*HEADER    SIGNALING PROTEIN/NEUROPEPTIDE          20-SEP-12   2LYW              
*TITLE     INTERMOLECULAR INTERACTIONS BETWEEN NEUROTENSIN AND THE THIRD         
*TITLE    2 EXTRACELLULAR LOOP OF HUMAN NEUROTENSIN 1 RECEPTOR                   
*COMPND    MOL_ID: 1;                                                            
*COMPND   2 MOLECULE: NEUROTENSIN RECEPTOR TYPE 1;                               
*COMPND   3 CHAIN: A;                                                            
*COMPND   4 FRAGMENT: EXTRACELLULAR DOMAIN RESIDUES 321-344;                     
*COMPND   5 SYNONYM: NT-R-1, NTR1, HIGH-AFFINITY LEVOCABASTINE-INSENSITIVE       
*COMPND   6 NEUROTENSIN RECEPTOR, NTRH;                                          
*COMPND   7 ENGINEERED: YES;                                                     
*COMPND   8 MUTATION: YES;                                                       
*COMPND   9 MOL_ID: 2;                                                           
*COMPND  10 MOLECULE: NEUROTENSIN;                                               
*COMPND  11 CHAIN: B;                                                            
*COMPND  12 SYNONYM: NT;                                                         
*COMPND  13 ENGINEERED: YES                                                      
*SOURCE    MOL_ID: 1;                                                            
*SOURCE   2 SYNTHETIC: YES;                                                      
*SOURCE   3 ORGANISM_SCIENTIFIC: HOMO SAPIENS;                                   
*SOURCE   4 ORGANISM_COMMON: HUMAN;                                              
*SOURCE   5 ORGANISM_TAXID: 9606;                                                
*SOURCE   6 MOL_ID: 2;                                                           
*SOURCE   7 SYNTHETIC: YES;                                                      
*SOURCE   8 ORGANISM_SCIENTIFIC: HOMO SAPIENS;                                   
*SOURCE   9 ORGANISM_COMMON: HUMAN;                                              
*SOURCE  10 ORGANISM_TAXID: 9606                                                 
*KEYWDS    INTERACTION LIGAND/RECEPTOR, NTS1, SIGNALING PROTEIN-NEUROPEPTIDE     
*KEYWDS   2 COMPLEX                                                              
*EXPDTA    SOLUTION NMR                                                          
*NUMMDL    10                                                                    
*AUTHOR    J.MONTI, G.DA COSTA                                                   
*REVDAT   1   12-DEC-12 2LYW    0                                                


  !BIOSYM restraint 1
!
#remote_prochiral_center
!
#chiral
1:VALN_1:CA        S
1:ARG+_2:CA        S
1:ARG+_3:CA        S
1:LEU_4:CA         S
1:MET_5:CA         S
1:PHE_6:CA         S
1:SER_7:CA         S
1:TYR_8:CA         S
1:ILE_9:CA         S
1:ILE_9:CB         S
1:SER_10:CA        S
1:ASP-_11:CA       S
1:GLU-_12:CA       S
1:GLN_13:CA        S
1:TRP_14:CA        S
1:THR_15:CA        S
1:THR_15:CB        R
1:PRO_16:CA        S
1:PHE_17:CA        S
1:LEU_18:CA        S
1:TYR_19:CA        S
1:ASP-_20:CA       S
1:PHE_21:CA        S
1:TYR_22:CA        S
1:HIS+_23:CA       S
1:TYRC_24:CA       S
1:PGLU_1B:CA       S
1:LEU_2B:CA        S
1:TYR_3B:CA        S
1:GLU-_4B:CA       S
1:ASN_5B:CA        S
1:LYS+_6B:CA       S
1:PRO_7B:CA        S
1:ARG+_8B:CA       S
1:ARG+_9B:CA       S
1:PRO_10B:CA       S
1:TYR_11B:CA       S
1:ILE_12B:CA       S
1:ILE_12B:CB       S
1:LEUC_13B:CA      S
!
#NOE_distance
!
1:PGLU_1B:HA       1:PGLU_1B:HB*      -1.000  7.000  6.000 30.00 30.00 1000.000  0.00
1:PGLU_1B:HA       1:PGLU_1B:HG*      -1.000  7.000  6.000 30.00 30.00 1000.000  0.00
1:PGLU_1B:HA       1:PGLU_1B:HN       -1.000  6.000  6.000 30.00 30.00 1000.000  0.00
1:PGLU_1B:HB*      1:PGLU_1B:HG*      -1.000  5.300  3.300 30.00 30.00 1000.000  0.00
1:PGLU_1B:HG*      1:PGLU_1B:HN       -1.000  7.000  6.000 30.00 30.00 1000.000  0.00
1:LEU_2B:HA        1:LEU_2B:HB*       -1.000  7.000  6.000 30.00 30.00 1000.000  0.00
1:LEU_2B:HA        1:LEU_2B:HG        -1.000  6.000  6.000 30.00 30.00 1000.000  0.00
1:LEU_2B:HA        1:LEU_2B:HD*       -1.000  8.000  6.000 30.00 30.00 1000.000  0.00
1:LEU_2B:HA        1:LEU_2B:HN        -1.000  5.000  5.000 30.00 30.00 1000.000  0.00
1:LEU_2B:HB*       1:LEU_2B:HD*       -1.000  9.000  6.000 30.00 30.00 1000.000  0.00
1:LEU_2B:HB*       1:LEU_2B:HN        -1.000  7.000  6.000 30.00 30.00 1000.000  0.00
1:LEU_2B:HG        1:LEU_2B:HD*       -1.000  8.000  6.000 30.00 30.00 1000.000  0.00
1:LEU_2B:HG        1:LEU_2B:HN        -1.000  6.000  6.000 30.00 30.00 1000.000  0.00
1:TYR_3B:HA        1:TYR_3B:HB*       -1.000  4.300  3.300 30.00 30.00 1000.000  0.00
1:TYR_3B:HA        1:TYR_3B:HD*       -1.000  8.200  6.000 30.00 30.00 1000.000  0.00
1:TYR_3B:HA        1:TYR_3B:HE*       -1.000  8.200  6.000 30.00 30.00 1000.000  0.00
1:TYR_3B:HA        1:TYR_3B:HN        -1.000  3.300  3.300 30.00 30.00 1000.000  0.00
1:TYR_3B:HB*       1:TYR_3B:HD*       -1.000  8.200  5.000 30.00 30.00 1000.000  0.00
1:TYR_3B:HB*       1:TYR_3B:HE*       -1.000  8.200  6.000 30.00 30.00 1000.000  0.00
1:TYR_3B:HB*       1:TYR_3B:HN        -1.000  6.000  5.000 30.00 30.00 1000.000  0.00
1:TYR_3B:HD*       1:TYR_3B:HN        -1.000  8.200  6.000 30.00 30.00 1000.000  0.00
1:GLU-_4B:HA       1:GLU-_4B:HB*      -1.000  6.000  5.000 30.00 30.00 1000.000  0.00
1:GLU-_4B:HA       1:GLU-_4B:HG*      -1.000  7.000  6.000 30.00 30.00 1000.000  0.00
1:GLU-_4B:HA       1:GLU-_4B:HN       -1.000  5.000  5.000 30.00 30.00 1000.000  0.00
1:GLU-_4B:HB*      1:GLU-_4B:HG*      -1.000  5.300  3.300 30.00 30.00 1000.000  0.00
1:GLU-_4B:HB*      1:GLU-_4B:HN       -1.000  6.000  5.000 30.00 30.00 1000.000  0.00
1:GLU-_4B:HG*      1:GLU-_4B:HN       -1.000  7.000  6.000 30.00 30.00 1000.000  0.00
1:ASN_5B:HA        1:ASN_5B:HB*       -1.000  4.300  3.300 30.00 30.00 1000.000  0.00
1:ASN_5B:HA        1:ASN_5B:HN        -1.000  3.300  3.300 30.00 30.00 1000.000  0.00
1:ASN_5B:HB*       1:ASN_5B:HD2*      -1.000  8.000  6.000 30.00 30.00 1000.000  0.00
1:ASN_5B:HB*       1:ASN_5B:HN        -1.000  4.300  3.300 30.00 30.00 1000.000  0.00
1:LYS+_6B:HA       1:LYS+_6B:HB*      -1.000  4.300  3.300 30.00 30.00 1000.000  0.00
1:LYS+_6B:HA       1:LYS+_6B:HG*      -1.000  6.000  5.000 30.00 30.00 1000.000  0.00
1:LYS+_6B:HA       1:LYS+_6B:HN       -1.000  6.000  6.000 30.00 30.00 1000.000  0.00
1:LYS+_6B:HB*      1:LYS+_6B:HG*      -1.000  5.300  3.300 30.00 30.00 1000.000  0.00
1:LYS+_6B:HB*      1:LYS+_6B:HN       -1.000  4.300  3.300 30.00 30.00 1000.000  0.00
1:LYS+_6B:HG*      1:LYS+_6B:HE*      -1.000  7.000  5.000 30.00 30.00 1000.000  0.00
1:LYS+_6B:HG*      1:LYS+_6B:HN       -1.000  6.000  5.000 30.00 30.00 1000.000  0.00
1:LYS+_6B:HD*      1:LYS+_6B:HE*      -1.000  5.300  3.300 30.00 30.00 1000.000  0.00
1:PRO_7B:HA        1:PRO_7B:HB*       -1.000  4.300  3.300 30.00 30.00 1000.000  0.00
1:PRO_7B:HA        1:PRO_7B:HG*       -1.000  7.000  6.000 30.00 30.00 1000.000  0.00
1:PRO_7B:HA        1:PRO_7B:HD*       -1.000  7.000  6.000 30.00 30.00 1000.000  0.00
1:PRO_7B:HB*       1:PRO_7B:HG*       -1.000  7.000  6.000 30.00 30.00 1000.000  0.00
1:PRO_7B:HB*       1:PRO_7B:HD*       -1.000  7.000  5.000 30.00 30.00 1000.000  0.00
1:PRO_7B:HG*       1:PRO_7B:HD*       -1.000  5.300  3.300 30.00 30.00 1000.000  0.00
1:ARG+_8B:HA       1:ARG+_8B:HB*      -1.000  4.300  3.300 30.00 30.00 1000.000  0.00
1:ARG+_8B:HA       1:ARG+_8B:HD*      -1.000  7.000  6.000 30.00 30.00 1000.000  0.00
1:ARG+_8B:HA       1:ARG+_8B:HN       -1.000  3.300  3.300 30.00 30.00 1000.000  0.00
1:ARG+_8B:HB*      1:ARG+_8B:HG*      -1.000  5.300  3.300 30.00 30.00 1000.000  0.00
1:ARG+_8B:HB*      1:ARG+_8B:HD*      -1.000  7.000  5.000 30.00 30.00 1000.000  0.00
1:ARG+_8B:HB*      1:ARG+_8B:HE*      -1.000  8.000  6.000 30.00 30.00 1000.000  0.00
1:ARG+_8B:HB*      1:ARG+_8B:HN       -1.000  6.000  5.000 30.00 30.00 1000.000  0.00
1:ARG+_8B:HG*      1:ARG+_8B:HD*      -1.000  7.000  5.000 30.00 30.00 1000.000  0.00
1:ARG+_8B:HG*      1:ARG+_8B:HE       -1.000  7.000  6.000 30.00 30.00 1000.000  0.00
1:ARG+_8B:HG*      1:ARG+_8B:HN       -1.000  8.000  6.000 30.00 30.00 1000.000  0.00
1:ARG+_8B:HD*      1:ARG+_8B:HE       -1.000  7.000  6.000 30.00 30.00 1000.000  0.00
1:ARG+_8B:HD*      1:ARG+_8B:HN       -1.000  7.000  6.000 30.00 30.00 1000.000  0.00
1:ARG+_9B:HA       1:ARG+_9B:HB*      -1.000  7.000  6.000 30.00 30.00 1000.000  0.00
1:ARG+_9B:HA       1:ARG+_9B:HG*      -1.000  7.000  6.000 30.00 30.00 1000.000  0.00
1:ARG+_9B:HA       1:ARG+_9B:HN       -1.000  5.000  5.000 30.00 30.00 1000.000  0.00
1:ARG+_9B:HB*      1:ARG+_9B:HG*      -1.000  5.300  3.300 30.00 30.00 1000.000  0.00
1:ARG+_9B:HB*      1:ARG+_9B:HD*      -1.000  7.000  5.000 30.00 30.00 1000.000  0.00
1:ARG+_9B:HB*      1:ARG+_9B:HE*      -1.000  8.000  6.000 30.00 30.00 1000.000  0.00
1:ARG+_9B:HB*      1:ARG+_9B:HN       -1.000  6.000  5.000 30.00 30.00 1000.000  0.00
1:ARG+_9B:HG*      1:ARG+_9B:HD*      -1.000  7.000  5.000 30.00 30.00 1000.000  0.00
1:ARG+_9B:HG*      1:ARG+_9B:HN       -1.000  6.000  5.000 30.00 30.00 1000.000  0.00
1:ARG+_9B:HD*      1:ARG+_9B:HN       -1.000  7.000  6.000 30.00 30.00 1000.000  0.00
1:PRO_10B:HA       1:PRO_10B:HB*      -1.000  4.300  3.300 30.00 30.00 1000.000  0.00
1:PRO_10B:HA       1:PRO_10B:HG*      -1.000  6.000  5.000 30.00 30.00 1000.000  0.00
1:PRO_10B:HA       1:PRO_10B:HD*      -1.000  7.000  5.000 30.00 30.00 1000.000  0.00
1:PRO_10B:HB*      1:PRO_10B:HD*      -1.000  8.000  5.000 30.00 30.00 1000.000  0.00
1:PRO_10B:HG*      1:PRO_10B:HD*      -1.000  5.300  3.300 30.00 30.00 1000.000  0.00
1:TYR_11B:HA       1:TYR_11B:HB*      -1.000  4.300  3.300 30.00 30.00 1000.000  0.00
1:TYR_11B:HA       1:TYR_11B:HD*      -1.000  8.200  6.000 30.00 30.00 1000.000  0.00
1:TYR_11B:HA       1:TYR_11B:HN       -1.000  5.000  5.000 30.00 30.00 1000.000  0.00
1:TYR_11B:HB*      1:TYR_11B:HD*      -1.000  7.200  5.000 30.00 30.00 1000.000  0.00
1:TYR_11B:HB*      1:TYR_11B:HE*      -1.000  8.200  6.000 30.00 30.00 1000.000  0.00
1:TYR_11B:HB*      1:TYR_11B:HN       -1.000  7.000  6.000 30.00 30.00 1000.000  0.00
1:TYR_11B:HD*      1:TYR_11B:HN       -1.000  8.200  6.000 30.00 30.00 1000.000  0.00
1:ILE_12B:HA       1:ILE_12B:HB*      -1.000  6.000  5.000 30.00 30.00 1000.000  0.00
1:ILE_12B:HA       1:ILE_12B:HG1*     -1.000  6.000  5.000 30.00 30.00 1000.000  0.00
1:ILE_12B:HA       1:ILE_12B:HG2*     -1.000  7.000  6.000 30.00 30.00 1000.000  0.00
1:ILE_12B:HA       1:ILE_12B:HD*      -1.000  7.000  6.000 30.00 30.00 1000.000  0.00
1:ILE_12B:HA       1:ILE_12B:HN       -1.000  5.000  5.000 30.00 30.00 1000.000  0.00
1:ILE_12B:HB       1:ILE_12B:HD*      -1.000  7.000  6.000 30.00 30.00 1000.000  0.00
1:ILE_12B:HB       1:ILE_12B:HN       -1.000  5.000  5.000 30.00 30.00 1000.000  0.00
1:ILE_12B:HG1*     1:ILE_12B:HD*      -1.000  7.000  5.000 30.00 30.00 1000.000  0.00
1:ILE_12B:HG1*     1:ILE_12B:HN       -1.000  7.000  6.000 30.00 30.00 1000.000  0.00
1:ILE_12B:HG2*     1:ILE_12B:HN       -1.000  7.000  6.000 30.00 30.00 1000.000  0.00
1:LEUC_13B:HA      1:LEUC_13B:HB*     -1.000  4.300  3.300 30.00 30.00 1000.000  0.00
1:LEUC_13B:HA      1:LEUC_13B:HG      -1.000  5.000  5.000 30.00 30.00 1000.000  0.00
1:LEUC_13B:HB*     1:LEUC_13B:HN      -1.000  7.000  6.000 30.00 30.00 1000.000  0.00
1:LEUC_13B:HG      1:LEUC_13B:HN      -1.000  5.000  5.000 30.00 30.00 1000.000  0.00
1:LEUC_13B:HD*     1:LEUC_13B:HN      -1.000  8.000  6.000 30.00 30.00 1000.000  0.00
1:PGLU_1B:HA       1:LEU_2B:HN        -1.000  5.000  5.000 30.00 30.00 1000.000  0.00
1:PGLU_1B:HG*      1:LEU_2B:HN        -1.000  7.000  6.000 30.00 30.00 1000.000  0.00
1:PGLU_1B:HB*      1:TYR_3B:HE*       -1.000  8.200  6.000 30.00 30.00 1000.000  0.00
1:PGLU_1B:HB*      1:TYR_3B:HN        -1.000  7.000  6.000 30.00 30.00 1000.000  0.00
1:PGLU_1B:HG*      1:TYR_3B:HD*       -1.000  9.200  6.000 30.00 30.00 1000.000  0.00
1:PGLU_1B:HG*      1:TYR_3B:HN        -1.000  7.000  6.000 30.00 30.00 1000.000  0.00
1:PGLU_1B:HG*      1:TYR_3B:HE*       -1.000  9.200  6.000 30.00 30.00 1000.000  0.00
1:LEU_2B:HA        1:TYR_3B:HD*       -1.000  8.200  6.000 30.00 30.00 1000.000  0.00
1:LEU_2B:HA        1:TYR_3B:HE*       -1.000  8.200  6.000 30.00 30.00 1000.000  0.00
1:LEU_2B:HA        1:TYR_3B:HN        -1.000  3.300  3.300 30.00 30.00 1000.000  0.00
1:LEU_2B:HB*       1:TYR_3B:HN        -1.000  7.000  6.000 30.00 30.00 1000.000  0.00
1:LEU_2B:HG        1:TYR_3B:HN        -1.000  6.000  6.000 30.00 30.00 1000.000  0.00
1:TYR_3B:HA        1:GLU-_4B:HN       -1.000  2.700  2.700 30.00 30.00 1000.000  0.00
1:TYR_3B:HB*       1:GLU-_4B:HN       -1.000  6.000  5.000 30.00 30.00 1000.000  0.00
1:TYR_3B:HD*       1:GLU-_4B:HA       -1.000  8.200  6.000 30.00 30.00 1000.000  0.00
1:TYR_3B:HD*       1:GLU-_4B:HN       -1.000  8.200  6.000 30.00 30.00 1000.000  0.00
1:TYR_3B:HN        1:GLU-_4B:HN       -1.000  6.000  6.000 30.00 30.00 1000.000  0.00
1:TYR_3B:HA        1:ASN_5B:HN        -1.000  6.000  6.000 30.00 30.00 1000.000  0.00
1:TYR_3B:HB*       1:ASN_5B:HN        -1.000  7.000  6.000 30.00 30.00 1000.000  0.00
1:TYR_3B:HD*       1:ASN_5B:HN        -1.000  8.200  6.000 30.00 30.00 1000.000  0.00
1:GLU-_4B:HA       1:ASN_5B:HB*       -1.000  7.000  6.000 30.00 30.00 1000.000  0.00
1:GLU-_4B:HA       1:ASN_5B:HN        -1.000  2.700  2.700 30.00 30.00 1000.000  0.00 
1:GLU-_4B:HB*      1:ASN_5B:HN        -1.000  6.000  5.000 30.00 30.00 1000.000  0.00
1:GLU-_4B:HG*      1:ASN_5B:HN        -1.000  7.000  6.000 30.00 30.00 1000.000  0.00
1:GLU-_4B:HG*      1:LYS+_6B:HE*      -1.000  8.000  6.000 30.00 30.00 1000.000  0.00
1:ASN_5B:HA        1:LYS+_6B:HN       -1.000  2.700  2.700 30.00 30.00 1000.000  0.00
1:ASN_5B:HB*       1:LYS+_6B:HN       -1.000  6.000  5.000 30.00 30.00 1000.000  0.00
1:ASN_5B:HN        1:LYS+_6B:HG*      -1.000  7.000  6.000 30.00 30.00 1000.000  0.00
1:ASN_5B:HN        1:LYS+_6B:HN       -1.000  6.000  6.000 30.00 30.00 1000.000  0.00
1:LYS+_6B:HA       1:PRO_7B:HD*       -1.000  3.700  2.700 30.00 30.00 1000.000  0.00
1:LYS+_6B:HA       1:PRO_7B:HB*       -1.000  7.000  6.000 30.00 30.00 1000.000  0.00
1:LYS+_6B:HB*      1:PRO_7B:HD*       -1.000  7.000  5.000 30.00 30.00 1000.000  0.00
1:LYS+_6B:HG*      1:PRO_7B:HD*       -1.000  8.000  6.000 30.00 30.00 1000.000  0.00
1:LYS+_6B:HN       1:PRO_7B:HD*       -1.000  7.000  6.000 30.00 30.00 1000.000  0.00
1:LYS+_6B:HG*      1:ARG+_8B:HE*      -1.000  8.000  6.000 30.00 30.00 1000.000  0.00
1:PRO_7B:HA        1:ARG+_8B:HN       -1.000  2.700  2.700 30.00 30.00 1000.000  0.00
1:PRO_7B:HB*       1:ARG+_8B:HN       -1.000  7.000  6.000 30.00 30.00 1000.000  0.00
1:PRO_7B:HD*       1:ARG+_8B:HN       -1.000  7.000  6.000 30.00 30.00 1000.000  0.00
1:ARG+_8B:HA       1:ARG+_9B:HN       -1.000  2.700  2.700 30.00 30.00 1000.000  0.00
1:ARG+_8B:HB*      1:ARG+_9B:HN       -1.000  7.000  6.000 30.00 30.00 1000.000  0.00
1:ARG+_8B:HD*      1:ARG+_9B:HN       -1.000  7.000  6.000 30.00 30.00 1000.000  0.00
!1:ARG+_8B:HB*      1:TYR_11B:HD*      -1.000  9.200  6.000 30.00 30.00 1000.000  0.00
1:ARG+_9B:HA       1:PRO_10B:HD*      -1.000  3.700  2.700 30.00 30.00 1000.000  0.00
1:ARG+_9B:HB*      1:PRO_10B:HD*      -1.000  8.000  6.000 30.00 30.00 1000.000  0.00
1:ARG+_9B:HG*      1:PRO_10B:HD*      -1.000  8.000  6.000 30.00 30.00 1000.000  0.00
1:ARG+_9B:HN       1:PRO_10B:HD*      -1.000  7.000  6.000 30.00 30.00 1000.000  0.00
1:PRO_10B:HA       1:TYR_11B:HN       -1.000  2.700  2.700 30.00 30.00 1000.000  0.00
1:PRO_10B:HB*      1:TYR_11B:HN       -1.000  7.000  6.000 30.00 30.00 1000.000  0.00
1:PRO_10B:HG*      1:TYR_11B:HD*      -1.000  9.200  6.000 30.00 30.00 1000.000  0.00
1:PRO_10B:HG*      1:TYR_11B:HN       -1.000  7.000  6.000 30.00 30.00 1000.000  0.00
1:PRO_10B:HD*      1:TYR_11B:HD*      -1.000  9.200  6.000 30.00 30.00 1000.000  0.00
1:PRO_10B:HD*      1:TYR_11B:HN       -1.000  7.000  6.000 30.00 30.00 1000.000  0.00
1:TYR_11B:HA       1:ILE_12B:HN       -1.000  2.700  2.700 30.00 30.00 1000.000  0.00
1:TYR_11B:HB*      1:ILE_12B:HN       -1.000  7.000  6.000 30.00 30.00 1000.000  0.00
1:TYR_11B:HD*      1:ILE_12B:HN       -1.000  8.200  6.000 30.00 30.00 1000.000  0.00
1:TYR_11B:HD*      1:LEUC_13B:HB*     -1.000  9.200  6.000 30.00 30.00 1000.000  0.00
1:TYR_11B:HE*      1:LEUC_13B:HG      -1.000  8.200  6.000 30.00 30.00 1000.000  0.00
1:TYR_11B:HE*      1:LEUC_13B:HD*     -1.000 10.200  6.000 30.00 30.00 1000.000  0.00
1:ILE_12B:HA       1:LEUC_13B:HN      -1.000  2.700  2.700 30.00 30.00 1000.000  0.00
1:ILE_12B:HB*      1:LEUC_13B:HN      -1.000  7.000  6.000 30.00 30.00 1000.000  0.00
1:VALN_1:HA        1:VALN_1:HB        -1.000  6.000  6.000 30.00 30.00 1000.000  0.00
1:VALN_1:HA        1:VALN_1:HG*       -1.000  8.000  6.000 30.00 30.00 1000.000  0.00
1:VALN_1:HB        1:VALN_1:HG*       -1.000  7.000  5.000 30.00 30.00 1000.000  0.00
1:ARG+_2:HA        1:ARG+_2:HB*       -1.000  6.000  5.000 30.00 30.00 1000.000  0.00
1:ARG+_2:HA        1:ARG+_2:HG*       -1.000  7.000  6.000 30.00 30.00 1000.000  0.00
1:ARG+_2:HA        1:ARG+_2:HD*       -1.000  7.000  6.000 30.00 30.00 1000.000  0.00
1:ARG+_2:HA        1:ARG+_2:HN        -1.000  6.000  6.000 30.00 30.00 1000.000  0.00
1:ARG+_2:HB*       1:ARG+_2:HG*       -1.000  7.000  5.000 30.00 30.00 1000.000  0.00
1:ARG+_2:HB*       1:ARG+_2:HD*       -1.000  8.000  6.000 30.00 30.00 1000.000  0.00
1:ARG+_2:HB*       1:ARG+_2:HN        -1.000  7.000  6.000 30.00 30.00 1000.000  0.00
1:ARG+_2:HG*       1:ARG+_2:HD*       -1.000  8.000  6.000 30.00 30.00 1000.000  0.00
1:ARG+_3:HA        1:ARG+_3:HB*       -1.000  4.300  3.300 30.00 30.00 1000.000  0.00
1:ARG+_3:HA        1:ARG+_3:HG*       -1.000  7.000  6.000 30.00 30.00 1000.000  0.00
1:ARG+_3:HA        1:ARG+_3:HD*       -1.000  7.000  6.000 30.00 30.00 1000.000  0.00
1:ARG+_3:HA        1:ARG+_3:HN        -1.000  5.000  5.000 30.00 30.00 1000.000  0.00
1:ARG+_3:HB*       1:ARG+_3:HG*       -1.000  7.000  5.000 30.00 30.00 1000.000  0.00
1:ARG+_3:HB*       1:ARG+_3:HD*       -1.000  8.000  6.000 30.00 30.00 1000.000  0.00
1:ARG+_3:HB*       1:ARG+_3:HN        -1.000  7.000  6.000 30.00 30.00 1000.000  0.00
1:ARG+_3:HG*       1:ARG+_3:HD*       -1.000  5.300  3.300 30.00 30.00 1000.000  0.00
1:ARG+_3:HG*       1:ARG+_3:HN        -1.000  7.000  6.000 30.00 30.00 1000.000  0.00
1:LEU_4:HA         1:LEU_4:HB*        -1.000  4.300  3.300 30.00 30.00 1000.000  0.00   
1:LEU_4:HA         1:LEU_4:HG         -1.000  6.000  6.000 30.00 30.00 1000.000  0.00
1:LEU_4:HA         1:LEU_4:HD*        -1.000  8.000  6.000 30.00 30.00 1000.000  0.00
1:LEU_4:HA         1:LEU_4:HN         -1.000  3.300  3.300 30.00 30.00 1000.000  0.00
1:LEU_4:HB*        1:LEU_4:HG         -1.000  7.000  6.000 30.00 30.00 1000.000  0.00
1:LEU_4:HB*        1:LEU_4:HD*        -1.000  9.000  6.000 30.00 30.00 1000.000  0.00
1:LEU_4:HB*        1:LEU_4:HN         -1.000  6.000  5.000 30.00 30.00 1000.000  0.00
1:LEU_4:HG         1:LEU_4:HD*        -1.000  8.000  6.000 30.00 30.00 1000.000  0.00
1:LEU_4:HG         1:LEU_4:HN         -1.000  6.000  6.000 30.00 30.00 1000.000  0.00
1:MET_5:HA         1:MET_5:HB*        -1.000  4.300  3.300 30.00 30.00 1000.000  0.00
1:MET_5:HA         1:MET_5:HG*        -1.000  7.000  6.000 30.00 30.00 1000.000  0.00
1:MET_5:HA         1:MET_5:HN         -1.000  5.000  5.000 30.00 30.00 1000.000  0.00
1:MET_5:HB*        1:MET_5:HG*        -1.000  8.000  6.000 30.00 30.00 1000.000  0.00
1:MET_5:HB*        1:MET_5:HN         -1.000  6.000  5.000 30.00 30.00 1000.000  0.00
1:MET_5:HG*        1:MET_5:HN         -1.000  7.000  6.000 30.00 30.00 1000.000  0.00
1:PHE_6:HA         1:PHE_6:HB*        -1.000  4.300  3.300 30.00 30.00 1000.000  0.00  
1:PHE_6:HA         1:PHE_6:HD*        -1.000  8.200  6.000 30.00 30.00 1000.000  0.00
1:PHE_6:HA         1:PHE_6:HE*        -1.000  8.200  6.000 30.00 30.00 1000.000  0.00
1:PHE_6:HA         1:PHE_6:HN         -1.000  5.000  5.000 30.00 30.00 1000.000  0.00
1:PHE_6:HB*        1:PHE_6:HD*        -1.000  9.200  6.000 30.00 30.00 1000.000  0.00
1:PHE_6:HB*        1:PHE_6:HE*        -1.000  9.200  6.000 30.00 30.00 1000.000  0.00
1:PHE_6:HB*        1:PHE_6:HN         -1.000  7.000  6.000 30.00 30.00 1000.000  0.00     
1:SER_7:HA         1:SER_7:HB*        -1.000  6.000  5.000 30.00 30.00 1000.000  0.00
1:SER_7:HA         1:SER_7:HN         -1.000  3.300  3.300 30.00 30.00 1000.000  0.00
1:SER_7:HB*        1:SER_7:HN         -1.000  7.000  6.000 30.00 30.00 1000.000  0.00
1:TYR_8:HA         1:TYR_8:HB*        -1.000  4.300  3.300 30.00 30.00 1000.000  0.00
1:TYR_8:HA         1:TYR_8:HD*        -1.000  7.200  5.000 30.00 30.00 1000.000  0.00
1:TYR_8:HA         1:TYR_8:HE*        -1.000  8.200  6.000 30.00 30.00 1000.000  0.00
1:TYR_8:HA         1:TYR_8:HN         -1.000  5.000  5.000 30.00 30.00 1000.000  0.00    
1:TYR_8:HB*        1:TYR_8:HD*        -1.000  9.200  6.000 30.00 30.00 1000.000  0.00
1:TYR_8:HB*        1:TYR_8:HN         -1.000  6.000  5.000 30.00 30.00 1000.000  0.00
1:TYR_8:HD*        1:TYR_8:HN         -1.000  8.200  6.000 30.00 30.00 1000.000  0.00
1:TYR_8:HE*        1:TYR_8:HN         -1.000  8.200  6.000 30.00 30.00 1000.000  0.00
1:ILE_9:HA         1:ILE_9:HB*        -1.000  6.000  5.000 30.00 30.00 1000.000  0.00
1:ILE_9:HA         1:ILE_9:HG1*       -1.000  7.000  6.000 30.00 30.00 1000.000  0.00
1:ILE_9:HA         1:ILE_9:HG2*       -1.000  6.000  5.000 30.00 30.00 1000.000  0.00
1:ILE_9:HA         1:ILE_9:HD1*       -1.000  7.000  6.000 30.00 30.00 1000.000  0.00
1:ILE_9:HA         1:ILE_9:HN         -1.000  5.000  5.000 30.00 30.00 1000.000  0.00
1:ILE_9:HB         1:ILE_9:HG1*       -1.000  4.300  3.300 30.00 30.00 1000.000  0.00
1:ILE_9:HB         1:ILE_9:HD1*       -1.000  7.000  6.000 30.00 30.00 1000.000  0.00
1:ILE_9:HB         1:ILE_9:HN         -1.000  5.000  5.000 30.00 30.00 1000.000  0.00 
1:ILE_9:HG1*       1:ILE_9:HG2*       -1.000  7.000  5.000 30.00 30.00 1000.000  0.00
1:ILE_9:HG1*       1:ILE_9:HD1*       -1.000  7.000  5.000 30.00 30.00 1000.000  0.00
1:ILE_9:HG2*       1:ILE_9:HD1*       -1.000  7.000  5.000 30.00 30.00 1000.000  0.00
1:ILE_9:HG1*       1:ILE_9:HN         -1.000  4.300  3.300 30.00 30.00 1000.000  0.00
1:ILE_9:HG2*       1:ILE_9:HN         -1.000  7.000  6.000 30.00 30.00 1000.000  0.00
1:SER_10:HA        1:SER_10:HB*       -1.000  6.000  5.000 30.00 30.00 1000.000  0.00
1:SER_10:HA        1:SER_10:HN        -1.000  5.000  5.000 30.00 30.00 1000.000  0.00   
1:SER_10:HB*       1:SER_10:HN        -1.000  7.000  6.000 30.00 30.00 1000.000  0.00
1:ASP-_11:HA       1:ASP-_11:HB*      -1.000  4.300  3.300 30.00 30.00 1000.000  0.00
1:ASP-_11:HA       1:ASP-_11:HN       -1.000  5.000  5.000 30.00 30.00 1000.000  0.00
1:ASP-_11:HB*      1:ASP-_11:HN       -1.000  6.000  5.000 30.00 30.00 1000.000  0.00
1:GLU-_12:HA       1:GLU-_12:HB*      -1.000  6.000  5.000 30.00 30.00 1000.000  0.00
1:GLU-_12:HA       1:GLU-_12:HG*      -1.000  7.000  6.000 30.00 30.00 1000.000  0.00
1:GLU-_12:HA       1:GLU-_12:HN       -1.000  5.000  5.000 30.00 30.00 1000.000  0.00
1:GLU-_12:HB*      1:GLU-_12:HG*      -1.000  7.000  5.000 30.00 30.00 1000.000  0.00
1:GLU-_12:HB*      1:GLU-_12:HN       -1.000  7.000  6.000 30.00 30.00 1000.000  0.00
1:GLU-_12:HG*      1:GLU-_12:HN       -1.000  7.000  6.000 30.00 30.00 1000.000  0.00
1:GLN_13:HA        1:GLN_13:HB*       -1.000  6.000  5.000 30.00 30.00 1000.000  0.00 
1:GLN_13:HA        1:GLN_13:HG*       -1.000  7.000  6.000 30.00 30.00 1000.000  0.00
1:GLN_13:HA        1:GLN_13:HN        -1.000  5.000  5.000 30.00 30.00 1000.000  0.00
1:GLN_13:HB*       1:GLN_13:HG*       -1.000  7.000  5.000 30.00 30.00 1000.000  0.00
1:GLN_13:HB*       1:GLN_13:HN        -1.000  6.000  5.000 30.00 30.00 1000.000  0.00
1:GLN_13:HG*       1:GLN_13:HE2*      -1.000  8.000  6.000 30.00 30.00 1000.000  0.00  
1:GLN_13:HG*       1:GLN_13:HN        -1.000  7.000  5.000 30.00 30.00 1000.000  0.00
1:TRP_14:HA        1:TRP_14:HB*       -1.000  6.000  5.000 30.00 30.00 1000.000  0.00
1:TRP_14:HA        1:TRP_14:HD1       -1.000  5.000  5.000 30.00 30.00 1000.000  0.00
1:TRP_14:HA        1:TRP_14:HE3       -1.000  5.000  5.000 30.00 30.00 1000.000  0.00
1:TRP_14:HA        1:TRP_14:HN        -1.000  5.000  5.000 30.00 30.00 1000.000  0.00
1:TRP_14:HB*       1:TRP_14:HD1       -1.000  7.000  6.000 30.00 30.00 1000.000  0.00
1:TRP_14:HB*       1:TRP_14:HE3       -1.000  7.000  6.000 30.00 30.00 1000.000  0.00
1:TRP_14:HB*       1:TRP_14:HN        -1.000  6.000  5.000 30.00 30.00 1000.000  0.00
1:TRP_14:HD1       1:TRP_14:HN        -1.000  6.000  6.000 30.00 30.00 1000.000  0.00
1:THR_15:HA        1:THR_15:HB        -1.000  6.000  6.000 30.00 30.00 1000.000  0.00
1:THR_15:HA        1:THR_15:HG2*      -1.000  7.000  6.000 30.00 30.00 1000.000  0.00
1:THR_15:HA        1:THR_15:HN        -1.000  5.000  5.000 30.00 30.00 1000.000  0.00
1:THR_15:HB        1:THR_15:HG2*      -1.000  4.300  3.300 30.00 30.00 1000.000  0.00
1:THR_15:HB        1:THR_15:HN        -1.000  5.000  5.000 30.00 30.00 1000.000  0.00
1:THR_15:HG2*      1:THR_15:HN        -1.000  7.000  6.000 30.00 30.00 1000.000  0.00
1:PRO_16:HA        1:PRO_16:HB*       -1.000  6.000  5.000 30.00 30.00 1000.000  0.00
1:PRO_16:HA        1:PRO_16:HG*       -1.000  6.000  5.000 30.00 30.00 1000.000  0.00
1:PRO_16:HA        1:PRO_16:HD*       -1.000  6.000  5.000 30.00 30.00 1000.000  0.00
1:PRO_16:HB*       1:PRO_16:HG*       -1.000  5.300  3.300 30.00 30.00 1000.000  0.00
1:PRO_16:HD*       1:PRO_16:HG*       -1.000  5.300  3.300 30.00 30.00 1000.000  0.00
1:PHE_17:HA        1:PHE_17:HB*       -1.000  6.000  5.000 30.00 30.00 1000.000  0.00
1:PHE_17:HA        1:PHE_17:HE*       -1.000  8.200  6.000 30.00 30.00 1000.000  0.00
1:PHE_17:HA        1:PHE_17:HN        -1.000  5.000  5.000 30.00 30.00 1000.000  0.00  
1:PHE_17:HB*       1:PHE_17:HN        -1.000  6.000  5.000 30.00 30.00 1000.000  0.00
1:LEU_18:HA        1:LEU_18:HB*       -1.000  4.300  3.300 30.00 30.00 1000.000  0.00
1:LEU_18:HA        1:LEU_18:HG        -1.000  6.000  6.000 30.00 30.00 1000.000  0.00
1:LEU_18:HA        1:LEU_18:HD*       -1.000  8.000  6.000 30.00 30.00 1000.000  0.00
1:LEU_18:HA        1:LEU_18:HN        -1.000  5.000  5.000 30.00 30.00 1000.000  0.00
1:LEU_18:HB*       1:LEU_18:HN        -1.000  6.000  5.000 30.00 30.00 1000.000  0.00
1:LEU_18:HG        1:LEU_18:HD*       -1.000  8.000  6.000 30.00 30.00 1000.000  0.00
1:LEU_18:HG        1:LEU_18:HN        -1.000  6.000  6.000 30.00 30.00 1000.000  0.00
1:LEU_18:HD*       1:LEU_18:HN        -1.000  8.000  6.000 30.00 30.00 1000.000  0.00
1:TYR_19:HA        1:TYR_19:HB*       -1.000  6.000  5.000 30.00 30.00 1000.000  0.00
1:TYR_19:HA        1:TYR_19:HD*       -1.000  7.200  5.000 30.00 30.00 1000.000  0.00      
1:TYR_19:HA        1:TYR_19:HE*       -1.000  8.200  6.000 30.00 30.00 1000.000  0.00  
1:TYR_19:HA        1:TYR_19:HN        -1.000  5.000  5.000 30.00 30.00 1000.000  0.00
1:TYR_19:HB*       1:TYR_19:HD*       -1.000  6.500  3.300 30.00 30.00 1000.000  0.00
1:TYR_19:HB*       1:TYR_19:HE*       -1.000  9.200  6.000 30.00 30.00 1000.000  0.00
1:TYR_19:HB*       1:TYR_19:HN        -1.000  6.000  5.000 30.00 30.00 1000.000  0.00 
1:TYR_19:HD*       1:TYR_19:HN        -1.000  8.200  6.000 30.00 30.00 1000.000  0.00
1:ASP-_20:HA       1:ASP-_20:HB*      -1.000  6.000  5.000 30.00 30.00 1000.000  0.00
1:ASP-_20:HA       1:ASP-_20:HN       -1.000  5.000  5.000 30.00 30.00 1000.000  0.00
1:ASP-_20:HB*      1:ASP-_20:HN       -1.000  7.000  6.000 30.00 30.00 1000.000  0.00
1:PHE_21:HA        1:PHE_21:HB*       -1.000  4.300  3.300 30.00 30.00 1000.000  0.00
1:PHE_21:HA        1:PHE_21:HD*       -1.000  8.200  6.000 30.00 30.00 1000.000  0.00
1:PHE_21:HA        1:PHE_21:HN        -1.000  5.000  5.000 30.00 30.00 1000.000  0.00
1:PHE_21:HB*       1:PHE_21:HD*       -1.000  8.200  5.000 30.00 30.00 1000.000  0.00
1:PHE_21:HB*       1:PHE_21:HE*       -1.000  9.200  6.000 30.00 30.00 1000.000  0.00
1:PHE_21:HB*       1:PHE_21:HN        -1.000  6.000  5.000 30.00 30.00 1000.000  0.00
1:PHE_21:HD*       1:PHE_21:HN        -1.000  8.200  6.000 30.00 30.00 1000.000  0.00
1:TYR_22:HA        1:TYR_22:HB*       -1.000  6.000  5.000 30.00 30.00 1000.000  0.00 
1:TYR_22:HA        1:TYR_22:HD*       -1.000  8.200  6.000 30.00 30.00 1000.000  0.00
1:TYR_22:HA        1:TYR_22:HE*       -1.000  8.200  6.000 30.00 30.00 1000.000  0.00
1:TYR_22:HA        1:TYR_22:HN        -1.000  5.000  5.000 30.00 30.00 1000.000  0.00 
1:TYR_22:HB*       1:TYR_22:HD*       -1.000  9.200  6.000 30.00 30.00 1000.000  0.00
1:TYR_22:HB*       1:TYR_22:HE*       -1.000  9.200  6.000 30.00 30.00 1000.000  0.00
1:TYR_22:HB*       1:TYR_22:HN        -1.000  6.000  5.000 30.00 30.00 1000.000  0.00
1:TYR_22:HD*       1:TYR_22:HN        -1.000  8.200  6.000 30.00 30.00 1000.000  0.00
1:HIS+_23:HA       1:HIS+_23:HB*      -1.000  6.000  5.000 30.00 30.00 1000.000  0.00
1:HIS+_23:HA       1:HIS+_23:HN       -1.000  5.000  5.000 30.00 30.00 1000.000  0.00
1:HIS+_23:HB*      1:HIS+_23:HD2      -1.000  7.000  6.000 30.00 30.00 1000.000  0.00
1:HIS+_23:HB*      1:HIS+_23:HN       -1.000  7.000  6.000 30.00 30.00 1000.000  0.00
1:TYRC_24:HA       1:TYRC_24:HB*      -1.000  6.000  5.000 30.00 30.00 1000.000  0.00
1:TYRC_24:HA       1:TYRC_24:HD*      -1.000  8.200  6.000 30.00 30.00 1000.000  0.00
1:TYRC_24:HA       1:TYRC_24:HN       -1.000  5.000  5.000 30.00 30.00 1000.000  0.00
1:TYRC_24:HB*      1:TYRC_24:HD*      -1.000  9.200  6.000 30.00 30.00 1000.000  0.00 
1:TYRC_24:HB*      1:TYRC_24:HE*      -1.000  9.200  6.000 30.00 30.00 1000.000  0.00
1:TYRC_24:HB*      1:TYRC_24:HN       -1.000  6.000  5.000 30.00 30.00 1000.000  0.00
1:TYRC_24:HD*      1:TYRC_24:HN       -1.000  8.200  6.000 30.00 30.00 1000.000  0.00
1:VALN_1:HA        1:ARG+_2:HN        -1.000  7.000  6.000 30.00 30.00 1000.000  0.00
1:ARG+_2:HA        1:ARG+_3:HN        -1.000  5.000  5.000 30.00 30.00 1000.000  0.00
1:ARG+_3:HB*       1:LEU_4:HN         -1.000  7.000  6.000 30.00 30.00 1000.000  0.00
1:ARG+_3:HN        1:LEU_4:HN         -1.000  6.000  6.000 30.00 30.00 1000.000  0.00
1:LEU_4:HA         1:MET_5:HN         -1.000  2.700  2.700 30.00 30.00 1000.000  0.00
1:LEU_4:HB*        1:MET_5:HN         -1.000  6.000  5.000 30.00 30.00 1000.000  0.00
1:LEU_4:HG         1:MET_5:HN         -1.000  6.000  6.000 30.00 30.00 1000.000  0.00
1:MET_5:HA         1:PHE_6:HN         -1.000  5.000  5.000 30.00 30.00 1000.000  0.00
1:MET_5:HB*        1:PHE_6:HN         -1.000  7.000  6.000 30.00 30.00 1000.000  0.00
1:PHE_6:HA         1:SER_7:HN         -1.000  6.000  6.000 30.00 30.00 1000.000  0.00
1:PHE_6:HB*        1:SER_7:HN         -1.000  7.000  6.000 30.00 30.00 1000.000  0.00
1:PHE_6:HD*        1:SER_7:HA         -1.000  8.200  6.000 30.00 30.00 1000.000  0.00
1:SER_7:HA         1:TYR_8:HB*        -1.000  7.000  6.000 30.00 30.00 1000.000  0.00
1:SER_7:HA         1:TYR_8:HN         -1.000  5.000  5.000 30.00 30.00 1000.000  0.00
1:SER_7:HB*        1:TYR_8:HN         -1.000  7.000  6.000 30.00 30.00 1000.000  0.00
1:SER_7:HN         1:TYR_8:HB*        -1.000  7.000  6.000 30.00 30.00 1000.000  0.00
1:TYR_8:HA         1:ILE_9:HN         -1.000  6.000  6.000 30.00 30.00 1000.000  0.00
1:ILE_9:HA         1:SER_10:HN        -1.000  5.000  5.000 30.00 30.00 1000.000  0.00
1:ILE_9:HG2*       1:SER_10:HA        -1.000  7.000  6.000 30.00 30.00 1000.000  0.00
1:ILE_9:HG2*       1:SER_10:HN        -1.000  7.000  6.000 30.00 30.00 1000.000  0.00
1:SER_10:HA        1:ASP-_11:HN       -1.000  3.300  3.300 30.00 30.00 1000.000  0.00
1:SER_10:HB*       1:ASP-_11:HN       -1.000  7.000  6.000 30.00 30.00 1000.000  0.00
1:SER_10:HN        1:ASP-_11:HN       -1.000  6.000  6.000 30.00 30.00 1000.000  0.00
1:ASP-_11:HA       1:GLU-_12:HN       -1.000  6.000  6.000 30.00 30.00 1000.000  0.00
1:ASP-_11:HB*      1:GLU-_12:HN       -1.000  7.000  6.000 30.00 30.00 1000.000  0.00
1:GLU-_12:HG*      1:GLN_13:HN        -1.000  7.000  6.000 30.00 30.00 1000.000  0.00
