1.607  -4.289
  248   1HD1  LEU  15          1HD1      LEU  15  -1.403  -0.264  -4.023
  249   2HD1  LEU  15          2HD1      LEU  15  -2.510  -1.635  -3.926
  250   3HD1  LEU  15          3HD1      LEU  15  -2.019  -1.006  -5.500
  251   1HD2  LEU  15          1HD2      LEU  15  -0.815  -2.755  -2.463
  252   2HD2  LEU  15          2HD2      LEU  15   0.127  -3.897  -3.422
  253   3HD2  LEU  15          3HD2      LEU  15  -1.618  -3.782  -3.651
  254    H    TYR  16           H        TYR  16  -0.058  -4.132  -8.188
  255    HA   TYR  16           HA       TYR  16  -0.463  -6.886  -7.828
  256   1HB   TYR  16          2HB       TYR  16  -1.445  -6.265  -9.806
  257   2HB   TYR  16          1HB       TYR  16  -0.217  -5.053 -10.150
  258    HD1  TYR  16           HD1      TYR  16  -1.098  -8.634 -10.422
  259    HD2  TYR  16           HD2      TYR  16   1.782  -5.602 -11.417
  260    HE1  TYR  16           HE1      TYR  16  -0.020 -10.184 -12.033
  261    HE2  TYR  16           HE2      TYR  16   2.858  -7.152 -13.027
  262    HH   TYR  16           HH       TYR  16   1.407 -10.205 -13.888
  263    H    LEU  17           H        LEU  17   2.442  -5.186  -8.974
  264    HA   LEU  17           HA       LEU  17   4.006  -7.570  -9.465
  265   1HB   LEU  17          2HB       LEU  17   4.392  -4.955 -10.031
  266   2HB   LEU  17          1HB       LEU  17   5.333  -5.055  -8.543
  267    HG   LEU  17           HG       LEU  17   6.237  -7.271  -9.745
  268   1HD1  LEU  17          1HD1      LEU  17   4.681  -6.671 -11.721
  269   2HD1  LEU  17          2HD1      LEU  17   6.350  -7.093 -12.102
  270   3HD1  LEU  17          3HD1      LEU  17   5.852  -5.402 -12.080
  271   1HD2  LEU  17          1HD2      LEU  17   7.223  -4.498 -10.473
  272   2HD2  LEU  17          2HD2      LEU  17   8.183  -5.976 -10.395
  273   3HD2  LEU  17          3HD2      LEU  17   7.526  -5.274  -8.916
  274    H    VAL  18           H        VAL  18   3.107  -5.657  -6.792
  275    HA   VAL  18           HA       VAL  18   4.985  -6.752  -4.856
  276    HB   VAL  18           HB       VAL  18   2.898  -4.675  -5.111
  277   1HG1  VAL  18          1HG1      VAL  18   3.395  -6.061  -2.489
  278   2HG1  VAL  18          2HG1      VAL  18   1.851  -5.807  -3.302
  279   3HG1  VAL  18          3HG1      VAL  18   2.725  -4.435  -2.618
  280   1HG2  VAL  18          1HG2      VAL  18   5.657  -5.001  -4.143
  281   2HG2  VAL  18          2HG2      VAL  18   4.693  -3.767  -3.332
  282   3HG2  VAL  18          3HG2      VAL  18   4.927  -3.697  -5.079
  283    H    CYS  19           H        CYS  19   1.508  -6.678  -5.240
  284    HA   CYS  19           HA       CYS  19   0.664  -8.495  -3.299
  285   1HB   CYS  19          2HB       CYS  19  -0.518  -8.226  -6.079
  286   2HB   CYS  19          1HB       CYS  19  -1.366  -8.674  -4.607
  287    H    GLY  20           H        GLY  20   2.319  -9.079  -6.281
  288   1HA   GLY  20          2HA       GLY  20   3.326 -11.073  -7.015
  289   2HA   GLY  20          1HA       GLY  20   2.651 -11.896  -5.608
  290    H    GLU  21           H        GLU  21   0.379 -12.585  -5.729
  291    HA   GLU  21           HA       GLU  21  -0.740 -12.629  -8.490
  292   1HB   GLU  21          2HB       GLU  21  -1.381 -15.117  -7.818
  293   2HB   GLU  21          1HB       GLU  21   0.180 -14.751  -8.554
  294   1HG   GLU  21          2HG       GLU  21   1.327 -15.226  -6.651
  295   2HG   GLU  21          1HG       GLU  21   0.121 -14.453  -5.620
  296    H    ARG  22           H        ARG  22  -1.285 -11.871  -5.324
  297    HA   ARG  22           HA       ARG  22  -4.064 -12.866  -5.230
  298   1HB   ARG  22          2HB       ARG  22  -4.142 -11.800  -3.009
  299   2HB   ARG  22          1HB       ARG  22  -2.726 -12.843  -3.151
  300   1HG   ARG  22          2HG       ARG  22  -1.983 -10.284  -4.123
  301   2HG   ARG  22          1HG       ARG  22  -2.815 -10.033  -2.590
  302   1HD   ARG  22          2HD       ARG  22  -0.532 -11.979  -3.036
  303   2HD   ARG  22          1HD       ARG  22  -0.377 -10.396  -2.274
  304    HE   ARG  22           HE       ARG  22  -2.388 -11.795  -0.862
  305   1HH1  ARG  22          1HH2      ARG  22   0.066 -13.673  -1.753
  306   2HH1  ARG  22          2HH2      ARG  22   0.874 -13.766  -0.224
  307   1HH2  ARG  22          1HH1      ARG  22  -0.957 -11.188   1.198
  308   2HH2  ARG  22          2HH1      ARG  22   0.293 -12.359   1.449
  309    H    GLY  23           H        GLY  23  -5.849 -11.289  -4.869
  310   1HA   GLY  23          2HA       GLY  23  -5.674  -9.123  -6.812
  311   2HA   GLY  23          1HA       GLY  23  -7.101  -9.563  -5.876
  312    H    PHE  24           H        PHE  24  -6.016  -6.845  -6.326
  313    HA   PHE  24           HA       PHE  24  -5.149  -6.131  -3.562
  314   1HB   PHE  24          2HB       PHE  24  -4.827  -3.806  -4.716
  315   2HB   PHE  24          1HB       PHE  24  -3.646  -5.073  -5.030
  316    HD1  PHE  24           HD1      PHE  24  -7.078  -4.262  -6.336
  317    HD2  PHE  24           HD2      PHE  24  -2.966  -5.104  -7.258
  318    HE1  PHE  24           HE1      PHE  24  -7.598  -4.146  -8.756
  319    HE2  PHE  24           HE2      PHE  24  -3.487  -4.985  -9.682
  320    HZ   PHE  24           HZ       PHE  24  -5.803  -4.504 -10.430
  321    H    PHE  25           H        PHE  25  -6.041  -3.578  -3.318
  322    HA   PHE  25           HA       PHE  25  -9.001  -3.950  -3.291
  323   1HB   PHE  25          2HB       PHE  25  -7.110  -2.958  -1.381
  324   2HB   PHE  25          1HB       PHE  25  -8.198  -1.640  -1.820
  325    HD1  PHE  25           HD1      PHE  25  -7.783  -4.424   0.294
  326    HD2  PHE  25           HD2      PHE  25 -10.767  -2.353  -2.003
  327    HE1  PHE  25           HE1      PHE  25  -9.562  -5.426   1.702
  328    HE2  PHE  25           HE2      PHE  25 -12.547  -3.354  -0.594
  329    HZ   PHE  25           HZ       PHE  25 -11.944  -4.891   1.259
  330    H    TYR  26           H        TYR  26 -10.142  -2.802  -4.787
  331    HA   TYR  26           HA       TYR  26  -8.886  -0.305  -5.856
  332   1HB   TYR  26          2HB       TYR  26  -9.786  -2.629  -7.243
  333   2HB   TYR  26          1HB       TYR  26 -10.890  -1.313  -7.640
  334    HD1  TYR  26           HD1      TYR  26  -8.663  -2.761  -9.372
  335    HD2  TYR  26           HD2      TYR  26  -8.852   0.961  -7.233
  336    HE1  TYR  26           HE1      TYR  26  -6.955  -1.799 -10.895
  337    HE2  TYR  26           HE2      TYR  26  -7.147   1.923  -8.756
  338    HH   TYR  26           HH       TYR  26  -6.112   0.269 -11.637
  339    H    THR  27           H        THR  27 -10.713   1.129  -6.893
  340    HA   THR  27           HA       THR  27 -13.328   0.952  -5.606
  341    HB   THR  27           HB       THR  27 -11.750   1.943  -3.848
  342    HG1  THR  27           HG1      THR  27 -13.731   3.772  -4.652
  343   1HG2  THR  27          1HG2      THR  27 -10.386   3.305  -5.350
  344   2HG2  THR  27          2HG2      THR  27 -11.198   4.343  -4.179
  345   3HG2  THR  27          3HG2      THR  27 -11.806   4.233  -5.831
  346    H    LYS  28           H        LYS  28 -14.653   2.971  -6.249
  347    HA   LYS  28           HA       LYS  28 -13.929   3.634  -9.047
  348   1HB   LYS  28          2HB       LYS  28 -16.508   4.062  -7.499
  349   2HB   LYS  28          1HB       LYS  28 -16.267   4.498  -9.192
  350   1HG   LYS  28          2HG       LYS  28 -17.297   2.331  -9.249
  351   2HG   LYS  28          1HG       LYS  28 -15.596   2.049  -9.597
  352   1HD   LYS  28          2HD       LYS  28 -16.616   0.407  -7.940
  353   2HD   LYS  28          1HD       LYS  28 -15.189   1.249  -7.332
  354   1HE   LYS  28          2HE       LYS  28 -16.425   2.569  -5.869
  355   2HE   LYS  28          1HE       LYS  28 -17.880   2.487  -6.862
  356   1HZ   LYS  28          1HZ       LYS  28 -17.806  -0.001  -6.270
  357   2HZ   LYS  28          2HZ       LYS  28 -18.379   1.100  -5.110
  358   3HZ   LYS  28          3HZ       LYS  28 -16.798   0.484  -4.994
  359    HA   PRO  29           HA       PRO  29 -12.761   7.715  -7.864
  360   1HB   PRO  29          2HB       PRO  29 -12.812   8.828 -10.375
  361   2HB   PRO  29          1HB       PRO  29 -11.518   7.759  -9.808
  362   1HG   PRO  29          2HG       PRO  29 -13.734   7.174 -11.715
  363   2HG   PRO  29          1HG       PRO  29 -12.134   6.423 -11.590
  364   1HD   PRO  29          2HD       PRO  29 -14.565   5.324 -10.637
  365   2HD   PRO  29          1HD       PRO  29 -12.929   4.750 -10.243
  366    H    THR  30           H        THR  30 -13.580  10.094  -8.655
  367    HA   THR  30           HA       THR  30 -16.497  10.085  -8.135
  368    HB   THR  30           HB       THR  30 -14.980  11.566  -6.806
  369    HG1  THR  30           HG1      THR  30 -17.120  12.187  -7.081
  370   1HG2  THR  30          1HG2      THR  30 -14.702  13.439  -9.088
  371   2HG2  THR  30          2HG2      THR  30 -13.684  11.999  -9.146
  372   3HG2  THR  30          3HG2      THR  30 -13.583  13.096  -7.768
  Start of MODEL   13
    1   1H    GLY   1          1H        GLY   1  -9.735   6.921   0.151
    2   2H    GLY   1          2H        GLY   1  -8.082   7.119  -0.189
    3   3H    GLY   1          3H        GLY   1  -8.618   7.051   1.423
    4   1HA   GLY   1          1HA       GLY   1  -8.483   4.819   1.361
    5   2HA   GLY   1          2HA       GLY   1  -9.511   4.718  -0.100
    6    H    ALA   2           H        ALA   2  -6.437   5.764   1.644
    7    HA   ALA   2           HA       ALA   2  -4.265   4.854   1.654
    8   1HB   ALA   2          1HB       ALA   2  -4.922   2.658  -0.230
    9   2HB   ALA   2          2HB       ALA   2  -5.814   2.654   1.292
   10   3HB   ALA   2          3HB       ALA   2  -4.050   2.604   1.303
   11    H    VAL   3           H        VAL   3  -5.040   6.855  -0.204
   12    HA   VAL   3           HA       VAL   3  -3.657   6.047  -2.713
   13    HB   VAL   3           HB       VAL   3  -5.851   7.858  -2.064
   14   1HG1  VAL   3          1HG1      VAL   3  -3.546   8.960  -3.694
   15   2HG1  VAL   3          2HG1      VAL   3  -4.302   9.688  -2.275
   16   3HG1  VAL   3          3HG1      VAL   3  -5.191   9.589  -3.795
   17   1HG2  VAL   3          1HG2      VAL   3  -5.378   7.618  -4.861
   18   2HG2  VAL   3          2HG2      VAL   3  -6.575   6.764  -3.886
   19   3HG2  VAL   3          3HG2      VAL   3  -4.970   6.070  -4.121
   20    H    GLU   4           H        GLU   4  -3.739   8.848  -0.481
   21    HA   GLU   4           HA       GLU   4  -1.031   9.622  -1.337
   22   1HB   GLU   4          2HB       GLU   4  -1.348  11.501   0.256
   23   2HB   GLU   4          1HB       GLU   4  -2.690  11.377  -0.883
   24   1HG   GLU   4          2HG       GLU   4  -4.145  10.485   0.726
   25   2HG   GLU   4          1HG       GLU   4  -2.824   9.961   1.769
   26    H    GLN   5           H        GLN   5  -0.837   7.122  -0.291
   27    HA   GLN   5           HA       GLN   5   0.180   7.548   2.487
   28   1HB   GLN   5          2HB       GLN   5  -0.993   5.159   1.085
   29   2HB   GLN   5          1HB       GLN   5   0.086   4.933   2.462
   30   1HG   GLN   5          2HG       GLN   5  -2.111   6.933   2.752