1:GLN_13:HA        1:TRP_14:HB*       -1.000  7.000  6.000 30.00 30.00 1000.000  0.00
1:GLN_13:HA        1:TRP_14:HN        -1.000  5.000  5.000 30.00 30.00 1000.000  0.00
1:GLN_13:HB*       1:TRP_14:HN        -1.000  7.000  6.000 30.00 30.00 1000.000  0.00
1:GLN_13:HB*       1:TRP_14:HD1       -1.000  7.000  6.000 30.00 30.00 1000.000  0.00
1:GLN_13:HG*       1:TRP_14:HD1       -1.000  7.000  6.000 30.00 30.00 1000.000  0.00
1:GLN_13:HG*       1:TRP_14:HN        -1.000  7.000  6.000 30.00 30.00 1000.000  0.00
1:GLN_13:HG*       1:TRP_14:HB*       -1.000  8.000  6.000 30.00 30.00 1000.000  0.00
1:GLN_13:HN        1:TRP_14:HN        -1.000  6.000  6.000 30.00 30.00 1000.000  0.00
1:TRP_14:HA        1:THR_15:HN        -1.000  5.000  5.000 30.00 30.00 1000.000  0.00
1:TRP_14:HB*       1:THR_15:HN        -1.000  7.000  6.000 30.00 30.00 1000.000  0.00
1:TRP_14:HN        1:THR_15:HN        -1.000  6.000  6.000 30.00 30.00 1000.000  0.00
1:TRP_14:HE3       1:PRO_16:HD*       -1.000  7.000  6.000 30.00 30.00 1000.000  0.00
1:THR_15:HA        1:PRO_16:HD*       -1.000  4.300  3.300 30.00 30.00 1000.000  0.00
1:THR_15:HA        1:PRO_16:HB*       -1.000  7.000  6.000 30.00 30.00 1000.000  0.00
1:THR_15:HG2*      1:PRO_16:HD*       -1.000  8.000  6.000 30.00 30.00 1000.000  0.00
1:THR_15:HN        1:PRO_16:HD*       -1.000  7.000  6.000 30.00 30.00 1000.000  0.00
!1:THR_15:HA        1:PHE_21:HN        -1.000  6.000  6.000 30.00 30.00 1000.000  0.00
!1:THR_15:HB        1:PHE_21:HN        -1.000  6.000  6.000 30.00 30.00 1000.000  0.00
1:THR_15:HG2*      1:PHE_17:HD*       -1.000  9.200  6.000 30.00 30.00 1000.000  0.00
1:PRO_16:HA        1:PHE_17:HN        -1.000  5.000  5.000 30.00 30.00 1000.000  0.00
1:PRO_16:HB*       1:PHE_17:HN        -1.000  7.000  6.000 30.00 30.00 1000.000  0.00
1:PRO_16:HD*       1:PHE_17:HN        -1.000  7.000  6.000 30.00 30.00 1000.000  0.00
1:PRO_16:HG*       1:PHE_17:HN        -1.000  7.000  6.000 30.00 30.00 1000.000  0.00
1:PHE_17:HA        1:LEU_18:HN        -1.000  6.000  6.000 30.00 30.00 1000.000  0.00    
1:PHE_17:HD*       1:LEU_18:HD*       -1.000 10.200  6.000 30.00 30.00 1000.000  0.00
1:PHE_17:HN        1:LEU_18:HN        -1.000  6.000  6.000 30.00 30.00 1000.000  0.00
1:LEU_18:HA        1:TYR_19:HB*       -1.000  7.000  6.000 30.00 30.00 1000.000  0.00
1:LEU_18:HA        1:TYR_19:HD*       -1.000  8.200  6.000 30.00 30.00 1000.000  0.00
1:LEU_18:HA        1:TYR_19:HN        -1.000  6.000  6.000 30.00 30.00 1000.000  0.00
1:LEU_18:HN        1:TYR_19:HN        -1.000  6.000  6.000 30.00 30.00 1000.000  0.00
1:TYR_19:HA        1:ASP-_20:HN       -1.000  5.000  5.000 30.00 30.00 1000.000  0.00
1:TYR_19:HB*       1:ASP-_20:HN       -1.000  7.000  6.000 30.00 30.00 1000.000  0.00
1:TYR_19:HD*       1:ASP-_20:HN       -1.000  7.000  6.000 30.00 30.00 1000.000  0.00
1:TYR_19:HN        1:ASP-_20:HN       -1.000  6.000  6.000 30.00 30.00 1000.000  0.00
1:ASP-_20:HA       1:PHE_21:HN        -1.000  6.000  6.000 30.00 30.00 1000.000  0.00
1:ASP-_20:HB*      1:PHE_21:HN        -1.000  7.000  6.000 30.00 30.00 1000.000  0.00
!1:PHE_21:HN        1:TYR_22:HD*       -1.000  8.200  6.000 30.00 30.00 1000.000  0.00
1:PHE_21:HN        1:TYR_22:HN        -1.000  6.000  6.000 30.00 30.00 1000.000  0.00 
1:TYR_22:HA        1:HIS+_23:HN       -1.000  5.000  5.000 30.00 30.00 1000.000  0.00
1:TYR_22:HB*       1:HIS+_23:HN       -1.000  7.000  6.000 30.00 30.00 1000.000  0.00
1:HIS+_23:HA       1:TYRC_24:HN       -1.000  5.000  5.000 30.00 30.00 1000.000  0.00
1:ARG+_3:HN        1:ILE_12B:HN       -1.000  6.000  6.000 30.00 30.00 1000.000  0.00 
1:PHE_6:HD*        1:LEUC_13B:HD*     -1.000  9.200  6.000 30.00 30.00 1000.000  0.00
1:PHE_6:HE*        1:LEUC_13B:HD*     -1.000  9.200  6.000 30.00 30.00 1000.000  0.00
1:TRP_14:HB*       1:PRO_10B:HD*      -1.000  8.000  6.000 30.00 30.00 1000.000  0.00  
1:THR_15:HA        1:ARG+_9B:HB*      -1.000  7.000  6.000 30.00 30.00 1000.000  0.00
1:GLN_13:HN        1:ARG+_9B:HB*      -1.000  7.000  6.000 30.00 30.00 1000.000  0.00
1:PHE_21:HN        1:PRO_10B:HA       -1.000  6.000  6.000 30.00 30.00 1000.000  0.00      
!
#NMR_dihedral
!
1:PGLU_1B:CA        1:PGLU_1B:C        1:LEU_2B:N         1:LEU_2B:CA        180.000 180.000 100.00 100.00 1000.000
1:LEU_2B:CA         1:LEU_2B:C         1:TYR_3B:N         1:TYR_3B:CA        180.000 180.000 100.00 100.00 1000.000
1:TYR_3B:CA         1:TYR_3B:C         1:GLU-_4B:N        1:GLU-_4B:CA       180.000 180.000 100.00 100.00 1000.000
1:GLU-_4B:CA        1:GLU-_4B:C        1:ASN_5B:N         1:ASN_5B:CA        180.000 180.000 100.00 100.00 1000.000
1:ASN_5B:CA         1:ASN_5B:C         1:LYS+_6B:N        1:LYS+_6B:CA       180.000 180.000 100.00 100.00 1000.000
1:LYS+_6B:CA        1:LYS+_6B:C        1:PRO_7B:N         1:PRO_7B:CA        180.000 180.000 100.00 100.00 1000.000
1:PRO_7B:CA         1:PRO_7B:C         1:ARG+_8B:N        1:ARG+_8B:CA       180.000 180.000 100.00 100.00 1000.000
1:ARG+_8B:CA        1:ARG+_8B:C        1:ARG+_9B:N        1:ARG+_9B:CA       180.000 180.000 100.00 100.00 1000.000
1:ARG+_9B:CA        1:ARG+_9B:C        1:PRO_10B:N        1:PRO_10B:CA       180.000 180.000 100.00 100.00 1000.000
1:PRO_10B:CA        1:PRO_10B:C        1:TYR_11B:N        1:TYR_11B:CA       180.000 180.000 100.00 100.00 1000.000
1:TYR_11B:CA        1:TYR_11B:C        1:ILE_12B:N        1:ILE_12B:CA       180.000 180.000 100.00 100.00 1000.000
1:ILE_12B:CA        1:ILE_12B:C        1:LEUC_13B:N       1:LEUC_13B:CA      180.000 180.000 100.00 100.00 1000.000
1:PGLU_1B:C         1:LEU_2B:N         1:LEU_2B:CA        1:LEU_2B:C        -124.000 -14.000 100.00 100.00 1000.000
1:LEU_2B:C          1:TYR_3B:N         1:TYR_3B:CA        1:TYR_3B:C        -129.000 -19.000 100.00 100.00 1000.000
1:TYR_3B:C          1:GLU-_4B:N        1:GLU-_4B:CA       1:GLU-_4B:C       -130.000 -20.000 100.00 100.00 1000.000
1:GLU-_4B:C         1:ASN_5B:N         1:ASN_5B:CA        1:ASN_5B:C        -133.000 -23.000 100.00 100.00 1000.000 
1:ASN_5B:C          1:LYS+_6B:N        1:LYS+_6B:CA       1:LYS+_6B:C       -125.000 -15.000 100.00 100.00 1000.000
1:LYS+_6B:C         1:PRO_7B:N         1:PRO_7B:CA        1:PRO_7B:C        -123.000 -13.000 100.00 100.00 1000.000  
1:PRO_7B:C          1:ARG+_8B:N        1:ARG+_8B:CA       1:ARG+_8B:C       -142.000 -33.000 100.00 100.00 1000.000
1:ARG+_8B:C         1:ARG+_9B:N        1:ARG+_9B:CA       1:ARG+_9B:C       -135.000 -24.000 100.00 100.00 1000.000
1:ARG+_9B:C         1:PRO_10B:N        1:PRO_10B:CA       1:PRO_10B:C       -121.000 -11.000 100.00 100.00 1000.000
1:PRO_10B:C         1:TYR_11B:N        1:TYR_11B:CA       1:TYR_11B:C       -132.000 -22.000 100.00 100.00 1000.000
1:TYR_11B:C         1:ILE_12B:N        1:ILE_12B:CA       1:ILE_12B:C       -134.000 -24.000 100.00 100.00 1000.000
1:LEU_2B:N          1:LEU_2B:CA        1:LEU_2B:C         1:TYR_3B:N        -88.000  172.000 100.00 100.00 1000.000
1:TYR_3B:N          1:TYR_3B:CA        1:TYR_3B:C         1:GLU-_4B:N       -82.000  178.000 100.00 100.00 1000.000
1:GLU-_4B:N         1:GLU-_4B:CA       1:GLU-_4B:C        1:ASN_5B:N         70.000 -170.000 100.00 100.00 1000.000
1:ASN_5B:N          1:ASN_5B:CA        1:ASN_5B:C         1:LYS+_6B:N        98.000 -142.000 100.00 100.00 1000.000
1:LYS+_6B:N         1:LYS+_6B:CA       1:LYS+_6B:C        1:PRO_7B:N         82.000 -158.000 100.00 100.00 1000.000
1:PRO_7B:N          1:PRO_7B:CA        1:PRO_7B:C         1:ARG+_8B:N       -83.000  177.000 100.00 100.00 1000.000
1:ARG+_8B:N         1:ARG+_8B:CA       1:ARG+_8B:C        1:ARG+_9B:N        83.000 -157.000 100.00 100.00 1000.000
1:ARG+_9B:N         1:ARG+_9B:CA       1:ARG+_9B:C        1:PRO_10B:N        93.000 -147.000 100.00 100.00 1000.000
1:PRO_10B:N         1:PRO_10B:CA       1:PRO_10B:C        1:TYR_11B:N       -85.000  175.000 100.00 100.00 1000.000
1:TYR_11B:N         1:TYR_11B:CA       1:TYR_11B:C        1:ILE_12B:N        89.000 -151.000 100.00 100.00 1000.000
1:ILE_12B:N         1:ILE_12B:CA       1:ILE_12B:C        1:LEUC_13B:N       61.000 -179.000 100.00 100.00 1000.000
1:VALN_1:CA         1:VALN_1:C         1:ARG+_2:N         1:ARG+_2:CA        180.000 180.000 100.00 100.00 1000.000
1:ARG+_2:CA         1:ARG+_2:C         1:ARG+_3:N         1:ARG+_3:CA        180.000 180.000 100.00 100.00 1000.000
1:ARG+_3:CA         1:ARG+_3:C         1:LEU_4:N          1:LEU_4:CA         180.000 180.000 100.00 100.00 1000.000
1:LEU_4:CA          1:LEU_4:C          1:MET_5:N          1:MET_5:CA         180.000 180.000 100.00 100.00 1000.000
1:MET_5:CA          1:MET_5:C          1:PHE_6:N          1:PHE_6:CA         180.000 180.000 100.00 100.00 1000.000
1:PHE_6:CA          1:PHE_6:C          1:SER_7:N          1:SER_7:CA         180.000 180.000 100.00 100.00 1000.000
1:SER_7:CA          1:SER_7:C          1:TYR_8:N          1:TYR_8:CA         180.000 180.000 100.00 100.00 1000.000
1:TYR_8:CA          1:TYR_8:C          1:ILE_9:N          1:ILE_9:CA         180.000 180.000 100.00 100.00 1000.000  
1:ILE_9:CA          1:ILE_9:C          1:SER_10:N         1:SER_10:CA        180.000 180.000 100.00 100.00 1000.000
1:SER_10:CA         1:SER_10:C         1:ASP-_11:N        1:ASP-_11:CA       180.000 180.000 100.00 100.00 1000.000
1:ASP-_11:CA        1:ASP-_11:C        1:GLU-_12:N        1:GLU-_12:CA       180.000 180.000 100.00 100.00 1000.000  
1:GLU-_12:CA        1:GLU-_12:C        1:GLN_13:N         1:GLN_13:CA        180.000 180.000 100.00 100.00 1000.000
1:GLN_13:CA         1:GLN_13:C         1:TRP_14:N         1:TRP_14:CA        180.000 180.000 100.00 100.00 1000.000
1:TRP_14:CA         1:TRP_14:C         1:THR_15:N         1:THR_15:CA        180.000 180.000 100.00 100.00 1000.000
1:THR_15:CA         1:THR_15:C         1:PRO_16:N         1:PRO_16:CA        180.000 180.000 100.00 100.00 1000.000
1:PRO_16:CA         1:PRO_16:C         1:PHE_17:N         1:PHE_17:CA        180.000 180.000 100.00 100.00 1000.000
1:PHE_17:CA         1:PHE_17:C         1:LEU_18:N         1:LEU_18:CA        180.000 180.000 100.00 100.00 1000.000
1:LEU_18:CA         1:LEU_18:C         1:TYR_19:N         1:TYR_19:CA        180.000 180.000 100.00 100.00 1000.000
1:TYR_19:CA         1:TYR_19:C         1:ASP-_20:N        1:ASP-_20:CA       180.000 180.000 100.00 100.00 1000.000
1:ASP-_20:CA        1:ASP-_20:C        1:PHE_21:N         1:PHE_21:CA        180.000 180.000 100.00 100.00 1000.000
1:PHE_21:CA         1:PHE_21:C         1:TYR_22:N         1:TYR_22:CA        180.000 180.000 100.00 100.00 1000.000
1:TYR_22:CA         1:TYR_22:C         1:HIS+_23:N        1:HIS+_23:CA       180.000 180.000 100.00 100.00 1000.000  
1:HIS+_23:CA        1:HIS+_23:C        1:TYRC_24:N        1:TYRC_24:CA       180.000 180.000 100.00 100.00 1000.000
1:VALN_1:C          1:ARG+_2:N         1:ARG+_2:CA        1:ARG+_2:C        -163.000 -53.000 100.00 100.00 1000.000
1:ARG+_2:C          1:ARG+_3:N         1:ARG+_3:CA        1:ARG+_3:C        -148.000 -38.000 100.00 100.00 1000.000
1:ARG+_3:C          1:LEU_4:N          1:LEU_4:CA         1:LEU_4:C         -163.000 -52.000 100.00 100.00 1000.000
1:LEU_4:C           1:MET_5:N          1:MET_5:CA         1:MET_5:C         -138.000 -28.000 100.00 100.00 1000.000
1:MET_5:C           1:PHE_6:N          1:PHE_6:CA         1:PHE_6:C         -160.000 -50.000 100.00 100.00 1000.000
1:PHE_6:C           1:SER_7:N          1:SER_7:CA         1:SER_7:C         -133.000 -23.000 100.00 100.00 1000.000
1:SER_7:C           1:TYR_8:N          1:TYR_8:CA         1:TYR_8:C         -135.000 -25.000 100.00 100.00 1000.000
1:TYR_8:C           1:ILE_9:N          1:ILE_9:CA         1:ILE_9:C         -124.000 -34.000 100.00 100.00 1000.000
1:ILE_9:C           1:SER_10:N         1:SER_10:CA        1:SER_10:C        -124.000 -34.000 100.00 100.00 1000.000
1:SER_10:C          1:ASP-_11:N        1:ASP-_11:CA       1:ASP-_11:C       -132.000 -22.000 100.00 100.00 1000.000
1:ASP-_11:C         1:GLU-_12:N        1:GLU-_12:CA       1:GLU-_12:C       -124.000 -14.000 100.00 100.00 1000.000
1:GLU-_12:C         1:GLN_13:N         1:GLN_13:CA        1:GLN_13:C        -125.000 -15.000 100.00 100.00 1000.000
1:GLN_13:C          1:TRP_14:N         1:TRP_14:CA        1:TRP_14:C        -148.000 -38.000 100.00 100.00 1000.000
1:TRP_14:C          1:THR_15:N         1:THR_15:CA        1:THR_15:C        -162.000 -52.000 100.00 100.00 1000.000
1:THR_15:C          1:PRO_16:N         1:PRO_16:CA        1:PRO_16:C        -130.000 -20.000 100.00 100.00 1000.000
1:PRO_16:C          1:PHE_17:N         1:PHE_17:CA        1:PHE_17:C        -127.000 -17.000 100.00 100.00 1000.000
1:PHE_17:C          1:LEU_18:N         1:LEU_18:CA        1:LEU_18:C        -130.000 -20.000 100.00 100.00 1000.000
1:LEU_18:C          1:TYR_19:N         1:TYR_19:CA        1:TYR_19:C        -129.000 -19.000 100.00 100.00 1000.000
1:TYR_19:C          1:ASP-_20:N        1:ASP-_20:CA       1:ASP-_20:C       -133.000 -23.000 100.00 100.00 1000.000
1:ASP-_20:C         1:PHE_21:N         1:PHE_21:CA        1:PHE_21:C        -120.000 -10.000 100.00 100.00 1000.000
1:PHE_21:C          1:TYR_22:N         1:TYR_22:CA        1:TYR_22:C        -128.000 -18.000 100.00 100.00 1000.000
1:TYR_22:C          1:HIS+_23:N        1:HIS+_23:CA       1:HIS+_23:C       -125.000 -15.000 100.00 100.00 1000.000
1:ARG+_2:N          1:ARG+_2:CA        1:ARG+_2:C         1:ARG+_3:N          82.000 -158.000 100.00 100.00 1000.000
1:ARG+_3:N          1:ARG+_3:CA        1:ARG+_3:C         1:LEU_4:N           61.000 -179.000 100.00 100.00 1000.000
1:LEU_4:N           1:LEU_4:CA         1:LEU_4:C          1:MET_5:N           87.000 -153.000 100.00 100.00 1000.000
1:MET_5:N           1:MET_5:CA         1:MET_5:C          1:PHE_6:N          -81.000  179.000 100.00 100.00 1000.000
1:PHE_6:N           1:PHE_6:CA         1:PHE_6:C          1:SER_7:N          -95.000  165.000 100.00 100.00 1000.000
1:SER_7:N           1:SER_7:CA         1:SER_7:C          1:TYR_8:N          -80.000  180.000 100.00 100.00 1000.000
1:TYR_8:N           1:TYR_8:CA         1:TYR_8:C          1:ILE_9:N           90.000 -150.000 100.00 100.00 1000.000
1:ILE_9:N           1:ILE_9:CA         1:ILE_9:C          1:SER_10:N          97.000 -143.000 100.00 100.00 1000.000
1:SER_10:N          1:SER_10:CA        1:SER_10:C         1:ASP-_11:N        -93.000  167.000 100.00 100.00 1000.000
1:ASP-_11:N         1:ASP-_11:CA       1:ASP-_11:C        1:GLU-_12:N        -87.000  173.000 100.00 100.00 1000.000
1:GLU-_12:N         1:GLU-_12:CA       1:GLU-_12:C        1:GLN_13:N         -96.000  164.000 100.00 100.00 1000.000
1:GLN_13:N          1:GLN_13:CA        1:GLN_13:C         1:TRP_14:N         -80.000  180.000 100.00 100.00 1000.000
1:TRP_14:N          1:TRP_14:CA        1:TRP_14:C         1:THR_15:N         -80.000  180.000 100.00 100.00 1000.000
1:THR_15:N          1:THR_15:CA        1:THR_15:C         1:PRO_16:N          88.000 -152.000 100.00 100.00 1000.000
1:PRO_16:N          1:PRO_16:CA        1:PRO_16:C         1:PHE_17:N         -80.000 -180.000 100.00 100.00 1000.000
1:PHE_17:N          1:PHE_17:CA        1:PHE_17:C         1:LEU_18:N         -92.000  168.000 100.00 100.00 1000.000
1:LEU_18:N          1:LEU_18:CA        1:LEU_18:C         1:TYR_19:N          62.000 -178.000 100.00 100.00 1000.000
1:TYR_19:N          1:TYR_19:CA        1:TYR_19:C         1:ASP-_20:N        -95.000  165.000 100.00 100.00 1000.000
1:ASP-_20:N         1:ASP-_20:CA       1:ASP-_20:C        1:PHE_21:N        -100.000  160.000 100.00 100.00 1000.000
1:PHE_21:N          1:PHE_21:CA        1:PHE_21:C         1:TYR_22:N         -92.000  168.000 100.00 100.00 1000.000
1:TYR_22:N          1:TYR_22:CA        1:TYR_22:C         1:HIS+_23:N        -98.000  162.000 100.00 100.00 1000.000
1:HIS+_23:N         1:HIS+_23:CA       1:HIS+_23:C        1:TYRC_24:N        -99.000  161.000 100.00 100.00 1000.000



  Entry H atom name         Submitted Coord H atom name
  Start of MODEL    1
    1    H1   VAL   1           HN1      VAL   1  11.785  38.014 -16.597
    2    H2   VAL   1           HN2      VAL   1  12.937  38.954 -15.873
    3    H3   VAL   1           HN3      VAL   1  12.072  39.544 -17.148
    4    HA   VAL   1           HA       VAL   1  10.918  38.776 -14.537
    5    HB   VAL   1           HB       VAL   1  10.559  41.205 -14.086
    6   HG11  VAL   1          1HG1      VAL   1  12.806  41.705 -13.230
    7   HG12  VAL   1          2HG1      VAL   1  12.441  39.985 -12.993
    8   HG13  VAL   1          3HG1      VAL   1  13.541  40.487 -14.299
    9   HG21  VAL   1          3HG2      VAL   1  11.827  42.995 -15.210
   10   HG22  VAL   1          1HG2      VAL   1  12.530  41.842 -16.371
   11   HG23  VAL   1          2HG2      VAL   1  10.784  42.187 -16.396
   12    H    ARG   2           HN       ARG   2   8.717  39.245 -14.254
   13    HA   ARG   2           HA       ARG   2   7.101  38.929 -16.747
   14    HB2  ARG   2           HB1      ARG   2   5.274  38.312 -15.465
   15    HB3  ARG   2           HB2      ARG   2   6.649  37.570 -14.688
   16    HG2  ARG   2           HG2      ARG   2   6.564  39.409 -12.885
   17    HG3  ARG   2           HG1      ARG   2   5.173  40.098 -13.727
   18    HD2  ARG   2           HD2      ARG   2   4.035  37.743 -13.461
   19    HD3  ARG   2           HD1      ARG   2   5.317  37.356 -12.312
   20    HE   ARG   2           HE       ARG   2   4.559  39.695 -11.164
   21   HH11  ARG   2          2HH1      ARG   2   2.307  37.377 -12.628
   22   HH12  ARG   2          1HH1      ARG   2   0.894  38.286 -11.894
   23   HH21  ARG   2          1HH2      ARG   2   2.896  40.649 -10.399
   24   HH22  ARG   2          2HH2      ARG   2   1.207  40.022 -10.739
   25    H    ARG   3           HN       ARG   3   5.377  40.233 -17.436
   26    HA   ARG   3           HA       ARG   3   5.693  43.216 -16.940
   27    HB2  ARG   3           HB2      ARG   3   3.985  41.667 -18.980
   28    HB3  ARG   3           HB1      ARG   3   3.943  43.409 -18.788
   29    HG2  ARG   3           HG1      ARG   3   6.392  43.581 -19.370
   30    HG3  ARG   3           HG2      ARG   3   6.472  41.833 -19.540
   31    HD2  ARG   3           HD1      ARG   3   6.283  42.685 -21.760
   32    HD3  ARG   3           HD2      ARG   3   4.753  41.918 -21.412
   33    HE   ARG   3           HE       ARG   3   5.297  44.950 -21.538
   34   HH11  ARG   3          1HH1      ARG   3   2.877  42.337 -21.538
   35   HH12  ARG   3          2HH1      ARG   3   1.605  43.522 -22.121
   36   HH21  ARG   3          2HH2      ARG   3   3.778  46.196 -22.198
   37   HH22  ARG   3          1HH2      ARG   3   2.082  45.554 -22.468
   38    H    LEU   4           HN       LEU   4   4.854  43.452 -14.850
   39    HA   LEU   4           HA       LEU   4   2.318  42.369 -13.905
   40    HB2  LEU   4           HB1      LEU   4   3.831  44.819 -12.799
   41    HB3  LEU   4           HB2      LEU   4   2.411  44.101 -12.092
   42    HG   LEU   4           HG       LEU   4   3.879  41.833 -12.110
   43   HD11  LEU   4          1HD1      LEU   4   5.922  42.806 -13.204
   44   HD12  LEU   4          2HD1      LEU   4   6.280  42.269 -11.557
   45   HD13  LEU   4          3HD1      LEU   4   6.071  44.004 -11.900
   46   HD21  LEU   4          3HD2      LEU   4   4.510  42.321  -9.742
   47   HD22  LEU   4          1HD2      LEU   4   2.870  42.902 -10.084
   48   HD23  LEU   4          2HD2      LEU   4   4.217  44.062  -9.997
   49    H    MET   5           HN       MET   5   0.487  42.815 -14.936
   50    HA   MET   5           HA       MET   5  -0.273  45.699 -15.645
   51    HB2  MET   5           HB1      MET   5   0.691  44.153 -17.542
   52    HB3  MET   5           HB2      MET   5  -0.786  43.227 -17.422
   53    HG2  MET   5           HG2      MET   5  -1.060  44.871 -19.215
   54    HG3  MET   5           HG1      MET   5  -2.074  45.446 -17.889
   55    HE1  MET   5           HE1      MET   5   0.619  46.365 -20.414
   56    HE2  MET   5           HE2      MET   5   1.811  47.366 -19.536
   57    HE3  MET   5           HE3      MET   5   1.729  45.604 -19.234
   58    H    PHE   6           HN       PHE   6  -2.076  46.268 -14.671
   59    HA   PHE   6           HA       PHE   6  -4.487  44.516 -14.572
   60    HB2  PHE   6           HB1      PHE   6  -4.840  44.602 -12.080
   61    HB3  PHE   6           HB2      PHE   6  -3.704  43.468 -12.714
   62    HD1  PHE   6           HD2      PHE   6  -1.284  43.585 -12.195
   63    HD2  PHE   6           HD1      PHE   6  -4.003  46.529 -10.621
   64    HE1  PHE   6           HE2      PHE   6   0.419  44.306 -10.579
   65    HE2  PHE   6           HE1      PHE   6  -2.281  47.242  -9.016
   66    HZ   PHE   6           HZ       PHE   6  -0.069  46.138  -8.991
   67    H    SER   7           HN       SER   7  -3.379  47.542 -12.924
   68    HA   SER   7           HA       SER   7  -6.090  48.745 -13.404
   69    HB2  SER   7           HB2      SER   7  -3.617  49.902 -12.008
   70    HB3  SER   7           HB1      SER   7  -5.138  50.775 -12.221
   71    HG   SER   7           HG       SER   7  -5.199  48.169 -11.190
   72    H    TYR   8           HN       TYR   8  -2.825  50.069 -14.273
   73    HA   TYR   8           HA       TYR   8  -4.075  51.441 -16.680
   74    HB2  TYR   8           HB1      TYR   8  -2.521  52.676 -15.101
   75    HB3  TYR   8           HB2      TYR   8  -1.204  51.644 -15.585
   76    HD1  TYR   8           HD1      TYR   8  -3.572  54.308 -16.726
   77    HD2  TYR   8           HD2      TYR   8  -0.103  51.998 -17.805
   78    HE1  TYR   8           HE1      TYR   8  -3.133  55.830 -18.603
   79    HE2  TYR   8           HE2      TYR   8   0.324  53.531 -19.677
   80    HH   TYR   8           HH       TYR   8  -1.815  56.307 -20.325
   81    H    ILE   9           HN       ILE   9  -4.466  49.829 -18.125
   82    HA   ILE   9           HA       ILE   9  -2.471  47.666 -18.686
   83    HB   ILE   9           HB       ILE   9  -5.242  48.079 -19.893
   84   HG12  ILE   9          2HG1      ILE   9  -4.499  45.963 -17.769
   85   HG13  ILE   9          1HG1      ILE   9  -5.045  47.548 -17.284
   86   HG21  ILE   9          1HG2      ILE   9  -3.414  45.578 -20.004
   87   HG22  ILE   9          2HG2      ILE   9  -3.792  46.641 -21.374
   88   HG23  ILE   9          3HG2      ILE   9  -5.072  45.674 -20.634
   89   HD11  ILE   9          3HD1      ILE   9  -6.730  45.642 -19.018
   90   HD12  ILE   9          1HD1      ILE   9  -7.217  47.274 -18.494
   91   HD13  ILE   9          2HD1      ILE   9  -6.945  45.992 -17.290
   92    H    SER  10           HN       SER  10  -0.767  48.798 -19.573
   93    HA   SER  10           HA       SER  10  -1.039  50.381 -22.117
   94    HB2  SER  10           HB1      SER  10   0.450  51.140 -20.309
   95    HB3  SER  10           HB2      SER  10   1.406  49.657 -20.390
   96    HG   SER  10           HG       SER  10   1.885  50.193 -22.560
   97    H    ASP  11           HN       ASP  11  -1.966  48.533 -23.261
   98    HA   ASP  11           HA       ASP  11   0.159  46.845 -24.702
   99    HB2  ASP  11           HB1      ASP  11  -2.609  45.922 -23.682
  100    HB3  ASP  11           HB2      ASP  11  -1.624  44.990 -24.802
  101    H    GLU  12           HN       GLU  12  -0.243  46.393 -26.835
  102    HA   GLU  12           HA       GLU  12  -1.724  48.467 -28.309
  103    HB2  GLU  12           HB2      GLU  12   0.534  47.750 -28.864
  104    HB3  GLU  12           HB1      GLU  12   0.018  46.139 -29.294
  105    HG2  GLU  12           HG1      GLU  12  -1.030  48.651 -30.773
  106    HG3  GLU  12           HG2      GLU  12   0.544  47.965 -31.127
  107    H    GLN  13           HN       GLN  13  -2.006  45.292 -29.772
  108    HA   GLN  13           HA       GLN  13  -4.891  45.721 -30.160
  109    HB2  GLN  13           HB1      GLN  13  -4.822  43.851 -31.702
  110    HB3  GLN  13           HB2      GLN  13  -3.484  44.936 -31.977
  111    HG2  GLN  13           HG1      GLN  13  -1.987  43.252 -30.630
  112    HG3  GLN  13           HG2      GLN  13  -3.361  42.169 -30.610
  113   HE21  GLN  13          2HE2      GLN  13  -1.182  43.922 -32.812
  114   HE22  GLN  13          1HE2      GLN  13  -1.310  42.698 -34.174
  115    H    TRP  14           HN       TRP  14  -6.551  44.174 -29.905
  116    HA   TRP  14           HA       TRP  14  -6.691  42.951 -27.192
  117    HB2  TRP  14           HB1      TRP  14  -9.018  42.510 -27.655
  118    HB3  TRP  14           HB2      TRP  14  -8.618  44.154 -28.030
  119    HD1  TRP  14           HD1      TRP  14  -8.937  44.998 -30.585
  120    HE1  TRP  14           HE1      TRP  14 -10.095  44.043 -32.755
  121    HE3  TRP  14           HE3      TRP  14  -9.506  40.207 -28.887
  122    HZ2  TRP  14           HZ2      TRP  14 -11.050  41.447 -33.481
  123    HZ3  TRP  14           HZ3      TRP  14 -10.542  38.532 -30.368
  124    HH2  TRP  14           HH2      TRP  14 -11.305  39.139 -32.629
  125    H    THR  15           HN       THR  15  -5.625  41.528 -30.117
  126    HA   THR  15           HA       THR  15  -7.131  39.171 -30.244
  127    HB   THR  15           HB       THR  15  -5.319  38.141 -31.661
  128    HG1  THR  15           HG1      THR  15  -3.729  40.129 -31.985
  129   HG21  THR  15          3HG2      THR  15  -6.964  39.671 -32.739
  130   HG22  THR  15          1HG2      THR  15  -5.356  39.786 -33.491
  131   HG23  THR  15          2HG2      THR  15  -5.914  41.070 -32.393
  132    HA   PRO  16           HA       PRO  16  -5.460  36.533 -26.896
  133    HB2  PRO  16           HB1      PRO  16  -6.785  34.175 -27.363
  134    HB3  PRO  16           HB2      PRO  16  -7.587  35.663 -26.847
  135    HG2  PRO  16           HG1      PRO  16  -7.363  34.595 -29.707
  136    HG3  PRO  16           HG2      PRO  16  -8.832  35.125 -28.854
  137    HD2  PRO  16           HD2      PRO  16  -7.446  36.817 -30.551
  138    HD3  PRO  16           HD1      PRO  16  -8.252  37.445 -29.084
  139    H    PHE  17           HN       PHE  17  -3.318  36.770 -27.804
  140    HA   PHE  17           HA       PHE  17  -2.032  35.097 -29.691
  141    HB2  PHE  17           HB1      PHE  17  -0.661  36.278 -27.204
  142    HB3  PHE  17           HB2      PHE  17   0.151  35.717 -28.635
  143    HD1  PHE  17           HD2      PHE  17  -0.483  36.910 -30.946
  144    HD2  PHE  17           HD1      PHE  17  -1.217  38.616 -27.062
  145    HE1  PHE  17           HE2      PHE  17  -0.473  39.171 -31.922
  146    HE2  PHE  17           HE1      PHE  17  -1.214  40.863 -28.058
  147    HZ   PHE  17           HZ       PHE  17  -0.803  41.145 -30.478
  148    H    LEU  18           HN       LEU  18  -2.163  34.429 -26.183
  149    HA   LEU  18           HA       LEU  18  -1.485  31.499 -26.710
  150    HB2  LEU  18           HB2      LEU  18  -0.251  33.240 -24.481
  151    HB3  LEU  18           HB1      LEU  18  -0.146  31.491 -24.520
  152    HG   LEU  18           HG       LEU  18   1.073  33.332 -26.664
  153   HD11  LEU  18          1HD1      LEU  18   3.268  32.807 -25.584
  154   HD12  LEU  18          2HD1      LEU  18   2.443  31.879 -24.307
  155   HD13  LEU  18          3HD1      LEU  18   2.186  33.635 -24.448
  156   HD21  LEU  18          3HD2      LEU  18   0.609  31.059 -27.606
  157   HD22  LEU  18          1HD2      LEU  18   1.429  30.286 -26.228
  158   HD23  LEU  18          2HD2      LEU  18   2.352  31.278 -27.385
  159    H    TYR  19           HN       TYR  19  -2.419  30.077 -25.248
  160    HA   TYR  19           HA       TYR  19  -4.992  31.093 -24.033
  161    HB2  TYR  19           HB2      TYR  19  -4.760  29.086 -25.670
  162    HB3  TYR  19           HB1      TYR  19  -4.094  28.170 -24.352
  163    HD1  TYR  19           HD1      TYR  19  -7.135  29.852 -25.694
  164    HD2  TYR  19           HD2      TYR  19  -5.631  27.394 -22.495
  165    HE1  TYR  19           HE1      TYR  19  -9.432  29.281 -25.039
  166    HE2  TYR  19           HE2      TYR  19  -7.932  26.855 -21.837
  167    HH   TYR  19           HH       TYR  19 -10.092  27.061 -22.336
  168    H    ASP  20           HN       ASP  20  -3.460  32.198 -22.423
  169    HA   ASP  20           HA       ASP  20  -2.808  30.479 -20.000
  170    HB2  ASP  20           HB2      ASP  20  -2.073  33.399 -20.627
  171    HB3  ASP  20           HB1      ASP  20  -1.636  32.543 -19.161
  172    H    PHE  21           HN       PHE  21  -3.780  33.810 -19.488
  173    HA   PHE  21           HA       PHE  21  -6.268  32.818 -18.001
  174    HB2  PHE  21           HB2      PHE  21  -4.352  33.629 -16.591
  175    HB3  PHE  21           HB1      PHE  21  -4.469  35.211 -17.315
  176    HD1  PHE  21           HD1      PHE  21  -6.388  32.669 -15.272
  177    HD2  PHE  21           HD2      PHE  21  -6.077  36.800 -16.409
  178    HE1  PHE  21           HE1      PHE  21  -8.032  33.277 -13.544
  179    HE2  PHE  21           HE2      PHE  21  -7.722  37.396 -14.676
  180    HZ   PHE  21           HZ       PHE  21  -8.703  35.638 -13.243
  181    H    TYR  22           HN       TYR  22  -5.265  36.061 -19.297
  182    HA   TYR  22           HA       TYR  22  -8.112  36.600 -20.091
  183    HB2  TYR  22           HB1      TYR  22  -5.599  38.329 -20.430
  184    HB3  TYR  22           HB2      TYR  22  -7.189  38.820 -20.936
  185    HD1  TYR  22           HD2      TYR  22  -9.123  38.710 -19.044
  186    HD2  TYR  22           HD1      TYR  22  -4.915  38.973 -18.240
  187    HE1  TYR  22           HE2      TYR  22  -9.601  39.709 -16.849
  188    HE2  TYR  22           HE1      TYR  22  -5.398  39.971 -16.042
  189    HH   TYR  22           HH       TYR  22  -8.747  40.428 -14.922
  190    H    HIS  23           HN       HIS  23  -8.598  35.175 -21.691
  191    HA   HIS  23           HA       HIS  23  -7.328  35.645 -24.443
  192    HB2  HIS  23           HB2      HIS  23  -7.576  33.212 -24.972
  193    HB3  HIS  23           HB1      HIS  23  -6.308  33.655 -23.870
  194    HD1  HIS  23           HD1      HIS  23 -10.004  32.246 -23.389
  195    HD2  HIS  23           HD2      HIS  23  -6.090  32.290 -21.694
  196    HE1  HIS  23           HE1      HIS  23  -9.895  30.650 -21.379
  197    HE2  HIS  23           HE2      HIS  23  -7.574  30.613 -20.264
  198    H    TYR  24           HN       TYR  24  -8.888  36.947 -25.153
  199    HA   TYR  24           HA       TYR  24 -11.754  35.843 -25.374
  200    HB2  TYR  24           HB2      TYR  24 -11.145  37.987 -23.873
  201    HB3  TYR  24           HB1      TYR  24 -11.030  38.817 -25.390
  202    HD1  TYR  24           HD2      TYR  24 -13.244  38.416 -27.038
  203    HD2  TYR  24           HD1      TYR  24 -13.200  38.075 -22.744
  204    HE1  TYR  24           HE2      TYR  24 -15.648  38.886 -26.966
  205    HE2  TYR  24           HE1      TYR  24 -15.603  38.565 -22.691
  206    HH   TYR  24           HH       TYR  24 -17.441  39.101 -25.702
  207    H1   PCA   1           HN       PCA   1 -27.531  43.206 -21.872
  208    HA   PCA   1           HA       PCA   1 -28.896  43.987 -19.587
  209    HB2  PCA   1           HB2      PCA   1 -27.722  41.291 -18.720
  210    HB3  PCA   1           HB1      PCA   1 -29.198  42.091 -18.143
  211    HG2  PCA   1           HG2      PCA   1 -30.455  41.365 -20.078
  212    HG3  PCA   1           HG1      PCA   1 -29.243  40.045 -20.038
  213    H    LEU   2           HN       LEU   2 -27.412  43.748 -17.351
  214    HA   LEU   2           HA       LEU   2 -25.020  45.402 -18.067
  215    HB2  LEU   2           HB2      LEU   2 -26.783  45.927 -16.242
  216    HB3  LEU   2           HB1      LEU   2 -26.008  44.736 -15.241
  217    HG   LEU   2           HG       LEU   2 -25.384  47.005 -14.663
  218   HD11  LEU   2          2HD1      LEU   2 -22.852  45.704 -15.827
  219   HD12  LEU   2          3HD1      LEU   2 -22.945  46.892 -14.508
  220   HD13  LEU   2          1HD1      LEU   2 -23.617  45.265 -14.278
  221   HD21  LEU   2          1HD2      LEU   2 -25.653  48.117 -16.899
  222   HD22  LEU   2          2HD2      LEU   2 -24.153  48.587 -16.076
  223   HD23  LEU   2          3HD2      LEU   2 -24.096  47.432 -17.427
  224    H    TYR   3           HN       TYR   3 -23.759  43.825 -19.030
  225    HA   TYR   3           HA       TYR   3 -22.009  42.243 -17.103
  226    HB2  TYR   3           HB1      TYR   3 -21.730  40.429 -18.892
  227    HB3  TYR   3           HB2      TYR   3 -23.124  40.423 -17.877
  228    HD1  TYR   3           HD1      TYR   3 -22.144  41.634 -21.380
  229    HD2  TYR   3           HD2      TYR   3 -25.220  39.983 -18.856
  230    HE1  TYR   3           HE1      TYR   3 -23.636  41.437 -23.311
  231    HE2  TYR   3           HE2      TYR   3 -26.673  39.737 -20.809
  232    HH   TYR   3           HH       TYR   3 -26.992  40.390 -22.960
  233    H    GLU   4           HN       GLU   4 -19.956  42.693 -17.314
  234    HA   GLU   4           HA       GLU   4 -19.063  44.673 -19.381
  235    HB2  GLU   4           HB1      GLU   4 -18.635  44.932 -16.930
  236    HB3  GLU   4           HB2      GLU   4 -17.602  43.516 -16.941
  237    HG2  GLU   4           HG2      GLU   4 -16.281  45.564 -16.895
  238    HG3  GLU   4           HG1      GLU   4 -15.933  44.667 -18.360
  239    H    ASN   5           HN       ASN   5 -19.429  43.003 -21.061
  240    HA   ASN   5           HA       ASN   5 -17.181  41.028 -21.540
  241    HB2  ASN   5           HB1      ASN   5 -19.906  41.568 -22.863
  242    HB3  ASN   5           HB2      ASN   5 -18.708  40.644 -23.709
  243   HD21  ASN   5          1HD2      ASN   5 -18.240  38.540 -23.037
  244   HD22  ASN   5          2HD2      ASN   5 -19.204  37.690 -21.727
  245    H    LYS   6           HN       LYS   6 -15.438  42.274 -21.928
  246    HA   LYS   6           HA       LYS   6 -15.387  43.898 -24.531
  247    HB2  LYS   6           HB1      LYS   6 -13.628  44.432 -22.064
  248    HB3  LYS   6           HB2      LYS   6 -13.564  45.295 -23.586
  249    HG2  LYS   6           HG2      LYS   6 -15.861  45.352 -21.554
  250    HG3  LYS   6           HG1      LYS   6 -14.672  46.608 -21.852
  251    HD2  LYS   6           HD1      LYS   6 -15.615  46.777 -24.277
  252    HD3  LYS   6           HD2      LYS   6 -16.917  45.715 -23.771
  253    HE2  LYS   6           HE1      LYS   6 -16.291  48.515 -22.624
  254    HE3  LYS   6           HE2      LYS   6 -17.606  48.102 -23.723
  255    HZ1  LYS   6           HZ1      LYS   6 -17.318  47.188 -20.921
  256    HZ2  LYS   6           HZ2      LYS   6 -18.451  48.232 -21.499
  257    HZ3  LYS   6           HZ3      LYS   6 -18.499  46.628 -21.924
  258    HA   PRO   7           HA       PRO   7 -12.298  40.776 -25.642
  259    HB2  PRO   7           HB1      PRO   7 -11.148  41.860 -27.890
  260    HB3  PRO   7           HB2      PRO   7 -12.804  41.261 -27.815
  261    HG2  PRO   7           HG1      PRO   7 -11.861  44.163 -27.527
  262    HG3  PRO   7           HG2      PRO   7 -13.148  43.535 -28.586
  263    HD2  PRO   7           HD2      PRO   7 -13.734  44.640 -26.126
  264    HD3  PRO   7           HD1      PRO   7 -14.667  43.239 -26.735
  265    H    ARG   8           HN       ARG   8 -10.590  40.284 -24.515
  266    HA   ARG   8           HA       ARG   8  -8.417  42.346 -23.827
  267    HB2  ARG   8           HB1      ARG   8  -9.567  40.050 -22.118
  268    HB3  ARG   8           HB2      ARG   8  -8.164  41.010 -21.674
  269    HG2  ARG   8           HG1      ARG   8  -9.532  43.109 -21.657
  270    HG3  ARG   8           HG2      ARG   8 -10.952  42.216 -22.138
  271    HD2  ARG   8           HD1      ARG   8 -11.482  41.696 -19.995
  272    HD3  ARG   8           HD2      ARG   8 -10.006  40.796 -19.812
  273    HE   ARG   8           HE       ARG   8  -8.933  42.632 -18.685
  274   HH11  ARG   8          1HH1      ARG   8 -12.115  43.672 -19.873
  275   HH12  ARG   8          2HH1      ARG   8 -12.017  45.188 -18.840
  276   HH21  ARG   8          1HH2      ARG   8  -8.927  44.387 -17.563
  277   HH22  ARG   8          2HH2      ARG   8 -10.331  45.565 -17.619
  278    H    ARG   9           HN       ARG   9  -6.495  41.887 -24.526
  279    HA   ARG   9           HA       ARG   9  -5.560  39.251 -25.516
  280    HB2  ARG   9           HB1      ARG   9  -3.594  40.344 -26.189
  281    HB3  ARG   9           HB2      ARG   9  -4.820  41.529 -26.409
  282    HG2  ARG   9           HG1      ARG   9  -2.809  41.447 -24.071
  283    HG3  ARG   9           HG2      ARG   9  -2.616  42.389 -25.522
  284    HD2  ARG   9           HD1      ARG   9  -4.961  42.832 -23.537
  285    HD3  ARG   9           HD2      ARG   9  -3.410  43.640 -23.431
  286    HE   ARG   9           HE       ARG   9  -4.355  44.059 -26.140
  287   HH11  ARG   9          2HH2      ARG   9  -5.203  45.101 -22.855
  288   HH12  ARG   9          1HH2      ARG   9  -5.725  46.737 -23.504
  289   HH21  ARG   9          1HH1      ARG   9  -4.923  45.950 -26.749
  290   HH22  ARG   9          2HH1      ARG   9  -5.574  47.185 -25.559
  291    HA   PRO  10           HA       PRO  10  -3.827  37.533 -21.675
  292    HB2  PRO  10           HB2      PRO  10  -1.533  36.175 -22.433
  293    HB3  PRO  10           HB1      PRO  10  -3.180  35.693 -22.860
  294    HG2  PRO  10           HG2      PRO  10  -1.237  37.341 -24.572
  295    HG3  PRO  10           HG1      PRO  10  -2.129  35.874 -25.043
  296    HD2  PRO  10           HD1      PRO  10  -3.116  38.311 -25.702
  297    HD3  PRO  10           HD2      PRO  10  -4.241  37.060 -25.111
  298    H    TYR  11           HN       TYR  11  -3.562  39.670 -20.803
  299    HA   TYR  11           HA       TYR  11  -0.718  40.621 -20.365
  300    HB2  TYR  11           HB2      TYR  11  -1.585  42.662 -19.594
  301    HB3  TYR  11           HB1      TYR  11  -2.348  42.270 -21.093
  302    HD1  TYR  11           HD2      TYR  11  -2.893  42.489 -17.419
  303    HD2  TYR  11           HD1      TYR  11  -4.845  42.126 -21.222
  304    HE1  TYR  11           HE2      TYR  11  -5.045  42.987 -16.355
  305    HE2  TYR  11           HE1      TYR  11  -7.006  42.593 -20.147
  306    HH   TYR  11           HH       TYR  11  -7.221  42.977 -16.601
  307    H    ILE  12           HN       ILE  12   0.399  40.007 -18.623
  308    HA   ILE  12           HA       ILE  12  -0.899  38.197 -16.686
  309    HB   ILE  12           HB       ILE  12   1.161  37.572 -17.742
  310   HG12  ILE  12          2HG1      ILE  12   1.492  37.655 -14.697
  311   HG13  ILE  12          1HG1      ILE  12   0.350  36.615 -15.523
  312   HG21  ILE  12          2HG2      ILE  12   2.733  39.558 -15.983
  313   HG22  ILE  12          3HG2      ILE  12   3.398  38.391 -17.143
  314   HG23  ILE  12          1HG2      ILE  12   2.446  39.756 -17.732
  315   HD11  ILE  12          1HD1      ILE  12   3.415  36.454 -15.831
  316   HD12  ILE  12          2HD1      ILE  12   2.356  35.320 -14.968
  317   HD13  ILE  12          3HD1      ILE  12   2.248  35.455 -16.741
  318    H    LEU  13           HN       LEU  13  -2.002  38.935 -15.080
  319    HA   LEU  13           HA       LEU  13  -1.447  41.482 -13.666
  320    HB2  LEU  13           HB1      LEU  13  -3.465  41.223 -12.507
  321    HB3  LEU  13           HB2      LEU  13  -3.769  40.812 -14.173
  322    HG   LEU  13           HG       LEU  13  -3.531  38.810 -11.822
  323   HD11  LEU  13          1HD2      LEU  13  -5.998  38.586 -12.012
  324   HD12  LEU  13          2HD2      LEU  13  -6.029  39.816 -13.302
  325   HD13  LEU  13          3HD2      LEU  13  -5.535  40.261 -11.649
  326   HD21  LEU  13          2HD1      LEU  13  -2.920  37.571 -13.869
  327   HD22  LEU  13          3HD1      LEU  13  -4.321  38.227 -14.751
  328   HD23  LEU  13          1HD1      LEU  13  -4.553  37.097 -13.393
  Start of MODEL    2
    1    H1   VAL   1           HN1      VAL   1   2.552  36.648 -19.288
    2    H2   VAL   1           HN2      VAL   1   1.380  35.557 -19.675
    3    H3   VAL   1           HN3      VAL   1   1.080  36.732 -18.560
    4    HA   VAL   1           HA       VAL   1   1.406  34.616 -17.417
    5    HB   VAL   1           HB       VAL   1   4.147  34.627 -18.815
    6   HG11  VAL   1          1HG1      VAL   1   2.969  32.621 -16.771
    7   HG12  VAL   1          2HG1      VAL   1   4.344  33.716 -16.484
    8   HG13  VAL   1          3HG1      VAL   1   4.489  32.411 -17.674
    9   HG21  VAL   1          3HG2      VAL   1   2.332  33.800 -20.350
   10   HG22  VAL   1          1HG2      VAL   1   3.359  32.458 -19.824
   11   HG23  VAL   1          2HG2      VAL   1   1.754  32.677 -19.090
   12    H    ARG   2           HN       ARG   2   4.487  36.500 -17.647
   13    HA   ARG   2           HA       ARG   2   3.722  37.852 -15.036
   14    HB2  ARG   2           HB2      ARG   2   6.256  36.158 -15.490
   15    HB3  ARG   2           HB1      ARG   2   6.188  37.396 -14.250
   16    HG2  ARG   2           HG1      ARG   2   4.174  35.071 -14.365
   17    HG3  ARG   2           HG2      ARG   2   5.686  34.969 -13.493
   18    HD2  ARG   2           HD2      ARG   2   3.594  37.173 -12.939
   19    HD3  ARG   2           HD1      ARG   2   3.587  35.614 -12.117
   20    HE   ARG   2           HE       ARG   2   6.212  36.392 -11.626
   21   HH11  ARG   2          1HH1      ARG   2   3.225  38.253 -11.336
   22   HH12  ARG   2          2HH1      ARG   2   3.826  39.017  -9.794
   23   HH21  ARG   2          1HH2      ARG   2   6.855  37.406  -9.916
   24   HH22  ARG   2          2HH2      ARG   2   5.766  38.605  -9.067
   25    H    ARG   3           HN       ARG   3   4.343  39.889 -14.941
   26    HA   ARG   3           HA       ARG   3   6.455  40.946 -16.838
   27    HB2  ARG   3           HB2      ARG   3   3.555  42.006 -16.895
   28    HB3  ARG   3           HB1      ARG   3   4.937  42.852 -17.575
   29    HG2  ARG   3           HG1      ARG   3   5.367  40.662 -19.005
   30    HG3  ARG   3           HG2      ARG   3   3.767  40.163 -18.479
   31    HD2  ARG   3           HD2      ARG   3   3.482  41.198 -20.640
   32    HD3  ARG   3           HD1      ARG   3   2.809  42.344 -19.470
   33    HE   ARG   3           HE       ARG   3   5.576  43.102 -19.774
   34   HH11  ARG   3          1HH2      ARG   3   2.736  42.823 -21.886
   35   HH12  ARG   3          2HH2      ARG   3   3.392  44.181 -22.927
   36   HH21  ARG   3          1HH1      ARG   3   6.185  44.675 -21.019
   37   HH22  ARG   3          2HH1      ARG   3   5.152  45.202 -22.440
   38    H    LEU   4           HN       LEU   4   7.634  42.422 -15.900
   39    HA   LEU   4           HA       LEU   4   6.968  43.354 -13.134
   40    HB2  LEU   4           HB1      LEU   4   9.346  43.982 -14.992
   41    HB3  LEU   4           HB2      LEU   4   9.248  44.512 -13.325
   42    HG   LEU   4           HG       LEU   4   9.256  41.555 -14.179
   43   HD11  LEU   4          3HD2      LEU   4  11.516  43.317 -13.021
   44   HD12  LEU   4          1HD2      LEU   4  11.616  41.567 -13.341
   45   HD13  LEU   4          2HD2      LEU   4  11.423  42.705 -14.692
   46   HD21  LEU   4          1HD1      LEU   4   9.738  41.131 -11.737
   47   HD22  LEU   4          2HD1      LEU   4   8.142  41.876 -11.954
   48   HD23  LEU   4          3HD1      LEU   4   9.514  42.862 -11.383
   49    H    MET   5           HN       MET   5   7.441  45.695 -12.570
   50    HA   MET   5           HA       MET   5   5.440  47.369 -13.981
   51    HB2  MET   5           HB2      MET   5   7.391  48.050 -11.704
   52    HB3  MET   5           HB1      MET   5   6.179  49.161 -12.327
   53    HG2  MET   5           HG1      MET   5   4.329  47.574 -11.719
   54    HG3  MET   5           HG2      MET   5   5.504  46.410 -11.085
   55    HE1  MET   5           HE1      MET   5   6.496  46.443  -8.774
   56    HE2  MET   5           HE2      MET   5   7.635  47.687  -9.375
   57    HE3  MET   5           HE3      MET   5   6.798  47.922  -7.813
   58    H    PHE   6           HN       PHE   6   5.976  47.913 -15.964
   59    HA   PHE   6           HA       PHE   6   8.684  49.091 -16.589
   60    HB2  PHE   6           HB2      PHE   6   7.954  48.931 -18.982
   61    HB3  PHE   6           HB1      PHE   6   8.056  47.423 -18.114
   62    HD1  PHE   6           HD2      PHE   6   5.613  49.905 -19.468
   63    HD2  PHE   6           HD1      PHE   6   6.148  45.993 -17.875
   64    HE1  PHE   6           HE2      PHE   6   3.330  49.305 -20.140
   65    HE2  PHE   6           HE1      PHE   6   3.863  45.417 -18.534
   66    HZ   PHE   6           HZ       PHE   6   2.461  47.078 -19.675
   67    H    SER   7           HN       SER   7   9.113  51.127 -16.924
   68    HA   SER   7           HA       SER   7   7.119  53.222 -16.443
   69    HB2  SER   7           HB1      SER   7   9.986  53.473 -17.545
   70    HB3  SER   7           HB2      SER   7   8.981  54.821 -16.991
   71    HG   SER   7           HG       SER   7  10.332  54.062 -15.343
   72    H    TYR   8           HN       TYR   8   8.814  52.335 -19.485
   73    HA   TYR   8           HA       TYR   8   7.108  54.275 -21.052
   74    HB2  TYR   8           HB1      TYR   8   9.187  52.197 -21.991
   75    HB3  TYR   8           HB2      TYR   8   8.294  53.248 -23.069
   76    HD1  TYR   8           HD1      TYR   8   8.599  55.747 -22.949
   77    HD2  TYR   8           HD2      TYR   8  11.080  53.089 -20.728
   78    HE1  TYR   8           HE1      TYR   8  10.249  57.528 -22.645
   79    HE2  TYR   8           HE2      TYR   8  12.719  54.875 -20.431
   80    HH   TYR   8           HH       TYR   8  13.237  56.978 -20.842
   81    H    ILE   9           HN       ILE   9   5.121  53.751 -21.576
   82    HA   ILE   9           HA       ILE   9   3.969  51.164 -21.134
   83    HB   ILE   9           HB       ILE   9   1.925  51.978 -22.315
   84   HG12  ILE   9          1HG1      ILE   9   3.325  54.709 -22.534
   85   HG13  ILE   9          2HG1      ILE   9   3.177  53.620 -23.904
   86   HG21  ILE   9          1HG2      ILE   9   1.366  53.598 -20.509
   87   HG22  ILE   9          2HG2      ILE   9   3.092  53.827 -20.139
   88   HG23  ILE   9          3HG2      ILE   9   2.316  52.249 -19.860
   89   HD11  ILE   9          3HD1      ILE   9   0.784  54.781 -22.334
   90   HD12  ILE   9          1HD1      ILE   9   1.323  55.251 -23.963
   91   HD13  ILE   9          2HD1      ILE   9   0.656  53.624 -23.685
   92    H    SER  10           HN       SER  10   4.893  49.518 -22.079
   93    HA   SER  10           HA       SER  10   4.396  49.171 -25.099
   94    HB2  SER  10           HB2      SER  10   6.714  48.039 -23.406
   95    HB3  SER  10           HB1      SER  10   6.436  47.715 -25.124
   96    HG   SER  10           HG       SER  10   6.701  50.324 -24.031
   97    H    ASP  11           HN       ASP  11   2.258  48.521 -24.147
   98    HA   ASP  11           HA       ASP  11   2.229  45.820 -22.858
   99    HB2  ASP  11           HB1      ASP  11  -0.118  46.142 -22.517
  100    HB3  ASP  11           HB2      ASP  11   0.753  47.575 -22.028
  101    H    GLU  12           HN       GLU  12   1.093  43.997 -23.660
  102    HA   GLU  12           HA       GLU  12   1.660  43.628 -26.597
  103    HB2  GLU  12           HB1      GLU  12   1.765  41.315 -26.189
  104    HB3  GLU  12           HB2      GLU  12   2.646  42.108 -24.907
  105    HG2  GLU  12           HG1      GLU  12  -0.091  40.700 -24.701
  106    HG3  GLU  12           HG2      GLU  12   1.426  40.202 -23.982
  107    H    GLN  13           HN       GLN  13  -0.351  45.163 -26.787
  108    HA   GLN  13           HA       GLN  13  -2.913  43.567 -26.861
  109    HB2  GLN  13           HB2      GLN  13  -2.742  45.959 -26.052
  110    HB3  GLN  13           HB1      GLN  13  -2.463  46.481 -27.708
  111    HG2  GLN  13           HG2      GLN  13  -4.720  45.644 -28.397
  112    HG3  GLN  13           HG1      GLN  13  -4.942  44.834 -26.851
  113   HE21  GLN  13          2HE2      GLN  13  -4.652  48.023 -28.344
  114   HE22  GLN  13          1HE2      GLN  13  -5.564  48.881 -26.998
  115    H    TRP  14           HN       TRP  14  -1.454  42.184 -28.379
  116    HA   TRP  14           HA       TRP  14  -2.725  42.527 -31.104
  117    HB2  TRP  14           HB2      TRP  14  -0.429  43.706 -31.122
  118    HB3  TRP  14           HB1      TRP  14   0.326  42.142 -30.859
  119    HD1  TRP  14           HD1      TRP  14  -1.821  44.103 -33.482
  120    HE1  TRP  14           HE1      TRP  14  -1.617  43.030 -35.897
  121    HE3  TRP  14           HE3      TRP  14   0.884  40.062 -32.095
  122    HZ2  TRP  14           HZ2      TRP  14  -0.396  40.685 -36.850
  123    HZ3  TRP  14           HZ3      TRP  14   1.527  38.409 -33.796
  124    HH2  TRP  14           HH2      TRP  14   0.898  38.714 -36.140
  125    H    THR  15           HN       THR  15  -3.930  40.708 -30.674
  126    HA   THR  15           HA       THR  15  -2.398  38.087 -30.894
  127    HB   THR  15           HB       THR  15  -3.812  36.972 -29.180
  128    HG1  THR  15           HG1      THR  15  -5.408  38.671 -29.227
  129   HG21  THR  15          3HG2      THR  15  -1.480  37.787 -28.580
  130   HG22  THR  15          1HG2      THR  15  -2.210  39.272 -27.913
  131   HG23  THR  15          2HG2      THR  15  -2.597  37.684 -27.203
  132    HA   PRO  16           HA       PRO  16  -5.894  37.903 -33.916
  133    HB2  PRO  16           HB1      PRO  16  -4.546  35.177 -34.297
  134    HB3  PRO  16           HB2      PRO  16  -5.207  36.267 -35.539
  135    HG2  PRO  16           HG1      PRO  16  -2.528  36.259 -35.113
  136    HG3  PRO  16           HG2      PRO  16  -3.355  37.829 -35.266
  137    HD2  PRO  16           HD1      PRO  16  -2.436  36.443 -32.695
  138    HD3  PRO  16           HD2      PRO  16  -2.324  38.174 -33.154
  139    H    PHE  17           HN       PHE  17  -5.058  35.121 -31.838
  140    HA   PHE  17           HA       PHE  17  -8.023  34.422 -31.566
  141    HB2  PHE  17           HB1      PHE  17  -6.318  32.577 -32.021
  142    HB3  PHE  17           HB2      PHE  17  -5.550  32.924 -30.483
  143    HD1  PHE  17           HD2      PHE  17  -6.745  32.377 -28.356
  144    HD2  PHE  17           HD1      PHE  17  -8.523  31.500 -32.127
  145    HE1  PHE  17           HE2      PHE  17  -8.358  30.905 -27.259
  146    HE2  PHE  17           HE1      PHE  17 -10.128  30.024 -31.019
  147    HZ   PHE  17           HZ       PHE  17 -10.050  29.725 -28.587
  148    H    LEU  18           HN       LEU  18  -8.987  35.608 -30.048
  149    HA   LEU  18           HA       LEU  18  -7.514  37.163 -28.052
  150    HB2  LEU  18           HB1      LEU  18 -10.507  36.644 -28.494
  151    HB3  LEU  18           HB2      LEU  18  -9.942  37.498 -27.075
  152    HG   LEU  18           HG       LEU  18  -8.754  39.195 -28.499
  153   HD11  LEU  18          3HD2      LEU  18  -8.492  37.991 -30.668
  154   HD12  LEU  18          1HD2      LEU  18  -9.498  39.427 -30.914
  155   HD13  LEU  18          2HD2      LEU  18 -10.260  37.819 -30.829
  156   HD21  LEU  18          1HD1      LEU  18 -11.792  38.887 -28.960
  157   HD22  LEU  18          2HD1      LEU  18 -11.025  39.587 -27.512
  158   HD23  LEU  18          3HD1      LEU  18 -10.863  40.402 -29.083
  159    H    TYR  19           HN       TYR  19  -7.353  37.060 -25.936
  160    HA   TYR  19           HA       TYR  19  -7.552  34.294 -24.638
  161    HB2  TYR  19           HB2      TYR  19  -5.359  35.482 -24.666
  162    HB3  TYR  19           HB1      TYR  19  -6.067  36.905 -23.937
  163    HD1  TYR  19           HD1      TYR  19  -5.148  33.350 -23.277
  164    HD2  TYR  19           HD2      TYR  19  -6.303  37.079 -21.571
  165    HE1  TYR  19           HE1      TYR  19  -4.434  32.572 -21.065
  166    HE2  TYR  19           HE2      TYR  19  -5.576  36.299 -19.379
  167    HH   TYR  19           HH       TYR  19  -4.852  34.574 -18.161
  168    H    ASP  20           HN       ASP  20  -9.812  34.336 -24.394
  169    HA   ASP  20           HA       ASP  20 -11.169  36.611 -23.118
  170    HB2  ASP  20           HB2      ASP  20 -12.070  34.931 -24.889
  171    HB3  ASP  20           HB1      ASP  20 -12.401  33.839 -23.546
  172    H    PHE  21           HN       PHE  21  -9.647  36.546 -21.277
  173    HA   PHE  21           HA       PHE  21 -10.946  35.038 -18.926
  174    HB2  PHE  21           HB1      PHE  21  -8.040  35.936 -19.388
  175    HB3  PHE  21           HB2      PHE  21  -8.643  35.599 -17.788
  176    HD1  PHE  21           HD1      PHE  21  -8.320  33.954 -21.162
  177    HD2  PHE  21           HD2      PHE  21  -8.631  33.423 -16.948
  178    HE1  PHE  21           HE1      PHE  21  -7.851  31.571 -21.423
  179    HE2  PHE  21           HE2      PHE  21  -8.160  31.041 -17.219
  180    HZ   PHE  21           HZ       PHE  21  -7.765  30.111 -19.454
  181    H    TYR  22           HN       TYR  22 -11.823  36.242 -17.384
  182    HA   TYR  22           HA       TYR  22 -12.138  39.123 -17.791
  183    HB2  TYR  22           HB1      TYR  22 -13.835  37.571 -16.736
  184    HB3  TYR  22           HB2      TYR  22 -12.848  37.476 -15.291
  185    HD1  TYR  22           HD2      TYR  22 -14.319  40.099 -17.578
  186    HD2  TYR  22           HD1      TYR  22 -13.457  38.972 -13.560
  187    HE1  TYR  22           HE2      TYR  22 -15.456  42.095 -16.769
  188    HE2  TYR  22           HE1      TYR  22 -14.634  40.963 -12.760
  189    HH   TYR  22           HH       TYR  22 -16.325  43.104 -15.002
  190    H    HIS  23           HN       HIS  23 -10.354  37.439 -15.157
  191    HA   HIS  23           HA       HIS  23  -8.615  39.943 -14.974
  192    HB2  HIS  23           HB1      HIS  23 -10.318  39.961 -13.100
  193    HB3  HIS  23           HB2      HIS  23  -9.670  38.437 -12.507
  194    HD1  HIS  23           HD1      HIS  23  -8.692  42.189 -12.921
  195    HD2  HIS  23           HD2      HIS  23  -7.105  38.497 -11.448
  196    HE1  HIS  23           HE1      HIS  23  -6.629  42.646 -11.431
  197    HE2  HIS  23           HE2      HIS  23  -5.586  40.476 -10.505
  198    H    TYR  24           HN       TYR  24  -7.186  38.853 -16.269
  199    HA   TYR  24           HA       TYR  24  -5.098  37.820 -16.544
  200    HB2  TYR  24           HB1      TYR  24  -5.260  36.753 -13.681
  201    HB3  TYR  24           HB2      TYR  24  -3.888  36.635 -14.743
  202    HD1  TYR  24           HD1      TYR  24  -4.567  39.826 -15.667
  203    HD2  TYR  24           HD2      TYR  24  -3.578  37.669 -12.124
  204    HE1  TYR  24           HE1      TYR  24  -3.529  41.819 -14.737
  205    HE2  TYR  24           HE2      TYR  24  -2.521  39.670 -11.214
  206    HH   TYR  24           HH       TYR  24  -1.887  41.751 -11.616
  207    H1   PCA   1           HN       PCA   1 -20.821  39.620 -11.743
  208    HA   PCA   1           HA       PCA   1 -19.750  41.941 -11.124
  209    HB2  PCA   1           HB2      PCA   1 -17.576  41.285 -10.651
  210    HB3  PCA   1           HB1      PCA   1 -17.200  41.753 -12.317
  211    HG2  PCA   1           HG2      PCA   1 -16.809  39.157 -11.342
  212    HG3  PCA   1           HG1      PCA   1 -17.226  39.457 -13.058
  213    H    LEU   2           HN       LEU   2 -18.580  43.482 -12.930
  214    HA   LEU   2           HA       LEU   2 -20.600  43.545 -15.151
  215    HB2  LEU   2           HB1      LEU   2 -19.909  45.600 -13.855
  216    HB3  LEU   2           HB2      LEU   2 -18.279  45.448 -14.495
  217    HG   LEU   2           HG       LEU   2 -19.214  45.727 -16.856
  218   HD11  LEU   2          2HD1      LEU   2 -21.835  46.406 -15.355
  219   HD12  LEU   2          3HD1      LEU   2 -21.527  46.705 -17.084
  220   HD13  LEU   2          1HD1      LEU   2 -21.596  45.041 -16.477
  221   HD21  LEU   2          1HD2      LEU   2 -19.560  48.192 -16.612
  222   HD22  LEU   2          2HD2      LEU   2 -19.801  48.006 -14.855
  223   HD23  LEU   2          3HD2      LEU   2 -18.218  47.640 -15.590
  224    H    TYR   3           HN       TYR   3 -20.199  42.039 -16.659
  225    HA   TYR   3           HA       TYR   3 -17.417  41.517 -17.679
  226    HB2  TYR   3           HB1      TYR   3 -20.125  40.311 -18.478
  227    HB3  TYR   3           HB2      TYR   3 -18.600  39.859 -19.210
  228    HD1  TYR   3           HD1      TYR   3 -16.780  38.806 -17.809
  229    HD2  TYR   3           HD2      TYR   3 -20.690  39.467 -16.252
  230    HE1  TYR   3           HE1      TYR   3 -16.316  37.266 -15.964
  231    HE2  TYR   3           HE2      TYR   3 -20.216  37.930 -14.418
  232    HH   TYR   3           HH       TYR   3 -18.587  36.852 -13.316
  233    H    GLU   4           HN       GLU   4 -16.877  43.504 -18.492
  234    HA   GLU   4           HA       GLU   4 -18.366  44.732 -20.734
  235    HB2  GLU   4           HB2      GLU   4 -15.469  45.239 -19.803
  236    HB3  GLU   4           HB1      GLU   4 -16.370  46.231 -20.942
  237    HG2  GLU   4           HG1      GLU   4 -18.091  46.726 -19.098
  238    HG3  GLU   4           HG2      GLU   4 -17.055  45.854 -17.958
  239    H    ASN   5           HN       ASN   5 -18.085  44.540 -22.863
  240    HA   ASN   5           HA       ASN   5 -16.100  42.477 -23.906
  241    HB2  ASN   5           HB1      ASN   5 -18.337  44.016 -25.346
  242    HB3  ASN   5           HB2      ASN   5 -17.271  42.846 -26.113
  243   HD21  ASN   5          2HD2      ASN   5 -20.254  42.964 -25.338
  244   HD22  ASN   5          1HD2      ASN   5 -20.513  41.279 -24.651
  245    H    LYS   6           HN       LYS   6 -14.237  43.456 -23.613
  246    HA   LYS   6           HA       LYS   6 -13.533  45.838 -25.419
  247    HB2  LYS   6           HB2      LYS   6 -12.766  45.213 -22.489
  248    HB3  LYS   6           HB1      LYS   6 -11.778  46.286 -23.453
  249    HG2  LYS   6           HG1      LYS   6 -13.655  47.850 -23.839
  250    HG3  LYS   6           HG2      LYS   6 -14.789  46.764 -23.034
  251    HD2  LYS   6           HD1      LYS   6 -13.591  46.988 -20.874
  252    HD3  LYS   6           HD2      LYS   6 -12.326  47.972 -21.617
  253    HE2  LYS   6           HE2      LYS   6 -13.962  49.798 -22.131
  254    HE3  LYS   6           HE1      LYS   6 -15.312  48.789 -21.580
  255    HZ1  LYS   6           HZ1      LYS   6 -14.383  48.735 -19.347
  256    HZ2  LYS   6           HZ2      LYS   6 -13.049  49.621 -19.781
  257    HZ3  LYS   6           HZ3      LYS   6 -14.567  50.296 -19.792
  258    HA   PRO   7           HA       PRO   7 -10.216  43.333 -27.070
  259    HB2  PRO   7           HB2      PRO   7  -8.085  45.195 -25.907
  260    HB3  PRO   7           HB1      PRO   7  -8.231  44.572 -27.567
  261    HG2  PRO   7           HG2      PRO   7  -9.053  47.099 -27.056
  262    HG3  PRO   7           HG1      PRO   7 -10.115  46.054 -28.035
  263    HD2  PRO   7           HD1      PRO   7 -10.367  46.717 -25.054
  264    HD3  PRO   7           HD2      PRO   7 -11.648  46.691 -26.310
  265    H    ARG   8           HN       ARG   8 -10.417  41.487 -25.898
  266    HA   ARG   8           HA       ARG   8  -9.045  41.118 -23.263
  267    HB2  ARG   8           HB1      ARG   8 -10.725  39.216 -24.981
  268    HB3  ARG   8           HB2      ARG   8 -10.017  38.767 -23.436
  269    HG2  ARG   8           HG2      ARG   8 -11.262  40.524 -22.221
  270    HG3  ARG   8           HG1      ARG   8 -11.884  41.192 -23.729
  271    HD2  ARG   8           HD2      ARG   8 -13.068  38.996 -24.205
  272    HD3  ARG   8           HD1      ARG   8 -12.540  38.386 -22.623
  273    HE   ARG   8           HE       ARG   8 -13.827  40.917 -22.087
  274   HH11  ARG   8          1HH2      ARG   8 -14.734  37.775 -23.453
  275   HH12  ARG   8          2HH2      ARG   8 -16.482  38.078 -23.008
  276   HH21  ARG   8          2HH1      ARG   8 -15.865  41.192 -21.683
  277   HH22  ARG   8          1HH1      ARG   8 -17.082  39.891 -22.105
  278    H    ARG   9           HN       ARG   9  -6.986  41.176 -23.426
  279    HA   ARG   9           HA       ARG   9  -5.516  39.129 -25.159
  280    HB2  ARG   9           HB1      ARG   9  -3.622  40.881 -25.250
  281    HB3  ARG   9           HB2      ARG   9  -5.058  41.159 -26.198
  282    HG2  ARG   9           HG2      ARG   9  -4.311  43.241 -25.270
  283    HG3  ARG   9           HG1      ARG   9  -5.880  42.868 -24.593
  284    HD2  ARG   9           HD1      ARG   9  -4.814  42.156 -22.430
  285    HD3  ARG   9           HD2      ARG   9  -3.202  42.352 -23.117
  286    HE   ARG   9           HE       ARG   9  -5.212  44.610 -22.576
  287   HH11  ARG   9          2HH1      ARG   9  -1.889  43.697 -23.450
  288   HH12  ARG   9          1HH1      ARG   9  -1.532  45.475 -23.774
  289   HH21  ARG   9          1HH2      ARG   9  -4.603  46.604 -22.904
  290   HH22  ARG   9          2HH2      ARG   9  -2.878  46.935 -23.469
  291    HA   PRO  10           HA       PRO  10  -3.713  37.702 -21.382
  292    HB2  PRO  10           HB2      PRO  10  -1.384  36.494 -22.153
  293    HB3  PRO  10           HB1      PRO  10  -2.968  35.999 -22.781
  294    HG2  PRO  10           HG1      PRO  10  -0.951  37.880 -24.118
  295    HG3  PRO  10           HG2      PRO  10  -1.735  36.449 -24.836
  296    HD2  PRO  10           HD2      PRO  10  -2.683  39.030 -25.195
  297    HD3  PRO  10           HD1      PRO  10  -3.801  37.632 -25.149
  298    H    TYR  11           HN       TYR  11  -3.578  39.953 -20.589
  299    HA   TYR  11           HA       TYR  11  -0.694  40.835 -20.056
  300    HB2  TYR  11           HB1      TYR  11  -2.375  42.512 -20.927
  301    HB3  TYR  11           HB2      TYR  11  -3.324  42.323 -19.463
  302    HD1  TYR  11           HD1      TYR  11  -0.134  43.562 -20.869
  303    HD2  TYR  11           HD2      TYR  11  -2.492  43.294 -17.335
  304    HE1  TYR  11           HE1      TYR  11   1.316  45.183 -19.782
  305    HE2  TYR  11           HE2      TYR  11  -1.041  44.935 -16.252
  306    HH   TYR  11           HH       TYR  11   0.706  46.266 -16.470
  307    H    ILE  12           HN       ILE  12   0.056  39.590 -18.457
  308    HA   ILE  12           HA       ILE  12  -1.499  39.534 -15.819
  309    HB   ILE  12           HB       ILE  12   0.126  37.145 -16.853
  310   HG12  ILE  12          2HG1      ILE  12  -2.382  36.087 -16.512
  311   HG13  ILE  12          1HG1      ILE  12  -2.863  37.710 -16.964
  312   HG21  ILE  12          2HG2      ILE  12  -1.603  37.459 -14.323
  313   HG22  ILE  12          3HG2      ILE  12  -0.789  35.966 -14.849
  314   HG23  ILE  12          1HG2      ILE  12   0.172  37.375 -14.368
  315   HD11  ILE  12          1HD1      ILE  12  -2.766  36.240 -18.957
  316   HD12  ILE  12          2HD1      ILE  12  -1.090  35.770 -18.608
  317   HD13  ILE  12          3HD1      ILE  12  -1.463  37.439 -19.123
  318    H    LEU  13           HN       LEU  13  -0.377  40.423 -14.259
  319    HA   LEU  13           HA       LEU  13   2.478  41.213 -14.702
  320    HB2  LEU  13           HB2      LEU  13   0.633  41.652 -12.286
  321    HB3  LEU  13           HB1      LEU  13   2.271  42.273 -12.403
  322    HG   LEU  13           HG       LEU  13   0.003  43.027 -14.343
  323   HD11  LEU  13          2HD1      LEU  13   0.023  45.219 -13.118
  324   HD12  LEU  13          3HD1      LEU  13   1.247  44.590 -11.984
  325   HD13  LEU  13          1HD1      LEU  13  -0.388  43.883 -12.019
  326   HD21  LEU  13          1HD2      LEU  13   1.597  44.886 -15.028
  327   HD22  LEU  13          2HD2      LEU  13   2.868  44.159 -14.014
  328   HD23  LEU  13          3HD2      LEU  13   2.240  43.282 -15.430
  Start of MODEL    3
    1    H1   VAL   1           HN1      VAL   1   5.909  39.117 -10.706
    2    H2   VAL   1           HN2      VAL   1   6.483  37.805 -11.525
    3    H3   VAL   1           HN3      VAL   1   6.548  39.302 -12.220
    4    HA   VAL   1           HA       VAL   1   4.823  37.915 -13.172
    5    HB   VAL   1           HB       VAL   1   2.726  37.471 -11.895
    6   HG11  VAL   1          3HG2      VAL   1   4.365  35.659 -12.382