   31   2HG   GLN   5          1HG       GLN   5  -2.553   5.226   2.787
   32   1HE2  GLN   5          1HE2      GLN   5  -0.882   7.775   4.539
   33   2HE2  GLN   5          2HE2      GLN   5  -0.542   6.857   5.927
   34    H    CYS   6           H        CYS   6   0.889   5.418  -0.322
   35    HA   CYS   6           HA       CYS   6   3.757   5.552   0.430
   36   1HB   CYS   6          2HB       CYS   6   2.146   3.752  -1.371
   37   2HB   CYS   6          1HB       CYS   6   3.899   3.836  -1.525
   38    H    CYS   7           H        CYS   7   1.757   7.421  -1.336
   39    HA   CYS   7           HA       CYS   7   3.518   7.716  -3.677
   40   1HB   CYS   7          2HB       CYS   7   0.981   7.861  -3.805
   41   2HB   CYS   7          1HB       CYS   7   1.123   9.414  -2.997
   42    H    THR   8           H        THR   8   4.318   9.942  -4.245
   43    HA   THR   8           HA       THR   8   5.794  11.674  -3.626
   44    HB   THR   8           HB       THR   8   4.733  13.427  -2.473
   45    HG1  THR   8           HG1      THR   8   4.418  12.398  -0.516
   46   1HG2  THR   8          1HG2      THR   8   2.603  13.545  -3.431
   47   2HG2  THR   8          2HG2      THR   8   2.275  11.835  -3.148
   48   3HG2  THR   8          3HG2      THR   8   3.390  12.319  -4.426
   49    H    SER   9           H        SER   9   6.531   9.258  -2.526
   50    HA   SER   9           HA       SER   9   8.390   9.797  -0.583
   51   1HB   SER   9          2HB       SER   9   5.720   9.922   0.556
   52   2HB   SER   9          1HB       SER   9   6.654   8.629   1.303
   53    HG   SER   9           HG       SER   9   6.897  10.794   2.233
   54    H    ILE  10           H        ILE  10   9.370   7.790   0.170
   55    HA   ILE  10           HA       ILE  10   8.211   5.447  -1.257
   56    HB   ILE  10           HB       ILE  10  10.916   5.043  -0.257
   57   1HG1  ILE  10          2HG1      ILE  10  11.059   7.503  -0.590
   58   2HG1  ILE  10          1HG1      ILE  10  12.017   6.634  -1.792
   59   1HG2  ILE  10          1HG2      ILE  10   9.256   4.676  -2.674
   60   2HG2  ILE  10          2HG2      ILE  10  10.442   3.591  -1.950
   61   3HG2  ILE  10          3HG2      ILE  10  10.975   4.916  -2.986
   62   1HD1  ILE  10          1HD1      ILE  10   9.177   7.180  -2.493
   63   2HD1  ILE  10          2HD1      ILE  10  10.613   7.199  -3.519
   64   3HD1  ILE  10          3HD1      ILE  10  10.264   8.569  -2.464
   65    H    CYS  11           H        CYS  11   6.783   4.723   0.334
   66    HA   CYS  11           HA       CYS  11   7.480   4.348   3.093
   67   1HB   CYS  11          2HB       CYS  11   5.509   2.794   3.098
   68   2HB   CYS  11          1HB       CYS  11   5.139   4.353   2.359
   69    H    SER  12           H        SER  12   6.472   1.310   2.462
   70    HA   SER  12           HA       SER  12   9.168   0.275   1.746
   71   1HB   SER  12          2HB       SER  12   9.233  -1.212   3.601
   72   2HB   SER  12          1HB       SER  12   8.739   0.332   4.288
   73    HG   SER  12           HG       SER  12   7.490  -1.866   4.593
   74    H    LEU  13           H        LEU  13   8.803  -0.962  -0.051
   75    HA   LEU  13           HA       LEU  13   6.468  -1.798  -1.201
   76   1HB   LEU  13          2HB       LEU  13   8.928  -2.321  -1.899
   77   2HB   LEU  13          1HB       LEU  13   8.679  -3.828  -1.014
   78    HG   LEU  13           HG       LEU  13   6.357  -3.581  -2.497
   79   1HD1  LEU  13          1HD1      LEU  13   8.723  -2.731  -4.191
   80   2HD1  LEU  13          2HD1      LEU  13   7.310  -1.745  -3.810
   81   3HD1  LEU  13          3HD1      LEU  13   7.138  -3.182  -4.817
   82   1HD2  LEU  13          1HD2      LEU  13   8.752  -5.037  -3.592
   83   2HD2  LEU  13          2HD2      LEU  13   7.070  -5.561  -3.529
   84   3HD2  LEU  13          3HD2      LEU  13   8.041  -5.538  -2.058
   85    H    TYR  14           H        TYR  14   7.908  -3.201   1.686
   86    HA   TYR  14           HA       TYR  14   6.359  -5.579   1.843
   87   1HB   TYR  14          2HB       TYR  14   7.750  -3.815   3.819
   88   2HB   TYR  14          1HB       TYR  14   6.594  -4.993   4.441
   89    HD1  TYR  14           HD1      TYR  14   9.961  -4.518   3.557
   90    HD2  TYR  14           HD2      TYR  14   6.794  -7.412   3.293
   91    HE1  TYR  14           HE1      TYR  14  11.637  -6.328   3.269
   92    HE2  TYR  14           HE2      TYR  14   8.468  -9.218   3.004
   93    HH   TYR  14           HH       TYR  14  11.045  -9.198   2.046
   94    H    GLN  15           H        GLN  15   5.706  -2.491   3.575
   95    HA   GLN  15           HA       GLN  15   3.068  -3.101   4.360
   96   1HB   GLN  15          2HB       GLN  15   4.717  -0.831   4.428
   97   2HB   GLN  15          1HB       GLN  15   3.307  -0.326   3.498
   98   1HG   GLN  15          2HG       GLN  15   2.014  -1.601   5.451
   99   2HG   GLN  15          1HG       GLN  15   3.482  -1.207   6.347
  100   1HE2  GLN  15          1HE2      GLN  15   4.181   1.299   5.486
  101   2HE2  GLN  15          2HE2      GLN  15   2.925   2.411   5.747
  102    H    LEU  16           H        LEU  16   4.382  -2.287   1.276
  103    HA   LEU  16           HA       LEU  16   1.987  -1.486  -0.090
  104   1HB   LEU  16          2HB       LEU  16   4.667  -1.735  -0.683
  105   2HB   LEU  16          1HB       LEU  16   3.949  -2.976  -1.693
  106    HG   LEU  16           HG       LEU  16   3.235  -0.030  -1.620
  107   1HD1  LEU  16          1HD1      LEU  16   3.764  -0.574  -4.193
  108   2HD1  LEU  16          2HD1      LEU  16   4.773  -1.816  -3.452
  109   3HD1  LEU  16          3HD1      LEU  16   5.034  -0.117  -3.059
  110   1HD2  LEU  16          1HD2      LEU  16   1.946  -2.355  -3.075
  111   2HD2  LEU  16          2HD2      LEU  16   1.668  -0.662  -3.487
  112   3HD2  LEU  16          3HD2      LEU  16   1.183  -1.275  -1.906
  113    H    GLU  17           H        GLU  17   3.491  -4.653   0.523
  114    HA   GLU  17           HA       GLU  17   1.560  -6.114  -1.070
  115   1HB   GLU  17          2HB       GLU  17   2.481  -8.106  -0.060
  116   2HB   GLU  17          1HB       GLU  17   3.825  -7.009  -0.370
  117   1HG   GLU  17          2HG       GLU  17   4.285  -6.768   1.837
  118   2HG   GLU  17          1HG       GLU  17   2.582  -6.624   2.270
  119    H    ASN  18           H        ASN  18   1.574  -4.661   2.036
  120    HA   ASN  18           HA       ASN  18  -0.585  -6.279   3.154
  121   1HB   ASN  18          2HB       ASN  18   0.561  -3.596   3.993
  122   2HB   ASN  18          1HB       ASN  18  -0.622  -4.517   4.921
  123   1HD2  ASN  18          1HD2      ASN  18   1.608  -4.146   6.356
  124   2HD2  ASN  18          2HD2      ASN  18   2.624  -5.505   6.353
  125    H    TYR  19           H        TYR  19  -0.479  -4.085   0.666
  126    HA   TYR  19           HA       TYR  19  -3.118  -2.869   1.301
  127   1HB   TYR  19          2HB       TYR  19  -0.870  -2.288  -0.565
  128   2HB   TYR  19          1HB       TYR  19  -2.488  -1.817  -1.085
  129    HD1  TYR  19           HD1      TYR  19   0.237  -0.360   0.041
  130    HD2  TYR  19           HD2      TYR  19  -3.761  -1.049   1.453
  131    HE1  TYR  19           HE1      TYR  19   0.414   1.634   1.492
  132    HE2  TYR  19           HE2      TYR  19  -3.588   0.949   2.910
  133    HH   TYR  19           HH       TYR  19  -2.314   2.645   3.567
  134    H    CYS  20           H        CYS  20  -2.034  -5.693   0.160
  135    HA   CYS  20           HA       CYS  20  -3.570  -5.986  -2.285
  136   1HB   CYS  20          2HB       CYS  20  -2.372  -8.098  -0.499
  137   2HB   CYS  20          1HB       CYS  20  -2.789  -8.255  -2.182
  138    H    ASN  21           H        ASN  21  -4.654  -8.504  -1.878
  139    HA   ASN  21           HA       ASN  21  -7.097  -7.838  -0.373
  140   1HB   ASN  21          2HB       ASN  21  -6.310  -9.727  -2.500
  141   2HB   ASN  21          1HB       ASN  21  -7.450 -10.390  -1.330
  142   1HD2  ASN  21          1HD2      ASN  21  -9.234 -10.325  -2.882
  143   2HD2  ASN  21          2HD2      ASN  21  -9.937  -8.855  -3.355
  144   1H    PHE   1          1H        PHE   1  11.167  -3.455  -4.818
  145   2H    PHE   1          2H        PHE   1  11.711  -3.963  -3.290
  146   3H    PHE   1          3H        PHE   1  12.019  -4.914  -4.664
  147    HA   PHE   1           HA       PHE   1  13.969  -3.615  -3.860
  148   1HB   PHE   1          2HB       PHE   1  12.808  -3.319  -6.627
  149   2HB   PHE   1          1HB       PHE   1  14.376  -2.617  -6.226
  150    HD1  PHE   1           HD1      PHE   1  12.819  -5.470  -7.510
  151    HD2  PHE   1           HD2      PHE   1  15.948  -4.304  -4.805
  152    HE1  PHE   1           HE1      PHE   1  13.885  -7.694  -7.784
  153    HE2  PHE   1           HE2      PHE   1  17.013  -6.528  -5.078
  154    HZ   PHE   1           HZ       PHE   1  15.981  -8.224  -6.566
  155    H    VAL   2           H        VAL   2  14.778  -1.253  -4.999
  156    HA   VAL   2           HA       VAL   2  13.382   0.702  -3.332
  157    HB   VAL   2           HB       VAL   2  15.114   2.242  -4.009
  158   1HG1  VAL   2          1HG1      VAL   2  16.858  -0.110  -4.043
  159   2HG1  VAL   2          2HG1      VAL   2  15.618  -0.199  -2.793
  160   3HG1  VAL   2          3HG1      VAL   2  16.726   1.171  -2.839
  161   1HG2  VAL   2          1HG2      VAL   2  16.795   1.377  -5.781
  162   2HG2  VAL   2          2HG2      VAL   2  15.240   1.979  -6.357
  163   3HG2  VAL   2          3HG2      VAL   2  15.523   0.242  -6.234
  164    H    ASN   3           H        ASN   3  12.426   2.668  -4.175
  165    HA   ASN   3           HA       ASN   3  11.793   2.742  -7.058
  166   1HB   ASN   3          2HB       ASN   3   9.795   2.203  -4.879
  167   2HB   ASN   3          1HB       ASN   3   9.302   3.135  -6.292
  168   1HD2  ASN   3          1HD2      ASN   3  10.097   2.014  -8.480
  169   2HD2  ASN   3          2HD2      ASN   3   9.855   0.336  -8.554
  170    H    GLN   4           H        GLN   4   9.935   4.749  -7.070
  171    HA   GLN   4           HA       GLN   4  11.251   6.914  -5.482
  172   1HB   GLN   4          2HB       GLN   4  10.460   8.366  -7.519
  173   2HB   GLN   4          1HB       GLN   4  11.930   7.401  -7.669
  174   1HG   GLN   4          2HG       GLN   4   9.370   6.054  -8.372
  175   2HG   GLN   4          1HG       GLN   4   9.950   7.289  -9.490
  176   1HE2  GLN   4          1HE2      GLN   4  10.029   4.888 -10.658
  177   2HE2  GLN   4          2HE2      GLN   4  11.580   4.198 -10.642
  178    H    HIS   5           H        HIS   5   8.603   7.771  -7.529
  179    HA   HIS   5           HA       HIS   5   6.962   8.244  -5.116
  180   1HB   HIS   5          2HB       HIS   5   6.015   8.972  -7.857
  181   2HB   HIS   5          1HB       HIS   5   5.840   9.852  -6.340
  182    HD2  HIS   5           HD2      HIS   5   7.598  10.594  -9.411
  183    HE1  HIS   5           HE1      HIS   5  10.470  11.572  -6.466
  184    HE2  HIS   5           HE2      HIS   5   9.833  11.835  -8.922
  185    H    LEU   6           H        LEU   6   4.920   7.305  -4.831