    7   HG12  VAL   1          1HG2      VAL   1   3.492  35.375 -10.865
    8   HG13  VAL   1          2HG2      VAL   1   5.176  35.952 -10.824
    9   HG21  VAL   1          1HG1      VAL   1   2.707  37.294  -9.421
   10   HG22  VAL   1          2HG1      VAL   1   2.949  38.980  -9.906
   11   HG23  VAL   1          3HG1      VAL   1   4.327  38.020  -9.315
   12    H    ARG   2           HN       ARG   2   4.235  40.654 -10.933
   13    HA   ARG   2           HA       ARG   2   2.000  41.722 -12.359
   14    HB2  ARG   2           HB2      ARG   2   2.812  42.171  -9.938
   15    HB3  ARG   2           HB1      ARG   2   3.964  43.304 -10.601
   16    HG2  ARG   2           HG2      ARG   2   2.218  44.701  -9.927
   17    HG3  ARG   2           HG1      ARG   2   1.908  44.559 -11.639
   18    HD2  ARG   2           HD1      ARG   2  -0.218  44.355 -10.606
   19    HD3  ARG   2           HD2      ARG   2   0.168  42.731 -11.130
   20    HE   ARG   2           HE       ARG   2   0.521  43.731  -8.223
   21   HH11  ARG   2          2HH1      ARG   2  -0.596  41.132 -10.381
   22   HH12  ARG   2          1HH1      ARG   2  -1.299  40.238  -8.943
   23   HH21  ARG   2          2HH2      ARG   2  -0.314  42.615  -6.678
   24   HH22  ARG   2          1HH2      ARG   2  -1.139  41.009  -7.011
   25    H    ARG   3           HN       ARG   3   2.028  42.304 -14.433
   26    HA   ARG   3           HA       ARG   3   4.368  43.724 -15.727
   27    HB2  ARG   3           HB2      ARG   3   1.801  42.449 -16.836
   28    HB3  ARG   3           HB1      ARG   3   2.868  43.406 -17.843
   29    HG2  ARG   3           HG1      ARG   3   4.766  41.927 -17.527
   30    HG3  ARG   3           HG2      ARG   3   3.947  41.011 -16.263
   31    HD2  ARG   3           HD1      ARG   3   2.229  40.179 -17.914
   32    HD3  ARG   3           HD2      ARG   3   2.942  41.163 -19.177
   33    HE   ARG   3           HE       ARG   3   4.542  39.479 -19.579
   34   HH11  ARG   3          2HH1      ARG   3   3.360  38.965 -16.264
   35   HH12  ARG   3          1HH1      ARG   3   4.190  37.330 -16.211
   36   HH21  ARG   3          2HH2      ARG   3   5.436  37.612 -19.406
   37   HH22  ARG   3          1HH2      ARG   3   5.291  36.623 -17.867
   38    H    LEU   4           HN       LEU   4   4.305  45.790 -14.910
   39    HA   LEU   4           HA       LEU   4   1.892  47.569 -15.241
   40    HB2  LEU   4           HB2      LEU   4   4.753  48.262 -14.326
   41    HB3  LEU   4           HB1      LEU   4   3.437  49.388 -14.420
   42    HG   LEU   4           HG       LEU   4   3.658  48.924 -12.178
   43   HD11  LEU   4          3HD2      LEU   4   1.515  47.984 -11.408
   44   HD12  LEU   4          1HD2      LEU   4   1.250  48.939 -12.884
   45   HD13  LEU   4          2HD2      LEU   4   1.264  47.159 -12.964
   46   HD21  LEU   4          1HD1      LEU   4   3.767  46.750 -11.047
   47   HD22  LEU   4          2HD1      LEU   4   3.595  45.883 -12.587
   48   HD23  LEU   4          3HD1      LEU   4   5.050  46.857 -12.269
   49    H    MET   5           HN       MET   5   1.688  47.225 -17.542
   50    HA   MET   5           HA       MET   5   3.629  48.863 -19.282
   51    HB2  MET   5           HB2      MET   5   1.937  46.463 -20.168
   52    HB3  MET   5           HB1      MET   5   2.988  47.435 -21.178
   53    HG2  MET   5           HG2      MET   5   3.794  45.486 -18.963
   54    HG3  MET   5           HG1      MET   5   4.231  45.439 -20.673
   55    HE1  MET   5           HE1      MET   5   6.144  46.936 -21.778
   56    HE2  MET   5           HE2      MET   5   7.004  48.260 -20.935
   57    HE3  MET   5           HE3      MET   5   5.283  48.454 -21.371
   58    H    PHE   6           HN       PHE   6   2.650  50.802 -19.157
   59    HA   PHE   6           HA       PHE   6  -0.006  51.134 -20.592
   60    HB2  PHE   6           HB1      PHE   6  -0.942  52.680 -18.929
   61    HB3  PHE   6           HB2      PHE   6  -0.873  51.018 -18.451
   62    HD1  PHE   6           HD2      PHE   6   0.672  50.245 -16.608
   63    HD2  PHE   6           HD1      PHE   6   0.312  54.415 -17.615
   64    HE1  PHE   6           HE2      PHE   6   1.679  50.866 -14.453
   65    HE2  PHE   6           HE1      PHE   6   1.355  55.012 -15.471
   66    HZ   PHE   6           HZ       PHE   6   2.042  53.243 -13.887
   67    H    SER   7           HN       SER   7   2.014  53.576 -18.905
   68    HA   SER   7           HA       SER   7   2.246  55.093 -21.533
   69    HB2  SER   7           HB2      SER   7   1.477  56.266 -19.479
   70    HB3  SER   7           HB1      SER   7   2.981  55.860 -18.638
   71    HG   SER   7           HG       SER   7   4.072  56.987 -20.348
   72    H    TYR   8           HN       TYR   8   3.685  52.749 -21.680
   73    HA   TYR   8           HA       TYR   8   6.587  53.685 -21.848
   74    HB2  TYR   8           HB2      TYR   8   5.998  50.892 -20.742
   75    HB3  TYR   8           HB1      TYR   8   7.488  51.784 -20.704
   76    HD1  TYR   8           HD1      TYR   8   7.488  54.023 -19.129
   77    HD2  TYR   8           HD2      TYR   8   4.640  50.817 -18.801
   78    HE1  TYR   8           HE1      TYR   8   6.914  54.749 -16.849
   79    HE2  TYR   8           HE2      TYR   8   4.087  51.542 -16.527
   80    HH   TYR   8           HH       TYR   8   4.450  53.027 -14.927
   81    H    ILE   9           HN       ILE   9   7.864  51.664 -22.947
   82    HA   ILE   9           HA       ILE   9   6.648  51.276 -25.638
   83    HB   ILE   9           HB       ILE   9   9.243  50.062 -24.529
   84   HG12  ILE   9          2HG1      ILE   9  10.313  51.664 -26.278
   85   HG13  ILE   9          1HG1      ILE   9   8.778  52.504 -26.370
   86   HG21  ILE   9          1HG2      ILE   9   8.363  48.634 -26.388
   87   HG22  ILE   9          2HG2      ILE   9   8.204  50.058 -27.440
   88   HG23  ILE   9          3HG2      ILE   9   9.809  49.498 -26.905
   89   HD11  ILE   9          3HD1      ILE   9   9.055  53.264 -23.995
   90   HD12  ILE   9          1HD1      ILE   9  10.456  52.176 -23.778
   91   HD13  ILE   9          2HD1      ILE   9  10.558  53.566 -24.882
   92    H    SER  10           HN       SER  10   4.868  50.099 -25.561
   93    HA   SER  10           HA       SER  10   4.576  47.815 -23.626
   94    HB2  SER  10           HB2      SER  10   2.480  49.524 -25.105
   95    HB3  SER  10           HB1      SER  10   2.108  48.262 -23.929
   96    HG   SER  10           HG       SER  10   3.689  50.563 -23.466
   97    H    ASP  11           HN       ASP  11   3.317  46.047 -24.012
   98    HA   ASP  11           HA       ASP  11   4.157  44.361 -26.185
   99    HB2  ASP  11           HB1      ASP  11   3.823  43.525 -24.001
  100    HB3  ASP  11           HB2      ASP  11   2.209  44.150 -23.818
  101    H    GLU  12           HN       GLU  12   3.020  43.198 -27.742
  102    HA   GLU  12           HA       GLU  12   1.245  44.869 -29.479
  103    HB2  GLU  12           HB1      GLU  12   2.315  41.999 -29.862
  104    HB3  GLU  12           HB2      GLU  12   1.479  42.911 -31.095
  105    HG2  GLU  12           HG1      GLU  12   3.299  44.587 -31.233
  106    HG3  GLU  12           HG2      GLU  12   4.158  43.838 -29.890
  107    H    GLN  13           HN       GLN  13  -0.708  43.890 -30.594
  108    HA   GLN  13           HA       GLN  13  -2.631  42.898 -28.560
  109    HB2  GLN  13           HB1      GLN  13  -3.197  44.660 -30.267
  110    HB3  GLN  13           HB2      GLN  13  -3.254  43.410 -31.502
  111    HG2  GLN  13           HG1      GLN  13  -5.079  42.213 -30.127
  112    HG3  GLN  13           HG2      GLN  13  -4.972  43.482 -28.924
  113   HE21  GLN  13          2HE2      GLN  13  -5.950  42.795 -32.255
  114   HE22  GLN  13          1HE2      GLN  13  -7.068  44.244 -32.387
  115    H    TRP  14           HN       TRP  14  -1.583  40.919 -28.125
  116    HA   TRP  14           HA       TRP  14  -1.565  38.655 -30.019
  117    HB2  TRP  14           HB2      TRP  14  -0.981  38.919 -26.998
  118    HB3  TRP  14           HB1      TRP  14  -0.777  37.414 -27.843
  119    HD1  TRP  14           HD1      TRP  14   1.204  40.317 -26.811
  120    HE1  TRP  14           HE1      TRP  14   3.567  40.456 -27.985
  121    HE3  TRP  14           HE3      TRP  14   0.178  36.979 -30.518
  122    HZ2  TRP  14           HZ2      TRP  14   4.655  39.214 -30.326
  123    HZ3  TRP  14           HZ3      TRP  14   1.909  36.504 -32.218
  124    HH2  TRP  14           HH2      TRP  14   4.107  37.613 -32.132
  125    H    THR  15           HN       THR  15  -2.256  36.463 -28.871
  126    HA   THR  15           HA       THR  15  -4.848  35.973 -29.673
  127    HB   THR  15           HB       THR  15  -3.293  34.341 -27.590
  128    HG1  THR  15           HG1      THR  15  -2.866  33.183 -29.618
  129   HG21  THR  15          3HG2      THR  15  -4.475  32.340 -28.468
  130   HG22  THR  15          1HG2      THR  15  -5.648  33.454 -27.743
  131   HG23  THR  15          2HG2      THR  15  -5.501  33.356 -29.517
  132    HA   PRO  16           HA       PRO  16  -7.539  37.728 -26.363
  133    HB2  PRO  16           HB2      PRO  16  -9.539  35.878 -27.781
  134    HB3  PRO  16           HB1      PRO  16  -9.814  37.503 -27.113
  135    HG2  PRO  16           HG1      PRO  16  -9.318  37.257 -29.762
  136    HG3  PRO  16           HG2      PRO  16  -8.473  38.539 -28.860
  137    HD2  PRO  16           HD1      PRO  16  -7.366  35.825 -29.751
  138    HD3  PRO  16           HD2      PRO  16  -6.580  37.433 -29.759
  139    H    PHE  17           HN       PHE  17  -7.925  37.240 -24.448
  140    HA   PHE  17           HA       PHE  17  -7.293  35.685 -22.556
  141    HB2  PHE  17           HB1      PHE  17  -9.018  37.558 -22.543
  142    HB3  PHE  17           HB2      PHE  17 -10.265  36.395 -22.868
  143    HD1  PHE  17           HD1      PHE  17  -7.463  37.134 -20.415
  144    HD2  PHE  17           HD2      PHE  17 -11.469  35.658 -20.925
  145    HE1  PHE  17           HE1      PHE  17  -7.745  37.032 -17.969
  146    HE2  PHE  17           HE2      PHE  17 -11.750  35.605 -18.483
  147    HZ   PHE  17           HZ       PHE  17  -9.892  36.284 -17.001
  148    H    LEU  18           HN       LEU  18 -10.077  34.219 -24.323
  149    HA   LEU  18           HA       LEU  18 -10.018  31.859 -22.444
  150    HB2  LEU  18           HB1      LEU  18 -11.876  32.405 -24.814
  151    HB3  LEU  18           HB2      LEU  18 -12.042  31.090 -23.669
  152    HG   LEU  18           HG       LEU  18 -12.308  34.081 -22.981
  153   HD11  LEU  18          3HD2      LEU  18 -14.187  33.236 -24.400
  154   HD12  LEU  18          1HD2      LEU  18 -14.745  33.604 -22.757
  155   HD13  LEU  18          2HD2      LEU  18 -14.488  31.911 -23.249
  156   HD21  LEU  18          1HD1      LEU  18 -13.218  33.311 -20.759
  157   HD22  LEU  18          2HD1      LEU  18 -11.522  32.860 -20.966
  158   HD23  LEU  18          3HD1      LEU  18 -12.793  31.627 -21.162
  159    H    TYR  19           HN       TYR  19  -7.784  31.390 -23.184
  160    HA   TYR  19           HA       TYR  19  -7.865  29.181 -25.267
  161    HB2  TYR  19           HB2      TYR  19  -6.035  29.854 -26.522
  162    HB3  TYR  19           HB1      TYR  19  -7.077  31.233 -26.444
  163    HD1  TYR  19           HD1      TYR  19  -6.396  33.063 -24.476
  164    HD2  TYR  19           HD2      TYR  19  -3.707  30.119 -26.081
  165    HE1  TYR  19           HE1      TYR  19  -4.487  34.433 -23.794
  166    HE2  TYR  19           HE2      TYR  19  -1.800  31.492 -25.387
  167    HH   TYR  19           HH       TYR  19  -1.133  33.321 -24.374
  168    H    ASP  20           HN       ASP  20  -5.018  30.353 -23.572
  169    HA   ASP  20           HA       ASP  20  -5.001  27.888 -21.755
  170    HB2  ASP  20           HB2      ASP  20  -2.665  29.669 -22.712
  171    HB3  ASP  20           HB1      ASP  20  -2.509  28.396 -21.518
  172    H    PHE  21           HN       PHE  21  -4.404  31.447 -21.708
  173    HA   PHE  21           HA       PHE  21  -3.859  31.861 -18.958
  174    HB2  PHE  21           HB2      PHE  21  -3.671  33.527 -20.763
  175    HB3  PHE  21           HB1      PHE  21  -5.408  33.593 -20.953
  176    HD1  PHE  21           HD2      PHE  21  -4.223  33.736 -17.377
  177    HD2  PHE  21           HD1      PHE  21  -5.016  36.009 -20.950
  178    HE1  PHE  21           HE2      PHE  21  -4.238  35.809 -16.069
  179    HE2  PHE  21           HE1      PHE  21  -4.975  38.076 -19.627
  180    HZ   PHE  21           HZ       PHE  21  -4.599  37.985 -17.186
  181    H    TYR  22           HN       TYR  22  -7.231  32.083 -20.290
  182    HA   TYR  22           HA       TYR  22  -8.247  31.180 -17.525
  183    HB2  TYR  22           HB2      TYR  22  -8.576  33.679 -18.109
  184    HB3  TYR  22           HB1      TYR  22  -9.681  33.191 -19.359
  185    HD1  TYR  22           HD1      TYR  22 -11.906  32.068 -18.670
  186    HD2  TYR  22           HD2      TYR  22  -9.163  33.622 -15.742
  187    HE1  TYR  22           HE1      TYR  22 -13.708  32.127 -17.007
  188    HE2  TYR  22           HE2      TYR  22 -10.974  33.671 -14.085
  189    HH   TYR  22           HH       TYR  22 -14.277  32.619 -14.918
  190    H    HIS  23           HN       HIS  23  -8.338  29.070 -18.138
  191    HA   HIS  23           HA       HIS  23 -10.505  28.326 -20.162
  192    HB2  HIS  23           HB2      HIS  23  -9.280  26.651 -21.205
  193    HB3  HIS  23           HB1      HIS  23  -8.184  27.994 -21.127
  194    HD1  HIS  23           HD1      HIS  23  -5.915  27.637 -19.533
  195    HD2  HIS  23           HD2      HIS  23  -8.671  24.370 -19.846
  196    HE1  HIS  23           HE1      HIS  23  -4.851  25.482 -18.621
  197    HE2  HIS  23           HE2      HIS  23  -6.450  23.459 -18.713
  198    H    TYR  24           HN       TYR  24 -11.416  26.244 -19.909
  199    HA   TYR  24           HA       TYR  24 -11.726  25.364 -16.994
  200    HB2  TYR  24           HB1      TYR  24 -13.784  25.993 -18.473
  201    HB3  TYR  24           HB2      TYR  24 -13.483  24.547 -19.393
  202    HD1  TYR  24           HD2      TYR  24 -13.856  22.270 -18.290
  203    HD2  TYR  24           HD1      TYR  24 -14.649  25.926 -16.161
  204    HE1  TYR  24           HE2      TYR  24 -15.212  21.034 -16.655
  205    HE2  TYR  24           HE1      TYR  24 -16.006  24.680 -14.539
  206    HH   TYR  24           HH       TYR  24 -16.464  21.156 -14.825
  207    H1   PCA   1           HN       PCA   1 -22.127  48.553 -36.858
  208    HA   PCA   1           HA       PCA   1 -22.425  51.306 -36.744
  209    HB2  PCA   1           HB2      PCA   1 -22.415  50.556 -33.768
  210    HB3  PCA   1           HB1      PCA   1 -23.197  51.943 -34.556
  211    HG2  PCA   1           HG2      PCA   1 -24.593  49.637 -33.847
  212    HG3  PCA   1           HG1      PCA   1 -25.056  50.584 -35.297
  213    H    LEU   2           HN       LEU   2 -20.757  52.539 -35.149
  214    HA   LEU   2           HA       LEU   2 -18.029  51.409 -35.820
  215    HB2  LEU   2           HB1      LEU   2 -18.814  54.106 -34.588
  216    HB3  LEU   2           HB2      LEU   2 -17.171  53.626 -34.951
  217    HG   LEU   2           HG       LEU   2 -19.383  53.932 -37.071
  218   HD11  LEU   2          2HD1      LEU   2 -18.237  56.064 -37.690
  219   HD12  LEU   2          3HD1      LEU   2 -18.805  56.123 -36.011
  220   HD13  LEU   2          1HD1      LEU   2 -17.078  55.860 -36.353
  221   HD21  LEU   2          1HD2      LEU   2 -17.492  53.887 -38.744
  222   HD22  LEU   2          2HD2      LEU   2 -17.618  52.351 -37.872
  223   HD23  LEU   2          3HD2      LEU   2 -16.337  53.512 -37.440
  224    H    TYR   3           HN       TYR   3 -17.932  49.669 -34.426
  225    HA   TYR   3           HA       TYR   3 -18.251  49.981 -31.464
  226    HB2  TYR   3           HB1      TYR   3 -17.410  47.515 -33.100
  227    HB3  TYR   3           HB2      TYR   3 -17.714  47.526 -31.389
  228    HD1  TYR   3           HD2      TYR   3 -20.103  48.247 -30.535
  229    HD2  TYR   3           HD1      TYR   3 -19.271  47.120 -34.605
  230    HE1  TYR   3           HE2      TYR   3 -22.487  47.770 -30.900
  231    HE2  TYR   3           HE1      TYR   3 -21.651  46.636 -34.950
  232    HH   TYR   3           HH       TYR   3 -23.729  46.907 -34.091
  233    H    GLU   4           HN       GLU   4 -16.582  51.455 -30.983
  234    HA   GLU   4           HA       GLU   4 -13.706  50.710 -31.349
  235    HB2  GLU   4           HB1      GLU   4 -14.397  53.021 -31.574
  236    HB3  GLU   4           HB2      GLU   4 -15.070  53.073 -29.955
  237    HG2  GLU   4           HG2      GLU   4 -12.906  54.277 -30.167
  238    HG3  GLU   4           HG1      GLU   4 -12.905  53.059 -28.907
  239    H    ASN   5           HN       ASN   5 -13.750  48.704 -30.341
  240    HA   ASN   5           HA       ASN   5 -13.276  48.770 -27.331
  241    HB2  ASN   5           HB2      ASN   5 -14.477  46.591 -27.046
  242    HB3  ASN   5           HB1      ASN   5 -15.460  47.989 -27.352
  243   HD21  ASN   5          1HD2      ASN   5 -13.961  45.471 -29.485
  244   HD22  ASN   5          2HD2      ASN   5 -15.538  45.120 -30.348
  245    H    LYS   6           HN       LYS   6 -11.286  48.167 -26.987
  246    HA   LYS   6           HA       LYS   6  -9.710  46.499 -28.934
  247    HB2  LYS   6           HB2      LYS   6  -9.013  48.211 -26.534
  248    HB3  LYS   6           HB1      LYS   6  -8.020  46.806 -26.761
  249    HG2  LYS   6           HG1      LYS   6  -6.918  48.575 -27.808
  250    HG3  LYS   6           HG2      LYS   6  -7.388  47.457 -29.060
  251    HD2  LYS   6           HD1      LYS   6  -9.036  50.010 -28.469
  252    HD3  LYS   6           HD2      LYS   6  -7.548  50.059 -29.400
  253    HE2  LYS   6           HE1      LYS   6  -8.581  48.281 -31.015
  254    HE3  LYS   6           HE2      LYS   6 -10.119  48.543 -30.180
  255    HZ1  LYS   6           HZ1      LYS   6  -9.874  50.932 -30.716
  256    HZ2  LYS   6           HZ2      LYS   6  -8.531  50.613 -31.612
  257    HZ3  LYS   6           HZ3      LYS   6 -10.001  49.991 -32.061
  258    HA   PRO   7           HA       PRO   7 -11.122  42.652 -26.798
  259    HB2  PRO   7           HB2      PRO   7  -8.617  41.565 -28.228
  260    HB3  PRO   7           HB1      PRO   7 -10.209  40.796 -28.052
  261    HG2  PRO   7           HG1      PRO   7  -9.631  42.065 -30.368
  262    HG3  PRO   7           HG2      PRO   7 -11.225  42.350 -29.625
  263    HD2  PRO   7           HD1      PRO   7  -8.763  44.174 -29.544
  264    HD3  PRO   7           HD2      PRO   7 -10.487  44.590 -29.777
  265    H    ARG   8           HN       ARG   8 -10.479  41.090 -25.243
  266    HA   ARG   8           HA       ARG   8  -8.467  42.112 -23.239
  267    HB2  ARG   8           HB1      ARG   8 -10.296  39.643 -23.045
  268    HB3  ARG   8           HB2      ARG   8  -9.286  40.269 -21.764
  269    HG2  ARG   8           HG1      ARG   8 -11.789  41.604 -22.956
  270    HG3  ARG   8           HG2      ARG   8 -11.614  40.826 -21.405
  271    HD2  ARG   8           HD2      ARG   8 -11.561  43.091 -20.813
  272    HD3  ARG   8           HD1      ARG   8  -9.852  42.644 -20.770
  273    HE   ARG   8           HE       ARG   8 -10.545  43.679 -23.448
  274   HH11  ARG   8          2HH1      ARG   8  -9.981  44.850 -20.138
  275   HH12  ARG   8          1HH1      ARG   8  -9.411  46.466 -20.802
  276   HH21  ARG   8          2HH2      ARG   8  -9.889  45.546 -24.073
  277   HH22  ARG   8          1HH2      ARG   8  -9.360  46.834 -22.879
  278    H    ARG   9           HN       ARG   9  -6.450  41.728 -24.028
  279    HA   ARG   9           HA       ARG   9  -5.707  39.088 -25.245
  280    HB2  ARG   9           HB2      ARG   9  -3.895  40.218 -26.175
  281    HB3  ARG   9           HB1      ARG   9  -5.170  41.381 -26.205
  282    HG2  ARG   9           HG2      ARG   9  -4.159  42.544 -24.158
  283    HG3  ARG   9           HG1      ARG   9  -2.900  41.305 -24.107
  284    HD2  ARG   9           HD2      ARG   9  -2.336  41.938 -26.554
  285    HD3  ARG   9           HD1      ARG   9  -3.374  43.348 -26.382
  286    HE   ARG   9           HE       ARG   9  -0.698  42.791 -25.058
  287   HH11  ARG   9          1HH2      ARG   9  -3.392  45.095 -25.303
  288   HH12  ARG   9          2HH2      ARG   9  -2.315  46.421 -24.627
  289   HH21  ARG   9          2HH1      ARG   9   0.405  44.342 -24.329
  290   HH22  ARG   9          1HH1      ARG   9  -0.286  46.029 -24.127
  291    HA   PRO  10           HA       PRO  10  -3.301  37.309 -21.818
  292    HB2  PRO  10           HB2      PRO  10  -0.642  37.266 -23.261
  293    HB3  PRO  10           HB1      PRO  10  -1.624  35.928 -22.655
  294    HG2  PRO  10           HG2      PRO  10  -1.462  36.480 -25.334
  295    HG3  PRO  10           HG1      PRO  10  -3.019  35.989 -24.630
  296    HD2  PRO  10           HD2      PRO  10  -2.084  38.861 -25.180
  297    HD3  PRO  10           HD1      PRO  10  -3.602  38.059 -25.675
  298    H    TYR  11           HN       TYR  11  -3.542  39.838 -21.115
  299    HA   TYR  11           HA       TYR  11  -0.917  41.091 -20.350
  300    HB2  TYR  11           HB1      TYR  11  -3.033  42.314 -21.224
  301    HB3  TYR  11           HB2      TYR  11  -3.777  42.026 -19.680
  302    HD1  TYR  11           HD2      TYR  11  -2.777  43.155 -17.588
  303    HD2  TYR  11           HD1      TYR  11  -1.346  44.049 -21.548
  304    HE1  TYR  11           HE2      TYR  11  -1.803  45.255 -16.771
  305    HE2  TYR  11           HE1      TYR  11  -0.406  46.160 -20.723
  306    HH   TYR  11           HH       TYR  11  -0.235  47.549 -18.957
  307    H    ILE  12           HN       ILE  12  -0.114  39.467 -18.999
  308    HA   ILE  12           HA       ILE  12  -1.615  38.411 -16.691
  309    HB   ILE  12           HB       ILE  12   1.367  38.035 -17.153
  310   HG12  ILE  12          2HG1      ILE  12   0.521  37.348 -19.256
  311   HG13  ILE  12          1HG1      ILE  12   1.014  35.945 -18.348
  312   HG21  ILE  12          2HG2      ILE  12   0.591  37.279 -14.917
  313   HG22  ILE  12          3HG2      ILE  12   1.082  35.894 -15.904
  314   HG23  ILE  12          1HG2      ILE  12  -0.648  36.246 -15.664
  315   HD11  ILE  12          1HD1      ILE  12  -1.438  35.423 -17.839
  316   HD12  ILE  12          2HD1      ILE  12  -1.077  35.466 -19.582
  317   HD13  ILE  12          3HD1      ILE  12  -1.900  36.842 -18.819
  318    H    LEU  13           HN       LEU  13  -2.128  40.175 -15.466
  319    HA   LEU  13           HA       LEU  13   0.046  41.877 -14.177
  320    HB2  LEU  13           HB2      LEU  13  -1.904  42.932 -15.404
  321    HB3  LEU  13           HB1      LEU  13  -3.013  42.189 -14.270
  322    HG   LEU  13           HG       LEU  13  -1.890  43.539 -12.390
  323   HD11  LEU  13          2HD1      LEU  13  -0.540  45.047 -14.732
  324   HD12  LEU  13          3HD1      LEU  13  -0.536  45.555 -13.028
  325   HD13  LEU  13          1HD1      LEU  13   0.313  44.077 -13.508
  326   HD21  LEU  13          1HD2      LEU  13  -3.186  45.136 -14.699
  327   HD22  LEU  13          2HD2      LEU  13  -4.053  44.242 -13.427
  328   HD23  LEU  13          3HD2      LEU  13  -3.078  45.662 -13.000
  Start of MODEL    4
    1    H1   VAL   1           HN1      VAL   1   3.075  41.694 -14.130
    2    H2   VAL   1           HN2      VAL   1   3.794  42.014 -15.589
    3    H3   VAL   1           HN3      VAL   1   2.626  40.860 -15.464
    4    HA   VAL   1           HA       VAL   1   4.989  39.994 -15.695
    5    HB   VAL   1           HB       VAL   1   5.135  40.967 -12.782
    6   HG11  VAL   1          1HG1      VAL   1   7.236  39.487 -14.516
    7   HG12  VAL   1          2HG1      VAL   1   6.360  38.776 -13.139
    8   HG13  VAL   1          3HG1      VAL   1   7.496  40.109 -12.870
    9   HG21  VAL   1          3HG2      VAL   1   7.047  42.395 -13.583
   10   HG22  VAL   1          1HG2      VAL   1   5.529  42.881 -14.355
   11   HG23  VAL   1          2HG2      VAL   1   6.721  41.917 -15.266
   12    H    ARG   2           HN       ARG   2   4.067  39.219 -12.365
   13    HA   ARG   2           HA       ARG   2   2.205  37.037 -13.354
   14    HB2  ARG   2           HB2      ARG   2   4.842  36.420 -11.876
   15    HB3  ARG   2           HB1      ARG   2   3.500  35.292 -11.996
   16    HG2  ARG   2           HG2      ARG   2   3.657  35.363 -14.532
   17    HG3  ARG   2           HG1      ARG   2   5.074  36.412 -14.394
   18    HD2  ARG   2           HD1      ARG   2   6.276  34.639 -13.055
   19    HD3  ARG   2           HD2      ARG   2   4.852  33.580 -13.177
   20    HE   ARG   2           HE       ARG   2   5.589  34.380 -15.888
   21   HH11  ARG   2          2HH1      ARG   2   6.820  32.451 -13.244
   22   HH12  ARG   2          1HH1      ARG   2   7.730  31.348 -14.389
   23   HH21  ARG   2          2HH2      ARG   2   6.651  33.089 -17.164
   24   HH22  ARG   2          1HH2      ARG   2   7.633  31.701 -16.494
   25    H    ARG   3           HN       ARG   3   0.538  37.724 -12.176
   26    HA   ARG   3           HA       ARG   3   0.737  37.415  -9.161
   27    HB2  ARG   3           HB1      ARG   3  -0.204  39.975 -10.603
   28    HB3  ARG   3           HB2      ARG   3  -0.763  39.587  -8.988
   29    HG2  ARG   3           HG2      ARG   3   1.595  39.463  -8.140
   30    HG3  ARG   3           HG1      ARG   3   2.214  39.905  -9.723
   31    HD2  ARG   3           HD1      ARG   3   0.238  41.691  -8.148
   32    HD3  ARG   3           HD2      ARG   3   2.001  41.778  -7.968
   33    HE   ARG   3           HE       ARG   3   1.098  41.988 -10.837
   34   HH11  ARG   3          2HH2      ARG   3   1.546  43.797  -7.875
   35   HH12  ARG   3          1HH2      ARG   3   1.913  45.335  -8.803
   36   HH21  ARG   3          1HH1      ARG   3   1.687  43.699 -11.836
   37   HH22  ARG   3          2HH1      ARG   3   1.953  45.290 -10.952
   38    H    LEU   4           HN       LEU   4  -1.369  37.421  -8.120
   39    HA   LEU   4           HA       LEU   4  -3.257  35.647  -9.625
   40    HB2  LEU   4           HB2      LEU   4  -3.230  36.778  -6.752
   41    HB3  LEU   4           HB1      LEU   4  -4.537  35.794  -7.346
   42    HG   LEU   4           HG       LEU   4  -3.129  34.440  -6.022
   43   HD11  LEU   4          3HD2      LEU   4  -2.697  33.590  -8.952
   44   HD12  LEU   4          1HD2      LEU   4  -2.697  32.535  -7.522
   45   HD13  LEU   4          2HD2      LEU   4  -4.198  33.348  -8.019
   46   HD21  LEU   4          1HD1      LEU   4  -0.737  34.930  -7.894
   47   HD22  LEU   4          2HD1      LEU   4  -0.939  35.657  -6.275
   48   HD23  LEU   4          3HD1      LEU   4  -0.785  33.895  -6.452
   49    H    MET   5           HN       MET   5  -5.761  36.306  -8.815
   50    HA   MET   5           HA       MET   5  -6.388  38.527 -10.683
   51    HB2  MET   5           HB1      MET   5  -7.757  36.421 -10.412
   52    HB3  MET   5           HB2      MET   5  -8.263  36.963  -8.813
   53    HG2  MET   5           HG1      MET   5  -9.339  39.024  -9.886
   54    HG3  MET   5           HG2      MET   5  -8.798  38.454 -11.475
   55    HE1  MET   5           HE1      MET   5 -10.545  36.889  -8.183
   56    HE2  MET   5           HE2      MET   5 -12.189  36.686  -8.858
   57    HE3  MET   5           HE3      MET   5 -11.469  38.319  -8.736
   58    H    PHE   6           HN       PHE   6  -5.977  40.534 -10.084
   59    HA   PHE   6           HA       PHE   6  -7.118  41.541  -7.441
   60    HB2  PHE   6           HB1      PHE   6  -5.202  42.768  -6.862
   61    HB3  PHE   6           HB2      PHE   6  -4.622  41.181  -7.277
   62    HD1  PHE   6           HD2      PHE   6  -3.561  40.890  -9.663
   63    HD2  PHE   6           HD1      PHE   6  -4.263  44.689  -7.878
   64    HE1  PHE   6           HE2      PHE   6  -1.906  41.894 -11.148
   65    HE2  PHE   6           HE1      PHE   6  -2.578  45.681  -9.343
   66    HZ   PHE   6           HZ       PHE   6  -1.402  44.286 -10.987
   67    H    SER   7           HN       SER   7  -7.362  43.900  -7.345
   68    HA   SER   7           HA       SER   7  -8.875  44.781  -9.775
   69    HB2  SER   7           HB1      SER   7  -9.781  45.119  -7.496
   70    HB3  SER   7           HB2      SER   7  -8.411  46.152  -7.058
   71    HG   SER   7           HG       SER   7  -9.031  47.562  -8.750
   72    H    TYR   8           HN       TYR   8  -7.108  44.898 -11.235
   73    HA   TYR   8           HA       TYR   8  -5.170  47.178 -10.876
   74    HB2  TYR   8           HB1      TYR   8  -4.026  46.326 -12.842
   75    HB3  TYR   8           HB2      TYR   8  -4.276  45.088 -11.651
   76    HD1  TYR   8           HD1      TYR   8  -5.401  46.272 -14.983
   77    HD2  TYR   8           HD2      TYR   8  -5.482  43.082 -12.168
   78    HE1  TYR   8           HE1      TYR   8  -6.306  44.778 -16.697
   79    HE2  TYR   8           HE2      TYR   8  -6.368  41.591 -13.887
   80    HH   TYR   8           HH       TYR   8  -6.992  41.384 -15.992
   81    H    ILE   9           HN       ILE   9  -4.671  48.395 -13.024
   82    HA   ILE   9           HA       ILE   9  -6.968  50.216 -13.372
   83    HB   ILE   9           HB       ILE   9  -4.317  50.147 -14.912
   84   HG12  ILE   9          1HG1      ILE   9  -3.771  50.398 -12.556
   85   HG13  ILE   9          2HG1      ILE   9  -3.497  51.909 -13.393
   86   HG21  ILE   9          1HG2      ILE   9  -5.936  51.552 -16.122
   87   HG22  ILE   9          2HG2      ILE   9  -6.348  52.452 -14.639
   88   HG23  ILE   9          3HG2      ILE   9  -4.721  52.584 -15.358
   89   HD11  ILE   9          3HD1      ILE   9  -4.548  52.324 -11.172
   90   HD12  ILE   9          1HD1      ILE   9  -5.938  51.296 -11.584
   91   HD13  ILE   9          2HD1      ILE   9  -5.678  52.836 -12.446
   92    H    SER  10           HN       SER  10  -8.445  50.350 -14.926
   93    HA   SER  10           HA       SER  10  -8.694  48.119 -16.888
   94    HB2  SER  10           HB2      SER  10 -10.470  50.597 -16.472
   95    HB3  SER  10           HB1      SER  10 -10.870  49.199 -17.474
   96    HG   SER  10           HG       SER  10 -10.530  47.913 -15.511
   97    H    ASP  11           HN       ASP  11  -6.630  48.726 -17.890
   98    HA   ASP  11           HA       ASP  11  -6.637  50.941 -19.851
   99    HB2  ASP  11           HB1      ASP  11  -4.696  48.628 -20.178
  100    HB3  ASP  11           HB2      ASP  11  -4.447  50.331 -20.451
  101    H    GLU  12           HN       GLU  12  -5.943  50.345 -22.215
  102    HA   GLU  12           HA       GLU  12  -8.231  49.210 -23.575
  103    HB2  GLU  12           HB1      GLU  12  -6.534  50.836 -24.531
  104    HB3  GLU  12           HB2      GLU  12  -5.350  49.535 -24.627
  105    HG2  GLU  12           HG1      GLU  12  -6.912  48.285 -26.235
  106    HG3  GLU  12           HG2      GLU  12  -8.046  49.639 -26.148
  107    H    GLN  13           HN       GLN  13  -8.682  47.259 -24.460
  108    HA   GLN  13           HA       GLN  13  -7.180  44.885 -23.357
  109    HB2  GLN  13           HB1      GLN  13  -9.771  45.106 -24.960
  110    HB3  GLN  13           HB2      GLN  13  -9.064  43.560 -24.507
  111    HG2  GLN  13           HG2      GLN  13  -9.737  45.747 -22.444
  112    HG3  GLN  13           HG1      GLN  13 -10.890  44.511 -22.944
  113   HE21  GLN  13          2HE2      GLN  13 -10.282  42.244 -22.536
  114   HE22  GLN  13          1HE2      GLN  13  -9.262  41.922 -21.035
  115    H    TRP  14           HN       TRP  14  -5.314  45.026 -24.405
  116    HA   TRP  14           HA       TRP  14  -4.963  45.055 -27.300
  117    HB2  TRP  14           HB2      TRP  14  -3.113  44.113 -25.025
  118    HB3  TRP  14           HB1      TRP  14  -2.589  44.327 -26.690
  119    HD1  TRP  14           HD1      TRP  14  -3.408  46.324 -23.508
  120    HE1  TRP  14           HE1      TRP  14  -2.852  48.898 -23.796
  121    HE3  TRP  14           HE3      TRP  14  -2.616  46.187 -28.493
  122    HZ2  TRP  14           HZ2      TRP  14  -2.180  50.472 -26.024
  123    HZ3  TRP  14           HZ3      TRP  14  -2.070  48.273 -29.678
  124    HH2  TRP  14           HH2      TRP  14  -1.858  50.385 -28.462
  125    H    THR  15           HN       THR  15  -5.960  43.488 -28.444
  126    HA   THR  15           HA       THR  15  -5.520  40.573 -27.682
  127    HB   THR  15           HB       THR  15  -7.463  41.691 -29.763
  128    HG1  THR  15           HG1      THR  15  -7.615  41.357 -26.973
  129   HG21  THR  15          3HG2      THR  15  -8.647  39.509 -29.359
  130   HG22  THR  15          1HG2      THR  15  -7.005  39.222 -29.981
  131   HG23  THR  15          2HG2      THR  15  -7.354  38.988 -28.252
  132    HA   PRO  16           HA       PRO  16  -2.690  40.845 -31.393
  133    HB2  PRO  16           HB2      PRO  16  -0.672  39.214 -30.489
  134    HB3  PRO  16           HB1      PRO  16  -0.931  40.828 -29.795
  135    HG2  PRO  16           HG2      PRO  16  -1.950  38.151 -28.688
  136    HG3  PRO  16           HG1      PRO  16  -0.997  39.384 -27.818
  137    HD2  PRO  16           HD1      PRO  16  -3.769  39.263 -27.676
  138    HD3  PRO  16           HD2      PRO  16  -2.896  40.833 -27.615
  139    H    PHE  17           HN       PHE  17  -1.642  38.940 -32.699
  140    HA   PHE  17           HA       PHE  17  -3.853  36.972 -33.279
  141    HB2  PHE  17           HB1      PHE  17  -1.149  37.426 -34.675
  142    HB3  PHE  17           HB2      PHE  17  -2.349  36.265 -35.197
  143    HD1  PHE  17           HD1      PHE  17  -4.667  37.078 -35.891
  144    HD2  PHE  17           HD2      PHE  17  -1.406  39.754 -35.298
  145    HE1  PHE  17           HE1      PHE  17  -5.822  38.787 -37.205
  146    HE2  PHE  17           HE2      PHE  17  -2.570  41.455 -36.614
  147    HZ   PHE  17           HZ       PHE  17  -4.778  40.976 -37.567
  148    H    LEU  18           HN       LEU  18  -3.501  36.150 -31.050
  149    HA   LEU  18           HA       LEU  18  -1.679  33.681 -31.153
  150    HB2  LEU  18           HB1      LEU  18  -2.200  35.526 -28.733
  151    HB3  LEU  18           HB2      LEU  18  -1.371  33.987 -28.622
  152    HG   LEU  18           HG       LEU  18  -0.358  36.393 -30.246
  153   HD11  LEU  18          3HD2      LEU  18   1.337  36.593 -28.420
  154   HD12  LEU  18          1HD2      LEU  18   0.600  35.226 -27.548
  155   HD13  LEU  18          2HD2      LEU  18  -0.302  36.746 -27.750
  156   HD21  LEU  18          1HD1      LEU  18   0.487  34.241 -31.222
  157   HD22  LEU  18          2HD1      LEU  18   1.005  33.684 -29.609
  158   HD23  LEU  18          3HD1      LEU  18   1.798  35.082 -30.376
  159    H    TYR  19           HN       TYR  19  -2.344  32.130 -29.328
  160    HA   TYR  19           HA       TYR  19  -5.261  31.525 -29.797
  161    HB2  TYR  19           HB2      TYR  19  -3.405  29.795 -29.983
  162    HB3  TYR  19           HB1      TYR  19  -3.141  29.912 -28.254
  163    HD1  TYR  19           HD2      TYR  19  -4.917  29.079 -26.676
  164    HD2  TYR  19           HD1      TYR  19  -5.354  28.652 -30.892
  165    HE1  TYR  19           HE2      TYR  19  -6.654  27.395 -26.331
  166    HE2  TYR  19           HE1      TYR  19  -7.085  26.967 -30.537
  167    HH   TYR  19           HH       TYR  19  -8.178  25.744 -29.055
  168    H    ASP  20           HN       ASP  20  -6.469  32.909 -28.587
  169    HA   ASP  20           HA       ASP  20  -5.940  33.511 -25.759
  170    HB2  ASP  20           HB2      ASP  20  -8.502  33.830 -27.451
  171    HB3  ASP  20           HB1      ASP  20  -8.365  34.373 -25.782
  172    H    PHE  21           HN       PHE  21  -6.261  32.251 -24.066
  173    HA   PHE  21           HA       PHE  21  -7.839  29.702 -24.315
  174    HB2  PHE  21           HB2      PHE  21  -6.175  30.866 -22.008
  175    HB3  PHE  21           HB1      PHE  21  -7.027  29.343 -21.907
  176    HD1  PHE  21           HD1      PHE  21  -6.345  27.389 -23.237
  177    HD2  PHE  21           HD2      PHE  21  -4.154  31.036 -23.468
  178    HE1  PHE  21           HE1      PHE  21  -4.473  26.208 -24.279
  179    HE2  PHE  21           HE2      PHE  21  -2.294  29.847 -24.513
  180    HZ   PHE  21           HZ       PHE  21  -2.448  27.433 -24.918
  181    H    TYR  22           HN       TYR  22  -9.621  31.516 -24.719
  182    HA   TYR  22           HA       TYR  22 -11.399  31.408 -22.209
  183    HB2  TYR  22           HB2      TYR  22 -10.477  33.724 -22.633
  184    HB3  TYR  22           HB1      TYR  22 -11.167  33.714 -24.244
  185    HD1  TYR  22           HD1      TYR  22 -12.033  33.631 -20.610
  186    HD2  TYR  22           HD2      TYR  22 -13.502  34.248 -24.562
  187    HE1  TYR  22           HE1      TYR  22 -14.110  34.559 -19.704
  188    HE2  TYR  22           HE2      TYR  22 -15.570  35.151 -23.650
  189    HH   TYR  22           HH       TYR  22 -16.740  35.636 -21.823
  190    H    HIS  23           HN       HIS  23 -12.098  29.416 -23.096
  191    HA   HIS  23           HA       HIS  23 -14.054  29.755 -25.436
  192    HB2  HIS  23           HB1      HIS  23 -12.271  27.286 -25.036
  193    HB3  HIS  23           HB2      HIS  23 -13.501  27.484 -26.270
  194    HD1  HIS  23           HD1      HIS  23 -12.392  30.681 -26.942
  195    HD2  HIS  23           HD2      HIS  23 -10.090  27.164 -26.452
  196    HE1  HIS  23           HE1      HIS  23 -10.332  30.793 -28.468
  197    HE2  HIS  23           HE2      HIS  23  -8.832  28.731 -28.186
  198    H    TYR  24           HN       TYR  24 -13.261  27.212 -22.993
  199    HA   TYR  24           HA       TYR  24 -15.997  27.484 -21.848
  200    HB2  TYR  24           HB1      TYR  24 -16.280  25.992 -23.948
  201    HB3  TYR  24           HB2      TYR  24 -15.204  24.823 -23.207
  202    HD1  TYR  24           HD1      TYR  24 -18.521  26.453 -22.986
  203    HD2  TYR  24           HD2      TYR  24 -16.001  23.454 -21.317
  204    HE1  TYR  24           HE1      TYR  24 -20.439  25.486 -21.821
  205    HE2  TYR  24           HE2      TYR  24 -17.929  22.488 -20.156
  206    HH   TYR  24           HH       TYR  24 -21.151  23.911 -20.458
  207    H1   PCA   1           HN       PCA   1 -28.763  32.722 -26.052
  208    HA   PCA   1           HA       PCA   1 -28.809  32.034 -23.367
  209    HB2  PCA   1           HB2      PCA   1 -26.082  30.946 -24.233
  210    HB3  PCA   1           HB1      PCA   1 -27.143  30.339 -22.942
  211    HG2  PCA   1           HG2      PCA   1 -27.001  29.138 -25.455
  212    HG3  PCA   1           HG1      PCA   1 -28.547  29.173 -24.546
  213    H    LEU   2           HN       LEU   2 -26.627  32.667 -22.024
  214    HA   LEU   2           HA       LEU   2 -26.130  35.540 -22.821
  215    HB2  LEU   2           HB2      LEU   2 -26.796  34.921 -20.479
  216    HB3  LEU   2           HB1      LEU   2 -25.327  33.969 -20.308
  217    HG   LEU   2           HG       LEU   2 -23.943  36.078 -20.653
  218   HD11  LEU   2          2HD1      LEU   2 -25.591  37.506 -21.894
  219   HD12  LEU   2          3HD1      LEU   2 -25.103  38.304 -20.387
  220   HD13  LEU   2          1HD1      LEU   2 -26.690  37.501 -20.489
  221   HD21  LEU   2          1HD2      LEU   2 -24.482  35.208 -18.368
  222   HD22  LEU   2          2HD2      LEU   2 -24.412  36.984 -18.371
  223   HD23  LEU   2          3HD2      LEU   2 -25.991  36.157 -18.341
  224    H    TYR   3           HN       TYR   3 -24.796  35.351 -24.573
  225    HA   TYR   3           HA       TYR   3 -22.201  33.832 -24.368
  226    HB2  TYR   3           HB2      TYR   3 -23.274  35.599 -26.643
  227    HB3  TYR   3           HB1      TYR   3 -21.824  34.624 -26.716
  228    HD1  TYR   3           HD2      TYR   3 -22.053  32.056 -26.412
  229    HD2  TYR   3           HD1      TYR   3 -25.395  34.599 -27.133
  230    HE1  TYR   3           HE2      TYR   3 -23.379  30.127 -27.132
  231    HE2  TYR   3           HE1      TYR   3 -26.703  32.670 -27.853
  232    HH   TYR   3           HH       TYR   3 -26.791  30.452 -27.969
  233    H    GLU   4           HN       GLU   4 -21.250  34.941 -22.652
  234    HA   GLU   4           HA       GLU   4 -20.549  37.830 -22.942
  235    HB2  GLU   4           HB1      GLU   4 -21.129  36.841 -20.759
  236    HB3  GLU   4           HB2      GLU   4 -19.793  35.704 -20.864
  237    HG2  GLU   4           HG1      GLU   4 -19.186  37.486 -19.328
  238    HG3  GLU   4           HG2      GLU   4 -18.133  37.589 -20.727
  239    H    ASN   5           HN       ASN   5 -19.421  37.809 -24.885
  240    HA   ASN   5           HA       ASN   5 -16.487  36.978 -24.585
  241    HB2  ASN   5           HB1      ASN   5 -17.804  35.356 -26.024
  242    HB3  ASN   5           HB2      ASN   5 -18.149  36.655 -27.159
  243   HD21  ASN   5          1HD2      ASN   5 -16.586  37.098 -28.673
  244   HD22  ASN   5          2HD2      ASN   5 -14.933  36.292 -28.685
  245    H    LYS   6           HN       LYS   6 -15.554  38.829 -24.288
  246    HA   LYS   6           HA       LYS   6 -15.941  41.039 -26.364
  247    HB2  LYS   6           HB1      LYS   6 -15.977  42.754 -24.689
  248    HB3  LYS   6           HB2      LYS   6 -17.113  41.531 -24.200
  249    HG2  LYS   6           HG2      LYS   6 -15.136  40.590 -22.673
  250    HG3  LYS   6           HG1      LYS   6 -14.325  42.111 -23.029
  251    HD2  LYS   6           HD1      LYS   6 -15.444  42.453 -20.940
  252    HD3  LYS   6           HD2      LYS   6 -16.419  43.344 -22.110
  253    HE2  LYS   6           HE2      LYS   6 -18.049  41.400 -22.243
  254    HE3  LYS   6           HE1      LYS   6 -17.016  40.439 -21.197
  255    HZ1  LYS   6           HZ1      LYS   6 -18.741  41.344 -19.893
  256    HZ2  LYS   6           HZ2      LYS   6 -18.514  42.905 -20.403
  257    HZ3  LYS   6           HZ3      LYS   6 -17.396  42.178 -19.419
  258    HA   PRO   7           HA       PRO   7 -11.637  41.243 -27.308
  259    HB2  PRO   7           HB1      PRO   7 -11.459  43.845 -25.696
  260    HB3  PRO   7           HB2      PRO   7 -10.664  43.466 -27.247
  261    HG2  PRO   7           HG2      PRO   7 -12.979  44.847 -27.329
  262    HG3  PRO   7           HG1      PRO   7 -12.827  43.443 -28.416
  263    HD2  PRO   7           HD1      PRO   7 -14.318  43.613 -25.757
  264    HD3  PRO   7           HD2      PRO   7 -14.824  42.800 -27.277
  265    H    ARG   8           HN       ARG   8  -9.866  40.296 -26.672
  266    HA   ARG   8           HA       ARG   8  -9.536  39.659 -23.710
  267    HB2  ARG   8           HB2      ARG   8  -8.274  38.323 -26.178
  268    HB3  ARG   8           HB1      ARG   8  -8.102  37.762 -24.535
  269    HG2  ARG   8           HG2      ARG   8 -10.754  37.812 -26.125
  270    HG3  ARG   8           HG1      ARG   8  -9.700  36.437 -25.895
  271    HD2  ARG   8           HD1      ARG   8 -11.400  36.072 -24.309
  272    HD3  ARG   8           HD2      ARG   8 -10.039  36.666 -23.343
  273    HE   ARG   8           HE       ARG   8 -11.992  38.790 -24.290
  274   HH11  ARG   8          2HH1      ARG   8 -11.254  36.510 -21.744
  275   HH12  ARG   8          1HH1      ARG   8 -12.116  37.536 -20.496
  276   HH21  ARG   8          1HH2      ARG   8 -12.884  39.944 -22.846
  277   HH22  ARG   8          2HH2      ARG   8 -13.007  39.396 -21.098
  278    H    ARG   9           HN       ARG   9  -7.563  39.678 -22.698
  279    HA   ARG   9           HA       ARG   9  -5.310  41.301 -24.002
  280    HB2  ARG   9           HB2      ARG   9  -6.780  42.767 -22.603
  281    HB3  ARG   9           HB1      ARG   9  -6.493  41.748 -21.198
  282    HG2  ARG   9           HG1      ARG   9  -4.015  42.316 -21.317
  283    HG3  ARG   9           HG2      ARG   9  -4.326  43.340 -22.729
  284    HD2  ARG   9           HD1      ARG   9  -5.921  44.755 -21.350
  285    HD3  ARG   9           HD2      ARG   9  -5.633  43.707 -19.948
  286    HE   ARG   9           HE       ARG   9  -3.057  44.750 -20.947
  287   HH11  ARG   9          1HH2      ARG   9  -5.955  45.755 -19.227
  288   HH12  ARG   9          2HH2      ARG   9  -5.001  47.071 -18.356
  289   HH21  ARG   9          1HH1      ARG   9  -2.064  46.326 -19.896
  290   HH22  ARG   9          2HH1      ARG   9  -3.030  47.380 -18.732
  291    HA   PRO  10           HA       PRO  10  -3.777  37.355 -22.068
  292    HB2  PRO  10           HB1      PRO  10  -1.773  37.573 -24.353
  293    HB3  PRO  10           HB2      PRO  10  -2.674  36.147 -23.794
  294    HG2  PRO  10           HG2      PRO  10  -3.483  37.405 -26.051
  295    HG3  PRO  10           HG1      PRO  10  -4.717  36.935 -24.857
  296    HD2  PRO  10           HD1      PRO  10  -3.435  39.713 -25.200
  297    HD3  PRO  10           HD2      PRO  10  -5.169  39.279 -25.091
  298    H    TYR  11           HN       TYR  11  -3.047  39.691 -20.839
  299    HA   TYR  11           HA       TYR  11  -0.134  39.105 -20.143
  300    HB2  TYR  11           HB1      TYR  11  -0.060  41.065 -21.651
  301    HB3  TYR  11           HB2      TYR  11  -1.243  41.920 -20.677
  302    HD1  TYR  11           HD2      TYR  11   2.115  40.220 -20.260
  303    HD2  TYR  11           HD1      TYR  11  -0.429  43.418 -19.055
  304    HE1  TYR  11           HE2      TYR  11   3.873  41.075 -18.790
  305    HE2  TYR  11           HE1      TYR  11   1.346  44.281 -17.619
  306    HH   TYR  11           HH       TYR  11   3.474  44.097 -17.027
  307    H    ILE  12           HN       ILE  12   0.064  38.692 -18.110
  308    HA   ILE  12           HA       ILE  12  -2.084  39.552 -16.127
  309    HB   ILE  12           HB       ILE  12   0.317  37.675 -15.747
  310   HG12  ILE  12          1HG1      ILE  12  -1.220  36.581 -17.279
  311   HG13  ILE  12          2HG1      ILE  12  -1.273  35.793 -15.716
  312   HG21  ILE  12          2HG2      ILE  12  -2.066  38.217 -13.864
  313   HG22  ILE  12          3HG2      ILE  12  -0.808  36.984 -13.620
  314   HG23  ILE  12          1HG2      ILE  12  -0.381  38.711 -13.596
  315   HD11  ILE  12          1HD1      ILE  12  -3.565  35.994 -16.673
  316   HD12  ILE  12          2HD1      ILE  12  -3.412  37.761 -16.792
  317   HD13  ILE  12          3HD1      ILE  12  -3.473  36.973 -15.192
  318    H    LEU  13           HN       LEU  13  -1.729  41.356 -15.003
  319    HA   LEU  13           HA       LEU  13   0.818  42.852 -15.306
  320    HB2  LEU  13           HB1      LEU  13  -1.747  43.478 -13.725
  321    HB3  LEU  13           HB2      LEU  13  -0.320  44.493 -13.688
  322    HG   LEU  13           HG       LEU  13  -0.425  44.684 -16.247
  323   HD11  LEU  13          2HD1      LEU  13  -3.254  43.517 -15.786
  324   HD12  LEU  13          3HD1      LEU  13  -2.748  44.385 -17.255
  325   HD13  LEU  13          1HD1      LEU  13  -1.988  42.841 -16.843
  326   HD21  LEU  13          1HD2      LEU  13  -1.113  46.509 -14.679
  327   HD22  LEU  13          2HD2      LEU  13  -2.754  45.824 -14.586
  328   HD23  LEU  13          3HD2      LEU  13  -2.150  46.488 -16.122
  Start of MODEL    5
    1    H1   VAL   1           HN1      VAL   1   2.854  31.111 -14.757
    2    H2   VAL   1           HN2      VAL   1   3.473  31.656 -16.190
    3    H3   VAL   1           HN3      VAL   1   4.195  30.398 -15.397
    4    HA   VAL   1           HA       VAL   1   4.432  32.022 -13.444
    5    HB   VAL   1           HB       VAL   1   6.666  32.830 -14.314
    6   HG11  VAL   1          3HG2      VAL   1   6.415  30.714 -13.017
    7   HG12  VAL   1          1HG2      VAL   1   6.159  29.799 -14.521
    8   HG13  VAL   1          2HG2      VAL   1   7.721  30.595 -14.212
    9   HG21  VAL   1          1HG1      VAL   1   6.083  31.138 -16.833
   10   HG22  VAL   1          2HG1      VAL   1   6.248  32.906 -16.810
   11   HG23  VAL   1          3HG1      VAL   1   7.636  31.886 -16.393
   12    H    ARG   2           HN       ARG   2   2.907  33.567 -13.173
   13    HA   ARG   2           HA       ARG   2   2.150  35.796 -14.664
   14    HB2  ARG   2           HB2      ARG   2   1.215  35.004 -12.469
   15    HB3  ARG   2           HB1      ARG   2   2.599  35.671 -11.615
   16    HG2  ARG   2           HG2      ARG   2   1.868  38.003 -12.343
   17    HG3  ARG   2           HG1      ARG   2   0.489  37.289 -13.183
   18    HD2  ARG   2           HD1      ARG   2  -0.336  36.308 -10.982
   19    HD3  ARG   2           HD2      ARG   2   1.057  37.020 -10.142
   20    HE   ARG   2           HE       ARG   2  -0.227  39.206 -11.494
   21   HH11  ARG   2          1HH1      ARG   2  -1.073  36.943  -8.885
   22   HH12  ARG   2          2HH1      ARG   2  -2.288  38.156  -8.228
   23   HH21  ARG   2          1HH2      ARG   2  -1.665  40.464 -10.677
   24   HH22  ARG   2          2HH2      ARG   2  -2.600  40.015  -9.166
   25    H    ARG   3           HN       ARG   3   2.807  37.873 -15.034
   26    HA   ARG   3           HA       ARG   3   5.602  38.785 -14.123
   27    HB2  ARG   3           HB1      ARG   3   4.568  39.052 -17.009
   28    HB3  ARG   3           HB2      ARG   3   6.087  39.657 -16.389
   29    HG2  ARG   3           HG1      ARG   3   5.303  36.697 -16.682
   30    HG3  ARG   3           HG2      ARG   3   6.309  37.618 -17.783
   31    HD2  ARG   3           HD2      ARG   3   8.050  37.929 -15.933
   32    HD3  ARG   3           HD1      ARG   3   7.037  36.991 -14.847
   33    HE   ARG   3           HE       ARG   3   7.581  34.940 -15.985
   34   HH11  ARG   3          1HH1      ARG   3   8.925  37.683 -17.802
   35   HH12  ARG   3          2HH1      ARG   3   9.948  36.538 -18.807
   36   HH21  ARG   3          1HH2      ARG   3   8.789  33.730 -17.180
   37   HH22  ARG   3          2HH2      ARG   3   9.872  34.448 -18.475
   38    H    LEU   4           HN       LEU   4   4.770  40.246 -12.693
   39    HA   LEU   4           HA       LEU   4   2.491  42.001 -13.301
   40    HB2  LEU   4           HB1      LEU   4   3.153  41.003 -11.066
   41    HB3  LEU   4           HB2      LEU   4   4.396  42.219 -10.902
   42    HG   LEU   4           HG       LEU   4   1.396  42.874 -11.283
   43   HD11  LEU   4          1HD1      LEU   4   1.662  41.459  -9.246
   44   HD12  LEU   4          2HD1      LEU   4   1.231  43.120  -8.804
   45   HD13  LEU   4          3HD1      LEU   4   2.911  42.559  -8.613
   46   HD21  LEU   4          3HD2      LEU   4   1.949  45.072 -10.182
   47   HD22  LEU   4          1HD2      LEU   4   2.808  44.868 -11.710
   48   HD23  LEU   4          2HD2      LEU   4   3.678  44.638 -10.173
   49    H    MET   5           HN       MET   5   3.158  43.025 -15.197
   50    HA   MET   5           HA       MET   5   5.373  45.094 -15.120
   51    HB2  MET   5           HB1      MET   5   3.602  44.042 -17.417
   52    HB3  MET   5           HB2      MET   5   4.810  45.300 -17.602
   53    HG2  MET   5           HG2      MET   5   6.629  43.725 -16.867
   54    HG3  MET   5           HG1      MET   5   5.431  42.420 -16.707
   55    HE1  MET   5           HE1      MET   5   8.022  42.229 -18.563
   56    HE2  MET   5           HE2      MET   5   7.343  41.504 -20.050
   57    HE3  MET   5           HE3      MET   5   6.815  40.910 -18.447
   58    H    PHE   6           HN       PHE   6   4.212  46.419 -13.533
   59    HA   PHE   6           HA       PHE   6   1.769  47.920 -14.471
   60    HB2  PHE   6           HB1      PHE   6   2.106  47.050 -12.091
   61    HB3  PHE   6           HB2      PHE   6   3.351  48.237 -11.848
   62    HD1  PHE   6           HD1      PHE   6  -0.306  47.693 -12.365
   63    HD2  PHE   6           HD2      PHE   6   2.711  50.652 -11.545
   64    HE1  PHE   6           HE1      PHE   6  -2.044  49.287 -11.681
   65    HE2  PHE   6           HE2      PHE   6   0.954  52.237 -10.871
   66    HZ   PHE   6           HZ       PHE   6  -1.424  51.561 -10.937
   67    H    SER   7           HN       SER   7   2.438  49.163 -16.171
   68    HA   SER   7           HA       SER   7   4.113  51.611 -15.530
   69    HB2  SER   7           HB2      SER   7   5.475  51.472 -17.584
   70    HB3  SER   7           HB1      SER   7   5.816  50.161 -16.457
   71    HG   SER   7           HG       SER   7   4.536  48.794 -17.716
   72    H    TYR   8           HN       TYR   8   2.850  50.537 -18.688
   73    HA   TYR   8           HA       TYR   8   0.772  52.814 -18.562
   74    HB2  TYR   8           HB1      TYR   8   2.496  51.920 -20.963
   75    HB3  TYR   8           HB2      TYR   8   1.110  52.966 -21.097
   76    HD1  TYR   8           HD2      TYR   8   1.123  55.290 -20.089
   77    HD2  TYR   8           HD1      TYR   8   4.648  52.819 -20.038
   78    HE1  TYR   8           HE2      TYR   8   2.506  57.258 -19.593
   79    HE2  TYR   8           HE1      TYR   8   6.018  54.797 -19.540
   80    HH   TYR   8           HH       TYR   8   6.034  56.988 -19.169
   81    H    ILE   9           HN       ILE   9  -1.048  51.732 -18.166
   82    HA   ILE   9           HA       ILE   9  -1.609  49.011 -19.303
   83    HB   ILE   9           HB       ILE   9  -3.378  50.751 -17.510
   84   HG12  ILE   9          2HG1      ILE   9  -1.716  48.271 -16.729
   85   HG13  ILE   9          1HG1      ILE   9  -1.156  49.907 -16.472
   86   HG21  ILE   9          1HG2      ILE   9  -3.723  47.774 -18.301
   87   HG22  ILE   9          2HG2      ILE   9  -4.723  48.648 -17.116
   88   HG23  ILE   9          3HG2      ILE   9  -4.774  49.110 -18.814
   89   HD11  ILE   9          3HD1      ILE   9  -2.070  49.053 -14.382
   90   HD12  ILE   9          1HD1      ILE   9  -3.639  48.689 -15.121
   91   HD13  ILE   9          2HD1      ILE   9  -3.109  50.385 -14.943
   92    H    SER  10           HN       SER  10  -1.648  49.381 -21.477
   93    HA   SER  10           HA       SER  10  -3.684  51.204 -22.757
   94    HB2  SER  10           HB1      SER  10  -2.522  50.658 -24.856
   95    HB3  SER  10           HB2      SER  10  -1.366  51.126 -23.619
   96    HG   SER  10           HG       SER  10  -0.674  49.314 -24.713
   97    H    ASP  11           HN       ASP  11  -4.911  50.325 -24.668
   98    HA   ASP  11           HA       ASP  11  -6.710  48.130 -23.834
   99    HB2  ASP  11           HB2      ASP  11  -6.577  50.005 -26.288
  100    HB3  ASP  11           HB1      ASP  11  -7.750  48.721 -26.234
  101    H    GLU  12           HN       GLU  12  -7.573  46.675 -25.702
  102    HA   GLU  12           HA       GLU  12  -5.719  44.484 -25.686
  103    HB2  GLU  12           HB1      GLU  12  -7.434  43.122 -26.733
  104    HB3  GLU  12           HB2      GLU  12  -8.000  44.071 -25.378
  105    HG2  GLU  12           HG2      GLU  12  -9.086  45.727 -27.018
  106    HG3  GLU  12           HG1      GLU  12  -8.601  44.677 -28.344
  107    H    GLN  13           HN       GLN  13  -3.939  44.572 -26.793
  108    HA   GLN  13           HA       GLN  13  -3.518  45.408 -29.553
  109    HB2  GLN  13           HB1      GLN  13  -1.848  43.533 -27.778
  110    HB3  GLN  13           HB2      GLN  13  -1.284  44.182 -29.303
  111    HG2  GLN  13           HG1      GLN  13  -1.128  46.443 -28.500
  112    HG3  GLN  13           HG2      GLN  13  -2.168  46.152 -27.124
  113   HE21  GLN  13          2HE2      GLN  13   1.132  45.766 -28.278
  114   HE22  GLN  13          1HE2      GLN  13   1.789  45.285 -26.631
  115    H    TRP  14           HN       TRP  14  -3.935  42.113 -28.242
  116    HA   TRP  14           HA       TRP  14  -4.682  41.084 -31.042
  117    HB2  TRP  14           HB1      TRP  14  -3.386  39.437 -28.762
  118    HB3  TRP  14           HB2      TRP  14  -4.012  38.774 -30.254
  119    HD1  TRP  14           HD1      TRP  14  -0.875  40.380 -28.802
  120    HE1  TRP  14           HE1      TRP  14   1.067  40.601 -30.578
  121    HE3  TRP  14           HE3      TRP  14  -3.714  39.270 -32.895
  122    HZ2  TRP  14           HZ2      TRP  14   1.156  40.309 -33.423
  123    HZ3  TRP  14           HZ3      TRP  14  -2.647  39.274 -35.128
  124    HH2  TRP  14           HH2      TRP  14  -0.253  39.786 -35.387
  125    H    THR  15           HN       THR  15  -6.697  40.099 -31.099
  126    HA   THR  15           HA       THR  15  -8.351  40.383 -28.554
  127    HB   THR  15           HB       THR  15  -8.752  42.025 -30.243
  128    HG1  THR  15           HG1      THR  15 -10.401  41.738 -29.047
  129   HG21  THR  15          3HG2      THR  15 -10.035  41.662 -32.273
  130   HG22  THR  15          1HG2      THR  15  -8.531  40.726 -32.437
  131   HG23  THR  15          2HG2      THR  15 -10.070  39.905 -32.050
  132    HA   PRO  16           HA       PRO  16  -9.181  35.828 -29.280
  133    HB2  PRO  16           HB1      PRO  16  -8.158  34.684 -27.021
  134    HB3  PRO  16           HB2      PRO  16  -7.116  35.261 -28.332
  135    HG2  PRO  16           HG2      PRO  16  -7.808  36.738 -25.732
  136    HG3  PRO  16           HG1      PRO  16  -6.192  36.446 -26.415
  137    HD2  PRO  16           HD1      PRO  16  -7.591  38.820 -26.856
  138    HD3  PRO  16           HD2      PRO  16  -6.458  38.123 -28.056
  139    H    PHE  17           HN       PHE  17 -11.095  34.940 -28.802
  140    HA   PHE  17           HA       PHE  17 -13.029  36.163 -27.015
  141    HB2  PHE  17           HB1      PHE  17 -13.191  33.462 -28.462
  142    HB3  PHE  17           HB2      PHE  17 -14.508  34.129 -27.539
  143    HD1  PHE  17           HD2      PHE  17 -15.414  36.513 -28.146
  144    HD2  PHE  17           HD1      PHE  17 -12.924  34.203 -30.791
  145    HE1  PHE  17           HE2      PHE  17 -16.179  37.858 -30.058
  146    HE2  PHE  17           HE1      PHE  17 -13.706  35.556 -32.691
  147    HZ   PHE  17           HZ       PHE  17 -15.330  37.385 -32.331
  148    H    LEU  18           HN       LEU  18 -11.297  33.047 -26.450
  149    HA   LEU  18           HA       LEU  18 -12.436  33.011 -23.600
  150    HB2  LEU  18           HB2      LEU  18 -10.853  30.871 -25.116
  151    HB3  LEU  18           HB1      LEU  18 -11.330  30.741 -23.438
  152    HG   LEU  18           HG       LEU  18 -13.345  31.024 -25.751
  153   HD11  LEU  18          3HD2      LEU  18 -12.064  28.889 -25.949
  154   HD12  LEU  18          1HD2      LEU  18 -13.748  28.577 -25.493
  155   HD13  LEU  18          2HD2      LEU  18 -12.462  28.465 -24.265
  156   HD21  LEU  18          1HD1      LEU  18 -14.348  31.769 -23.586
  157   HD22  LEU  18          2HD1      LEU  18 -13.803  30.277 -22.780
  158   HD23  LEU  18          3HD1      LEU  18 -15.041  30.212 -24.060
  159    H    TYR  19           HN       TYR  19 -11.314  34.834 -22.948
  160    HA   TYR  19           HA       TYR  19  -8.275  34.717 -22.770
  161    HB2  TYR  19           HB1      TYR  19  -8.270  37.047 -22.373
  162    HB3  TYR  19           HB2      TYR  19  -9.212  36.708 -23.785
  163    HD1  TYR  19           HD1      TYR  19 -11.805  36.871 -23.649
  164    HD2  TYR  19           HD2      TYR  19  -9.243  38.361 -20.530
  165    HE1  TYR  19           HE1      TYR  19 -13.668  38.176 -22.729
  166    HE2  TYR  19           HE2      TYR  19 -11.103  39.688 -19.644
  167    HH   TYR  19           HH       TYR  19 -14.370  39.448 -21.055
  168    H    ASP  20           HN       ASP  20  -9.113  32.827 -21.221
  169    HA   ASP  20           HA       ASP  20  -9.732  33.713 -18.444
  170    HB2  ASP  20           HB2      ASP  20  -9.339  30.913 -19.670
  171    HB3  ASP  20           HB1      ASP  20  -9.863  31.205 -18.031
  172    H    PHE  21           HN       PHE  21  -7.473  34.896 -18.618
  173    HA   PHE  21           HA       PHE  21  -5.183  33.183 -17.624
  174    HB2  PHE  21           HB1      PHE  21  -3.742  35.107 -17.965
  175    HB3  PHE  21           HB2      PHE  21  -4.571  34.589 -19.390
  176    HD1  PHE  21           HD1      PHE  21  -6.272  36.054 -20.514
  177    HD2  PHE  21           HD2      PHE  21  -4.156  37.421 -17.021
  178    HE1  PHE  21           HE1      PHE  21  -6.924  38.376 -21.005
  179    HE2  PHE  21           HE2      PHE  21  -4.882  39.716 -17.497
  180    HZ   PHE  21           HZ       PHE  21  -6.236  40.206 -19.502
  181    H    TYR  22           HN       TYR  22  -6.739  32.817 -15.752
  182    HA   TYR  22           HA       TYR  22  -6.670  34.890 -13.601
  183    HB2  TYR  22           HB2      TYR  22  -7.779  32.085 -13.173
  184    HB3  TYR  22           HB1      TYR  22  -8.162  33.552 -12.321
  185    HD1  TYR  22           HD1      TYR  22  -9.102  35.553 -14.137
  186    HD2  TYR  22           HD2      TYR  22  -9.497  31.286 -14.563
  187    HE1  TYR  22           HE1      TYR  22 -11.013  35.868 -15.649
  188    HE2  TYR  22           HE2      TYR  22 -11.414  31.618 -16.048
  189    HH   TYR  22           HH       TYR  22 -12.490  33.175 -17.344
  190    H    HIS  23           HN       HIS  23  -5.376  31.556 -13.878
  191    HA   HIS  23           HA       HIS  23  -3.414  32.138 -11.582
  192    HB2  HIS  23           HB1      HIS  23  -5.310  30.617 -10.877
  193    HB3  HIS  23           HB2      HIS  23  -4.910  29.492 -12.156
  194    HD1  HIS  23           HD1      HIS  23  -2.319  28.276 -11.902
  195    HD2  HIS  23           HD2      HIS  23  -3.894  30.515  -8.598
  196    HE1  HIS  23           HE1      HIS  23  -1.018  27.731  -9.755
  197    HE2  HIS  23           HE2      HIS  23  -1.856  29.059  -7.714
  198    H    TYR  24           HN       TYR  24  -1.658  32.548 -12.793
  199    HA   TYR  24           HA       TYR  24  -0.723  30.485 -14.864
  200    HB2  TYR  24           HB1      TYR  24  -1.705  32.539 -15.971
  201    HB3  TYR  24           HB2      TYR  24  -0.538  33.552 -15.160
  202    HD1  TYR  24           HD1      TYR  24  -0.780  30.560 -17.503
  203    HD2  TYR  24           HD2      TYR  24   1.562  33.950 -16.274
  204    HE1  TYR  24           HE1      TYR  24   0.807  30.138 -19.334
  205    HE2  TYR  24           HE2      TYR  24   3.154  33.501 -18.090
  206    HH   TYR  24           HH       TYR  24   2.663  30.813 -20.368
  207    H1   PCA   1           HN       PCA   1 -26.367  49.782 -16.250
  208    HA   PCA   1           HA       PCA   1 -25.559  47.454 -15.060
  209    HB2  PCA   1           HB2      PCA   1 -26.550  45.536 -16.111
  210    HB3  PCA   1           HB1      PCA   1 -26.694  46.341 -17.684
  211    HG2  PCA   1           HG2      PCA   1 -28.501  46.693 -15.260
  212    HG3  PCA   1           HG1      PCA   1 -28.920  46.703 -17.001
  213    H    LEU   2           HN       LEU   2 -23.773  48.952 -15.468
  214    HA   LEU   2           HA       LEU   2 -22.382  48.864 -18.105
  215    HB2  LEU   2           HB1      LEU   2 -20.900  50.479 -17.361
  216    HB3  LEU   2           HB2      LEU   2 -22.518  50.958 -16.940
  217    HG   LEU   2           HG       LEU   2 -20.375  49.956 -14.953
  218   HD11  LEU   2          2HD1      LEU   2 -20.224  52.318 -14.226
  219   HD12  LEU   2          3HD1      LEU   2 -21.424  52.806 -15.449
  220   HD13  LEU   2          1HD1      LEU   2 -19.836  52.173 -15.949
  221   HD21  LEU   2          1HD2      LEU   2 -21.892  50.826 -13.128
  222   HD22  LEU   2          2HD2      LEU   2 -22.580  49.428 -13.959
  223   HD23  LEU   2          3HD2      LEU   2 -23.190  51.063 -14.327
  224    H    TYR   3           HN       TYR   3 -22.217  46.524 -18.060
  225    HA   TYR   3           HA       TYR   3 -19.815  45.416 -16.505
  226    HB2  TYR   3           HB1      TYR   3 -22.134  43.942 -17.894
  227    HB3  TYR   3           HB2      TYR   3 -20.768  43.167 -17.140
  228    HD1  TYR   3           HD2      TYR   3 -20.327  43.530 -14.602
  229    HD2  TYR   3           HD1      TYR   3 -24.035  44.628 -16.493
  230    HE1  TYR   3           HE2      TYR   3 -21.445  43.552 -12.415
  231    HE2  TYR   3           HE1      TYR   3 -25.140  44.644 -14.298
  232    HH   TYR   3           HH       TYR   3 -24.914  44.315 -12.115