  186    HA   LEU   6           HA       LEU   6   4.102   5.253  -6.812
  187   1HB   LEU   6          2HB       LEU   6   5.216   4.707  -4.286
  188   2HB   LEU   6          1HB       LEU   6   3.488   4.463  -4.081
  189    HG   LEU   6           HG       LEU   6   3.941   2.373  -4.857
  190   1HD1  LEU   6          1HD1      LEU   6   2.795   3.638  -6.804
  191   2HD1  LEU   6          2HD1      LEU   6   3.541   2.078  -7.153
  192   3HD1  LEU   6          3HD1      LEU   6   4.375   3.570  -7.585
  193   1HD2  LEU   6          1HD2      LEU   6   6.267   3.252  -6.539
  194   2HD2  LEU   6          2HD2      LEU   6   5.984   1.694  -5.762
  195   3HD2  LEU   6          3HD2      LEU   6   6.433   3.095  -4.790
  196    H    CYS   7           H        CYS   7   2.252   6.244  -7.530
  197    HA   CYS   7           HA       CYS   7   0.239   7.025  -5.451
  198   1HB   CYS   7          2HB       CYS   7   1.094   8.287  -7.982
  199   2HB   CYS   7          1HB       CYS   7  -0.655   8.135  -7.821
  200    H    GLY   8           H        GLY   8  -1.952   6.358  -5.901
  201   1HA   GLY   8          2HA       GLY   8  -2.690   3.885  -6.415
  202   2HA   GLY   8          1HA       GLY   8  -3.627   5.162  -7.183
  203    H    SER   9           H        SER   9  -2.350   6.001  -9.294
  204    HA   SER   9           HA       SER   9  -2.545   4.044 -11.273
  205   1HB   SER   9          2HB       SER   9  -1.199   6.678 -11.065
  206   2HB   SER   9          1HB       SER   9  -0.610   5.622 -12.347
  207    HG   SER   9           HG       SER   9  -2.342   6.814 -13.121
  208    H    ASP  10           H        ASP  10   0.570   5.189  -9.887
  209    HA   ASP  10           HA       ASP  10   1.937   2.849 -11.006
  210   1HB   ASP  10          2HB       ASP  10   3.088   4.826  -9.027
  211   2HB   ASP  10          1HB       ASP  10   3.950   3.845 -10.214
  212    H    LEU  11           H        LEU  11   0.499   3.762  -7.968
  213    HA   LEU  11           HA       LEU  11   1.901   1.845  -6.310
  214   1HB   LEU  11          2HB       LEU  11  -0.432   3.641  -6.046
  215   2HB   LEU  11          1HB       LEU  11  -0.493   2.204  -5.060
  216    HG   LEU  11           HG       LEU  11   1.889   4.035  -5.161
  217   1HD1  LEU  11          1HD1      LEU  11  -0.147   3.812  -2.940
  218   2HD1  LEU  11          2HD1      LEU  11  -0.282   5.025  -4.214
  219   3HD1  LEU  11          3HD1      LEU  11   1.115   5.029  -3.136
  220   1HD2  LEU  11          1HD2      LEU  11   1.179   2.054  -3.019
  221   2HD2  LEU  11          2HD2      LEU  11   2.760   2.716  -3.433
  222   3HD2  LEU  11          3HD2      LEU  11   2.002   1.520  -4.483
  223    H    VAL  12           H        VAL  12  -0.867   1.742  -8.424
  224    HA   VAL  12           HA       VAL  12  -1.874  -0.777  -7.460
  225    HB   VAL  12           HB       VAL  12  -2.314   0.933  -9.889
  226   1HG1  VAL  12          1HG1      VAL  12  -3.341  -1.910  -9.591
  227   2HG1  VAL  12          2HG1      VAL  12  -2.171  -1.362 -10.791
  228   3HG1  VAL  12          3HG1      VAL  12  -3.829  -0.767 -10.843
  229   1HG2  VAL  12          1HG2      VAL  12  -3.545   1.272  -7.740
  230   2HG2  VAL  12          2HG2      VAL  12  -4.222  -0.348  -7.914
  231   3HG2  VAL  12          3HG2      VAL  12  -4.610   0.901  -9.097
  232    H    GLU  13           H        GLU  13  -0.312   0.018 -10.531
  233    HA   GLU  13           HA       GLU  13   0.314  -2.509 -11.459
  234   1HB   GLU  13          2HB       GLU  13   2.332  -0.262 -11.572
  235   2HB   GLU  13          1HB       GLU  13   2.013  -1.508 -12.784
  236   1HG   GLU  13          2HG       GLU  13  -0.417  -0.495 -12.768
  237   2HG   GLU  13          1HG       GLU  13   0.387   0.927 -12.101
  238    H    ALA  14           H        ALA  14   2.396  -0.579  -9.242
  239    HA   ALA  14           HA       ALA  14   4.282  -2.714  -8.819
  240   1HB   ALA  14          1HB       ALA  14   4.942  -0.478  -8.189
  241   2HB   ALA  14          2HB       ALA  14   4.797  -1.392  -6.687
  242   3HB   ALA  14          3HB       ALA  14   3.516  -0.280  -7.170
  243    H    LEU  15           H        LEU  15   1.286  -1.695  -7.254
  244    HA   LEU  15           HA       LEU  15   1.278  -3.437  -5.036
  245   1HB   LEU  15          2HB       LEU  15  -0.725  -1.946  -6.584
  246   2HB   LEU  15          1HB       LEU  15  -1.350  -3.433  -5.882
  247    HG   LEU  15           HG       LEU  15   0.243  -1.422  -4.297
  248   1HD1  LEU  15          1HD1      LEU  15  -1.647  -0.269  -3.728
  249   2HD1  LEU  15          2HD1      LEU  15  -2.683  -1.688  -3.888
  250   3HD1  LEU  15          3HD1      LEU  15  -2.168  -0.805  -5.326
  251   1HD2  LEU  15          1HD2      LEU  15  -1.707  -3.504  -3.321
  252   2HD2  LEU  15          2HD2      LEU  15  -0.447  -2.672  -2.408
  253   3HD2  LEU  15          3HD2      LEU  15  -0.009  -3.891  -3.606
  254    H    TYR  16           H        TYR  16   0.760  -4.045  -8.429
  255    HA   TYR  16           HA       TYR  16  -0.260  -6.770  -7.944
  256   1HB   TYR  16          2HB       TYR  16  -1.189  -6.101  -9.944
  257   2HB   TYR  16          1HB       TYR  16   0.115  -4.970 -10.287
  258    HD1  TYR  16           HD1      TYR  16  -0.833  -8.573 -10.360
  259    HD2  TYR  16           HD2      TYR  16   1.947  -5.575 -11.680
  260    HE1  TYR  16           HE1      TYR  16   0.165 -10.199 -11.949
  261    HE2  TYR  16           HE2      TYR  16   2.946  -7.197 -13.268
  262    HH   TYR  16           HH       TYR  16   2.862 -10.191 -13.128
  263    H    LEU  17           H        LEU  17   2.706  -5.127  -8.896
  264    HA   LEU  17           HA       LEU  17   4.256  -7.518  -9.405
  265   1HB   LEU  17          2HB       LEU  17   4.691  -4.820  -9.726
  266   2HB   LEU  17          1HB       LEU  17   5.643  -5.151  -8.278
  267    HG   LEU  17           HG       LEU  17   6.478  -7.218  -9.689
  268   1HD1  LEU  17          1HD1      LEU  17   6.599  -5.737 -12.095
  269   2HD1  LEU  17          2HD1      LEU  17   4.911  -5.707 -11.584
  270   3HD1  LEU  17          3HD1      LEU  17   5.735  -7.249 -11.815
  271   1HD2  LEU  17          1HD2      LEU  17   7.675  -5.042  -8.864
  272   2HD2  LEU  17          2HD2      LEU  17   7.529  -4.533 -10.547
  273   3HD2  LEU  17          3HD2      LEU  17   8.429  -5.995 -10.143
  274    H    VAL  18           H        VAL  18   3.172  -5.696  -6.721
  275    HA   VAL  18           HA       VAL  18   4.849  -7.026  -4.721
  276    HB   VAL  18           HB       VAL  18   3.067  -4.695  -4.956
  277   1HG1  VAL  18          1HG1      VAL  18   1.632  -5.541  -3.367
  278   2HG1  VAL  18          2HG1      VAL  18   2.844  -4.774  -2.339
  279   3HG1  VAL  18          3HG1      VAL  18   2.886  -6.518  -2.600
  280   1HG2  VAL  18          1HG2      VAL  18   5.549  -4.721  -4.668
  281   2HG2  VAL  18          2HG2      VAL  18   5.291  -5.322  -3.030
  282   3HG2  VAL  18          3HG2      VAL  18   4.687  -3.730  -3.492
  283    H    CYS  19           H        CYS  19   1.419  -6.593  -5.350
  284    HA   CYS  19           HA       CYS  19   0.516  -8.687  -3.577
  285   1HB   CYS  19          2HB       CYS  19  -0.866  -7.307  -5.899
  286   2HB   CYS  19          1HB       CYS  19  -1.670  -8.351  -4.745
  287    H    GLY  20           H        GLY  20   2.480  -9.894  -5.123
  288   1HA   GLY  20          2HA       GLY  20   1.415 -11.161  -7.483
  289   2HA   GLY  20          1HA       GLY  20   2.868 -11.661  -6.620
  290    H    GLU  21           H        GLU  21   0.185 -12.986  -7.639
  291    HA   GLU  21           HA       GLU  21  -0.896 -14.973  -7.049
  292   1HB   GLU  21          2HB       GLU  21   0.130 -16.392  -5.581
  293   2HB   GLU  21          1HB       GLU  21   1.435 -15.221  -5.713
  294   1HG   GLU  21          2HG       GLU  21   1.312 -15.139  -3.447
  295   2HG   GLU  21          1HG       GLU  21  -0.101 -14.119  -3.706
  296    H    ARG  22           H        ARG  22  -1.668 -12.151  -6.177
  297    HA   ARG  22           HA       ARG  22  -4.037 -12.957  -4.685
  298   1HB   ARG  22          2HB       ARG  22  -3.637 -11.527  -2.727
  299   2HB   ARG  22          1HB       ARG  22  -2.383 -12.762  -2.846
  300   1HG   ARG  22          2HG       ARG  22  -1.030 -11.001  -4.157
  301   2HG   ARG  22          1HG       ARG  22  -2.193  -9.829  -3.534
  302   1HD   ARG  22          2HD       ARG  22  -0.281 -11.572  -1.979
  303   2HD   ARG  22          1HD       ARG  22  -0.439  -9.815  -1.941
  304    HE   ARG  22           HE       ARG  22  -2.780 -10.329  -0.924
  305   1HH1  ARG  22          1HH2      ARG  22  -1.392 -13.261  -1.080
  306   2HH1  ARG  22          2HH2      ARG  22  -1.250 -13.541   0.624
  307   1HH2  ARG  22          1HH1      ARG  22  -1.985 -10.263   1.489
  308   2HH2  ARG  22          2HH1      ARG  22  -1.587 -11.843   2.078
  309    H    GLY  23           H        GLY  23  -5.076 -10.616  -3.904
  310   1HA   GLY  23          2HA       GLY  23  -4.801  -8.829  -6.290
  311   2HA   GLY  23          1HA       GLY  23  -6.368  -9.200  -5.567
  312    H    PHE  24           H        PHE  24  -6.442  -6.760  -5.377
  313    HA   PHE  24           HA       PHE  24  -5.415  -5.983  -2.706
  314   1HB   PHE  24          2HB       PHE  24  -4.575  -3.836  -3.516
  315   2HB   PHE  24          1HB       PHE  24  -3.737  -5.137  -4.355
  316    HD1  PHE  24           HD1      PHE  24  -5.294  -2.082  -4.830
  317    HD2  PHE  24           HD2      PHE  24  -5.146  -6.029  -6.516
  318    HE1  PHE  24           HE1      PHE  24  -6.098  -1.181  -7.003
  319    HE2  PHE  24           HE2      PHE  24  -5.954  -5.135  -8.687
  320    HZ   PHE  24           HZ       PHE  24  -6.430  -2.710  -8.931
  321    H    PHE  25           H        PHE  25  -6.224  -3.332  -2.802
  322    HA   PHE  25           HA       PHE  25  -9.076  -3.398  -3.639
  323   1HB   PHE  25          2HB       PHE  25  -8.483  -4.012  -1.071
  324   2HB   PHE  25          1HB       PHE  25  -8.552  -2.254  -0.950
  325    HD1  PHE  25           HD1      PHE  25 -10.463  -5.313  -1.365
  326    HD2  PHE  25           HD2      PHE  25 -10.617  -1.034  -1.731
  327    HE1  PHE  25           HE1      PHE  25 -12.943  -5.406  -1.411
  328    HE2  PHE  25           HE2      PHE  25 -13.095  -1.127  -1.776
  329    HZ   PHE  25           HZ       PHE  25 -14.259  -3.313  -1.618
  330    H    TYR  26           H        TYR  26  -9.557  -1.502  -4.639
  331    HA   TYR  26           HA       TYR  26  -7.931   0.903  -3.916
  332   1HB   TYR  26          2HB       TYR  26  -7.368  -0.096  -6.166
  333   2HB   TYR  26          1HB       TYR  26  -9.020   0.255  -6.669
  334    HD1  TYR  26           HD1      TYR  26  -8.067   2.715  -4.336
  335    HD2  TYR  26           HD2      TYR  26  -7.471   1.554  -8.432
  336    HE1  TYR  26           HE1      TYR  26  -7.401   5.035  -4.899
  337    HE2  TYR  26           HE2      TYR  26  -6.806   3.876  -8.992
  338    HH   TYR  26           HH       TYR  26  -6.904   6.053  -8.212
  339    H    THR  27           H        THR  27 -10.992  -0.196  -5.393
  340    HA   THR  27           HA       THR  27 -12.401   1.903  -3.874
  341    HB   THR  27           HB       THR  27 -12.196   3.222  -5.770
  342    HG1  THR  27           HG1      THR  27 -14.333   3.131  -5.608
  343   1HG2  THR  27          1HG2      THR  27 -11.497   2.484  -7.789
  344   2HG2  THR  27          2HG2      THR  27 -12.780   1.281  -7.890
  345   3HG2  THR  27          3HG2      THR  27 -11.299   0.916  -7.011
  346    H    LYS  28           H        LYS  28 -14.139   0.607  -6.539
  347    HA   LYS  28           HA       LYS  28 -16.078  -0.740  -6.454
  348   1HB   LYS  28          2HB       LYS  28 -15.170  -3.064  -5.229
  349   2HB   LYS  28          1HB       LYS  28 -15.066  -2.703  -6.949
  350   1HG   LYS  28          2HG       LYS  28 -12.918  -1.979  -4.908
  351   2HG   LYS  28          1HG       LYS  28 -12.860  -3.394  -5.943
  352   1HD   LYS  28          2HD       LYS  28 -12.435  -0.512  -6.661
  353   2HD   LYS  28          1HD       LYS  28 -11.573  -1.939  -7.216
  354   1HE   LYS  28          2HE       LYS  28 -13.738  -2.588  -8.438
  355   2HE   LYS  28          1HE       LYS  28 -14.282  -0.940  -8.121
  356   1HZ   LYS  28          1HZ       LYS  28 -12.637  -1.798 -10.168
  357   2HZ   LYS  28          2HZ       LYS  28 -11.633  -0.930  -9.107
  358   3HZ   LYS  28          3HZ       LYS  28 -13.020  -0.197  -9.762
  359    HA   PRO  29           HA       PRO  29 -17.047   0.071  -2.065
  360   1HB   PRO  29          2HB       PRO  29 -19.402   1.376  -2.616
  361   2HB   PRO  29          1HB       PRO  29 -17.824   2.181  -2.553
  362   1HG   PRO  29          2HG       PRO  29 -19.472   1.461  -4.934
  363   2HG   PRO  29          1HG       PRO  29 -18.276   2.754  -4.747
  364   1HD   PRO  29          2HD       PRO  29 -17.850   0.284  -6.062
  365   2HD   PRO  29          1HD       PRO  29 -16.589   1.438  -5.573
  366    H    THR  30           H        THR  30 -18.094  -1.516  -0.937
  367    HA   THR  30           HA       THR  30 -19.986  -3.277  -2.372
  368    HB   THR  30           HB       THR  30 -18.140  -4.194  -0.904
  369    HG1  THR  30           HG1      THR  30 -19.492  -5.778  -0.877
  370   1HG2  THR  30          1HG2      THR  30 -17.960  -3.623   1.278
  371   2HG2  THR  30          2HG2      THR  30 -19.700  -3.752   1.541
  372   3HG2  THR  30          3HG2      THR  30 -19.016  -2.270   0.871
  Start of MODEL   14
    1   1H    GLY   1          1H        GLY   1  -4.512   9.503   0.292
    2   2H    GLY   1          2H        GLY   1  -5.287  10.628   1.301
    3   3H    GLY   1          3H        GLY   1  -5.715  10.522  -0.339
    4   1HA   GLY   1          1HA       GLY   1  -6.493   8.750   1.798
    5   2HA   GLY   1          2HA       GLY   1  -7.495   9.350   0.440
    6    H    ALA   2           H        ALA   2  -4.380   7.742   1.596
    7    HA   ALA   2           HA       ALA   2  -3.715   5.487   1.677
    8   1HB   ALA   2          1HB       ALA   2  -6.518   4.703   0.882
    9   2HB   ALA   2          2HB       ALA   2  -6.157   5.241   2.522
   10   3HB   ALA   2          3HB       ALA   2  -5.365   3.807   1.870
   11    H    VAL   3           H        VAL   3  -3.477   7.053  -0.722
   12    HA   VAL   3           HA       VAL   3  -3.208   4.848  -2.641
   13    HB   VAL   3           HB       VAL   3  -5.576   6.139  -2.750
   14   1HG1  VAL   3          1HG1      VAL   3  -4.609   8.350  -3.160
   15   2HG1  VAL   3          2HG1      VAL   3  -5.497   7.809  -4.582
   16   3HG1  VAL   3          3HG1      VAL   3  -3.736   7.727  -4.562
   17   1HG2  VAL   3          1HG2      VAL   3  -5.818   4.794  -4.542
   18   2HG2  VAL   3          2HG2      VAL   3  -4.109   4.398  -4.361
   19   3HG2  VAL   3          3HG2      VAL   3  -4.605   5.687  -5.458
   20    H    GLU   4           H        GLU   4  -3.025   8.384  -2.201
   21    HA   GLU   4           HA       GLU   4  -0.527   8.365  -3.836
   22   1HB   GLU   4          2HB       GLU   4  -0.901  10.898  -3.831
   23   2HB   GLU   4          1HB       GLU   4  -2.083   9.946  -4.727
   24   1HG   GLU   4          2HG       GLU   4  -3.769  10.504  -3.321
   25   2HG   GLU   4          1HG       GLU   4  -2.764  10.277  -1.890
   26    H    GLN   5           H        GLN   5   0.091   7.338  -1.491
   27    HA   GLN   5           HA       GLN   5   1.163   9.635   0.100
   28   1HB   GLN   5          2HB       GLN   5   1.173   7.760   1.976
   29   2HB   GLN   5          1HB       GLN   5  -0.292   8.683   1.639
   30   1HG   GLN   5          2HG       GLN   5  -1.312   6.917   0.520
   31   2HG   GLN   5          1HG       GLN   5   0.226   6.164   0.095
   32   1HE2  GLN   5          1HE2      GLN   5   0.972   4.513   1.467
   33   2HE2  GLN   5          2HE2      GLN   5   0.295   4.147   2.980
   34    H    CYS   6           H        CYS   6   2.014   7.246  -1.996
   35    HA   CYS   6           HA       CYS   6   4.705   6.927  -0.721
   36   1HB   CYS   6          2HB       CYS   6   3.296   4.984  -2.579
   37   2HB   CYS   6          1HB       CYS   6   4.880   4.748  -1.843
   38    H    CYS   7           H        CYS   7   3.710   9.026  -2.552
   39    HA   CYS   7           HA       CYS   7   5.559   8.519  -4.838
   40   1HB   CYS   7          2HB       CYS   7   3.729  10.500  -5.648
   41   2HB   CYS   7          1HB       CYS   7   3.837   8.845  -6.244
   42    H    THR   8           H        THR   8   5.000  10.317  -2.108
   43    HA   THR   8           HA       THR   8   6.631  12.594  -3.159
   44    HB   THR   8           HB       THR   8   5.830  13.738  -1.009
   45    HG1  THR   8           HG1      THR   8   3.679  11.990  -1.009
   46   1HG2  THR   8          1HG2      THR   8   3.375  13.129  -2.539
   47   2HG2  THR   8          2HG2      THR   8   4.750  13.663  -3.506
   48   3HG2  THR   8          3HG2      THR   8   4.138  14.683  -2.203
   49    H    SER   9           H        SER   9   7.399   9.845  -2.295
   50    HA   SER   9           HA       SER   9   9.829  10.228  -1.041
   51   1HB   SER   9          2HB       SER   9   8.689  11.124   0.935
   52   2HB   SER   9          1HB       SER   9   7.595   9.743   0.968
   53    HG   SER   9           HG       SER   9   9.877   9.952   2.187
   54    H    ILE  10           H        ILE  10   9.158   7.816   0.860
   55    HA   ILE  10           HA       ILE  10   8.275   5.862  -1.153
   56    HB   ILE  10           HB       ILE  10  10.758   4.956   0.120
   57   1HG1  ILE  10          2HG1      ILE  10  11.137   7.480  -0.454
   58   2HG1  ILE  10          1HG1      ILE  10  12.308   6.303  -1.038
   59   1HG2  ILE  10          1HG2      ILE  10   9.833   3.578  -1.536
   60   2HG2  ILE  10          2HG2      ILE  10  11.119   4.419  -2.397
   61   3HG2  ILE  10          3HG2      ILE  10   9.446   4.939  -2.588
   62   1HD1  ILE  10          1HD1      ILE  10  10.924   8.157  -2.602
   63   2HD1  ILE  10          2HD1      ILE  10  10.099   6.632  -2.913
   64   3HD1  ILE  10          3HD1      ILE  10  11.831   6.768  -3.195
   65    H    CYS  11           H        CYS  11   6.781   4.753  -0.044
   66    HA   CYS  11           HA       CYS  11   6.787   4.546   2.838
   67   1HB   CYS  11          2HB       CYS  11   5.228   2.893   0.826
   68   2HB   CYS  11          1HB       CYS  11   4.847   3.094   2.535
   69    H    SER  12           H        SER  12   6.102   1.448   1.596
   70    HA   SER  12           HA       SER  12   8.836   0.430   1.698
   71   1HB   SER  12          2HB       SER  12   7.901  -1.164   3.667
   72   2HB   SER  12          1HB       SER  12   8.807   0.312   3.984
   73    HG   SER  12           HG       SER  12   7.066   1.143   4.806
   74    H    LEU  13           H        LEU  13   8.781  -1.121   0.138
   75    HA   LEU  13           HA       LEU  13   6.594  -2.205  -1.161
   76   1HB   LEU  13          2HB       LEU  13   9.202  -2.664  -1.411
   77   2HB   LEU  13          1HB       LEU  13   8.806  -4.106  -0.474
   78    HG   LEU  13           HG       LEU  13   8.662  -4.497  -2.934
   79   1HD1  LEU  13          1HD1      LEU  13   6.839  -5.884  -2.706
   80   2HD1  LEU  13          2HD1      LEU  13   5.836  -4.620  -1.996
   81   3HD1  LEU  13          3HD1      LEU  13   7.044  -5.440  -1.011
   82   1HD2  LEU  13          1HD2      LEU  13   6.158  -2.858  -3.012
   83   2HD2  LEU  13          2HD2      LEU  13   7.269  -3.267  -4.320
   84   3HD2  LEU  13          3HD2      LEU  13   7.702  -2.016  -3.154
   85    H    TYR  14           H        TYR  14   7.771  -3.022   2.038
   86    HA   TYR  14           HA       TYR  14   6.302  -5.462   2.389
   87   1HB   TYR  14          2HB       TYR  14   7.452  -3.403   4.263
   88   2HB   TYR  14          1HB       TYR  14   6.428  -4.694   4.891
   89    HD1  TYR  14           HD1      TYR  14   9.733  -3.840   4.412
   90    HD2  TYR  14           HD2      TYR  14   7.028  -7.089   3.637
   91    HE1  TYR  14           HE1      TYR  14  11.649  -5.412   4.320
   92    HE2  TYR  14           HE2      TYR  14   8.945  -8.662   3.545
   93    HH   TYR  14           HH       TYR  14  11.492  -8.424   3.007
   94    H    GLN  15           H        GLN  15   5.538  -2.197   3.688
   95    HA   GLN  15           HA       GLN  15   2.859  -2.810   4.385
   96   1HB   GLN  15          2HB       GLN  15   4.286  -0.245   3.713
   97   2HB   GLN  15          1HB       GLN  15   2.543  -0.243   3.976
   98   1HG   GLN  15          2HG       GLN  15   4.355  -1.590   5.962
   99   2HG   GLN  15          1HG       GLN  15   4.126   0.158   6.022
  100   1HE2  GLN  15          1HE2      GLN  15   2.139   0.950   6.865
  101   2HE2  GLN  15          2HE2      GLN  15   0.879  -0.057   7.393
  102    H    LEU  16           H        LEU  16   4.365  -2.259   1.345
  103    HA   LEU  16           HA       LEU  16   2.046  -1.491  -0.184
  104   1HB   LEU  16          2HB       LEU  16   4.774  -1.883  -0.655
  105   2HB   LEU  16          1HB       LEU  16   3.985  -3.081  -1.668
  106    HG   LEU  16           HG       LEU  16   3.631  -0.080  -1.690
  107   1HD1  LEU  16          1HD1      LEU  16   5.393  -0.941  -3.127
  108   2HD1  LEU  16          2HD1      LEU  16   4.034  -0.456  -4.140
  109   3HD1  LEU  16          3HD1      LEU  16   4.308  -2.163  -3.789
  110   1HD2  LEU  16          1HD2      LEU  16   1.377  -0.836  -1.776
  111   2HD2  LEU  16          2HD2      LEU  16   1.803  -2.236  -2.762
  112   3HD2  LEU  16          3HD2      LEU  16   1.841  -0.617  -3.462
  113    H    GLU  17           H        GLU  17   3.592  -4.625   0.522
  114    HA   GLU  17           HA       GLU  17   1.716  -6.195  -0.985
  115   1HB   GLU  17          2HB       GLU  17   3.407  -6.936   1.426
  116   2HB   GLU  17          1HB       GLU  17   2.541  -8.090   0.412
  117   1HG   GLU  17          2HG       GLU  17   3.955  -7.773  -1.402
  118   2HG   GLU  17          1HG       GLU  17   4.402  -6.142  -0.899
  119    H    ASN  18           H        ASN  18   1.604  -4.638   2.103
  120    HA   ASN  18           HA       ASN  18  -0.641  -6.221   3.113
  121   1HB   ASN  18          2HB       ASN  18   0.980  -3.929   4.064
  122   2HB   ASN  18          1HB       ASN  18  -0.695  -3.952   4.613
  123   1HD2  ASN  18          1HD2      ASN  18  -0.263  -4.605   6.802