  233    H    GLU   4           HN       GLU   4 -18.213  46.215 -17.766
  234    HA   GLU   4           HA       GLU   4 -18.086  46.046 -20.691
  235    HB2  GLU   4           HB1      GLU   4 -16.144  46.846 -18.459
  236    HB3  GLU   4           HB2      GLU   4 -15.486  46.597 -20.045
  237    HG2  GLU   4           HG1      GLU   4 -17.915  48.469 -19.656
  238    HG3  GLU   4           HG2      GLU   4 -16.267  49.003 -19.354
  239    H    ASN   5           HN       ASN   5 -18.465  43.918 -21.219
  240    HA   ASN   5           HA       ASN   5 -16.243  41.861 -20.721
  241    HB2  ASN   5           HB1      ASN   5 -19.202  41.537 -21.534
  242    HB3  ASN   5           HB2      ASN   5 -18.038  40.243 -21.659
  243   HD21  ASN   5          1HD2      ASN   5 -19.786  42.226 -19.347
  244   HD22  ASN   5          2HD2      ASN   5 -19.417  41.143 -17.913
  245    H    LYS   6           HN       LYS   6 -14.781  42.425 -22.180
  246    HA   LYS   6           HA       LYS   6 -15.462  42.245 -25.168
  247    HB2  LYS   6           HB1      LYS   6 -13.528  44.166 -23.723
  248    HB3  LYS   6           HB2      LYS   6 -13.448  43.891 -25.449
  249    HG2  LYS   6           HG1      LYS   6 -15.609  44.833 -25.891
  250    HG3  LYS   6           HG2      LYS   6 -16.092  44.808 -24.196
  251    HD2  LYS   6           HD2      LYS   6 -14.412  46.510 -23.592
  252    HD3  LYS   6           HD1      LYS   6 -13.767  46.542 -25.238
  253    HE2  LYS   6           HE2      LYS   6 -15.897  47.453 -26.144
  254    HE3  LYS   6           HE1      LYS   6 -16.711  47.248 -24.586
  255    HZ1  LYS   6           HZ1      LYS   6 -15.322  48.884 -23.615
  256    HZ2  LYS   6           HZ2      LYS   6 -15.892  49.543 -25.010
  257    HZ3  LYS   6           HZ3      LYS   6 -14.324  49.002 -24.919
  258    HA   PRO   7           HA       PRO   7 -12.280  39.014 -25.120
  259    HB2  PRO   7           HB1      PRO   7 -11.568  38.848 -27.802
  260    HB3  PRO   7           HB2      PRO   7 -13.125  38.358 -27.126
  261    HG2  PRO   7           HG2      PRO   7 -12.473  40.999 -28.507
  262    HG3  PRO   7           HG1      PRO   7 -13.836  39.903 -28.819
  263    HD2  PRO   7           HD2      PRO   7 -14.038  42.148 -27.220
  264    HD3  PRO   7           HD1      PRO   7 -14.975  40.667 -26.854
  265    H    ARG   8           HN       ARG   8 -10.908  40.446 -23.714
  266    HA   ARG   8           HA       ARG   8  -8.731  42.019 -24.810
  267    HB2  ARG   8           HB1      ARG   8  -9.439  41.061 -21.985
  268    HB3  ARG   8           HB2      ARG   8  -7.834  41.662 -22.242
  269    HG2  ARG   8           HG2      ARG   8  -8.981  43.518 -21.457
  270    HG3  ARG   8           HG1      ARG   8  -8.681  43.829 -23.148
  271    HD2  ARG   8           HD2      ARG   8 -10.889  44.639 -22.647
  272    HD3  ARG   8           HD1      ARG   8 -11.103  43.227 -23.668
  273    HE   ARG   8           HE       ARG   8 -11.611  41.840 -21.574
  274   HH11  ARG   8          1HH2      ARG   8 -12.212  45.349 -21.459
  275   HH12  ARG   8          2HH2      ARG   8 -13.591  45.061 -20.282
  276   HH21  ARG   8          2HH1      ARG   8 -13.151  41.649 -20.265
  277   HH22  ARG   8          1HH1      ARG   8 -14.093  43.103 -19.661
  278    H    ARG   9           HN       ARG   9  -6.542  41.793 -24.850
  279    HA   ARG   9           HA       ARG   9  -5.424  39.155 -25.443
  280    HB2  ARG   9           HB1      ARG   9  -3.684  40.234 -26.373
  281    HB3  ARG   9           HB2      ARG   9  -4.745  41.599 -26.324
  282    HG2  ARG   9           HG2      ARG   9  -2.351  41.101 -24.488
  283    HG3  ARG   9           HG1      ARG   9  -2.522  42.238 -25.814
  284    HD2  ARG   9           HD1      ARG   9  -4.597  43.177 -24.326
  285    HD3  ARG   9           HD2      ARG   9  -3.756  42.363 -23.006
  286    HE   ARG   9           HE       ARG   9  -1.790  43.966 -24.439
  287   HH11  ARG   9          1HH2      ARG   9  -4.701  44.523 -22.495
  288   HH12  ARG   9          2HH2      ARG   9  -4.219  46.280 -22.261
  289   HH21  ARG   9          1HH1      ARG   9  -1.341  45.969 -24.113
  290   HH22  ARG   9          2HH1      ARG   9  -2.434  47.045 -23.109
  291    HA   PRO  10           HA       PRO  10  -3.881  37.827 -21.405
  292    HB2  PRO  10           HB1      PRO  10  -1.704  36.251 -21.949
  293    HB3  PRO  10           HB2      PRO  10  -3.349  35.864 -22.471
  294    HG2  PRO  10           HG2      PRO  10  -1.159  37.238 -24.122
  295    HG3  PRO  10           HG1      PRO  10  -2.133  35.820 -24.579
  296    HD2  PRO  10           HD1      PRO  10  -2.812  38.362 -25.397
  297    HD3  PRO  10           HD2      PRO  10  -4.085  37.170 -24.995
  298    H    TYR  11           HN       TYR  11  -3.504  40.175 -20.955
  299    HA   TYR  11           HA       TYR  11  -0.628  40.945 -20.379
  300    HB2  TYR  11           HB2      TYR  11  -2.125  42.671 -21.234
  301    HB3  TYR  11           HB1      TYR  11  -3.306  42.380 -19.982
  302    HD1  TYR  11           HD1      TYR  11   0.480  43.080 -19.967
  303    HD2  TYR  11           HD2      TYR  11  -3.418  44.206 -18.518
  304    HE1  TYR  11           HE1      TYR  11   1.484  44.875 -18.621
  305    HE2  TYR  11           HE2      TYR  11  -2.404  46.005 -17.212
  306    HH   TYR  11           HH       TYR  11   1.093  46.431 -17.020
  307    H    ILE  12           HN       ILE  12  -0.086  39.322 -19.019
  308    HA   ILE  12           HA       ILE  12  -1.612  38.493 -16.638
  309    HB   ILE  12           HB       ILE  12   0.404  37.014 -16.188
  310   HG12  ILE  12          2HG1      ILE  12   1.496  38.069 -18.876
  311   HG13  ILE  12          1HG1      ILE  12   2.164  38.478 -17.309
  312   HG21  ILE  12          2HG2      ILE  12  -1.601  36.241 -17.441
  313   HG22  ILE  12          3HG2      ILE  12  -0.863  36.748 -18.980
  314   HG23  ILE  12          1HG2      ILE  12  -0.133  35.442 -18.017
  315   HD11  ILE  12          1HD1      ILE  12   3.531  36.741 -18.356
  316   HD12  ILE  12          2HD1      ILE  12   2.134  35.669 -18.560
  317   HD13  ILE  12          3HD1      ILE  12   2.748  36.035 -16.923
  318    H    LEU  13           HN       LEU  13  -1.648  40.853 -15.967
  319    HA   LEU  13           HA       LEU  13   0.654  41.996 -14.563
  320    HB2  LEU  13           HB1      LEU  13  -1.105  43.365 -15.678
  321    HB3  LEU  13           HB2      LEU  13  -2.330  42.742 -14.589
  322    HG   LEU  13           HG       LEU  13  -1.146  43.865 -12.630
  323   HD11  LEU  13          1HD2      LEU  13   1.160  44.074 -13.561
  324   HD12  LEU  13          2HD2      LEU  13   0.532  45.658 -13.096
  325   HD13  LEU  13          3HD2      LEU  13   0.583  45.195 -14.816
  326   HD21  LEU  13          2HD1      LEU  13  -1.998  46.126 -13.142
  327   HD22  LEU  13          3HD1      LEU  13  -2.032  45.766 -14.885
  328   HD23  LEU  13          1HD1      LEU  13  -3.119  44.903 -13.768
  Start of MODEL    6
    1    H1   VAL   1           HN1      VAL   1   5.715  39.115 -11.184
    2    H2   VAL   1           HN2      VAL   1   5.438  38.739  -9.600
    3    H3   VAL   1           HN3      VAL   1   4.910  40.173 -10.208
    4    HA   VAL   1           HA       VAL   1   3.927  37.458 -10.950
    5    HB   VAL   1           HB       VAL   1   1.732  38.180 -10.055
    6   HG11  VAL   1          3HG2      VAL   1   3.974  38.193  -7.936
    7   HG12  VAL   1          1HG2      VAL   1   3.278  36.742  -8.706
    8   HG13  VAL   1          2HG2      VAL   1   2.266  37.776  -7.681
    9   HG21  VAL   1          1HG1      VAL   1   1.550  40.038  -8.404
   10   HG22  VAL   1          2HG1      VAL   1   3.195  40.589  -8.780
   11   HG23  VAL   1          3HG1      VAL   1   1.906  40.673 -10.014
   12    H    ARG   2           HN       ARG   2   3.286  40.951 -11.617
   13    HA   ARG   2           HA       ARG   2   1.788  40.134 -14.049
   14    HB2  ARG   2           HB2      ARG   2   1.471  42.553 -14.452
   15    HB3  ARG   2           HB1      ARG   2   0.909  41.981 -12.895
   16    HG2  ARG   2           HG2      ARG   2   2.791  43.072 -11.723
   17    HG3  ARG   2           HG1      ARG   2   3.606  43.430 -13.244
   18    HD2  ARG   2           HD1      ARG   2   2.480  45.445 -12.311
   19    HD3  ARG   2           HD2      ARG   2   1.852  45.028 -13.915
   20    HE   ARG   2           HE       ARG   2   0.020  43.713 -12.170
   21   HH11  ARG   2          2HH2      ARG   2   1.081  47.011 -12.657
   22   HH12  ARG   2          1HH2      ARG   2  -0.591  47.639 -12.245
   23   HH21  ARG   2          2HH1      ARG   2  -1.772  44.431 -11.729
   24   HH22  ARG   2          1HH1      ARG   2  -2.159  46.231 -11.720
   25    H    ARG   3           HN       ARG   3   2.142  40.802 -16.143
   26    HA   ARG   3           HA       ARG   3   5.044  40.467 -16.982
   27    HB2  ARG   3           HB1      ARG   3   2.458  40.556 -18.649
   28    HB3  ARG   3           HB2      ARG   3   4.071  40.340 -19.318
   29    HG2  ARG   3           HG2      ARG   3   4.364  38.216 -17.958
   30    HG3  ARG   3           HG1      ARG   3   2.732  38.422 -17.314
   31    HD2  ARG   3           HD2      ARG   3   1.840  38.404 -19.729
   32    HD3  ARG   3           HD1      ARG   3   3.479  38.023 -20.291
   33    HE   ARG   3           HE       ARG   3   2.940  36.060 -18.269
   34   HH11  ARG   3          1HH1      ARG   3   1.425  37.038 -21.291
   35   HH12  ARG   3          2HH1      ARG   3   0.704  35.367 -21.517
   36   HH21  ARG   3          2HH2      ARG   3   2.082  34.170 -18.595
   37   HH22  ARG   3          1HH2      ARG   3   1.019  33.857 -20.056
   38    H    LEU   4           HN       LEU   4   6.063  42.367 -16.678
   39    HA   LEU   4           HA       LEU   4   4.822  44.971 -17.523
   40    HB2  LEU   4           HB1      LEU   4   7.619  44.332 -16.438
   41    HB3  LEU   4           HB2      LEU   4   7.030  45.951 -16.763
   42    HG   LEU   4           HG       LEU   4   5.729  44.023 -14.741
   43   HD11  LEU   4          3HD2      LEU   4   7.617  46.425 -14.279
   44   HD12  LEU   4          1HD2      LEU   4   8.044  44.710 -14.058
   45   HD13  LEU   4          2HD2      LEU   4   6.821  45.462 -13.008
   46   HD21  LEU   4          1HD1      LEU   4   4.571  46.112 -13.906
   47   HD22  LEU   4          2HD1      LEU   4   5.264  47.042 -15.258
   48   HD23  LEU   4          3HD1      LEU   4   4.094  45.734 -15.574
   49    H    MET   5           HN       MET   5   4.501  44.525 -19.686
   50    HA   MET   5           HA       MET   5   7.017  44.769 -21.433
   51    HB2  MET   5           HB1      MET   5   5.697  42.637 -21.664
   52    HB3  MET   5           HB2      MET   5   4.289  43.558 -22.187
   53    HG2  MET   5           HG1      MET   5   5.592  44.412 -24.189
   54    HG3  MET   5           HG2      MET   5   7.031  43.531 -23.631
   55    HE1  MET   5           HE1      MET   5   7.121  42.378 -26.036
   56    HE2  MET   5           HE2      MET   5   5.626  43.240 -26.518
   57    HE3  MET   5           HE3      MET   5   5.754  41.471 -26.752
   58    H    PHE   6           HN       PHE   6   3.533  45.712 -21.587
   59    HA   PHE   6           HA       PHE   6   4.323  48.040 -23.323
   60    HB2  PHE   6           HB1      PHE   6   1.961  48.486 -23.637
   61    HB3  PHE   6           HB2      PHE   6   2.383  46.847 -24.046
   62    HD1  PHE   6           HD2      PHE   6   1.532  44.946 -22.675
   63    HD2  PHE   6           HD1      PHE   6   0.430  48.960 -21.772
   64    HE1  PHE   6           HE2      PHE   6  -0.307  44.139 -21.280
   65    HE2  PHE   6           HE1      PHE   6  -1.412  48.140 -20.392
   66    HZ   PHE   6           HZ       PHE   6  -1.776  45.728 -20.134
   67    H    SER   7           HN       SER   7   5.158  49.725 -22.385
   68    HA   SER   7           HA       SER   7   4.606  50.510 -19.590
   69    HB2  SER   7           HB1      SER   7   6.791  50.918 -20.745
   70    HB3  SER   7           HB2      SER   7   6.027  52.102 -21.815
   71    HG   SER   7           HG       SER   7   5.412  53.263 -19.892
   72    H    TYR   8           HN       TYR   8   3.625  51.975 -22.694
   73    HA   TYR   8           HA       TYR   8   1.703  53.827 -21.193
   74    HB2  TYR   8           HB2      TYR   8   2.632  53.812 -24.140
   75    HB3  TYR   8           HB1      TYR   8   1.428  54.908 -23.505
   76    HD1  TYR   8           HD2      TYR   8   2.056  56.547 -21.660
   77    HD2  TYR   8           HD1      TYR   8   4.983  54.302 -23.792
   78    HE1  TYR   8           HE2      TYR   8   3.790  58.121 -20.953
   79    HE2  TYR   8           HE1      TYR   8   6.705  55.880 -23.080
   80    HH   TYR   8           HH       TYR   8   7.158  57.713 -21.942
   81    H    ILE   9           HN       ILE   9  -0.427  54.133 -22.551
   82    HA   ILE   9           HA       ILE   9  -1.781  51.484 -22.453
   83    HB   ILE   9           HB       ILE   9  -2.911  54.181 -23.348
   84   HG12  ILE   9          1HG1      ILE   9  -2.182  54.415 -21.041
   85   HG13  ILE   9          2HG1      ILE   9  -3.930  54.369 -21.112
   86   HG21  ILE   9          1HG2      ILE   9  -4.392  51.593 -22.556
   87   HG22  ILE   9          2HG2      ILE   9  -4.341  52.335 -24.173
   88   HG23  ILE   9          3HG2      ILE   9  -5.160  53.175 -22.843
   89   HD11  ILE   9          3HD1      ILE   9  -3.106  53.043 -19.174
   90   HD12  ILE   9          1HD1      ILE   9  -3.901  51.941 -20.320
   91   HD13  ILE   9          2HD1      ILE   9  -2.119  52.012 -20.233
   92    H    SER  10           HN       SER  10  -0.859  50.244 -23.981
   93    HA   SER  10           HA       SER  10  -0.879  51.018 -26.858
   94    HB2  SER  10           HB2      SER  10   0.337  48.957 -27.218
   95    HB3  SER  10           HB1      SER  10   0.953  49.666 -25.727
   96    HG   SER  10           HG       SER  10  -0.845  47.495 -26.061
   97    H    ASP  11           HN       ASP  11  -1.710  49.578 -28.537
   98    HA   ASP  11           HA       ASP  11  -4.539  49.250 -28.444
   99    HB2  ASP  11           HB2      ASP  11  -2.493  47.826 -30.272
  100    HB3  ASP  11           HB1      ASP  11  -4.224  47.903 -30.582
  101    H    GLU  12           HN       GLU  12  -5.881  47.392 -28.658
  102    HA   GLU  12           HA       GLU  12  -5.277  45.379 -26.548
  103    HB2  GLU  12           HB2      GLU  12  -7.562  46.559 -27.078
  104    HB3  GLU  12           HB1      GLU  12  -7.742  45.375 -28.361
  105    HG2  GLU  12           HG1      GLU  12  -8.908  44.514 -26.414
  106    HG3  GLU  12           HG2      GLU  12  -7.472  43.516 -26.580
  107    H    GLN  13           HN       GLN  13  -3.784  43.986 -27.111
  108    HA   GLN  13           HA       GLN  13  -3.542  42.748 -29.766
  109    HB2  GLN  13           HB1      GLN  13  -1.691  43.240 -28.132
  110    HB3  GLN  13           HB2      GLN  13  -2.267  41.953 -27.073
  111    HG2  GLN  13           HG2      GLN  13  -1.741  40.235 -28.799
  112    HG3  GLN  13           HG1      GLN  13  -1.384  41.476 -29.999
  113   HE21  GLN  13          1HE2      GLN  13   0.686  42.170 -30.129
  114   HE22  GLN  13          2HE2      GLN  13   1.983  41.770 -28.891
  115    H    TRP  14           HN       TRP  14  -3.873  40.653 -30.434
  116    HA   TRP  14           HA       TRP  14  -6.324  39.392 -29.543
  117    HB2  TRP  14           HB1      TRP  14  -4.105  38.199 -31.293
  118    HB3  TRP  14           HB2      TRP  14  -5.708  37.511 -31.107
  119    HD1  TRP  14           HD1      TRP  14  -7.459  40.331 -31.373
  120    HE1  TRP  14           HE1      TRP  14  -7.736  41.473 -33.746
  121    HE3  TRP  14           HE3      TRP  14  -3.451  38.156 -33.519
  122    HZ2  TRP  14           HZ2      TRP  14  -6.262  41.300 -36.137
  123    HZ3  TRP  14           HZ3      TRP  14  -2.903  38.682 -35.868
  124    HH2  TRP  14           HH2      TRP  14  -4.292  40.231 -37.156
  125    H    THR  15           HN       THR  15  -6.818  37.603 -28.444
  126    HA   THR  15           HA       THR  15  -4.650  36.505 -26.591
  127    HB   THR  15           HB       THR  15  -6.196  37.826 -25.403
  128    HG1  THR  15           HG1      THR  15  -6.677  35.057 -25.080
  129   HG21  THR  15          3HG2      THR  15  -8.264  37.713 -26.867
  130   HG22  THR  15          1HG2      THR  15  -8.593  37.411 -25.156
  131   HG23  THR  15          2HG2      THR  15  -8.555  36.047 -26.300
  132    HA   PRO  16           HA       PRO  16  -5.758  32.554 -28.708
  133    HB2  PRO  16           HB2      PRO  16  -3.212  31.726 -27.233
  134    HB3  PRO  16           HB1      PRO  16  -3.671  31.386 -28.916
  135    HG2  PRO  16           HG2      PRO  16  -1.821  33.304 -28.413
  136    HG3  PRO  16           HG1      PRO  16  -3.101  33.647 -29.606
  137    HD2  PRO  16           HD2      PRO  16  -3.002  34.544 -26.668
  138    HD3  PRO  16           HD1      PRO  16  -3.391  35.501 -28.135
  139    H    PHE  17           HN       PHE  17  -5.729  30.189 -27.732
  140    HA   PHE  17           HA       PHE  17  -7.267  30.336 -25.133
  141    HB2  PHE  17           HB1      PHE  17  -6.736  27.992 -27.050
  142    HB3  PHE  17           HB2      PHE  17  -7.628  27.839 -25.553
  143    HD1  PHE  17           HD1      PHE  17  -9.780  29.097 -25.214
  144    HD2  PHE  17           HD2      PHE  17  -7.822  29.016 -28.996
  145    HE1  PHE  17           HE1      PHE  17 -11.842  29.833 -26.305
  146    HE2  PHE  17           HE2      PHE  17  -9.889  29.751 -30.075
  147    HZ   PHE  17           HZ       PHE  17 -11.899  30.163 -28.733
  148    H    LEU  18           HN       LEU  18  -5.284  31.118 -24.126
  149    HA   LEU  18           HA       LEU  18  -3.708  28.780 -22.889
  150    HB2  LEU  18           HB1      LEU  18  -2.788  31.662 -23.521
  151    HB3  LEU  18           HB2      LEU  18  -1.822  30.510 -22.625
  152    HG   LEU  18           HG       LEU  18  -2.730  30.080 -25.534
  153   HD11  LEU  18          3HD2      LEU  18  -1.159  32.021 -25.299
  154   HD12  LEU  18          1HD2      LEU  18  -0.010  31.005 -24.397
  155   HD13  LEU  18          2HD2      LEU  18  -0.359  30.654 -26.110
  156   HD21  LEU  18          1HD1      LEU  18  -0.961  28.278 -25.533
  157   HD22  LEU  18          2HD1      LEU  18  -2.252  27.911 -24.372
  158   HD23  LEU  18          3HD1      LEU  18  -0.687  28.539 -23.792
  159    H    TYR  19           HN       TYR  19  -2.794  29.267 -20.764
  160    HA   TYR  19           HA       TYR  19  -4.898  30.600 -19.027
  161    HB2  TYR  19           HB2      TYR  19  -3.837  29.471 -17.124
  162    HB3  TYR  19           HB1      TYR  19  -4.420  28.383 -18.353
  163    HD1  TYR  19           HD1      TYR  19  -2.835  27.072 -19.744
  164    HD2  TYR  19           HD2      TYR  19  -1.430  29.566 -16.590
  165    HE1  TYR  19           HE1      TYR  19  -0.689  25.897 -19.761
  166    HE2  TYR  19           HE2      TYR  19   0.708  28.390 -16.617
  167    HH   TYR  19           HH       TYR  19   1.915  26.802 -17.551
  168    H    ASP  20           HN       ASP  20  -3.979  32.548 -20.237
  169    HA   ASP  20           HA       ASP  20  -1.729  33.838 -18.616
  170    HB2  ASP  20           HB2      ASP  20  -2.975  34.507 -21.354
  171    HB3  ASP  20           HB1      ASP  20  -1.898  35.605 -20.507
  172    H    PHE  21           HN       PHE  21  -4.451  35.463 -20.180
  173    HA   PHE  21           HA       PHE  21  -5.209  36.631 -17.449
  174    HB2  PHE  21           HB2      PHE  21  -3.868  38.129 -19.071
  175    HB3  PHE  21           HB1      PHE  21  -5.237  38.095 -20.163
  176    HD1  PHE  21           HD1      PHE  21  -4.577  38.715 -16.485
  177    HD2  PHE  21           HD2      PHE  21  -6.571  40.020 -20.016
  178    HE1  PHE  21           HE1      PHE  21  -5.409  40.679 -15.293
  179    HE2  PHE  21           HE2      PHE  21  -7.380  41.993 -18.816
  180    HZ   PHE  21           HZ       PHE  21  -6.811  42.319 -16.455
  181    H    TYR  22           HN       TYR  22  -7.409  37.660 -17.518
  182    HA   TYR  22           HA       TYR  22  -9.366  35.538 -18.144
  183    HB2  TYR  22           HB2      TYR  22  -9.493  37.020 -16.153
  184    HB3  TYR  22           HB1      TYR  22  -9.726  38.429 -17.167
  185    HD1  TYR  22           HD1      TYR  22 -11.279  35.023 -16.606
  186    HD2  TYR  22           HD2      TYR  22 -11.936  39.146 -17.455
  187    HE1  TYR  22           HE1      TYR  22 -13.693  34.670 -16.484
  188    HE2  TYR  22           HE2      TYR  22 -14.350  38.782 -17.321
  189    HH   TYR  22           HH       TYR  22 -15.696  35.581 -16.679
  190    H    HIS  23           HN       HIS  23  -9.282  35.200 -20.312
  191    HA   HIS  23           HA       HIS  23 -10.197  37.384 -22.202
  192    HB2  HIS  23           HB2      HIS  23  -9.749  35.717 -24.017
  193    HB3  HIS  23           HB1      HIS  23  -8.380  36.273 -23.084
  194    HD1  HIS  23           HD1      HIS  23 -10.659  33.065 -23.187
  195    HD2  HIS  23           HD2      HIS  23  -6.757  34.482 -22.135
  196    HE1  HIS  23           HE1      HIS  23  -9.100  31.058 -22.637
  197    HE2  HIS  23           HE2      HIS  23  -6.718  31.833 -21.941
  198    H    TYR  24           HN       TYR  24 -12.214  37.740 -21.594
  199    HA   TYR  24           HA       TYR  24 -14.297  35.819 -22.598
  200    HB2  TYR  24           HB2      TYR  24 -13.806  35.238 -20.118
  201    HB3  TYR  24           HB1      TYR  24 -14.347  36.845 -19.685
  202    HD1  TYR  24           HD1      TYR  24 -16.765  37.444 -19.926
  203    HD2  TYR  24           HD2      TYR  24 -15.388  33.507 -20.783
  204    HE1  TYR  24           HE1      TYR  24 -19.064  36.608 -19.810
  205    HE2  TYR  24           HE2      TYR  24 -17.685  32.681 -20.663
  206    HH   TYR  24           HH       TYR  24 -19.808  33.196 -20.357
  207    H1   PCA   1           HN       PCA   1 -29.966  33.536 -23.993
  208    HA   PCA   1           HA       PCA   1 -27.922  33.958 -22.445
  209    HB2  PCA   1           HB2      PCA   1 -27.655  31.854 -21.534
  210    HB3  PCA   1           HB1      PCA   1 -26.376  31.627 -22.743
  211    HG2  PCA   1           HG2      PCA   1 -27.841  30.326 -24.165
  212    HG3  PCA   1           HG1      PCA   1 -28.633  29.972 -22.597
  213    H    LEU   2           HN       LEU   2 -27.798  35.512 -24.197
  214    HA   LEU   2           HA       LEU   2 -25.988  34.788 -26.532
  215    HB2  LEU   2           HB1      LEU   2 -27.471  37.394 -25.873
  216    HB3  LEU   2           HB2      LEU   2 -26.479  37.148 -27.298
  217    HG   LEU   2           HG       LEU   2 -28.994  35.492 -26.648
  218   HD11  LEU   2          1HD2      LEU   2 -29.530  37.898 -27.109
  219   HD12  LEU   2          2HD2      LEU   2 -30.080  36.859 -28.442
  220   HD13  LEU   2          3HD2      LEU   2 -28.599  37.833 -28.627
  221   HD21  LEU   2          2HD1      LEU   2 -27.279  35.643 -29.222
  222   HD22  LEU   2          3HD1      LEU   2 -27.419  34.234 -28.138
  223   HD23  LEU   2          1HD1      LEU   2 -28.829  34.779 -29.065
  224    H    TYR   3           HN       TYR   3 -24.042  34.486 -25.570
  225    HA   TYR   3           HA       TYR   3 -22.791  36.852 -24.077
  226    HB2  TYR   3           HB2      TYR   3 -21.970  33.892 -24.235
  227    HB3  TYR   3           HB1      TYR   3 -20.981  35.132 -23.500
  228    HD1  TYR   3           HD1      TYR   3 -21.730  36.332 -21.457
  229    HD2  TYR   3           HD2      TYR   3 -23.988  33.092 -23.055
  230    HE1  TYR   3           HE1      TYR   3 -22.922  36.114 -19.338
  231    HE2  TYR   3           HE2      TYR   3 -25.174  32.880 -20.923
  232    HH   TYR   3           HH       TYR   3 -24.460  35.018 -18.203
  233    H    GLU   4           HN       GLU   4 -22.228  38.192 -25.712
  234    HA   GLU   4           HA       GLU   4 -20.517  37.189 -27.989
  235    HB2  GLU   4           HB2      GLU   4 -22.299  39.002 -28.256
  236    HB3  GLU   4           HB1      GLU   4 -21.308  40.071 -27.269
  237    HG2  GLU   4           HG1      GLU   4 -19.376  39.609 -29.041
  238    HG3  GLU   4           HG2      GLU   4 -20.629  38.868 -30.036
  239    H    ASN   5           HN       ASN   5 -18.688  36.454 -26.992
  240    HA   ASN   5           HA       ASN   5 -17.234  37.831 -24.925
  241    HB2  ASN   5           HB1      ASN   5 -16.241  35.736 -26.954
  242    HB3  ASN   5           HB2      ASN   5 -15.268  36.305 -25.604
  243   HD21  ASN   5          1HD2      ASN   5 -16.413  36.238 -23.432
  244   HD22  ASN   5          2HD2      ASN   5 -17.338  34.678 -23.105
  245    H    LYS   6           HN       LYS   6 -15.398  38.941 -24.791
  246    HA   LYS   6           HA       LYS   6 -14.730  40.654 -27.253
  247    HB2  LYS   6           HB2      LYS   6 -14.481  41.326 -24.269
  248    HB3  LYS   6           HB1      LYS   6 -13.954  42.382 -25.565
  249    HG2  LYS   6           HG2      LYS   6 -16.886  41.505 -25.099
  250    HG3  LYS   6           HG1      LYS   6 -16.155  42.985 -24.524
  251    HD2  LYS   6           HD2      LYS   6 -17.030  43.912 -26.405
  252    HD3  LYS   6           HD1      LYS   6 -15.531  43.378 -27.123
  253    HE2  LYS   6           HE2      LYS   6 -17.316  42.775 -28.643
  254    HE3  LYS   6           HE1      LYS   6 -16.749  41.252 -27.967
  255    HZ1  LYS   6           HZ1      LYS   6 -18.718  41.016 -26.720
  256    HZ2  LYS   6           HZ2      LYS   6 -19.320  41.868 -28.013
  257    HZ3  LYS   6           HZ3      LYS   6 -18.992  42.643 -26.596
  258    HA   PRO   7           HA       PRO   7 -10.665  38.675 -26.750
  259    HB2  PRO   7           HB2      PRO   7  -9.223  40.009 -28.675
  260    HB3  PRO   7           HB1      PRO   7 -10.558  38.903 -29.064
  261    HG2  PRO   7           HG1      PRO   7 -10.684  41.959 -28.838
  262    HG3  PRO   7           HG2      PRO   7 -11.252  40.952 -30.195
  263    HD2  PRO   7           HD1      PRO   7 -12.972  41.833 -28.214
  264    HD3  PRO   7           HD2      PRO   7 -13.188  40.212 -28.956
  265    H    ARG   8           HN       ARG   8 -10.509  39.472 -24.593
  266    HA   ARG   8           HA       ARG   8  -9.037  41.998 -24.044
  267    HB2  ARG   8           HB2      ARG   8 -10.822  40.814 -22.608
  268    HB3  ARG   8           HB1      ARG   8  -9.577  39.680 -22.090
  269    HG2  ARG   8           HG2      ARG   8  -8.233  41.590 -21.149
  270    HG3  ARG   8           HG1      ARG   8  -9.397  42.755 -21.761
  271    HD2  ARG   8           HD2      ARG   8 -10.004  40.596 -19.618
  272    HD3  ARG   8           HD1      ARG   8  -9.660  42.280 -19.303
  273    HE   ARG   8           HE       ARG   8 -11.813  42.981 -20.297
  274   HH11  ARG   8          2HH1      ARG   8 -11.429  39.462 -20.196
  275   HH12  ARG   8          1HH1      ARG   8 -13.207  39.286 -20.696
  276   HH21  ARG   8          2HH2      ARG   8 -13.847  42.589 -20.798
  277   HH22  ARG   8          1HH2      ARG   8 -14.406  40.844 -20.980
  278    H    ARG   9           HN       ARG   9  -6.944  42.281 -24.104
  279    HA   ARG   9           HA       ARG   9  -5.107  40.545 -25.206
  280    HB2  ARG   9           HB2      ARG   9  -3.354  42.078 -24.581
  281    HB3  ARG   9           HB1      ARG   9  -4.819  42.952 -24.969
  282    HG2  ARG   9           HG1      ARG   9  -5.294  43.173 -22.432
  283    HG3  ARG   9           HG2      ARG   9  -3.747  42.400 -22.128
  284    HD2  ARG   9           HD1      ARG   9  -3.296  44.743 -21.963
  285    HD3  ARG   9           HD2      ARG   9  -2.621  44.272 -23.533
  286    HE   ARG   9           HE       ARG   9  -5.466  45.195 -23.765
  287   HH11  ARG   9          2HH2      ARG   9  -2.150  46.341 -23.511
  288   HH12  ARG   9          1HH2      ARG   9  -2.619  47.921 -24.325
  289   HH21  ARG   9          2HH1      ARG   9  -5.910  46.979 -24.630
  290   HH22  ARG   9          1HH1      ARG   9  -4.604  48.251 -24.965
  291    HA   PRO  10           HA       PRO  10  -3.876  37.533 -22.097
  292    HB2  PRO  10           HB1      PRO  10  -1.968  36.165 -23.482
  293    HB3  PRO  10           HB2      PRO  10  -3.642  36.262 -24.068
  294    HG2  PRO  10           HG1      PRO  10  -1.274  38.016 -24.938
  295    HG3  PRO  10           HG2      PRO  10  -2.361  37.080 -25.993
  296    HD2  PRO  10           HD2      PRO  10  -2.769  39.779 -25.442
  297    HD3  PRO  10           HD1      PRO  10  -4.139  38.664 -25.720
  298    H    TYR  11           HN       TYR  11  -3.121  39.629 -20.945
  299    HA   TYR  11           HA       TYR  11  -0.149  39.257 -20.247
  300    HB2  TYR  11           HB1      TYR  11  -1.689  41.909 -20.550
  301    HB3  TYR  11           HB2      TYR  11  -0.147  41.785 -19.731
  302    HD1  TYR  11           HD1      TYR  11  -1.796  41.424 -23.025
  303    HD2  TYR  11           HD2      TYR  11   1.926  41.473 -20.965
  304    HE1  TYR  11           HE1      TYR  11  -0.619  41.555 -25.159
  305    HE2  TYR  11           HE2      TYR  11   3.100  41.596 -23.107
  306    HH   TYR  11           HH       TYR  11   1.360  41.361 -26.164
  307    H    ILE  12           HN       ILE  12   0.084  38.637 -18.241
  308    HA   ILE  12           HA       ILE  12  -2.117  38.704 -16.272
  309    HB   ILE  12           HB       ILE  12   0.873  38.133 -15.849
  310   HG12  ILE  12          1HG1      ILE  12  -1.460  36.129 -16.082
  311   HG13  ILE  12          2HG1      ILE  12  -0.435  36.554 -17.441
  312   HG21  ILE  12          2HG2      ILE  12  -1.509  37.515 -13.970
  313   HG22  ILE  12          3HG2      ILE  12   0.184  37.038 -13.696
  314   HG23  ILE  12          1HG2      ILE  12  -0.260  38.748 -13.677
  315   HD11  ILE  12          1HD1      ILE  12   0.392  34.461 -16.463
  316   HD12  ILE  12          2HD1      ILE  12   0.552  35.195 -14.854
  317   HD13  ILE  12          3HD1      ILE  12   1.616  35.728 -16.182
  318    H    LEU  13           HN       LEU  13  -2.701  40.327 -15.001
  319    HA   LEU  13           HA       LEU  13  -0.746  42.627 -14.466
  320    HB2  LEU  13           HB2      LEU  13  -3.740  42.838 -15.109
  321    HB3  LEU  13           HB1      LEU  13  -2.741  44.177 -14.573
  322    HG   LEU  13           HG       LEU  13  -2.252  42.601 -17.172
  323   HD11  LEU  13          1HD2      LEU  13  -3.220  44.598 -18.321
  324   HD12  LEU  13          2HD2      LEU  13  -3.583  45.354 -16.747
  325   HD13  LEU  13          3HD2      LEU  13  -4.413  43.854 -17.234
  326   HD21  LEU  13          2HD1      LEU  13  -0.766  44.552 -17.774
  327   HD22  LEU  13          3HD1      LEU  13  -0.160  43.696 -16.342
  328   HD23  LEU  13          1HD1      LEU  13  -1.015  45.248 -16.151
  Start of MODEL    7
    1    H1   VAL   1           HN1      VAL   1   1.684  32.627 -17.707
    2    H2   VAL   1           HN2      VAL   1   3.266  33.094 -17.552
    3    H3   VAL   1           HN3      VAL   1   2.084  34.196 -17.897
    4    HA   VAL   1           HA       VAL   1   0.994  33.504 -15.675
    5    HB   VAL   1           HB       VAL   1   3.869  32.543 -15.151
    6   HG11  VAL   1          1HG1      VAL   1   2.845  33.663 -13.136
    7   HG12  VAL   1          2HG1      VAL   1   1.410  32.618 -13.270
    8   HG13  VAL   1          3HG1      VAL   1   2.999  31.913 -12.885
    9   HG21  VAL   1          3HG2      VAL   1   2.574  30.789 -16.402
   10   HG22  VAL   1          1HG2      VAL   1   2.791  30.300 -14.713
   11   HG23  VAL   1          2HG2      VAL   1   1.220  30.936 -15.254
   12    H    ARG   2           HN       ARG   2   4.400  34.728 -15.967
   13    HA   ARG   2           HA       ARG   2   3.256  37.446 -15.099
   14    HB2  ARG   2           HB1      ARG   2   6.001  36.296 -14.323
   15    HB3  ARG   2           HB2      ARG   2   5.514  37.981 -14.168
   16    HG2  ARG   2           HG2      ARG   2   3.409  37.039 -12.835