  124   2HD2  ASN  18          2HD2      ASN  18   0.394  -6.121   7.192
  125    H    TYR  19           H        TYR  19  -0.419  -4.089   0.610
  126    HA   TYR  19           HA       TYR  19  -3.026  -2.785   1.187
  127   1HB   TYR  19          2HB       TYR  19  -0.680  -2.150  -0.465
  128   2HB   TYR  19          1HB       TYR  19  -2.216  -1.883  -1.293
  129    HD1  TYR  19           HD1      TYR  19   0.116  -0.642   1.146
  130    HD2  TYR  19           HD2      TYR  19  -4.000  -0.491  -0.075
  131    HE1  TYR  19           HE1      TYR  19  -0.183   1.462   2.421
  132    HE2  TYR  19           HE2      TYR  19  -4.300   1.616   1.197
  133    HH   TYR  19           HH       TYR  19  -2.057   3.566   2.082
  134    H    CYS  20           H        CYS  20  -1.782  -5.546  -0.219
  135    HA   CYS  20           HA       CYS  20  -3.570  -5.765  -2.489
  136   1HB   CYS  20          2HB       CYS  20  -2.217  -8.034  -1.038
  137   2HB   CYS  20          1HB       CYS  20  -2.658  -7.920  -2.725
  138    H    ASN  21           H        ASN  21  -4.551  -8.355  -2.120
  139    HA   ASN  21           HA       ASN  21  -6.879  -7.817  -0.436
  140   1HB   ASN  21          2HB       ASN  21  -6.075  -9.808  -2.464
  141   2HB   ASN  21          1HB       ASN  21  -7.108 -10.441  -1.184
  142   1HD2  ASN  21          1HD2      ASN  21  -8.980 -10.606  -2.611
  143   2HD2  ASN  21          2HD2      ASN  21  -9.797  -9.224  -3.163
  144   1H    PHE   1          1H        PHE   1  12.339  -3.754  -3.147
  145   2H    PHE   1          2H        PHE   1  11.317  -5.098  -3.349
  146   3H    PHE   1          3H        PHE   1  10.729  -3.528  -3.632
  147    HA   PHE   1           HA       PHE   1  12.691  -5.054  -5.245
  148   1HB   PHE   1          2HB       PHE   1  10.276  -5.460  -5.662
  149   2HB   PHE   1          1HB       PHE   1  10.046  -3.731  -5.926
  150    HD1  PHE   1           HD1      PHE   1  12.570  -6.296  -7.022
  151    HD2  PHE   1           HD2      PHE   1   9.864  -3.160  -8.169
  152    HE1  PHE   1           HE1      PHE   1  13.266  -6.561  -9.389
  153    HE2  PHE   1           HE2      PHE   1  10.561  -3.425 -10.536
  154    HZ   PHE   1           HZ       PHE   1  12.262  -5.126 -11.146
  155    H    VAL   2           H        VAL   2  11.131  -1.866  -4.793
  156    HA   VAL   2           HA       VAL   2  13.610  -0.620  -5.864
  157    HB   VAL   2           HB       VAL   2  11.109   0.706  -6.725
  158   1HG1  VAL   2          1HG1      VAL   2  13.144  -0.035  -8.703
  159   2HG1  VAL   2          2HG1      VAL   2  13.808   0.834  -7.320
  160   3HG1  VAL   2          3HG1      VAL   2  12.517   1.559  -8.279
  161   1HG2  VAL   2          1HG2      VAL   2  11.927  -2.020  -7.762
  162   2HG2  VAL   2          2HG2      VAL   2  10.965  -0.895  -8.721
  163   3HG2  VAL   2          3HG2      VAL   2  10.336  -1.511  -7.193
  164    H    ASN   3           H        ASN   3  12.322   2.027  -5.843
  165    HA   ASN   3           HA       ASN   3  11.082   2.582  -3.341
  166   1HB   ASN   3          2HB       ASN   3  13.942   2.128  -3.232
  167   2HB   ASN   3          1HB       ASN   3  13.571   3.796  -2.792
  168   1HD2  ASN   3          1HD2      ASN   3  12.984   4.089  -0.638
  169   2HD2  ASN   3          2HD2      ASN   3  12.364   2.878   0.377
  170    H    GLN   4           H        GLN   4  10.051   3.794  -5.176
  171    HA   GLN   4           HA       GLN   4  11.319   6.464  -5.404
  172   1HB   GLN   4          2HB       GLN   4  11.319   4.591  -7.518
  173   2HB   GLN   4          1HB       GLN   4  10.085   5.786  -7.922
  174   1HG   GLN   4          2HG       GLN   4  11.718   7.600  -7.500
  175   2HG   GLN   4          1HG       GLN   4  12.953   6.391  -7.149
  176   1HE2  GLN   4          1HE2      GLN   4  10.462   6.577  -9.759
  177   2HE2  GLN   4          2HE2      GLN   4  11.576   6.410 -11.029
  178    H    HIS   5           H        HIS   5   9.387   7.422  -7.307
  179    HA   HIS   5           HA       HIS   5   7.232   8.038  -5.491
  180   1HB   HIS   5          2HB       HIS   5   7.414   8.519  -8.479
  181   2HB   HIS   5          1HB       HIS   5   6.304   9.314  -7.362
  182    HD2  HIS   5           HD2      HIS   5   7.363  11.844  -7.096
  183    HE1  HIS   5           HE1      HIS   5  11.386  10.698  -6.481
  184    HE2  HIS   5           HE2      HIS   5   9.769  12.670  -6.549
  185    H    LEU   6           H        LEU   6   5.552   6.717  -5.062
  186    HA   LEU   6           HA       LEU   6   4.469   5.002  -7.233
  187   1HB   LEU   6          2HB       LEU   6   5.850   4.016  -5.102
  188   2HB   LEU   6          1HB       LEU   6   4.204   4.018  -4.463
  189    HG   LEU   6           HG       LEU   6   3.426   2.783  -6.431
  190   1HD1  LEU   6          1HD1      LEU   6   4.667   3.129  -8.294
  191   2HD1  LEU   6          2HD1      LEU   6   5.673   1.815  -7.682
  192   3HD1  LEU   6          3HD1      LEU   6   6.121   3.492  -7.365
  193   1HD2  LEU   6          1HD2      LEU   6   5.770   1.141  -5.714
  194   2HD2  LEU   6          2HD2      LEU   6   4.052   0.783  -5.542
  195   3HD2  LEU   6          3HD2      LEU   6   4.872   1.775  -4.337
  196    H    CYS   7           H        CYS   7   2.719   6.308  -7.661
  197    HA   CYS   7           HA       CYS   7   0.912   6.982  -5.397
  198   1HB   CYS   7          2HB       CYS   7   1.571   8.256  -7.937
  199   2HB   CYS   7          1HB       CYS   7  -0.172   8.088  -7.724
  200    H    GLY   8           H        GLY   8  -1.355   6.446  -5.606
  201   1HA   GLY   8          2HA       GLY   8  -2.248   3.990  -5.971
  202   2HA   GLY   8          1HA       GLY   8  -3.215   5.298  -6.645
  203    H    SER   9           H        SER   9  -2.101   6.058  -8.899
  204    HA   SER   9           HA       SER   9  -2.638   4.092 -10.813
  205   1HB   SER   9          2HB       SER   9  -2.389   6.141 -11.834
  206   2HB   SER   9          1HB       SER   9  -1.049   6.612 -10.792
  207    HG   SER   9           HG       SER   9  -0.860   5.784 -13.224
  208    H    ASP  10           H        ASP  10   0.716   5.152 -10.148
  209    HA   ASP  10           HA       ASP  10   1.841   2.715 -11.192
  210   1HB   ASP  10          2HB       ASP  10   3.127   4.737  -9.329
  211   2HB   ASP  10          1HB       ASP  10   3.969   3.566 -10.343
  212    H    LEU  11           H        LEU  11   0.650   3.652  -8.070
  213    HA   LEU  11           HA       LEU  11   2.050   1.629  -6.544
  214   1HB   LEU  11          2HB       LEU  11  -0.066   3.618  -6.071
  215   2HB   LEU  11          1HB       LEU  11  -0.228   2.174  -5.121
  216    HG   LEU  11           HG       LEU  11   2.302   3.779  -5.302
  217   1HD1  LEU  11          1HD1      LEU  11   1.617   4.247  -2.839
  218   2HD1  LEU  11          2HD1      LEU  11   0.002   3.764  -3.352
  219   3HD1  LEU  11          3HD1      LEU  11   0.786   5.151  -4.105
  220   1HD2  LEU  11          1HD2      LEU  11   1.611   1.778  -3.182
  221   2HD2  LEU  11          2HD2      LEU  11   3.198   2.289  -3.753
  222   3HD2  LEU  11          3HD2      LEU  11   2.213   1.209  -4.739
  223    H    VAL  12           H        VAL  12  -0.915   1.718  -8.417
  224    HA   VAL  12           HA       VAL  12  -1.901  -0.791  -7.344
  225    HB   VAL  12           HB       VAL  12  -2.963   1.253  -8.939
  226   1HG1  VAL  12          1HG1      VAL  12  -2.734  -1.329 -10.510
  227   2HG1  VAL  12          2HG1      VAL  12  -2.191   0.273 -11.005
  228   3HG1  VAL  12          3HG1      VAL  12  -3.915  -0.072 -10.873
  229   1HG2  VAL  12          1HG2      VAL  12  -4.068  -0.192  -7.206
  230   2HG2  VAL  12          2HG2      VAL  12  -4.163  -1.479  -8.409
  231   3HG2  VAL  12          3HG2      VAL  12  -5.037   0.032  -8.662
  232    H    GLU  13           H        GLU  13  -0.008   0.207 -10.129
  233    HA   GLU  13           HA       GLU  13   0.144  -2.441 -11.303
  234   1HB   GLU  13          2HB       GLU  13   2.000  -0.064 -11.656
  235   2HB   GLU  13          1HB       GLU  13   1.916  -1.479 -12.707
  236   1HG   GLU  13          2HG       GLU  13  -0.731  -0.578 -12.510
  237   2HG   GLU  13          1HG       GLU  13   0.233   0.890 -12.686
  238    H    ALA  14           H        ALA  14   2.254  -0.517  -9.157
  239    HA   ALA  14           HA       ALA  14   4.283  -2.581  -8.958
  240   1HB   ALA  14          1HB       ALA  14   3.691  -0.507  -6.834
  241   2HB   ALA  14          2HB       ALA  14   4.499  -0.065  -8.339
  242   3HB   ALA  14          3HB       ALA  14   5.244  -1.232  -7.247
  243    H    LEU  15           H        LEU  15   1.315  -1.726  -7.283
  244    HA   LEU  15           HA       LEU  15   1.505  -3.430  -5.034
  245   1HB   LEU  15          2HB       LEU  15  -0.659  -2.104  -6.537
  246   2HB   LEU  15          1HB       LEU  15  -1.151  -3.609  -5.764
  247    HG   LEU  15           HG       LEU  15   0.457  -1.596  -4.226
  248   1HD1  LEU  15          1HD1      LEU  15  -2.148  -1.114  -5.322
  249   2HD1  LEU  15          2HD1      LEU  15  -1.219  -0.093  -4.224
  250   3HD1  LEU  15          3HD1      LEU  15  -2.303  -1.323  -3.577
  251   1HD2  LEU  15          1HD2      LEU  15  -0.257  -4.076  -3.594
  252   2HD2  LEU  15          2HD2      LEU  15  -1.772  -3.283  -3.161
  253   3HD2  LEU  15          3HD2      LEU  15  -0.267  -2.796  -2.381
  254    H    TYR  16           H        TYR  16  -0.078  -4.100  -8.153
  255    HA   TYR  16           HA       TYR  16  -0.502  -6.871  -7.722
  256   1HB   TYR  16          2HB       TYR  16  -1.602  -6.284  -9.649
  257   2HB   TYR  16          1HB       TYR  16  -0.439  -5.026 -10.047
  258    HD1  TYR  16           HD1      TYR  16  -1.341  -8.558 -10.466
  259    HD2  TYR  16           HD2      TYR  16   1.626  -5.560 -11.291
  260    HE1  TYR  16           HE1      TYR  16  -0.314 -10.042 -12.168
  261    HE2  TYR  16           HE2      TYR  16   2.653  -7.044 -12.995
  262    HH   TYR  16           HH       TYR  16   1.130 -10.068 -13.953
  263    H    LEU  17           H        LEU  17   2.323  -5.128  -9.024
  264    HA   LEU  17           HA       LEU  17   3.893  -7.469  -9.621
  265   1HB   LEU  17          2HB       LEU  17   4.263  -4.750  -9.919
  266   2HB   LEU  17          1HB       LEU  17   5.347  -5.109  -8.575
  267    HG   LEU  17           HG       LEU  17   5.976  -7.164 -10.197
  268   1HD1  LEU  17          1HD1      LEU  17   5.891  -5.137 -12.311
  269   2HD1  LEU  17          2HD1      LEU  17   4.288  -5.678 -11.812
  270   3HD1  LEU  17          3HD1      LEU  17   5.476  -6.849 -12.384
  271   1HD2  LEU  17          1HD2      LEU  17   7.061  -4.552  -9.570
  272   2HD2  LEU  17          2HD2      LEU  17   7.513  -5.027 -11.207
  273   3HD2  LEU  17          3HD2      LEU  17   7.918  -6.069  -9.844
  274    H    VAL  18           H        VAL  18   3.074  -5.636  -6.846
  275    HA   VAL  18           HA       VAL  18   4.919  -6.868  -4.974
  276    HB   VAL  18           HB       VAL  18   2.863  -4.774  -5.105
  277   1HG1  VAL  18          1HG1      VAL  18   3.084  -6.502  -2.652
  278   2HG1  VAL  18          2HG1      VAL  18   1.629  -5.970  -3.494
  279   3HG1  VAL  18          3HG1      VAL  18   2.583  -4.814  -2.568
  280   1HG2  VAL  18          1HG2      VAL  18   4.934  -3.916  -4.849
  281   2HG2  VAL  18          2HG2      VAL  18   5.508  -5.295  -3.909
  282   3HG2  VAL  18          3HG2      VAL  18   4.502  -4.061  -3.147
  283    H    CYS  19           H        CYS  19   1.466  -6.876  -5.514
  284    HA   CYS  19           HA       CYS  19   0.883  -9.145  -3.798
  285   1HB   CYS  19          2HB       CYS  19  -0.903  -8.136  -6.010
  286   2HB   CYS  19          1HB       CYS  19  -1.365  -8.778  -4.445
  287    H    GLY  20           H        GLY  20   2.899  -9.917  -5.627
  288   1HA   GLY  20          2HA       GLY  20   1.888 -11.136  -8.012
  289   2HA   GLY  20          1HA       GLY  20   3.405 -11.558  -7.223
  290    H    GLU  21           H        GLU  21  -0.107 -11.964  -6.651
  291    HA   GLU  21           HA       GLU  21  -0.316 -14.704  -6.765
  292   1HB   GLU  21          2HB       GLU  21   1.429 -15.120  -5.201
  293   2HB   GLU  21          1HB       GLU  21   0.876 -13.838  -4.123
  294   1HG   GLU  21          2HG       GLU  21  -0.619 -15.202  -3.105
  295   2HG   GLU  21          1HG       GLU  21  -1.173 -15.873  -4.639
  296    H    ARG  22           H        ARG  22  -1.154 -11.756  -5.117
  297    HA   ARG  22           HA       ARG  22  -3.943 -12.788  -4.850
  298   1HB   ARG  22          2HB       ARG  22  -2.578 -11.029  -2.793
  299   2HB   ARG  22          1HB       ARG  22  -4.181 -11.756  -2.677
  300   1HG   ARG  22          2HG       ARG  22  -2.587 -13.948  -3.171
  301   2HG   ARG  22          1HG       ARG  22  -1.543 -12.947  -2.161
  302   1HD   ARG  22          2HD       ARG  22  -4.412 -13.358  -1.368
  303   2HD   ARG  22          1HD       ARG  22  -3.225 -14.615  -1.021
  304    HE   ARG  22           HE       ARG  22  -2.347 -11.977  -0.155
  305   1HH1  ARG  22          1HH2      ARG  22  -2.195 -14.908   1.031
  306   2HH1  ARG  22          2HH2      ARG  22  -2.992 -14.632   2.544
  307   1HH2  ARG  22          1HH1      ARG  22  -4.268 -11.545   1.608
  308   2HH2  ARG  22          2HH1      ARG  22  -4.169 -12.727   2.869
  309    H    GLY  23           H        GLY  23  -5.570 -11.141  -5.061
  310   1HA   GLY  23          2HA       GLY  23  -4.744  -8.907  -6.759
  311   2HA   GLY  23          1HA       GLY  23  -6.402  -9.300  -6.297
  312    H    PHE  24           H        PHE  24  -5.846  -6.644  -6.137
  313    HA   PHE  24           HA       PHE  24  -5.201  -6.182  -3.252
  314   1HB   PHE  24          2HB       PHE  24  -4.904  -3.752  -4.019
  315   2HB   PHE  24          1HB       PHE  24  -3.674  -4.897  -4.545
  316    HD1  PHE  24           HD1      PHE  24  -6.521  -2.812  -5.589
  317    HD2  PHE  24           HD2      PHE  24  -3.580  -5.671  -6.873
  318    HE1  PHE  24           HE1      PHE  24  -7.015  -2.262  -7.958
  319    HE2  PHE  24           HE2      PHE  24  -4.075  -5.122  -9.241
  320    HZ   PHE  24           HZ       PHE  24  -5.793  -3.415  -9.783
  321    H    PHE  25           H        PHE  25  -6.336  -3.887  -2.646
  322    HA   PHE  25           HA       PHE  25  -9.063  -3.645  -3.680
  323   1HB   PHE  25          2HB       PHE  25  -8.786  -5.566  -1.779
  324   2HB   PHE  25          1HB       PHE  25  -9.045  -4.154  -0.754
  325    HD1  PHE  25           HD1      PHE  25 -10.734  -6.753  -2.261
  326    HD2  PHE  25           HD2      PHE  25 -10.921  -2.473  -1.917
  327    HE1  PHE  25           HE1      PHE  25 -13.159  -6.816  -2.783
  328    HE2  PHE  25           HE2      PHE  25 -13.345  -2.537  -2.437
  329    HZ   PHE  25           HZ       PHE  25 -14.465  -4.708  -2.871
  330    H    TYR  26           H        TYR  26  -8.440  -1.455  -4.013
  331    HA   TYR  26           HA       TYR  26  -7.744   0.105  -1.575
  332   1HB   TYR  26          2HB       TYR  26  -6.877   1.787  -3.056
  333   2HB   TYR  26          1HB       TYR  26  -6.312   0.237  -3.678
  334    HD1  TYR  26           HD1      TYR  26  -8.256   3.205  -4.377
  335    HD2  TYR  26           HD2      TYR  26  -7.602  -0.872  -5.571
  336    HE1  TYR  26           HE1      TYR  26  -9.353   3.664  -6.554
  337    HE2  TYR  26           HE2      TYR  26  -8.699  -0.412  -7.746
  338    HH   TYR  26           HH       TYR  26  -9.847   1.075  -8.949
  339    H    THR  27           H        THR  27  -8.734   2.644  -2.429
  340    HA   THR  27           HA       THR  27 -11.551   2.281  -1.778
  341    HB   THR  27           HB       THR  27 -11.589   4.791  -1.882
  342    HG1  THR  27           HG1      THR  27  -9.611   4.521  -3.434
  343   1HG2  THR  27          1HG2      THR  27 -10.007   5.085   0.029
  344   2HG2  THR  27          2HG2      THR  27  -9.379   3.468  -0.291
  345   3HG2  THR  27          3HG2      THR  27 -11.056   3.678   0.210
  346    H    LYS  28           H        LYS  28 -11.435   4.933  -3.845
  347    HA   LYS  28           HA       LYS  28 -12.138   3.315  -6.228
  348   1HB   LYS  28          2HB       LYS  28 -14.323   3.908  -6.292
  349   2HB   LYS  28          1HB       LYS  28 -14.120   4.246  -4.578
  350   1HG   LYS  28          2HG       LYS  28 -13.715   6.311  -6.788
  351   2HG   LYS  28          1HG       LYS  28 -15.198   6.145  -5.860
  352   1HD   LYS  28          2HD       LYS  28 -12.468   6.829  -4.674
  353   2HD   LYS  28          1HD       LYS  28 -13.759   7.989  -4.980
  354   1HE   LYS  28          2HE       LYS  28 -15.006   7.279  -3.203
  355   2HE   LYS  28          1HE       LYS  28 -14.521   5.596  -3.390
  356   1HZ   LYS  28          1HZ       LYS  28 -13.439   7.579  -1.688
  357   2HZ   LYS  28          2HZ       LYS  28 -12.230   6.997  -2.731
  358   3HZ   LYS  28          3HZ       LYS  28 -13.096   5.918  -1.743
  359    HA   PRO  29           HA       PRO  29 -10.111   6.537  -8.413
  360   1HB   PRO  29          2HB       PRO  29 -11.338   6.263 -10.850
  361   2HB   PRO  29          1HB       PRO  29 -10.155   5.104 -10.220
  362   1HG   PRO  29          2HG       PRO  29 -13.107   4.818 -10.470
  363   2HG   PRO  29          1HG       PRO  29 -11.861   3.561 -10.407
  364   1HD   PRO  29          2HD       PRO  29 -13.559   4.376  -8.267
  365   2HD   PRO  29          1HD       PRO  29 -12.161   3.285  -8.155
  366    H    THR  30           H        THR  30 -10.989   8.177 -10.408
  367    HA   THR  30           HA       THR  30 -12.525  10.185  -9.024
  368    HB   THR  30           HB       THR  30 -10.853  10.725 -10.786
  369    HG1  THR  30           HG1      THR  30 -13.532  11.515 -10.979
  370   1HG2  THR  30          1HG2      THR  30 -11.941   8.673 -12.179
  371   2HG2  THR  30          2HG2      THR  30 -11.002   9.960 -12.936
  372   3HG2  THR  30          3HG2      THR  30 -12.763  10.030 -12.945
  Start of MODEL   15
    1   1H    GLY   1          1H        GLY   1  -6.904   9.667   0.923
    2   2H    GLY   1          2H        GLY   1  -8.100   8.591   1.466
    3   3H    GLY   1          3H        GLY   1  -7.441   8.416  -0.090
    4   1HA   GLY   1          1HA       GLY   1  -5.265   8.042   1.162
    5   2HA   GLY   1          2HA       GLY   1  -6.271   7.767   2.617
    6    H    ALA   2           H        ALA   2  -4.429   6.020   2.071
    7    HA   ALA   2           HA       ALA   2  -3.886   3.886   1.239
    8   1HB   ALA   2          1HB       ALA   2  -6.605   4.082   0.777
    9   2HB   ALA   2          2HB       ALA   2  -5.626   2.645   0.489
   10   3HB   ALA   2          3HB       ALA   2  -5.960   3.762  -0.834
   11    H    VAL   3           H        VAL   3  -3.242   6.598  -0.079
   12    HA   VAL   3           HA       VAL   3  -1.765   5.459  -2.312
   13    HB   VAL   3           HB       VAL   3  -2.978   7.466  -3.743
   14   1HG1  VAL   3          1HG1      VAL   3  -3.934   5.690  -5.040
   15   2HG1  VAL   3          2HG1      VAL   3  -3.971   4.609  -3.647
   16   3HG1  VAL   3          3HG1      VAL   3  -2.428   5.070  -4.365
   17   1HG2  VAL   3          1HG2      VAL   3  -4.667   7.358  -1.669
   18   2HG2  VAL   3          2HG2      VAL   3  -5.321   6.005  -2.592
   19   3HG2  VAL   3          3HG2      VAL   3  -5.246   7.612  -3.315
   20    H    GLU   4           H        GLU   4  -3.059   8.755  -1.758
   21    HA   GLU   4           HA       GLU   4  -0.610  10.072  -2.233
   22   1HB   GLU   4          2HB       GLU   4  -3.045  10.799  -0.630
   23   2HB   GLU   4          1HB       GLU   4  -1.630  11.854  -0.625
   24   1HG   GLU   4          2HG       GLU   4  -2.188  11.053  -3.327
   25   2HG   GLU   4          1HG       GLU   4  -3.662  11.699  -2.602
   26    H    GLN   5           H        GLN   5   1.202   9.335  -1.216
   27    HA   GLN   5           HA       GLN   5   2.019  10.090   1.294
   28   1HB   GLN   5          2HB       GLN   5   0.106   7.872   1.464
   29   2HB   GLN   5          1HB       GLN   5   1.645   7.508   2.244
   30   1HG   GLN   5          2HG       GLN   5   0.463  10.197   2.757
   31   2HG   GLN   5          1HG       GLN   5  -0.315   8.813   3.526
   32   1HE2  GLN   5          1HE2      GLN   5   0.479   9.503   5.662
   33   2HE2  GLN   5          2HE2      GLN   5   2.110   9.309   6.088
   34    H    CYS   6           H        CYS   6   1.932   7.574  -1.115
   35    HA   CYS   6           HA       CYS   6   4.750   6.852  -0.485
   36   1HB   CYS   6          2HB       CYS   6   2.854   5.481  -2.414
   37   2HB   CYS   6          1HB       CYS   6   4.403   4.875  -1.840
   38    H    CYS   7           H        CYS   7   2.909   8.830  -2.540
   39    HA   CYS   7           HA       CYS   7   4.896   8.638  -4.732
   40   1HB   CYS   7          2HB       CYS   7   3.374  10.380  -5.827
   41   2HB   CYS   7          1HB       CYS   7   2.718   8.757  -5.607
   42    H    THR   8           H        THR   8   4.107  10.608  -2.014
   43    HA   THR   8           HA       THR   8   5.924  12.763  -2.984
   44    HB   THR   8           HB       THR   8   5.166  13.929  -0.864
   45    HG1  THR   8           HG1      THR   8   4.445  11.661  -0.117
   46   1HG2  THR   8          1HG2      THR   8   3.916  13.694  -3.315
   47   2HG2  THR   8          2HG2      THR   8   3.497  14.864  -2.064
   48   3HG2  THR   8          3HG2      THR   8   2.613  13.342  -2.179
   49    H    SER   9           H        SER   9   6.632   9.964  -2.089
   50    HA   SER   9           HA       SER   9   9.069  10.438  -0.791
   51   1HB   SER   9          2HB       SER   9   7.133  10.954   1.045
   52   2HB   SER   9          1HB       SER   9   7.300   9.216   1.271
   53    HG   SER   9           HG       SER   9   8.967  11.239   1.980
   54    H    ILE  10           H        ILE  10   8.594   7.913   0.946
   55    HA   ILE  10           HA       ILE  10   7.878   5.981  -1.163
   56    HB   ILE  10           HB       ILE  10  10.385   5.173   0.090
   57   1HG1  ILE  10          2HG1      ILE  10  10.631   7.744  -0.176
   58   2HG1  ILE  10          1HG1      ILE  10  11.875   6.729  -0.897
   59   1HG2  ILE  10          1HG2      ILE  10  10.859   4.960  -2.475
   60   2HG2  ILE  10          2HG2      ILE  10   9.142   5.324  -2.639
   61   3HG2  ILE  10          3HG2      ILE  10   9.660   3.908  -1.728