   17    HG3  ARG   2           HG1      ARG   2   4.370  35.573 -12.655
   18    HD2  ARG   2           HD2      ARG   2   6.240  36.953 -11.618
   19    HD3  ARG   2           HD1      ARG   2   5.300  38.424 -11.840
   20    HE   ARG   2           HE       ARG   2   4.870  36.352  -9.724
   21   HH11  ARG   2          2HH1      ARG   2   3.276  38.937 -11.561
   22   HH12  ARG   2          1HH1      ARG   2   2.100  39.206 -10.202
   23   HH21  ARG   2          2HH2      ARG   2   3.446  36.717  -8.231
   24   HH22  ARG   2          1HH2      ARG   2   2.182  38.023  -8.437
   25    H    ARG   3           HN       ARG   3   2.999  38.349 -16.967
   26    HA   ARG   3           HA       ARG   3   5.061  38.102 -19.159
   27    HB2  ARG   3           HB1      ARG   3   2.493  37.908 -19.362
   28    HB3  ARG   3           HB2      ARG   3   2.398  39.649 -19.152
   29    HG2  ARG   3           HG2      ARG   3   3.767  39.981 -21.254
   30    HG3  ARG   3           HG1      ARG   3   4.039  38.236 -21.363
   31    HD2  ARG   3           HD2      ARG   3   1.470  37.904 -21.455
   32    HD3  ARG   3           HD1      ARG   3   1.296  39.645 -21.496
   33    HE   ARG   3           HE       ARG   3   1.707  39.553 -23.850
   34   HH11  ARG   3          2HH2      ARG   3   2.995  36.608 -22.377
   35   HH12  ARG   3          1HH2      ARG   3   3.248  35.903 -24.047
   36   HH21  ARG   3          1HH1      ARG   3   1.885  38.645 -25.605
   37   HH22  ARG   3          2HH1      ARG   3   2.648  36.977 -25.798
   38    H    LEU   4           HN       LEU   4   6.799  39.274 -18.471
   39    HA   LEU   4           HA       LEU   4   6.568  42.084 -17.507
   40    HB2  LEU   4           HB2      LEU   4   8.960  40.313 -18.261
   41    HB3  LEU   4           HB1      LEU   4   9.144  42.013 -17.892
   42    HG   LEU   4           HG       LEU   4   8.109  41.694 -15.626
   43   HD11  LEU   4          3HD2      LEU   4   8.266  38.680 -16.314
   44   HD12  LEU   4          1HD2      LEU   4   6.797  39.600 -15.894
   45   HD13  LEU   4          2HD2      LEU   4   8.053  39.339 -14.673
   46   HD21  LEU   4          1HD1      LEU   4  10.585  39.958 -16.261
   47   HD22  LEU   4          2HD1      LEU   4  10.155  40.616 -14.662
   48   HD23  LEU   4          3HD1      LEU   4  10.590  41.719 -15.987
   49    H    MET   5           HN       MET   5   5.339  42.963 -19.173
   50    HA   MET   5           HA       MET   5   6.909  43.678 -21.717
   51    HB2  MET   5           HB1      MET   5   4.803  42.303 -21.942
   52    HB3  MET   5           HB2      MET   5   3.880  43.596 -21.192
   53    HG2  MET   5           HG1      MET   5   3.610  43.714 -23.627
   54    HG3  MET   5           HG2      MET   5   4.529  45.144 -23.127
   55    HE1  MET   5           HE1      MET   5   4.288  43.738 -26.098
   56    HE2  MET   5           HE2      MET   5   5.957  44.007 -26.680
   57    HE3  MET   5           HE3      MET   5   5.107  45.299 -25.778
   58    H    PHE   6           HN       PHE   6   8.028  45.316 -20.600
   59    HA   PHE   6           HA       PHE   6   6.514  47.636 -19.471
   60    HB2  PHE   6           HB1      PHE   6   8.753  46.768 -18.604
   61    HB3  PHE   6           HB2      PHE   6   9.530  47.403 -20.041
   62    HD1  PHE   6           HD1      PHE   6   7.666  48.302 -16.959
   63    HD2  PHE   6           HD2      PHE   6   9.904  49.823 -20.249
   64    HE1  PHE   6           HE1      PHE   6   7.838  50.469 -15.845
   65    HE2  PHE   6           HE2      PHE   6  10.070  51.989 -19.127
   66    HZ   PHE   6           HZ       PHE   6   9.039  52.317 -16.926
   67    H    SER   7           HN       SER   7   8.516  47.177 -22.423
   68    HA   SER   7           HA       SER   7   7.872  49.930 -23.411
   69    HB2  SER   7           HB1      SER   7   9.142  49.287 -25.418
   70    HB3  SER   7           HB2      SER   7  10.042  48.830 -23.970
   71    HG   SER   7           HG       SER   7   8.289  47.056 -25.339
   72    H    TYR   8           HN       TYR   8   5.709  50.142 -23.646
   73    HA   TYR   8           HA       TYR   8   4.010  48.082 -24.898
   74    HB2  TYR   8           HB1      TYR   8   3.358  51.005 -24.222
   75    HB3  TYR   8           HB2      TYR   8   2.185  49.811 -24.737
   76    HD1  TYR   8           HD1      TYR   8   2.062  47.581 -23.326
   77    HD2  TYR   8           HD2      TYR   8   3.835  51.180 -21.892
   78    HE1  TYR   8           HE1      TYR   8   1.864  46.773 -21.032
   79    HE2  TYR   8           HE2      TYR   8   3.629  50.360 -19.599
   80    HH   TYR   8           HH       TYR   8   2.397  47.126 -18.897
   81    H    ILE   9           HN       ILE   9   5.002  47.711 -26.857
   82    HA   ILE   9           HA       ILE   9   4.865  49.762 -29.002
   83    HB   ILE   9           HB       ILE   9   6.663  47.975 -28.585
   84   HG12  ILE   9          1HG1      ILE   9   5.550  48.080 -31.430
   85   HG13  ILE   9          2HG1      ILE   9   6.432  49.391 -30.639
   86   HG21  ILE   9          1HG2      ILE   9   6.396  45.703 -29.494
   87   HG22  ILE   9          2HG2      ILE   9   5.096  45.970 -28.317
   88   HG23  ILE   9          3HG2      ILE   9   4.747  46.055 -30.060
   89   HD11  ILE   9          3HD1      ILE   9   7.567  46.584 -31.247
   90   HD12  ILE   9          1HD1      ILE   9   8.014  48.116 -32.030
   91   HD13  ILE   9          2HD1      ILE   9   8.438  47.838 -30.323
   92    H    SER  10           HN       SER  10   3.800  49.180 -31.144
   93    HA   SER  10           HA       SER  10   0.916  48.666 -30.636
   94    HB2  SER  10           HB1      SER  10   2.425  49.213 -33.258
   95    HB3  SER  10           HB2      SER  10   0.665  49.151 -33.092
   96    HG   SER  10           HG       SER  10   1.480  51.269 -32.891
   97    H    ASP  11           HN       ASP  11   1.782  46.456 -29.815
   98    HA   ASP  11           HA       ASP  11   0.966  44.381 -31.922
   99    HB2  ASP  11           HB2      ASP  11   3.426  44.316 -31.659
  100    HB3  ASP  11           HB1      ASP  11   3.292  44.180 -29.908
  101    H    GLU  12           HN       GLU  12   1.704  44.290 -28.412
  102    HA   GLU  12           HA       GLU  12  -0.685  42.616 -27.936
  103    HB2  GLU  12           HB2      GLU  12   1.639  42.525 -26.781
  104    HB3  GLU  12           HB1      GLU  12   1.141  43.928 -25.848
  105    HG2  GLU  12           HG2      GLU  12   0.697  42.017 -24.463
  106    HG3  GLU  12           HG1      GLU  12  -0.893  42.524 -25.015
  107    H    GLN  13           HN       GLN  13  -1.904  44.563 -28.971
  108    HA   GLN  13           HA       GLN  13  -2.972  46.467 -26.842
  109    HB2  GLN  13           HB1      GLN  13  -3.555  46.325 -29.861
  110    HB3  GLN  13           HB2      GLN  13  -4.251  47.505 -28.754
  111    HG2  GLN  13           HG1      GLN  13  -1.955  48.374 -28.180
  112    HG3  GLN  13           HG2      GLN  13  -1.216  47.195 -29.259
  113   HE21  GLN  13          2HE2      GLN  13  -1.528  47.439 -31.533
  114   HE22  GLN  13          1HE2      GLN  13  -2.058  49.065 -32.211
  115    H    TRP  14           HN       TRP  14  -4.437  44.269 -29.255
  116    HA   TRP  14           HA       TRP  14  -6.285  43.166 -27.174
  117    HB2  TRP  14           HB1      TRP  14  -8.392  43.631 -28.323
  118    HB3  TRP  14           HB2      TRP  14  -7.621  45.080 -27.727
  119    HD1  TRP  14           HD1      TRP  14  -6.503  46.809 -29.636
  120    HE1  TRP  14           HE1      TRP  14  -7.262  47.366 -32.114
  121    HE3  TRP  14           HE3      TRP  14  -9.257  42.648 -30.334
  122    HZ2  TRP  14           HZ2      TRP  14  -8.898  46.013 -33.963
  123    HZ3  TRP  14           HZ3      TRP  14 -10.440  42.324 -32.478
  124    HH2  TRP  14           HH2      TRP  14 -10.258  43.982 -34.263
  125    H    THR  15           HN       THR  15  -4.711  41.559 -27.715
  126    HA   THR  15           HA       THR  15  -4.856  40.341 -30.419
  127    HB   THR  15           HB       THR  15  -3.186  38.674 -29.473
  128    HG1  THR  15           HG1      THR  15  -2.319  39.937 -27.393
  129   HG21  THR  15          3HG2      THR  15  -2.411  40.714 -30.686
  130   HG22  THR  15          1HG2      THR  15  -2.484  41.664 -29.184
  131   HG23  THR  15          2HG2      THR  15  -1.312  40.335 -29.340
  132    HA   PRO  16           HA       PRO  16  -8.116  37.425 -29.297
  133    HB2  PRO  16           HB1      PRO  16  -8.029  35.728 -31.484
  134    HB3  PRO  16           HB2      PRO  16  -8.582  37.412 -31.577
  135    HG2  PRO  16           HG2      PRO  16  -5.793  36.333 -32.239
  136    HG3  PRO  16           HG1      PRO  16  -6.818  37.381 -33.250
  137    HD2  PRO  16           HD2      PRO  16  -4.817  38.416 -31.650
  138    HD3  PRO  16           HD1      PRO  16  -6.352  39.315 -31.882
  139    H    PHE  17           HN       PHE  17  -4.853  36.246 -29.685
  140    HA   PHE  17           HA       PHE  17  -5.598  33.495 -28.612
  141    HB2  PHE  17           HB2      PHE  17  -2.918  34.656 -29.583
  142    HB3  PHE  17           HB1      PHE  17  -3.099  33.045 -28.923
  143    HD1  PHE  17           HD1      PHE  17  -4.646  31.380 -30.083
  144    HD2  PHE  17           HD2      PHE  17  -3.512  35.063 -31.899
  145    HE1  PHE  17           HE1      PHE  17  -5.251  30.490 -32.279
  146    HE2  PHE  17           HE2      PHE  17  -4.123  34.163 -34.090
  147    HZ   PHE  17           HZ       PHE  17  -4.991  31.878 -34.283
  148    H    LEU  18           HN       LEU  18  -6.143  33.787 -26.527
  149    HA   LEU  18           HA       LEU  18  -4.336  35.322 -24.671
  150    HB2  LEU  18           HB2      LEU  18  -6.929  35.298 -24.723
  151    HB3  LEU  18           HB1      LEU  18  -6.862  33.738 -23.924
  152    HG   LEU  18           HG       LEU  18  -5.614  36.362 -22.862
  153   HD11  LEU  18          3HD2      LEU  18  -8.101  36.501 -23.015
  154   HD12  LEU  18          1HD2      LEU  18  -7.582  36.429 -21.317
  155   HD13  LEU  18          2HD2      LEU  18  -8.267  34.980 -22.099
  156   HD21  LEU  18          1HD1      LEU  18  -6.108  33.665 -21.427
  157   HD22  LEU  18          2HD1      LEU  18  -5.563  35.165 -20.634
  158   HD23  LEU  18          3HD1      LEU  18  -4.512  34.359 -21.814
  159    H    TYR  19           HN       TYR  19  -2.504  33.990 -25.025
  160    HA   TYR  19           HA       TYR  19  -2.583  31.207 -23.850
  161    HB2  TYR  19           HB1      TYR  19  -0.452  30.821 -24.956
  162    HB3  TYR  19           HB2      TYR  19  -1.682  31.376 -26.057
  163    HD1  TYR  19           HD1      TYR  19   1.497  32.299 -24.402
  164    HD2  TYR  19           HD2      TYR  19  -1.456  33.511 -27.220
  165    HE1  TYR  19           HE1      TYR  19   3.021  33.998 -25.279
  166    HE2  TYR  19           HE2      TYR  19   0.063  35.217 -28.078
  167    HH   TYR  19           HH       TYR  19   2.113  36.041 -28.012
  168    H    ASP  20           HN       ASP  20  -0.917  34.238 -22.998
  169    HA   ASP  20           HA       ASP  20   1.018  33.048 -21.243
  170    HB2  ASP  20           HB1      ASP  20   0.774  35.510 -22.102
  171    HB3  ASP  20           HB2      ASP  20  -0.242  35.793 -20.694
  172    H    PHE  21           HN       PHE  21  -2.288  34.034 -20.363
  173    HA   PHE  21           HA       PHE  21  -1.986  33.604 -17.492
  174    HB2  PHE  21           HB2      PHE  21  -3.846  34.880 -18.730
  175    HB3  PHE  21           HB1      PHE  21  -4.560  33.340 -19.168
  176    HD1  PHE  21           HD1      PHE  21  -3.785  35.636 -16.370
  177    HD2  PHE  21           HD2      PHE  21  -5.734  32.008 -17.456
  178    HE1  PHE  21           HE1      PHE  21  -4.942  35.605 -14.216
  179    HE2  PHE  21           HE2      PHE  21  -6.882  31.983 -15.300
  180    HZ   PHE  21           HZ       PHE  21  -6.489  33.780 -13.677
  181    H    TYR  22           HN       TYR  22  -2.424  31.906 -16.171
  182    HA   TYR  22           HA       TYR  22  -1.836  29.220 -17.230
  183    HB2  TYR  22           HB1      TYR  22  -1.147  30.140 -14.961
  184    HB3  TYR  22           HB2      TYR  22  -2.817  30.070 -14.433
  185    HD1  TYR  22           HD2      TYR  22   0.081  28.007 -15.551
  186    HD2  TYR  22           HD1      TYR  22  -3.775  27.948 -13.738
  187    HE1  TYR  22           HE2      TYR  22   0.426  25.681 -14.871
  188    HE2  TYR  22           HE1      TYR  22  -3.417  25.629 -13.063
  189    HH   TYR  22           HH       TYR  22  -2.060  23.889 -13.114
  190    H    HIS  23           HN       HIS  23  -3.141  27.627 -17.800
  191    HA   HIS  23           HA       HIS  23  -6.148  27.857 -17.230
  192    HB2  HIS  23           HB2      HIS  23  -4.952  26.894 -19.897
  193    HB3  HIS  23           HB1      HIS  23  -6.651  26.890 -19.471
  194    HD1  HIS  23           HD1      HIS  23  -3.988  29.124 -20.938
  195    HD2  HIS  23           HD2      HIS  23  -7.706  29.552 -18.864
  196    HE1  HIS  23           HE1      HIS  23  -4.935  31.468 -21.340
  197    HE2  HIS  23           HE2      HIS  23  -7.180  31.854 -20.111
  198    H    TYR  24           HN       TYR  24  -3.904  25.421 -18.616
  199    HA   TYR  24           HA       TYR  24  -3.478  23.212 -17.998
  200    HB2  TYR  24           HB1      TYR  24  -3.316  24.187 -15.634
  201    HB3  TYR  24           HB2      TYR  24  -4.963  23.657 -15.358
  202    HD1  TYR  24           HD2      TYR  24  -5.478  21.227 -15.252
  203    HD2  TYR  24           HD1      TYR  24  -1.478  22.573 -15.814
  204    HE1  TYR  24           HE2      TYR  24  -4.643  19.020 -14.615
  205    HE2  TYR  24           HE1      TYR  24  -0.649  20.360 -15.176
  206    HH   TYR  24           HH       TYR  24  -2.871  17.752 -14.303
  207    H1   PCA   1           HN       PCA   1 -28.695  41.595 -34.601
  208    HA   PCA   1           HA       PCA   1 -28.670  43.908 -33.342
  209    HB2  PCA   1           HB2      PCA   1 -27.406  43.217 -30.904
  210    HB3  PCA   1           HB1      PCA   1 -29.157  43.245 -31.179
  211    HG2  PCA   1           HG2      PCA   1 -29.046  40.958 -30.610
  212    HG3  PCA   1           HG1      PCA   1 -27.329  40.821 -31.103
  213    H    LEU   2           HN       LEU   2 -26.445  44.815 -32.164
  214    HA   LEU   2           HA       LEU   2 -24.395  44.509 -34.359
  215    HB2  LEU   2           HB1      LEU   2 -24.424  46.330 -31.886
  216    HB3  LEU   2           HB2      LEU   2 -23.164  46.339 -33.105
  217    HG   LEU   2           HG       LEU   2 -26.120  46.987 -33.679
  218   HD11  LEU   2          1HD2      LEU   2 -25.332  49.360 -33.799
  219   HD12  LEU   2          2HD2      LEU   2 -25.017  48.683 -32.185
  220   HD13  LEU   2          3HD2      LEU   2 -23.682  48.859 -33.351
  221   HD21  LEU   2          2HD1      LEU   2 -24.924  46.163 -35.736
  222   HD22  LEU   2          3HD1      LEU   2 -23.601  47.323 -35.451
  223   HD23  LEU   2          1HD1      LEU   2 -25.235  47.906 -35.853
  224    H    TYR   3           HN       TYR   3 -23.280  42.686 -34.185
  225    HA   TYR   3           HA       TYR   3 -22.250  41.725 -31.512
  226    HB2  TYR   3           HB2      TYR   3 -21.990  40.523 -34.332
  227    HB3  TYR   3           HB1      TYR   3 -21.333  39.794 -32.884
  228    HD1  TYR   3           HD2      TYR   3 -22.862  38.972 -31.064
  229    HD2  TYR   3           HD1      TYR   3 -24.399  40.397 -34.773
  230    HE1  TYR   3           HE2      TYR   3 -25.020  37.919 -30.585
  231    HE2  TYR   3           HE1      TYR   3 -26.544  39.344 -34.285
  232    HH   TYR   3           HH       TYR   3 -27.809  38.455 -32.644
  233    H    GLU   4           HN       GLU   4 -20.853  43.373 -30.976
  234    HA   GLU   4           HA       GLU   4 -18.489  43.996 -32.709
  235    HB2  GLU   4           HB2      GLU   4 -19.842  45.570 -31.092
  236    HB3  GLU   4           HB1      GLU   4 -18.893  44.878 -29.789
  237    HG2  GLU   4           HG1      GLU   4 -17.733  46.283 -32.300
  238    HG3  GLU   4           HG2      GLU   4 -18.063  47.088 -30.776
  239    H    ASN   5           HN       ASN   5 -16.694  42.795 -32.721
  240    HA   ASN   5           HA       ASN   5 -16.183  40.872 -30.380
  241    HB2  ASN   5           HB1      ASN   5 -16.869  39.779 -32.555
  242    HB3  ASN   5           HB2      ASN   5 -15.450  40.462 -33.336
  243   HD21  ASN   5          2HD2      ASN   5 -16.583  38.144 -30.960
  244   HD22  ASN   5          1HD2      ASN   5 -14.998  37.212 -30.892
  245    H    LYS   6           HN       LYS   6 -14.938  42.237 -29.235
  246    HA   LYS   6           HA       LYS   6 -12.155  42.814 -30.407
  247    HB2  LYS   6           HB1      LYS   6 -13.555  44.815 -30.232
  248    HB3  LYS   6           HB2      LYS   6 -13.849  44.542 -28.516
  249    HG2  LYS   6           HG1      LYS   6 -11.529  45.005 -27.940
  250    HG3  LYS   6           HG2      LYS   6 -10.992  44.799 -29.600
  251    HD2  LYS   6           HD2      LYS   6 -10.931  47.142 -29.055
  252    HD3  LYS   6           HD1      LYS   6 -12.088  46.885 -30.342
  253    HE2  LYS   6           HE1      LYS   6 -13.026  47.049 -27.397
  254    HE3  LYS   6           HE2      LYS   6 -12.623  48.514 -28.293
  255    HZ1  LYS   6           HZ1      LYS   6 -14.756  46.542 -29.117
  256    HZ2  LYS   6           HZ2      LYS   6 -14.260  47.771 -30.052
  257    HZ3  LYS   6           HZ3      LYS   6 -14.978  48.082 -28.602
  258    HA   PRO   7           HA       PRO   7 -11.763  39.702 -26.970
  259    HB2  PRO   7           HB2      PRO   7  -9.104  39.448 -28.478
  260    HB3  PRO   7           HB1      PRO   7 -10.056  38.154 -27.710
  261    HG2  PRO   7           HG1      PRO   7 -10.293  38.490 -30.378
  262    HG3  PRO   7           HG2      PRO   7 -11.793  38.314 -29.431
  263    HD2  PRO   7           HD2      PRO   7 -10.540  40.889 -30.501
  264    HD3  PRO   7           HD1      PRO   7 -12.254  40.380 -30.509
  265    H    ARG   8           HN       ARG   8 -10.300  39.260 -25.286
  266    HA   ARG   8           HA       ARG   8  -8.979  41.791 -24.214
  267    HB2  ARG   8           HB2      ARG   8  -9.759  39.158 -22.812
  268    HB3  ARG   8           HB1      ARG   8  -9.005  40.532 -22.015
  269    HG2  ARG   8           HG2      ARG   8 -10.987  41.993 -22.604
  270    HG3  ARG   8           HG1      ARG   8 -11.751  40.628 -23.424
  271    HD2  ARG   8           HD2      ARG   8 -11.716  39.312 -21.243
  272    HD3  ARG   8           HD1      ARG   8 -11.023  40.728 -20.423
  273    HE   ARG   8           HE       ARG   8 -13.447  41.601 -21.803
  274   HH11  ARG   8          2HH1      ARG   8 -12.482  39.554 -19.140
  275   HH12  ARG   8          1HH1      ARG   8 -14.088  39.786 -18.291
  276   HH21  ARG   8          2HH2      ARG   8 -15.281  41.844 -20.789
  277   HH22  ARG   8          1HH2      ARG   8 -15.585  41.020 -19.186
  278    H    ARG   9           HN       ARG   9  -6.829  41.961 -24.345
  279    HA   ARG   9           HA       ARG   9  -5.181  39.773 -25.348
  280    HB2  ARG   9           HB1      ARG   9  -3.418  41.251 -25.508
  281    HB3  ARG   9           HB2      ARG   9  -4.795  42.296 -25.698
  282    HG2  ARG   9           HG1      ARG   9  -3.023  41.972 -23.204
  283    HG3  ARG   9           HG2      ARG   9  -2.974  43.311 -24.326
  284    HD2  ARG   9           HD1      ARG   9  -5.428  42.664 -22.563
  285    HD3  ARG   9           HD2      ARG   9  -4.138  43.788 -22.112
  286    HE   ARG   9           HE       ARG   9  -5.047  44.636 -24.737
  287   HH11  ARG   9          2HH2      ARG   9  -6.280  44.404 -21.472
  288   HH12  ARG   9          1HH2      ARG   9  -7.381  45.847 -21.729
  289   HH21  ARG   9          1HH1      ARG   9  -6.290  46.243 -24.983
  290   HH22  ARG   9          2HH1      ARG   9  -7.382  46.849 -23.639
  291    HA   PRO  10           HA       PRO  10  -3.991  37.773 -21.493
  292    HB2  PRO  10           HB1      PRO  10  -1.689  36.437 -22.234
  293    HB3  PRO  10           HB2      PRO  10  -3.278  36.059 -22.903
  294    HG2  PRO  10           HG2      PRO  10  -1.115  37.851 -24.138
  295    HG3  PRO  10           HG1      PRO  10  -1.968  36.495 -24.919
  296    HD2  PRO  10           HD1      PRO  10  -2.765  39.113 -25.253
  297    HD3  PRO  10           HD2      PRO  10  -3.981  37.798 -25.185
  298    H    TYR  11           HN       TYR  11  -3.551  40.306 -20.994
  299    HA   TYR  11           HA       TYR  11  -0.643  40.726 -20.248
  300    HB2  TYR  11           HB1      TYR  11  -2.047  42.552 -21.306
  301    HB3  TYR  11           HB2      TYR  11  -2.999  42.651 -19.834
  302    HD1  TYR  11           HD1      TYR  11   0.365  43.146 -21.321
  303    HD2  TYR  11           HD2      TYR  11  -1.998  43.667 -17.815
  304    HE1  TYR  11           HE1      TYR  11   2.113  44.549 -20.340
  305    HE2  TYR  11           HE2      TYR  11  -0.243  45.061 -16.845
  306    HH   TYR  11           HH       TYR  11   1.827  45.806 -17.062
  307    H    ILE  12           HN       ILE  12  -0.284  39.270 -18.690
  308    HA   ILE  12           HA       ILE  12  -1.551  39.874 -15.972
  309    HB   ILE  12           HB       ILE  12  -2.510  37.811 -16.787
  310   HG12  ILE  12          2HG1      ILE  12  -1.787  36.193 -14.973
  311   HG13  ILE  12          1HG1      ILE  12  -0.467  37.274 -14.552
  312   HG21  ILE  12          2HG2      ILE  12  -1.199  35.723 -17.207
  313   HG22  ILE  12          3HG2      ILE  12   0.322  36.631 -17.094
  314   HG23  ILE  12          1HG2      ILE  12  -0.831  36.979 -18.401
  315   HD11  ILE  12          1HD1      ILE  12  -2.129  39.084 -13.941
  316   HD12  ILE  12          2HD1      ILE  12  -2.498  37.581 -13.069
  317   HD13  ILE  12          3HD1      ILE  12  -3.474  38.044 -14.483
  318    H    LEU  13           HN       LEU  13  -0.020  41.150 -15.195
  319    HA   LEU  13           HA       LEU  13   2.901  40.436 -15.499
  320    HB2  LEU  13           HB1      LEU  13   2.069  42.779 -15.865
  321    HB3  LEU  13           HB2      LEU  13   1.490  42.840 -14.205
  322    HG   LEU  13           HG       LEU  13   3.881  42.543 -13.384
  323   HD11  LEU  13          1HD2      LEU  13   5.752  42.969 -15.019
  324   HD12  LEU  13          2HD2      LEU  13   4.893  41.466 -15.420
  325   HD13  LEU  13          3HD2      LEU  13   4.588  42.942 -16.370
  326   HD21  LEU  13          2HD1      LEU  13   3.371  44.951 -15.253
  327   HD22  LEU  13          3HD1      LEU  13   4.545  44.898 -13.913
  328   HD23  LEU  13          1HD1      LEU  13   2.803  44.802 -13.570
  Start of MODEL    8
    1    H1   VAL   1           HN1      VAL   1   7.505  31.291 -19.570
    2    H2   VAL   1           HN2      VAL   1   6.447  31.406 -18.311
    3    H3   VAL   1           HN3      VAL   1   8.055  31.693 -18.065
    4    HA   VAL   1           HA       VAL   1   8.048  33.645 -19.392
    5    HB   VAL   1           HB       VAL   1   5.940  34.590 -20.327
    6   HG11  VAL   1          1HG1      VAL   1   6.682  31.895 -21.611
    7   HG12  VAL   1          2HG1      VAL   1   5.910  33.285 -22.409
    8   HG13  VAL   1          3HG1      VAL   1   7.575  33.422 -21.813
    9   HG21  VAL   1          3HG2      VAL   1   4.616  31.833 -19.914
   10   HG22  VAL   1          1HG2      VAL   1   4.176  33.327 -19.052
   11   HG23  VAL   1          2HG2      VAL   1   3.938  33.217 -20.805
   12    H    ARG   2           HN       ARG   2   7.940  35.529 -18.304
   13    HA   ARG   2           HA       ARG   2   5.961  35.919 -16.037
   14    HB2  ARG   2           HB1      ARG   2   8.019  34.825 -15.005
   15    HB3  ARG   2           HB2      ARG   2   8.994  36.154 -15.586
   16    HG2  ARG   2           HG1      ARG   2   8.683  36.842 -13.436
   17    HG3  ARG   2           HG2      ARG   2   7.354  37.717 -14.141
   18    HD2  ARG   2           HD2      ARG   2   7.213  35.041 -12.608
   19    HD3  ARG   2           HD1      ARG   2   6.850  36.607 -11.932
   20    HE   ARG   2           HE       ARG   2   5.021  34.879 -13.465
   21   HH11  ARG   2          1HH2      ARG   2   5.549  38.319 -12.735
   22   HH12  ARG   2          2HH2      ARG   2   3.735  38.574 -12.637
   23   HH21  ARG   2          1HH1      ARG   2   2.998  35.288 -13.312
   24   HH22  ARG   2          2HH1      ARG   2   2.398  36.981 -12.937
   25    H    ARG   3           HN       ARG   3   5.116  37.797 -16.318
   26    HA   ARG   3           HA       ARG   3   6.554  40.120 -17.697
   27    HB2  ARG   3           HB2      ARG   3   4.467  39.372 -18.694
   28    HB3  ARG   3           HB1      ARG   3   3.591  39.455 -17.172
   29    HG2  ARG   3           HG2      ARG   3   3.705  41.907 -17.151
   30    HG3  ARG   3           HG1      ARG   3   4.761  41.938 -18.571
   31    HD2  ARG   3           HD1      ARG   3   2.982  40.998 -20.013
   32    HD3  ARG   3           HD2      ARG   3   1.927  40.700 -18.619
   33    HE   ARG   3           HE       ARG   3   2.280  43.418 -18.332
   34   HH11  ARG   3          1HH2      ARG   3   1.355  41.514 -21.180
   35   HH12  ARG   3          2HH2      ARG   3   0.182  42.831 -21.685
   36   HH21  ARG   3          1HH1      ARG   3   0.924  44.835 -18.979
   37   HH22  ARG   3          2HH1      ARG   3  -0.042  44.592 -20.521
   38    H    LEU   4           HN       LEU   4   6.285  42.254 -16.781
   39    HA   LEU   4           HA       LEU   4   7.015  42.416 -13.951
   40    HB2  LEU   4           HB2      LEU   4   7.243  44.825 -14.280
   41    HB3  LEU   4           HB1      LEU   4   8.031  43.874 -15.499
   42    HG   LEU   4           HG       LEU   4   6.088  44.403 -17.114
   43   HD11  LEU   4          1HD1      LEU   4   5.322  46.472 -14.940
   44   HD12  LEU   4          2HD1      LEU   4   4.730  46.488 -16.622
   45   HD13  LEU   4          3HD1      LEU   4   4.299  45.154 -15.554
   46   HD21  LEU   4          3HD2      LEU   4   8.305  45.553 -17.233
   47   HD22  LEU   4          1HD2      LEU   4   7.758  46.777 -16.061
   48   HD23  LEU   4          2HD2      LEU   4   6.992  46.662 -17.665
   49    H    MET   5           HN       MET   5   6.077  43.897 -12.362
   50    HA   MET   5           HA       MET   5   3.234  43.116 -11.847
   51    HB2  MET   5           HB2      MET   5   5.125  42.831 -10.204
   52    HB3  MET   5           HB1      MET   5   5.285  44.570 -10.064
   53    HG2  MET   5           HG2      MET   5   4.027  43.620  -8.155
   54    HG3  MET   5           HG1      MET   5   2.989  44.720  -9.066
   55    HE1  MET   5           HE1      MET   5   2.557  40.074  -8.865
   56    HE2  MET   5           HE2      MET   5   4.100  40.794  -9.407
   57    HE3  MET   5           HE3      MET   5   3.513  41.081  -7.738
   58    H    PHE   6           HN       PHE   6   1.800  44.370 -12.937
   59    HA   PHE   6           HA       PHE   6   1.955  47.430 -12.826
   60    HB2  PHE   6           HB2      PHE   6   0.571  47.503 -14.837
   61    HB3  PHE   6           HB1      PHE   6   2.092  46.709 -15.075
   62    HD1  PHE   6           HD1      PHE   6   2.201  44.259 -15.564
   63    HD2  PHE   6           HD2      PHE   6  -1.615  46.211 -15.174
   64    HE1  PHE   6           HE1      PHE   6   1.093  42.323 -16.538
   65    HE2  PHE   6           HE2      PHE   6  -2.715  44.208 -16.082
   66    HZ   PHE   6           HZ       PHE   6  -1.367  42.255 -16.737
   67    H    SER   7           HN       SER   7   0.945  47.755 -10.808
   68    HA   SER   7           HA       SER   7  -1.045  46.437  -9.542
   69    HB2  SER   7           HB1      SER   7  -1.598  48.433  -8.214
   70    HB3  SER   7           HB2      SER   7   0.128  48.303  -8.521
   71    HG   SER   7           HG       SER   7  -0.729  50.397  -8.843
   72    H    TYR   8           HN       TYR   8  -2.140  48.937 -11.877
   73    HA   TYR   8           HA       TYR   8  -5.013  47.939 -11.532
   74    HB2  TYR   8           HB2      TYR   8  -4.610  50.378 -11.220
   75    HB3  TYR   8           HB1      TYR   8  -3.926  50.513 -12.821
   76    HD1  TYR   8           HD1      TYR   8  -7.117  49.443 -11.042
   77    HD2  TYR   8           HD2      TYR   8  -5.396  51.064 -14.633
   78    HE1  TYR   8           HE1      TYR   8  -9.366  49.785 -11.973
   79    HE2  TYR   8           HE2      TYR   8  -7.646  51.386 -15.563
   80    HH   TYR   8           HH       TYR   8  -9.829  51.174 -15.225
   81    H    ILE   9           HN       ILE   9  -5.959  46.821 -13.081
   82    HA   ILE   9           HA       ILE   9  -4.404  45.760 -15.358
   83    HB   ILE   9           HB       ILE   9  -6.273  44.301 -15.826
   84   HG12  ILE   9          1HG1      ILE   9  -8.333  45.384 -15.234
   85   HG13  ILE   9          2HG1      ILE   9  -8.176  43.858 -14.428
   86   HG21  ILE   9          1HG2      ILE   9  -4.478  43.574 -14.319
   87   HG22  ILE   9          2HG2      ILE   9  -5.388  44.149 -12.901
   88   HG23  ILE   9          3HG2      ILE   9  -6.019  42.810 -13.892
   89   HD11  ILE   9          3HD1      ILE   9  -7.929  46.632 -13.107
   90   HD12  ILE   9          1HD1      ILE   9  -7.566  45.108 -12.250
   91   HD13  ILE   9          2HD1      ILE   9  -9.201  45.418 -12.878
   92    H    SER  10           HN       SER  10  -4.065  47.616 -16.616
   93    HA   SER  10           HA       SER  10  -6.429  48.588 -18.312
   94    HB2  SER  10           HB1      SER  10  -5.310  50.168 -16.691
   95    HB3  SER  10           HB2      SER  10  -3.790  50.004 -17.578
   96    HG   SER  10           HG       SER  10  -5.049  50.693 -19.448
   97    H    ASP  11           HN       ASP  11  -4.437  46.257 -19.152
   98    HA   ASP  11           HA       ASP  11  -3.223  47.478 -21.608
   99    HB2  ASP  11           HB1      ASP  11  -2.086  45.733 -20.196
  100    HB3  ASP  11           HB2      ASP  11  -3.285  44.569 -20.724
  101    H    GLU  12           HN       GLU  12  -5.231  48.259 -22.449
  102    HA   GLU  12           HA       GLU  12  -6.857  46.218 -24.060
  103    HB2  GLU  12           HB1      GLU  12  -8.019  47.416 -22.174
  104    HB3  GLU  12           HB2      GLU  12  -7.753  48.960 -22.964
  105    HG2  GLU  12           HG1      GLU  12  -9.202  48.248 -24.894
  106    HG3  GLU  12           HG2      GLU  12  -9.312  46.615 -24.250
  107    H    GLN  13           HN       GLN  13  -4.415  48.349 -24.835
  108    HA   GLN  13           HA       GLN  13  -5.310  49.969 -26.939
  109    HB2  GLN  13           HB1      GLN  13  -3.036  49.996 -26.000
  110    HB3  GLN  13           HB2      GLN  13  -2.656  48.452 -26.736
  111    HG2  GLN  13           HG2      GLN  13  -1.565  50.178 -28.005
  112    HG3  GLN  13           HG1      GLN  13  -2.787  49.461 -29.023
  113   HE21  GLN  13          2HE2      GLN  13  -1.909  52.362 -27.220
  114   HE22  GLN  13          1HE2      GLN  13  -3.118  53.455 -28.061
  115    H    TRP  14           HN       TRP  14  -3.839  46.802 -27.871
  116    HA   TRP  14           HA       TRP  14  -5.573  46.721 -30.347
  117    HB2  TRP  14           HB2      TRP  14  -3.536  44.589 -29.488
  118    HB3  TRP  14           HB1      TRP  14  -4.281  44.775 -31.050
  119    HD1  TRP  14           HD1      TRP  14  -1.202  45.747 -29.121
  120    HE1  TRP  14           HE1      TRP  14   0.305  47.546 -30.329
  121    HE3  TRP  14           HE3      TRP  14  -4.623  47.062 -32.669
  122    HZ2  TRP  14           HZ2      TRP  14  -0.146  49.301 -32.544
  123    HZ3  TRP  14           HZ3      TRP  14  -4.049  48.848 -34.280
  124    HH2  TRP  14           HH2      TRP  14  -1.847  49.951 -34.218
  125    H    THR  15           HN       THR  15  -7.372  45.484 -30.557
  126    HA   THR  15           HA       THR  15  -8.178  43.588 -28.271
  127    HB   THR  15           HB       THR  15 -10.515  44.294 -28.672
  128    HG1  THR  15           HG1      THR  15 -10.616  46.418 -29.746
  129   HG21  THR  15          3HG2      THR  15  -8.701  46.664 -27.934