   62   1HD1  ILE  10          1HD1      ILE  10   9.722   7.087  -2.786
   63   2HD1  ILE  10          2HD1      ILE  10  11.416   7.547  -2.941
   64   3HD1  ILE  10          3HD1      ILE  10  10.265   8.658  -2.202
   65    H    CYS  11           H        CYS  11   6.304   5.006   0.023
   66    HA   CYS  11           HA       CYS  11   6.409   4.545   2.838
   67   1HB   CYS  11          2HB       CYS  11   4.869   3.008   0.719
   68   2HB   CYS  11          1HB       CYS  11   4.519   3.019   2.449
   69    H    SER  12           H        SER  12   5.807   1.499   1.447
   70    HA   SER  12           HA       SER  12   8.576   0.572   1.435
   71   1HB   SER  12          2HB       SER  12   6.744  -0.030   3.758
   72   2HB   SER  12          1HB       SER  12   8.081  -1.094   3.332
   73    HG   SER  12           HG       SER  12   8.100   1.287   4.616
   74    H    LEU  13           H        LEU  13   8.449  -0.773  -0.316
   75    HA   LEU  13           HA       LEU  13   6.183  -1.928  -1.444
   76   1HB   LEU  13          2HB       LEU  13   8.768  -2.060  -2.109
   77   2HB   LEU  13          1HB       LEU  13   8.623  -3.650  -1.353
   78    HG   LEU  13           HG       LEU  13   6.367  -3.648  -2.829
   79   1HD1  LEU  13          1HD1      LEU  13   7.781  -1.388  -3.773
   80   2HD1  LEU  13          2HD1      LEU  13   6.349  -2.131  -4.488
   81   3HD1  LEU  13          3HD1      LEU  13   7.957  -2.633  -5.009
   82   1HD2  LEU  13          1HD2      LEU  13   9.176  -4.511  -3.415
   83   2HD2  LEU  13          2HD2      LEU  13   7.950  -4.714  -4.666
   84   3HD2  LEU  13          3HD2      LEU  13   7.748  -5.496  -3.098
   85    H    TYR  14           H        TYR  14   7.884  -2.892   1.448
   86    HA   TYR  14           HA       TYR  14   6.732  -5.522   1.699
   87   1HB   TYR  14          2HB       TYR  14   8.159  -3.610   3.490
   88   2HB   TYR  14          1HB       TYR  14   7.169  -4.844   4.271
   89    HD1  TYR  14           HD1      TYR  14  10.399  -4.188   3.226
   90    HD2  TYR  14           HD2      TYR  14   7.401  -7.256   2.956
   91    HE1  TYR  14           HE1      TYR  14  12.166  -5.880   2.812
   92    HE2  TYR  14           HE2      TYR  14   9.168  -8.947   2.542
   93    HH   TYR  14           HH       TYR  14  12.553  -8.003   2.125
   94    H    GLN  15           H        GLN  15   5.868  -2.376   3.189
   95    HA   GLN  15           HA       GLN  15   3.422  -3.345   4.355
   96   1HB   GLN  15          2HB       GLN  15   4.260  -0.536   3.566
   97   2HB   GLN  15          1HB       GLN  15   2.826  -0.917   4.517
   98   1HG   GLN  15          2HG       GLN  15   5.319  -2.147   5.512
   99   2HG   GLN  15          1HG       GLN  15   5.281  -0.384   5.598
  100   1HE2  GLN  15          1HE2      GLN  15   4.688   0.114   7.723
  101   2HE2  GLN  15          2HE2      GLN  15   3.378  -0.583   8.550
  102    H    LEU  16           H        LEU  16   4.332  -2.141   1.227
  103    HA   LEU  16           HA       LEU  16   1.773  -1.546   0.136
  104   1HB   LEU  16          2HB       LEU  16   4.413  -1.682  -0.777
  105   2HB   LEU  16          1HB       LEU  16   3.557  -2.848  -1.771
  106    HG   LEU  16           HG       LEU  16   3.100   0.117  -1.503
  107   1HD1  LEU  16          1HD1      LEU  16   4.537  -0.614  -3.315
  108   2HD1  LEU  16          2HD1      LEU  16   2.994  -0.112  -4.004
  109   3HD1  LEU  16          3HD1      LEU  16   3.358  -1.826  -3.815
  110   1HD2  LEU  16          1HD2      LEU  16   0.875  -0.680  -1.180
  111   2HD2  LEU  16          2HD2      LEU  16   1.098  -1.994  -2.334
  112   3HD2  LEU  16          3HD2      LEU  16   0.994  -0.328  -2.901
  113    H    GLU  17           H        GLU  17   3.404  -4.567   0.802
  114    HA   GLU  17           HA       GLU  17   1.695  -6.256  -0.792
  115   1HB   GLU  17          2HB       GLU  17   3.801  -6.595   1.202
  116   2HB   GLU  17          1HB       GLU  17   2.501  -7.767   1.417
  117   1HG   GLU  17          2HG       GLU  17   3.828  -7.217  -1.250
  118   2HG   GLU  17          1HG       GLU  17   4.325  -8.515  -0.165
  119    H    ASN  18           H        ASN  18   1.403  -4.655   2.254
  120    HA   ASN  18           HA       ASN  18  -0.847  -6.266   3.202
  121   1HB   ASN  18          2HB       ASN  18   0.477  -3.716   4.127
  122   2HB   ASN  18          1HB       ASN  18  -1.033  -4.273   4.847
  123   1HD2  ASN  18          1HD2      ASN  18  -0.856  -6.870   5.301
  124   2HD2  ASN  18          2HD2      ASN  18   0.551  -7.316   6.139
  125    H    TYR  19           H        TYR  19  -0.562  -4.130   0.706
  126    HA   TYR  19           HA       TYR  19  -3.228  -2.892   1.163
  127   1HB   TYR  19          2HB       TYR  19  -0.798  -2.193  -0.370
  128   2HB   TYR  19          1HB       TYR  19  -2.320  -1.857  -1.198
  129    HD1  TYR  19           HD1      TYR  19   0.024  -0.171   0.416
  130    HD2  TYR  19           HD2      TYR  19  -4.118  -1.145   0.993
  131    HE1  TYR  19           HE1      TYR  19  -0.251   1.849   1.821
  132    HE2  TYR  19           HE2      TYR  19  -4.399   0.875   2.399
  133    HH   TYR  19           HH       TYR  19  -1.777   3.224   2.787
  134    H    CYS  20           H        CYS  20  -2.033  -5.683   0.043
  135    HA   CYS  20           HA       CYS  20  -3.549  -5.878  -2.462
  136   1HB   CYS  20          2HB       CYS  20  -1.884  -7.863  -0.892
  137   2HB   CYS  20          1HB       CYS  20  -2.580  -8.152  -2.473
  138    H    ASN  21           H        ASN  21  -4.452  -8.473  -2.317
  139    HA   ASN  21           HA       ASN  21  -6.860  -8.184  -0.709
  140   1HB   ASN  21          2HB       ASN  21  -5.818 -10.041  -2.755
  141   2HB   ASN  21          1HB       ASN  21  -6.863 -10.791  -1.550
  142   1HD2  ASN  21          1HD2      ASN  21  -7.326  -7.390  -2.321
  143   2HD2  ASN  21          2HD2      ASN  21  -8.765  -7.590  -3.200
  144   1H    PHE   1          1H        PHE   1   9.247  -2.233 -11.640
  145   2H    PHE   1          2H        PHE   1   8.557  -0.702 -11.388
  146   3H    PHE   1          3H        PHE   1   7.705  -2.105 -10.947
  147    HA   PHE   1           HA       PHE   1   8.489  -1.713  -8.903
  148   1HB   PHE   1          2HB       PHE   1   9.780  -3.694  -9.751
  149   2HB   PHE   1          1HB       PHE   1  11.095  -2.599 -10.179
  150    HD1  PHE   1           HD1      PHE   1   9.693  -4.613  -7.599
  151    HD2  PHE   1           HD2      PHE   1  11.954  -1.020  -8.273
  152    HE1  PHE   1           HE1      PHE   1  10.522  -4.695  -5.261
  153    HE2  PHE   1           HE2      PHE   1  12.782  -1.103  -5.935
  154    HZ   PHE   1           HZ       PHE   1  12.068  -2.941  -4.429
  155    H    VAL   2           H        VAL   2   8.782   0.253  -7.976
  156    HA   VAL   2           HA       VAL   2  11.217   1.800  -8.657
  157    HB   VAL   2           HB       VAL   2   8.681   3.365  -8.458
  158   1HG1  VAL   2          1HG1      VAL   2  11.290   4.004  -8.895
  159   2HG1  VAL   2          2HG1      VAL   2   9.942   4.985  -9.467
  160   3HG1  VAL   2          3HG1      VAL   2  10.723   3.837 -10.555
  161   1HG2  VAL   2          1HG2      VAL   2   7.946   1.698 -10.025
  162   2HG2  VAL   2          2HG2      VAL   2   9.504   1.699 -10.851
  163   3HG2  VAL   2          3HG2      VAL   2   8.435   3.096 -10.983
  164    H    ASN   3           H        ASN   3  11.385   3.734  -7.071
  165    HA   ASN   3           HA       ASN   3   9.989   3.286  -4.504
  166   1HB   ASN   3          2HB       ASN   3  12.970   3.531  -4.370
  167   2HB   ASN   3          1HB       ASN   3  11.863   2.725  -3.257
  168   1HD2  ASN   3          1HD2      ASN   3  13.659   2.337  -6.287
  169   2HD2  ASN   3          2HD2      ASN   3  13.405   0.664  -6.428
  170    H    GLN   4           H        GLN   4   9.634   5.405  -6.220
  171    HA   GLN   4           HA       GLN   4  10.994   7.613  -4.747
  172   1HB   GLN   4          2HB       GLN   4  10.823   7.142  -7.701
  173   2HB   GLN   4          1HB       GLN   4  10.793   8.802  -7.101
  174   1HG   GLN   4          2HG       GLN   4  12.928   8.621  -6.126
  175   2HG   GLN   4          1HG       GLN   4  12.883   6.858  -6.136
  176   1HE2  GLN   4          1HE2      GLN   4  15.115   7.408  -7.278
  177   2HE2  GLN   4          2HE2      GLN   4  15.059   7.537  -8.970
  178    H    HIS   5           H        HIS   5   8.316   6.910  -7.055
  179    HA   HIS   5           HA       HIS   5   6.575   8.565  -5.311
  180   1HB   HIS   5          2HB       HIS   5   6.776   8.960  -8.308
  181   2HB   HIS   5          1HB       HIS   5   5.687   9.818  -7.219
  182    HD2  HIS   5           HD2      HIS   5   8.767  10.758  -8.887
  183    HE1  HIS   5           HE1      HIS   5   9.342  12.258  -4.975
  184    HE2  HIS   5           HE2      HIS   5  10.170  12.356  -7.387
  185    H    LEU   6           H        LEU   6   5.264   6.793  -4.727
  186    HA   LEU   6           HA       LEU   6   3.950   5.323  -6.979
  187   1HB   LEU   6          2HB       LEU   6   5.294   4.367  -4.705
  188   2HB   LEU   6          1HB       LEU   6   3.580   4.105  -4.381
  189    HG   LEU   6           HG       LEU   6   3.350   3.006  -6.593
  190   1HD1  LEU   6          1HD1      LEU   6   5.939   4.208  -6.942
  191   2HD1  LEU   6          2HD1      LEU   6   4.927   3.403  -8.142
  192   3HD1  LEU   6          3HD1      LEU   6   6.068   2.466  -7.177
  193   1HD2  LEU   6          1HD2      LEU   6   5.065   2.043  -4.395
  194   2HD2  LEU   6          2HD2      LEU   6   5.300   1.188  -5.919
  195   3HD2  LEU   6          3HD2      LEU   6   3.699   1.252  -5.183
  196    H    CYS   7           H        CYS   7   1.987   6.269  -7.362
  197    HA   CYS   7           HA       CYS   7   0.118   6.444  -5.093
  198   1HB   CYS   7          2HB       CYS   7   1.155   8.802  -6.491
  199   2HB   CYS   7          1HB       CYS   7  -0.605   8.716  -6.459
  200    H    GLY   8           H        GLY   8  -2.106   6.498  -5.760
  201   1HA   GLY   8          2HA       GLY   8  -3.787   5.418  -7.001
  202   2HA   GLY   8          1HA       GLY   8  -3.298   6.614  -8.197
  203    H    SER   9           H        SER   9  -2.404   5.838 -10.134
  204    HA   SER   9           HA       SER   9  -2.492   3.036 -10.674
  205   1HB   SER   9          2HB       SER   9  -2.553   3.932 -12.733
  206   2HB   SER   9          1HB       SER   9  -1.975   5.479 -12.124
  207    HG   SER   9           HG       SER   9  -0.502   4.607 -13.606
  208    H    ASP  10           H        ASP  10   0.401   5.169 -10.489
  209    HA   ASP  10           HA       ASP  10   2.341   3.210 -10.824
  210   1HB   ASP  10          2HB       ASP  10   2.816   5.184  -8.618
  211   2HB   ASP  10          1HB       ASP  10   3.895   4.671  -9.910
  212    H    LEU  11           H        LEU  11   0.331   3.740  -7.977
  213    HA   LEU  11           HA       LEU  11   1.897   1.843  -6.378
  214   1HB   LEU  11          2HB       LEU  11  -0.421   3.602  -5.940
  215   2HB   LEU  11          1HB       LEU  11  -0.508   2.067  -5.094
  216    HG   LEU  11           HG       LEU  11   1.857   3.938  -5.006
  217   1HD1  LEU  11          1HD1      LEU  11   1.124   4.600  -2.845
  218   2HD1  LEU  11          2HD1      LEU  11  -0.070   3.303  -2.770
  219   3HD1  LEU  11          3HD1      LEU  11  -0.322   4.673  -3.852
  220   1HD2  LEU  11          1HD2      LEU  11   2.938   2.321  -3.822
  221   2HD2  LEU  11          2HD2      LEU  11   1.793   1.231  -4.601
  222   3HD2  LEU  11          3HD2      LEU  11   1.471   1.834  -2.977
  223    H    VAL  12           H        VAL  12  -0.721   1.737  -8.629
  224    HA   VAL  12           HA       VAL  12  -1.767  -0.814  -7.699
  225    HB   VAL  12           HB       VAL  12  -2.190   0.880 -10.157
  226   1HG1  VAL  12          1HG1      VAL  12  -2.227  -1.406 -10.983
  227   2HG1  VAL  12          2HG1      VAL  12  -3.888  -0.824 -10.870
  228   3HG1  VAL  12          3HG1      VAL  12  -3.250  -1.914  -9.639
  229   1HG2  VAL  12          1HG2      VAL  12  -3.532   0.367  -7.608
  230   2HG2  VAL  12          2HG2      VAL  12  -4.615   0.210  -8.992
  231   3HG2  VAL  12          3HG2      VAL  12  -3.730   1.713  -8.731
  232    H    GLU  13           H        GLU  13   0.095   0.230 -10.515
  233    HA   GLU  13           HA       GLU  13   0.624  -2.357 -11.560
  234   1HB   GLU  13          2HB       GLU  13   2.559  -0.047 -11.750
  235   2HB   GLU  13          1HB       GLU  13   2.204  -1.285 -12.958
  236   1HG   GLU  13          2HG       GLU  13  -0.235  -0.341 -12.839
  237   2HG   GLU  13          1HG       GLU  13   0.536   1.084 -12.142
  238    H    ALA  14           H        ALA  14   2.117  -0.544  -8.951
  239    HA   ALA  14           HA       ALA  14   4.328  -2.486  -8.694
  240   1HB   ALA  14          1HB       ALA  14   5.290  -0.838  -7.467
  241   2HB   ALA  14          2HB       ALA  14   3.904  -0.777  -6.377
  242   3HB   ALA  14          3HB       ALA  14   3.905   0.178  -7.859
  243    H    LEU  15           H        LEU  15   1.285  -1.606  -7.106
  244    HA   LEU  15           HA       LEU  15   1.376  -3.368  -4.899
  245   1HB   LEU  15          2HB       LEU  15  -0.722  -1.984  -6.438
  246   2HB   LEU  15          1HB       LEU  15  -1.250  -3.503  -5.730
  247    HG   LEU  15           HG       LEU  15   0.269  -1.495  -4.095
  248   1HD1  LEU  15          1HD1      LEU  15  -2.591  -1.460  -4.943
  249   2HD1  LEU  15          2HD1      LEU  15  -1.515  -0.110  -4.578
  250   3HD1  LEU  15          3HD1      LEU  15  -2.230  -1.050  -3.267
  251   1HD2  LEU  15          1HD2      LEU  15  -1.751  -3.649  -3.417
  252   2HD2  LEU  15          2HD2      LEU  15  -0.885  -2.646  -2.254
  253   3HD2  LEU  15          3HD2      LEU  15  -0.002  -3.804  -3.246
  254    H    TYR  16           H        TYR  16   0.123  -3.909  -8.178
  255    HA   TYR  16           HA       TYR  16  -0.523  -6.670  -7.837
  256   1HB   TYR  16          2HB       TYR  16  -1.455  -5.955  -9.810
  257   2HB   TYR  16          1HB       TYR  16  -0.172  -4.790 -10.110
  258    HD1  TYR  16           HD1      TYR  16  -0.733  -8.503 -10.016
  259    HD2  TYR  16           HD2      TYR  16   1.344  -5.210 -11.834
  260    HE1  TYR  16           HE1      TYR  16   0.296 -10.056 -11.655
  261    HE2  TYR  16           HE2      TYR  16   2.374  -6.762 -13.474
  262    HH   TYR  16           HH       TYR  16   2.099 -10.223 -13.148
  263    H    LEU  17           H        LEU  17   2.454  -5.027  -8.848
  264    HA   LEU  17           HA       LEU  17   3.976  -7.410  -9.410
  265   1HB   LEU  17          2HB       LEU  17   4.457  -4.744  -9.697
  266   2HB   LEU  17          1HB       LEU  17   5.356  -5.058  -8.210
  267    HG   LEU  17           HG       LEU  17   6.287  -7.114  -9.533
  268   1HD1  LEU  17          1HD1      LEU  17   5.268  -5.281 -11.716
  269   2HD1  LEU  17          2HD1      LEU  17   4.890  -6.988 -11.487
  270   3HD1  LEU  17          3HD1      LEU  17   6.510  -6.505 -11.988
  271   1HD2  LEU  17          1HD2      LEU  17   7.454  -4.692 -10.719
  272   2HD2  LEU  17          2HD2      LEU  17   8.191  -5.884  -9.648
  273   3HD2  LEU  17          3HD2      LEU  17   7.218  -4.579  -8.974
  274    H    VAL  18           H        VAL  18   3.045  -5.603  -6.657
  275    HA   VAL  18           HA       VAL  18   4.725  -6.923  -4.699
  276    HB   VAL  18           HB       VAL  18   2.720  -4.776  -4.927
  277   1HG1  VAL  18          1HG1      VAL  18   1.411  -5.613  -3.282
  278   2HG1  VAL  18          2HG1      VAL  18   2.658  -4.896  -2.262
  279   3HG1  VAL  18          3HG1      VAL  18   2.692  -6.624  -2.616
  280   1HG2  VAL  18          1HG2      VAL  18   4.745  -3.858  -4.605
  281   2HG2  VAL  18          2HG2      VAL  18   5.375  -5.286  -3.782
  282   3HG2  VAL  18          3HG2      VAL  18   4.382  -4.125  -2.900
  283    H    CYS  19           H        CYS  19   1.263  -6.772  -5.280
  284    HA   CYS  19           HA       CYS  19   0.365  -8.789  -3.538
  285   1HB   CYS  19          2HB       CYS  19  -0.765  -8.111  -6.272
  286   2HB   CYS  19          1HB       CYS  19  -1.640  -8.849  -4.938
  287    H    GLY  20           H        GLY  20   2.056  -9.039  -6.548
  288   1HA   GLY  20          2HA       GLY  20   2.661 -10.894  -7.849
  289   2HA   GLY  20          1HA       GLY  20   2.743 -11.738  -6.303
  290    H    GLU  21           H        GLU  21   0.059 -10.442  -8.295
  291    HA   GLU  21           HA       GLU  21  -1.713 -11.631  -9.326
  292   1HB   GLU  21          2HB       GLU  21  -0.035 -13.593  -9.371
  293   2HB   GLU  21          1HB       GLU  21  -0.835 -14.136  -7.895
  294   1HG   GLU  21          2HG       GLU  21  -2.732 -14.752  -8.990
  295   2HG   GLU  21          1HG       GLU  21  -2.662 -13.372 -10.087
  296    H    ARG  22           H        ARG  22  -0.955 -12.253  -5.915
  297    HA   ARG  22           HA       ARG  22  -3.328 -13.165  -4.880
  298   1HB   ARG  22          2HB       ARG  22  -1.121 -12.103  -3.751
  299   2HB   ARG  22          1HB       ARG  22  -2.256 -10.780  -3.472
  300   1HG   ARG  22          2HG       ARG  22  -3.864 -12.663  -2.639
  301   2HG   ARG  22          1HG       ARG  22  -2.390 -13.621  -2.487
  302   1HD   ARG  22          2HD       ARG  22  -1.405 -11.961  -1.008
  303   2HD   ARG  22          1HD       ARG  22  -2.780 -10.883  -1.244
  304    HE   ARG  22           HE       ARG  22  -4.131 -12.843  -0.175
  305   1HH1  ARG  22          1HH2      ARG  22  -1.725 -14.536   0.361
  306   2HH1  ARG  22          2HH2      ARG  22  -1.332 -14.114   1.994
  307   1HH2  ARG  22          1HH1      ARG  22  -3.249 -11.222   1.989
  308   2HH2  ARG  22          2HH1      ARG  22  -2.196 -12.238   2.917
  309    H    GLY  23           H        GLY  23  -2.819 -10.048  -6.355
  310   1HA   GLY  23          2HA       GLY  23  -4.496  -8.578  -7.158
  311   2HA   GLY  23          1HA       GLY  23  -5.710  -9.615  -6.409
  312    H    PHE  24           H        PHE  24  -5.914  -6.827  -6.129
  313    HA   PHE  24           HA       PHE  24  -5.269  -6.524  -3.223
  314   1HB   PHE  24          2HB       PHE  24  -5.206  -3.988  -3.761
  315   2HB   PHE  24          1HB       PHE  24  -3.806  -4.956  -4.206
  316    HD1  PHE  24           HD1      PHE  24  -6.087  -2.536  -5.381
  317    HD2  PHE  24           HD2      PHE  24  -3.990  -6.076  -6.624
  318    HE1  PHE  24           HE1      PHE  24  -6.316  -1.851  -7.754
  319    HE2  PHE  24           HE2      PHE  24  -4.229  -5.393  -8.994
  320    HZ   PHE  24           HZ       PHE  24  -5.395  -3.279  -9.559
  321    H    PHE  25           H        PHE  25  -6.693  -4.386  -2.513
  322    HA   PHE  25           HA       PHE  25  -9.477  -5.219  -3.137
  323   1HB   PHE  25          2HB       PHE  25 -10.119  -4.301  -1.050
  324   2HB   PHE  25          1HB       PHE  25  -8.561  -5.054  -0.728
  325    HD1  PHE  25           HD1      PHE  25 -10.466  -2.041  -0.534
  326    HD2  PHE  25           HD2      PHE  25  -6.449  -3.519  -0.934
  327    HE1  PHE  25           HE1      PHE  25  -9.583   0.140   0.250
  328    HE2  PHE  25           HE2      PHE  25  -5.570  -1.340  -0.151
  329    HZ   PHE  25           HZ       PHE  25  -7.135   0.491   0.443
  330    H    TYR  26           H        TYR  26  -8.420  -3.861  -5.213
  331    HA   TYR  26           HA       TYR  26 -10.153  -1.604  -5.512
  332   1HB   TYR  26          2HB       TYR  26  -8.757  -0.341  -4.079
  333   2HB   TYR  26          1HB       TYR  26  -7.289  -1.079  -4.711
  334    HD1  TYR  26           HD1      TYR  26 -10.236   0.853  -6.031
  335    HD2  TYR  26           HD2      TYR  26  -5.983   0.240  -6.093
  336    HE1  TYR  26           HE1      TYR  26  -9.991   2.704  -7.666
  337    HE2  TYR  26           HE2      TYR  26  -5.738   2.090  -7.726
  338    HH   TYR  26           HH       TYR  26  -8.361   3.411  -9.411
  339    H    THR  27           H        THR  27  -9.245  -4.022  -6.904
  340    HA   THR  27           HA       THR  27  -7.599  -3.160  -9.155
  341    HB   THR  27           HB       THR  27  -7.649  -5.521  -8.354
  342    HG1  THR  27           HG1      THR  27  -7.223  -6.074 -10.326
  343   1HG2  THR  27          1HG2      THR  27 -10.338  -5.780  -9.677
  344   2HG2  THR  27          2HG2      THR  27 -10.222  -5.343  -7.973
  345   3HG2  THR  27          3HG2      THR  27  -9.556  -6.874  -8.537
  346    H    LYS  28           H        LYS  28  -8.292  -2.462 -11.135
  347    HA   LYS  28           HA       LYS  28 -11.225  -2.015 -11.455
  348   1HB   LYS  28          2HB       LYS  28  -8.869  -0.688 -12.842
  349   2HB   LYS  28          1HB       LYS  28 -10.565  -0.252 -13.062
  350   1HG   LYS  28          2HG       LYS  28  -9.176  -0.199 -10.353
  351   2HG   LYS  28          1HG       LYS  28  -9.284   1.212 -11.398
  352   1HD   LYS  28          2HD       LYS  28 -11.543  -0.257 -10.001
  353   2HD   LYS  28          1HD       LYS  28 -11.119   1.452  -9.888
  354   1HE   LYS  28          2HE       LYS  28 -12.822   1.671 -11.400
  355   2HE   LYS  28          1HE       LYS  28 -11.546   1.279 -12.554
  356   1HZ   LYS  28          1HZ       LYS  28 -12.361  -0.779 -12.896
  357   2HZ   LYS  28          2HZ       LYS  28 -13.820  -0.066 -12.400
  358   3HZ   LYS  28          3HZ       LYS  28 -12.895  -0.972 -11.298
  359    HA   PRO  29           HA       PRO  29 -10.705  -5.211 -14.577
  360   1HB   PRO  29          2HB       PRO  29 -13.402  -5.542 -15.013
  361   2HB   PRO  29          1HB       PRO  29 -12.523  -6.297 -13.672
  362   1HG   PRO  29          2HG       PRO  29 -14.384  -3.963 -13.622
  363   2HG   PRO  29          1HG       PRO  29 -14.013  -5.130 -12.342
  364   1HD   PRO  29          2HD       PRO  29 -12.981  -2.510 -12.521
  365   2HD   PRO  29          1HD       PRO  29 -12.345  -3.806 -11.485
  366    H    THR  30           H        THR  30 -11.410  -5.386 -16.902
  367    HA   THR  30           HA       THR  30 -11.355  -4.328 -19.012
  368    HB   THR  30           HB       THR  30 -13.774  -4.569 -18.538
  369    HG1  THR  30           HG1      THR  30 -14.378  -2.631 -19.840
  370   1HG2  THR  30          1HG2      THR  30 -13.962  -3.270 -16.510
  371   2HG2  THR  30          2HG2      THR  30 -14.993  -2.523 -17.730
  372   3HG2  THR  30          3HG2      THR  30 -13.426  -1.810 -17.341