  130   HG22  THR  15          1HG2      THR  15 -10.425  46.483 -27.548
  131   HG23  THR  15          2HG2      THR  15  -9.236  45.385 -26.814
  132    HA   PRO  16           HA       PRO  16  -8.637  40.719 -31.974
  133    HB2  PRO  16           HB1      PRO  16  -7.092  38.670 -30.402
  134    HB3  PRO  16           HB2      PRO  16  -6.712  39.389 -31.965
  135    HG2  PRO  16           HG2      PRO  16  -5.282  39.937 -29.650
  136    HG3  PRO  16           HG1      PRO  16  -5.474  41.140 -30.947
  137    HD2  PRO  16           HD1      PRO  16  -7.105  40.914 -28.346
  138    HD3  PRO  16           HD2      PRO  16  -6.319  42.335 -29.082
  139    H    PHE  17           HN       PHE  17 -10.423  39.419 -32.142
  140    HA   PHE  17           HA       PHE  17 -12.350  38.990 -30.282
  141    HB2  PHE  17           HB1      PHE  17 -12.197  37.341 -32.756
  142    HB3  PHE  17           HB2      PHE  17 -13.589  37.497 -31.726
  143    HD1  PHE  17           HD2      PHE  17 -14.727  39.786 -31.357
  144    HD2  PHE  17           HD1      PHE  17 -11.700  39.179 -34.350
  145    HE1  PHE  17           HE2      PHE  17 -15.439  41.853 -32.550
  146    HE2  PHE  17           HE1      PHE  17 -12.458  41.219 -35.510
  147    HZ   PHE  17           HZ       PHE  17 -14.336  42.542 -34.599
  148    H    LEU  18           HN       LEU  18  -9.846  37.105 -29.498
  149    HA   LEU  18           HA       LEU  18 -11.660  35.070 -28.090
  150    HB2  LEU  18           HB1      LEU  18  -9.927  34.258 -29.753
  151    HB3  LEU  18           HB2      LEU  18  -8.662  34.981 -28.776
  152    HG   LEU  18           HG       LEU  18  -9.243  33.390 -26.889
  153   HD11  LEU  18          1HD1      LEU  18 -11.198  32.136 -28.943
  154   HD12  LEU  18          2HD1      LEU  18 -10.699  31.376 -27.410
  155   HD13  LEU  18          3HD1      LEU  18 -11.640  32.877 -27.386
  156   HD21  LEU  18          3HD2      LEU  18  -8.220  31.390 -28.014
  157   HD22  LEU  18          1HD2      LEU  18  -8.597  32.075 -29.616
  158   HD23  LEU  18          2HD2      LEU  18  -7.426  32.885 -28.549
  159    H    TYR  19           HN       TYR  19 -12.053  35.586 -26.027
  160    HA   TYR  19           HA       TYR  19 -10.357  37.369 -24.338
  161    HB2  TYR  19           HB2      TYR  19 -12.825  35.640 -23.689
  162    HB3  TYR  19           HB1      TYR  19 -11.965  36.487 -22.446
  163    HD1  TYR  19           HD1      TYR  19 -11.574  39.090 -22.737
  164    HD2  TYR  19           HD2      TYR  19 -14.618  36.851 -24.800
  165    HE1  TYR  19           HE1      TYR  19 -12.952  41.107 -22.901
  166    HE2  TYR  19           HE2      TYR  19 -15.974  38.890 -24.988
  167    HH   TYR  19           HH       TYR  19 -14.754  42.006 -24.159
  168    H    ASP  20           HN       ASP  20  -8.385  36.579 -23.846
  169    HA   ASP  20           HA       ASP  20  -8.031  33.775 -22.757
  170    HB2  ASP  20           HB2      ASP  20  -6.505  34.655 -24.532
  171    HB3  ASP  20           HB1      ASP  20  -5.882  35.864 -23.420
  172    H    PHE  21           HN       PHE  21  -6.225  36.589 -21.434
  173    HA   PHE  21           HA       PHE  21  -6.851  35.632 -18.683
  174    HB2  PHE  21           HB2      PHE  21  -4.592  36.511 -19.676
  175    HB3  PHE  21           HB1      PHE  21  -5.216  38.119 -19.444
  176    HD1  PHE  21           HD1      PHE  21  -4.012  35.006 -17.811
  177    HD2  PHE  21           HD2      PHE  21  -5.320  39.043 -17.080
  178    HE1  PHE  21           HE1      PHE  21  -3.043  34.925 -15.554
  179    HE2  PHE  21           HE2      PHE  21  -4.359  38.935 -14.823
  180    HZ   PHE  21           HZ       PHE  21  -3.213  36.883 -14.056
  181    H    TYR  22           HN       TYR  22  -9.260  36.387 -19.714
  182    HA   TYR  22           HA       TYR  22 -10.086  38.600 -17.770
  183    HB2  TYR  22           HB2      TYR  22  -9.913  39.414 -20.245
  184    HB3  TYR  22           HB1      TYR  22 -11.211  38.318 -20.630
  185    HD1  TYR  22           HD1      TYR  22 -10.274  41.183 -18.422
  186    HD2  TYR  22           HD2      TYR  22 -13.546  39.088 -20.220
  187    HE1  TYR  22           HE1      TYR  22 -11.773  43.023 -17.796
  188    HE2  TYR  22           HE2      TYR  22 -15.067  40.906 -19.554
  189    HH   TYR  22           HH       TYR  22 -15.268  42.840 -18.454
  190    H    HIS  23           HN       HIS  23 -10.382  36.647 -16.515
  191    HA   HIS  23           HA       HIS  23 -13.203  35.519 -16.805
  192    HB2  HIS  23           HB1      HIS  23 -10.766  33.681 -16.336
  193    HB3  HIS  23           HB2      HIS  23 -12.443  33.200 -16.220
  194    HD1  HIS  23           HD1      HIS  23  -9.649  33.391 -18.704
  195    HD2  HIS  23           HD2      HIS  23 -13.925  33.617 -18.777
  196    HE1  HIS  23           HE1      HIS  23 -10.520  32.871 -21.056
  197    HE2  HIS  23           HE2      HIS  23 -13.083  33.036 -21.232
  198    H    TYR  24           HN       TYR  24 -13.752  36.835 -15.127
  199    HA   TYR  24           HA       TYR  24 -12.284  36.525 -12.438
  200    HB2  TYR  24           HB2      TYR  24 -13.488  39.174 -13.351
  201    HB3  TYR  24           HB1      TYR  24 -12.457  38.871 -11.981
  202    HD1  TYR  24           HD2      TYR  24 -10.058  37.419 -13.286
  203    HD2  TYR  24           HD1      TYR  24 -12.370  40.823 -14.562
  204    HE1  TYR  24           HE2      TYR  24  -8.150  38.242 -14.599
  205    HE2  TYR  24           HE1      TYR  24 -10.442  41.650 -15.820
  206    HH   TYR  24           HH       TYR  24  -7.543  39.715 -16.249
  207    H1   PCA   1           HN       PCA   1 -27.647  48.629 -27.468
  208    HA   PCA   1           HA       PCA   1 -28.175  49.382 -29.976
  209    HB2  PCA   1           HB2      PCA   1 -28.654  51.701 -30.223
  210    HB3  PCA   1           HB1      PCA   1 -27.586  52.178 -28.887
  211    HG2  PCA   1           HG2      PCA   1 -30.403  51.052 -28.700
  212    HG3  PCA   1           HG1      PCA   1 -29.576  52.216 -27.622
  213    H    LEU   2           HN       LEU   2 -25.662  51.068 -27.964
  214    HA   LEU   2           HA       LEU   2 -23.571  50.488 -30.098
  215    HB2  LEU   2           HB2      LEU   2 -23.530  52.223 -27.562
  216    HB3  LEU   2           HB1      LEU   2 -22.062  51.742 -28.374
  217    HG   LEU   2           HG       LEU   2 -22.804  52.803 -30.514
  218   HD11  LEU   2          1HD2      LEU   2 -25.280  52.908 -30.280
  219   HD12  LEU   2          2HD2      LEU   2 -24.638  54.545 -30.460
  220   HD13  LEU   2          3HD2      LEU   2 -25.142  53.965 -28.852
  221   HD21  LEU   2          2HD1      LEU   2 -22.304  55.132 -29.755
  222   HD22  LEU   2          3HD1      LEU   2 -21.269  53.965 -28.914
  223   HD23  LEU   2          1HD1      LEU   2 -22.660  54.686 -28.068
  224    H    TYR   3           HN       TYR   3 -23.744  48.219 -29.843
  225    HA   TYR   3           HA       TYR   3 -22.832  46.915 -27.289
  226    HB2  TYR   3           HB1      TYR   3 -23.621  45.630 -29.971
  227    HB3  TYR   3           HB2      TYR   3 -23.241  44.762 -28.510
  228    HD1  TYR   3           HD2      TYR   3 -24.698  45.325 -26.340
  229    HD2  TYR   3           HD1      TYR   3 -25.926  46.265 -30.357
  230    HE1  TYR   3           HE2      TYR   3 -27.037  45.469 -25.601
  231    HE2  TYR   3           HE1      TYR   3 -28.259  46.393 -29.606
  232    HH   TYR   3           HH       TYR   3 -29.653  46.277 -27.883
  233    H    GLU   4           HN       GLU   4 -20.717  47.352 -26.992
  234    HA   GLU   4           HA       GLU   4 -18.627  47.281 -29.059
  235    HB2  GLU   4           HB1      GLU   4 -18.316  47.097 -25.993
  236    HB3  GLU   4           HB2      GLU   4 -16.976  47.196 -27.123
  237    HG2  GLU   4           HG2      GLU   4 -17.878  49.423 -27.985
  238    HG3  GLU   4           HG1      GLU   4 -19.123  49.369 -26.732
  239    H    ASN   5           HN       ASN   5 -17.933  45.502 -30.041
  240    HA   ASN   5           HA       ASN   5 -17.830  42.829 -28.623
  241    HB2  ASN   5           HB1      ASN   5 -18.435  43.087 -31.148
  242    HB3  ASN   5           HB2      ASN   5 -16.721  43.311 -31.437
  243   HD21  ASN   5          1HD2      ASN   5 -18.887  40.994 -31.738
  244   HD22  ASN   5          2HD2      ASN   5 -17.818  39.553 -31.348
  245    H    LYS   6           HN       LYS   6 -16.374  42.913 -27.099
  246    HA   LYS   6           HA       LYS   6 -13.743  44.455 -27.443
  247    HB2  LYS   6           HB2      LYS   6 -15.547  45.406 -26.030
  248    HB3  LYS   6           HB1      LYS   6 -15.547  43.976 -24.998
  249    HG2  LYS   6           HG1      LYS   6 -13.179  44.470 -24.260
  250    HG3  LYS   6           HG2      LYS   6 -13.079  45.803 -25.382
  251    HD2  LYS   6           HD1      LYS   6 -15.093  45.538 -23.043
  252    HD3  LYS   6           HD2      LYS   6 -13.583  46.382 -22.926
  253    HE2  LYS   6           HE1      LYS   6 -15.976  47.177 -24.676
  254    HE3  LYS   6           HE2      LYS   6 -15.377  48.016 -23.250
  255    HZ1  LYS   6           HZ1      LYS   6 -13.319  48.537 -24.501
  256    HZ2  LYS   6           HZ2      LYS   6 -14.663  49.104 -25.292
  257    HZ3  LYS   6           HZ3      LYS   6 -13.903  47.744 -25.826
  258    HA   PRO   7           HA       PRO   7 -12.433  40.126 -26.062
  259    HB2  PRO   7           HB1      PRO   7 -11.331  39.093 -28.171
  260    HB3  PRO   7           HB2      PRO   7 -13.048  39.388 -28.164
  261    HG2  PRO   7           HG2      PRO   7 -10.949  41.319 -29.379
  262    HG3  PRO   7           HG1      PRO   7 -12.326  40.654 -30.257
  263    HD2  PRO   7           HD2      PRO   7 -12.579  43.041 -29.107
  264    HD3  PRO   7           HD1      PRO   7 -13.893  41.819 -29.033
  265    H    ARG   8           HN       ARG   8 -10.910  40.417 -24.596
  266    HA   ARG   8           HA       ARG   8  -8.563  42.231 -25.074
  267    HB2  ARG   8           HB2      ARG   8  -9.925  41.077 -22.571
  268    HB3  ARG   8           HB1      ARG   8  -8.411  41.943 -22.474
  269    HG2  ARG   8           HG2      ARG   8  -9.336  44.018 -23.350
  270    HG3  ARG   8           HG1      ARG   8 -10.814  43.230 -23.864
  271    HD2  ARG   8           HD2      ARG   8 -11.388  44.470 -21.905
  272    HD3  ARG   8           HD1      ARG   8 -11.471  42.779 -21.495
  273    HE   ARG   8           HE       ARG   8  -9.451  42.945 -20.094
  274   HH11  ARG   8          1HH1      ARG   8 -10.480  46.135 -21.285
  275   HH12  ARG   8          2HH1      ARG   8  -9.595  46.936 -19.892
  276   HH21  ARG   8          2HH2      ARG   8  -8.492  44.017 -18.558
  277   HH22  ARG   8          1HH2      ARG   8  -8.581  45.849 -18.485
  278    H    ARG   9           HN       ARG   9  -6.487  41.873 -24.501
  279    HA   ARG   9           HA       ARG   9  -5.414  39.251 -25.386
  280    HB2  ARG   9           HB2      ARG   9  -4.243  42.035 -24.744
  281    HB3  ARG   9           HB1      ARG   9  -3.144  40.718 -24.991
  282    HG2  ARG   9           HG1      ARG   9  -4.136  40.205 -27.241
  283    HG3  ARG   9           HG2      ARG   9  -5.235  41.566 -27.062
  284    HD2  ARG   9           HD2      ARG   9  -2.137  41.803 -27.067
  285    HD3  ARG   9           HD1      ARG   9  -3.164  42.020 -28.474
  286    HE   ARG   9           HE       ARG   9  -4.238  44.018 -27.463
  287   HH11  ARG   9          1HH2      ARG   9  -1.409  42.908 -25.636
  288   HH12  ARG   9          2HH2      ARG   9  -1.485  44.423 -24.604
  289   HH21  ARG   9          2HH1      ARG   9  -4.245  45.664 -26.246
  290   HH22  ARG   9          1HH1      ARG   9  -2.988  45.889 -24.930
  291    HA   PRO  10           HA       PRO  10  -3.765  37.557 -21.478
  292    HB2  PRO  10           HB2      PRO  10  -1.304  36.472 -22.156
  293    HB3  PRO  10           HB1      PRO  10  -2.857  35.831 -22.697
  294    HG2  PRO  10           HG1      PRO  10  -1.019  37.741 -24.236
  295    HG3  PRO  10           HG2      PRO  10  -1.711  36.201 -24.806
  296    HD2  PRO  10           HD1      PRO  10  -2.917  38.559 -25.433
  297    HD3  PRO  10           HD2      PRO  10  -3.930  37.157 -24.999
  298    H    TYR  11           HN       TYR  11  -3.728  39.776 -20.610
  299    HA   TYR  11           HA       TYR  11  -0.999  40.951 -20.078
  300    HB2  TYR  11           HB2      TYR  11  -2.117  42.836 -19.029
  301    HB3  TYR  11           HB1      TYR  11  -2.545  42.536 -20.678
  302    HD1  TYR  11           HD1      TYR  11  -3.888  42.222 -17.160
  303    HD2  TYR  11           HD2      TYR  11  -4.861  42.270 -21.362
  304    HE1  TYR  11           HE1      TYR  11  -6.267  42.272 -16.621
  305    HE2  TYR  11           HE2      TYR  11  -7.237  42.435 -20.781
  306    HH   TYR  11           HH       TYR  11  -8.323  42.216 -17.405
  307    H    ILE  12           HN       ILE  12  -0.047  39.307 -18.920
  308    HA   ILE  12           HA       ILE  12  -1.193  38.272 -16.407
  309    HB   ILE  12           HB       ILE  12   1.617  37.932 -17.559
  310   HG12  ILE  12          2HG1      ILE  12  -0.680  35.866 -17.429
  311   HG13  ILE  12          1HG1      ILE  12  -0.442  36.900 -18.822
  312   HG21  ILE  12          2HG2      ILE  12   1.724  37.586 -15.088
  313   HG22  ILE  12          3HG2      ILE  12   1.908  36.036 -15.898
  314   HG23  ILE  12          1HG2      ILE  12   0.348  36.466 -15.140
  315   HD11  ILE  12          1HD1      ILE  12   1.641  34.863 -17.815
  316   HD12  ILE  12          2HD1      ILE  12   1.881  35.985 -19.181
  317   HD13  ILE  12          3HD1      ILE  12   0.616  34.732 -19.260
  318    H    LEU  13           HN       LEU  13  -1.393  39.494 -14.721
  319    HA   LEU  13           HA       LEU  13   0.304  41.784 -13.986
  320    HB2  LEU  13           HB2      LEU  13  -2.143  41.601 -13.629
  321    HB3  LEU  13           HB1      LEU  13  -1.947  40.303 -12.477
  322    HG   LEU  13           HG       LEU  13  -2.542  42.596 -11.620
  323   HD11  LEU  13          2HD1      LEU  13   0.026  41.529 -10.309
  324   HD12  LEU  13          3HD1      LEU  13  -1.206  42.576  -9.571
  325   HD13  LEU  13          1HD1      LEU  13  -1.623  40.910 -10.022
  326   HD21  LEU  13          1HD2      LEU  13   0.372  43.362 -12.223
  327   HD22  LEU  13          2HD2      LEU  13  -0.815  44.332 -11.320
  328   HD23  LEU  13          3HD2      LEU  13  -1.080  43.971 -13.049
  Start of MODEL    9
    1    H1   VAL   1           HN1      VAL   1  -0.946  40.714 -11.413
    2    H2   VAL   1           HN2      VAL   1   0.432  40.313 -10.627
    3    H3   VAL   1           HN3      VAL   1  -0.982  39.547 -10.219
    4    HA   VAL   1           HA       VAL   1   0.334  39.405 -12.898
    5    HB   VAL   1           HB       VAL   1   0.971  37.061 -12.342
    6   HG11  VAL   1          3HG2      VAL   1   3.015  37.644 -11.092
    7   HG12  VAL   1          1HG2      VAL   1   2.639  38.925 -12.264
    8   HG13  VAL   1          2HG2      VAL   1   2.301  39.172 -10.531
    9   HG21  VAL   1          1HG1      VAL   1   1.174  36.288 -10.003
   10   HG22  VAL   1          2HG1      VAL   1  -0.533  36.596 -10.372
   11   HG23  VAL   1          3HG1      VAL   1   0.392  37.761  -9.388
   12    H    ARG   2           HN       ARG   2  -2.125  40.108 -13.087
   13    HA   ARG   2           HA       ARG   2  -3.361  37.745 -14.418
   14    HB2  ARG   2           HB1      ARG   2  -5.513  37.758 -13.240
   15    HB3  ARG   2           HB2      ARG   2  -4.212  37.355 -12.137
   16    HG2  ARG   2           HG1      ARG   2  -4.244  39.730 -11.223
   17    HG3  ARG   2           HG2      ARG   2  -5.500  40.152 -12.372
   18    HD2  ARG   2           HD1      ARG   2  -6.631  39.764 -10.305
   19    HD3  ARG   2           HD2      ARG   2  -7.030  38.382 -11.341
   20    HE   ARG   2           HE       ARG   2  -4.675  37.637  -9.796
   21   HH11  ARG   2          1HH2      ARG   2  -8.042  38.412  -9.267
   22   HH12  ARG   2          2HH2      ARG   2  -8.117  37.358  -7.772
   23   HH21  ARG   2          1HH1      ARG   2  -4.807  36.439  -8.070
   24   HH22  ARG   2          2HH1      ARG   2  -6.372  36.301  -7.137
   25    H    ARG   3           HN       ARG   3  -4.946  38.308 -15.932
   26    HA   ARG   3           HA       ARG   3  -4.791  41.127 -16.866
   27    HB2  ARG   3           HB1      ARG   3  -6.131  40.408 -18.787
   28    HB3  ARG   3           HB2      ARG   3  -4.719  39.406 -18.513
   29    HG2  ARG   3           HG2      ARG   3  -6.177  37.610 -17.473
   30    HG3  ARG   3           HG1      ARG   3  -7.609  38.599 -17.769
   31    HD2  ARG   3           HD2      ARG   3  -7.156  38.587 -20.230
   32    HD3  ARG   3           HD1      ARG   3  -5.659  37.663 -19.970
   33    HE   ARG   3           HE       ARG   3  -7.749  36.124 -18.708
   34   HH11  ARG   3          1HH1      ARG   3  -6.913  37.249 -21.907
   35   HH12  ARG   3          2HH1      ARG   3  -7.736  35.817 -22.700
   36   HH21  ARG   3          2HH2      ARG   3  -8.677  34.498 -19.652
   37   HH22  ARG   3          1HH2      ARG   3  -8.679  34.333 -21.474
   38    H    LEU   4           HN       LEU   4  -5.643  42.064 -14.938
   39    HA   LEU   4           HA       LEU   4  -8.655  42.506 -15.183
   40    HB2  LEU   4           HB2      LEU   4  -7.978  40.699 -13.477
   41    HB3  LEU   4           HB1      LEU   4  -7.137  41.921 -12.552
   42    HG   LEU   4           HG       LEU   4  -9.352  41.203 -11.679
   43   HD11  LEU   4          1HD1      LEU   4 -10.171  43.361 -10.948
   44   HD12  LEU   4          2HD1      LEU   4  -9.436  44.201 -12.323
   45   HD13  LEU   4          3HD1      LEU   4  -8.400  43.471 -11.072
   46   HD21  LEU   4          3HD2      LEU   4 -10.579  40.920 -13.856
   47   HD22  LEU   4          1HD2      LEU   4 -10.638  42.692 -14.050
   48   HD23  LEU   4          2HD2      LEU   4 -11.481  41.917 -12.691
   49    H    MET   5           HN       MET   5  -9.245  44.574 -14.951
   50    HA   MET   5           HA       MET   5  -7.101  46.653 -14.613
   51    HB2  MET   5           HB1      MET   5  -8.823  48.315 -15.156
   52    HB3  MET   5           HB2      MET   5  -8.612  47.101 -16.396
   53    HG2  MET   5           HG1      MET   5 -10.968  47.073 -14.397
   54    HG3  MET   5           HG2      MET   5 -11.008  47.797 -16.010
   55    HE1  MET   5           HE1      MET   5 -12.987  45.512 -14.910
   56    HE2  MET   5           HE2      MET   5 -13.137  44.494 -16.374
   57    HE3  MET   5           HE3      MET   5 -13.140  46.278 -16.522
   58    H    PHE   6           HN       PHE   6  -6.444  46.537 -12.560
   59    HA   PHE   6           HA       PHE   6  -8.221  46.482 -10.250
   60    HB2  PHE   6           HB1      PHE   6  -5.254  47.284 -10.405
   61    HB3  PHE   6           HB2      PHE   6  -6.136  47.068  -8.911
   62    HD1  PHE   6           HD1      PHE   6  -7.020  44.813  -8.270
   63    HD2  PHE   6           HD2      PHE   6  -4.488  45.327 -11.658
   64    HE1  PHE   6           HE1      PHE   6  -6.481  42.428  -8.239
   65    HE2  PHE   6           HE2      PHE   6  -3.961  42.943 -11.623
   66    HZ   PHE   6           HZ       PHE   6  -4.941  41.495  -9.900
   67    H    SER   7           HN       SER   7  -6.144  49.268 -11.184
   68    HA   SER   7           HA       SER   7  -8.392  51.097 -10.294
   69    HB2  SER   7           HB2      SER   7  -6.902  52.523  -8.896
   70    HB3  SER   7           HB1      SER   7  -7.126  50.907  -8.224
   71    HG   SER   7           HG       SER   7  -5.113  50.317  -9.048
   72    H    TYR   8           HN       TYR   8  -5.026  51.934 -11.013
   73    HA   TYR   8           HA       TYR   8  -6.070  53.429 -13.463
   74    HB2  TYR   8           HB1      TYR   8  -4.110  54.859 -13.320
   75    HB3  TYR   8           HB2      TYR   8  -5.099  54.909 -11.887
   76    HD1  TYR   8           HD1      TYR   8  -4.283  53.861  -9.751
   77    HD2  TYR   8           HD2      TYR   8  -1.778  54.156 -13.184
   78    HE1  TYR   8           HE1      TYR   8  -2.316  53.509  -8.350
   79    HE2  TYR   8           HE2      TYR   8   0.188  53.808 -11.770
   80    HH   TYR   8           HH       TYR   8  -0.121  53.330  -8.282
   81    H    ILE   9           HN       ILE   9  -6.188  51.721 -14.871
   82    HA   ILE   9           HA       ILE   9  -3.703  50.206 -15.531
   83    HB   ILE   9           HB       ILE   9  -5.871  49.073 -15.408
   84   HG12  ILE   9          2HG1      ILE   9  -4.835  49.024 -18.288
   85   HG13  ILE   9          1HG1      ILE   9  -3.906  48.387 -16.929
   86   HG21  ILE   9          1HG2      ILE   9  -7.426  50.854 -16.301
   87   HG22  ILE   9          2HG2      ILE   9  -7.635  49.328 -17.174
   88   HG23  ILE   9          3HG2      ILE   9  -6.729  50.659 -17.926
   89   HD11  ILE   9          3HD1      ILE   9  -6.711  47.367 -17.707
   90   HD12  ILE   9          1HD1      ILE   9  -5.681  46.713 -16.404
   91   HD13  ILE   9          2HD1      ILE   9  -5.171  46.572 -18.106
   92    H    SER  10           HN       SER  10  -2.432  50.468 -17.257
   93    HA   SER  10           HA       SER  10  -2.557  53.062 -18.665
   94    HB2  SER  10           HB1      SER  10  -0.392  52.471 -19.634
   95    HB3  SER  10           HB2      SER  10  -0.404  52.105 -17.909
   96    HG   SER  10           HG       SER  10  -0.793  50.269 -20.054
   97    H    ASP  11           HN       ASP  11  -2.906  49.773 -19.833
   98    HA   ASP  11           HA       ASP  11  -4.230  50.920 -22.331
   99    HB2  ASP  11           HB1      ASP  11  -1.814  50.473 -22.872
  100    HB3  ASP  11           HB2      ASP  11  -2.028  48.771 -22.462
  101    H    GLU  12           HN       GLU  12  -5.996  50.027 -22.852
  102    HA   GLU  12           HA       GLU  12  -6.501  47.058 -22.304
  103    HB2  GLU  12           HB2      GLU  12  -8.618  49.273 -21.921
  104    HB3  GLU  12           HB1      GLU  12  -8.951  47.548 -22.000
  105    HG2  GLU  12           HG1      GLU  12  -7.278  47.257 -20.005
  106    HG3  GLU  12           HG2      GLU  12  -7.346  49.006 -19.825
  107    H    GLN  13           HN       GLN  13  -5.286  47.930 -24.517
  108    HA   GLN  13           HA       GLN  13  -7.461  47.825 -26.682
  109    HB2  GLN  13           HB2      GLN  13  -4.636  49.045 -26.816
  110    HB3  GLN  13           HB1      GLN  13  -5.808  49.026 -28.129
  111    HG2  GLN  13           HG2      GLN  13  -7.398  50.429 -26.728
  112    HG3  GLN  13           HG1      GLN  13  -6.195  50.492 -25.441
  113   HE21  GLN  13          1HE2      GLN  13  -3.992  51.350 -26.127
  114   HE22  GLN  13          2HE2      GLN  13  -4.059  52.781 -27.285
  115    H    TRP  14           HN       TRP  14  -4.300  46.444 -25.789
  116    HA   TRP  14           HA       TRP  14  -3.902  45.049 -28.321
  117    HB2  TRP  14           HB1      TRP  14  -2.789  44.287 -25.567
  118    HB3  TRP  14           HB2      TRP  14  -2.180  43.711 -27.105
  119    HD1  TRP  14           HD1      TRP  14  -1.809  46.351 -28.833
  120    HE1  TRP  14           HE1      TRP  14  -0.077  48.251 -28.189
  121    HE3  TRP  14           HE3      TRP  14  -1.484  45.198 -23.926
  122    HZ2  TRP  14           HZ2      TRP  14   1.166  48.966 -25.773
  123    HZ3  TRP  14           HZ3      TRP  14  -0.015  46.530 -22.473
  124    HH2  TRP  14           HH2      TRP  14   1.291  48.390 -23.382
  125    H    THR  15           HN       THR  15  -5.989  44.177 -28.719
  126    HA   THR  15           HA       THR  15  -6.545  41.524 -27.301
  127    HB   THR  15           HB       THR  15  -8.296  43.086 -27.039
  128    HG1  THR  15           HG1      THR  15  -8.981  41.167 -29.001
  129   HG21  THR  15          3HG2      THR  15  -9.762  43.921 -28.861
  130   HG22  THR  15          1HG2      THR  15  -8.674  43.263 -30.101
  131   HG23  THR  15          2HG2      THR  15  -8.126  44.587 -29.044
  132    HA   PRO  16           HA       PRO  16  -5.226  40.079 -31.528
  133    HB2  PRO  16           HB1      PRO  16  -3.594  37.990 -30.764
  134    HB3  PRO  16           HB2      PRO  16  -3.080  39.686 -30.637
  135    HG2  PRO  16           HG1      PRO  16  -4.266  37.938 -28.413
  136    HG3  PRO  16           HG2      PRO  16  -2.753  38.881 -28.356
  137    HD2  PRO  16           HD1      PRO  16  -5.141  39.868 -27.355
  138    HD3  PRO  16           HD2      PRO  16  -3.949  40.959 -28.134
  139    H    PHE  17           HN       PHE  17  -5.637  38.064 -32.650
  140    HA   PHE  17           HA       PHE  17  -8.215  36.863 -31.913
  141    HB2  PHE  17           HB2      PHE  17  -6.202  35.945 -34.056
  142    HB3  PHE  17           HB1      PHE  17  -7.818  35.297 -33.869
  143    HD1  PHE  17           HD1      PHE  17  -9.828  36.860 -34.120
  144    HD2  PHE  17           HD2      PHE  17  -5.890  38.019 -35.258
  145    HE1  PHE  17           HE1      PHE  17 -10.750  38.636 -35.526
  146    HE2  PHE  17           HE2      PHE  17  -6.823  39.793 -36.658
  147    HZ   PHE  17           HZ       PHE  17  -9.251  40.104 -36.795
  148    H    LEU  18           HN       LEU  18  -4.941  35.384 -31.938
  149    HA   LEU  18           HA       LEU  18  -6.049  33.058 -30.289
  150    HB2  LEU  18           HB1      LEU  18  -3.329  33.471 -31.671
  151    HB3  LEU  18           HB2      LEU  18  -3.640  32.176 -30.542
  152    HG   LEU  18           HG       LEU  18  -3.768  31.310 -32.752
  153   HD11  LEU  18          1HD1      LEU  18  -6.647  31.405 -31.655
  154   HD12  LEU  18          2HD1      LEU  18  -5.353  30.333 -31.057
  155   HD13  LEU  18          3HD1      LEU  18  -5.949  30.167 -32.724
  156   HD21  LEU  18          3HD2      LEU  18  -5.375  31.970 -34.484
  157   HD22  LEU  18          1HD2      LEU  18  -6.086  33.215 -33.435
  158   HD23  LEU  18          2HD2      LEU  18  -4.409  33.388 -34.018
  159    H    TYR  19           HN       TYR  19  -6.480  34.345 -28.492
  160    HA   TYR  19           HA       TYR  19  -4.182  35.652 -27.060
  161    HB2  TYR  19           HB1      TYR  19  -5.880  36.353 -25.371
  162    HB3  TYR  19           HB2      TYR  19  -6.106  36.949 -26.991
  163    HD1  TYR  19           HD2      TYR  19  -7.535  34.681 -24.433
  164    HD2  TYR  19           HD1      TYR  19  -8.037  36.338 -28.321
  165    HE1  TYR  19           HE2      TYR  19  -9.868  33.951 -24.448
  166    HE2  TYR  19           HE1      TYR  19 -10.364  35.605 -28.331
  167    HH   TYR  19           HH       TYR  19 -11.711  33.743 -25.654
  168    H    ASP  20           HN       ASP  20  -2.869  33.881 -26.726
  169    HA   ASP  20           HA       ASP  20  -3.746  31.633 -25.011
  170    HB2  ASP  20           HB2      ASP  20  -1.995  31.474 -26.815
  171    HB3  ASP  20           HB1      ASP  20  -0.900  32.455 -25.839
  172    H    PHE  21           HN       PHE  21  -4.288  32.053 -23.030
  173    HA   PHE  21           HA       PHE  21  -2.359  33.610 -21.214
  174    HB2  PHE  21           HB1      PHE  21  -4.516  34.829 -21.708
  175    HB3  PHE  21           HB2      PHE  21  -5.428  33.514 -20.995
  176    HD1  PHE  21           HD2      PHE  21  -2.831  36.105 -20.250
  177    HD2  PHE  21           HD1      PHE  21  -5.666  33.394 -18.598
  178    HE1  PHE  21           HE2      PHE  21  -2.571  37.161 -18.062
  179    HE2  PHE  21           HE1      PHE  21  -5.376  34.434 -16.404
  180    HZ   PHE  21           HZ       PHE  21  -3.823  36.311 -16.131
  181    H    TYR  22           HN       TYR  22  -4.992  31.147 -20.977
  182    HA   TYR  22           HA       TYR  22  -3.651  29.999 -18.526
  183    HB2  TYR  22           HB2      TYR  22  -6.122  28.968 -20.037
  184    HB3  TYR  22           HB1      TYR  22  -5.558  28.406 -18.481
  185    HD1  TYR  22           HD1      TYR  22  -5.378  30.258 -16.568
  186    HD2  TYR  22           HD2      TYR  22  -7.744  30.670 -20.087
  187    HE1  TYR  22           HE1      TYR  22  -6.754  31.942 -15.453
  188    HE2  TYR  22           HE2      TYR  22  -9.124  32.340 -18.957
  189    HH   TYR  22           HH       TYR  22  -8.528  33.259 -15.604
  190    H    HIS  23           HN       HIS  23  -1.708  29.659 -19.841
  191    HA   HIS  23           HA       HIS  23  -1.767  27.217 -21.625
  192    HB2  HIS  23           HB1      HIS  23  -0.578  29.345 -22.259
  193    HB3  HIS  23           HB2      HIS  23   0.552  29.123 -20.935
  194    HD1  HIS  23           HD1      HIS  23   2.349  27.020 -21.200
  195    HD2  HIS  23           HD2      HIS  23  -0.280  27.890 -24.477
  196    HE1  HIS  23           HE1      HIS  23   3.191  25.843 -23.350
  197    HE2  HIS  23           HE2      HIS  23   1.670  26.314 -25.392
  198    H    TYR  24           HN       TYR  24   0.317  28.129 -18.795
  199    HA   TYR  24           HA       TYR  24  -0.024  25.421 -17.653
  200    HB2  TYR  24           HB2      TYR  24   1.737  25.084 -19.528
  201    HB3  TYR  24           HB1      TYR  24   2.805  26.163 -18.647
  202    HD1  TYR  24           HD1      TYR  24   1.110  22.872 -18.604
  203    HD2  TYR  24           HD2      TYR  24   3.877  25.385 -16.565
  204    HE1  TYR  24           HE1      TYR  24   1.871  20.964 -17.281
  205    HE2  TYR  24           HE2      TYR  24   4.638  23.466 -15.246
  206    HH   TYR  24           HH       TYR  24   3.219  20.259 -15.689
  207    H1   PCA   1           HN       PCA   1 -25.723  39.697 -33.859
  208    HA   PCA   1           HA       PCA   1 -25.147  37.339 -32.571
  209    HB2  PCA   1           HB2      PCA   1 -22.885  36.653 -32.986
  210    HB3  PCA   1           HB1      PCA   1 -22.319  38.328 -33.174
  211    HG2  PCA   1           HG2      PCA   1 -23.807  36.639 -35.235
  212    HG3  PCA   1           HG1      PCA   1 -22.509  37.850 -35.487
  213    H    LEU   2           HN       LEU   2 -25.859  38.124 -30.681
  214    HA   LEU   2           HA       LEU   2 -24.563  40.568 -29.422
  215    HB2  LEU   2           HB2      LEU   2 -26.981  38.892 -28.546
  216    HB3  LEU   2           HB1      LEU   2 -26.388  40.301 -27.688
  217    HG   LEU   2           HG       LEU   2 -27.403  40.366 -30.595
  218   HD11  LEU   2          2HD1      LEU   2 -29.224  39.798 -28.974
  219   HD12  LEU   2          3HD1      LEU   2 -29.444  41.441 -29.615
  220   HD13  LEU   2          1HD1      LEU   2 -28.799  41.208 -27.970
  221   HD21  LEU   2          1HD2      LEU   2 -25.820  42.250 -30.133
  222   HD22  LEU   2          2HD2      LEU   2 -26.700  42.659 -28.637
  223   HD23  LEU   2          3HD2      LEU   2 -27.481  42.868 -30.225
  224    H    TYR   3           HN       TYR   3 -22.574  39.816 -28.875
  225    HA   TYR   3           HA       TYR   3 -22.521  37.925 -26.479
  226    HB2  TYR   3           HB1      TYR   3 -20.588  36.751 -27.292
  227    HB3  TYR   3           HB2      TYR   3 -21.841  36.667 -28.497
  228    HD1  TYR   3           HD1      TYR   3 -21.586  37.894 -30.659
  229    HD2  TYR   3           HD2      TYR   3 -18.493  37.953 -27.736
  230    HE1  TYR   3           HE1      TYR   3 -19.990  38.646 -32.355
  231    HE2  TYR   3           HE2      TYR   3 -16.902  38.690 -29.437
  232    HH   TYR   3           HH       TYR   3 -16.588  39.181 -31.566
  233    H    GLU   4           HN       GLU   4 -20.233  37.997 -25.458
  234    HA   GLU   4           HA       GLU   4 -19.940  40.770 -24.457
  235    HB2  GLU   4           HB1      GLU   4 -19.771  38.832 -22.963
  236    HB3  GLU   4           HB2      GLU   4 -18.408  38.180 -23.863
  237    HG2  GLU   4           HG1      GLU   4 -17.600  39.209 -21.795
  238    HG3  GLU   4           HG2      GLU   4 -16.965  40.108 -23.164
  239    H    ASN   5           HN       ASN   5 -19.153  42.154 -25.901
  240    HA   ASN   5           HA       ASN   5 -16.515  41.531 -27.337
  241    HB2  ASN   5           HB2      ASN   5 -18.632  43.727 -27.746
  242    HB3  ASN   5           HB1      ASN   5 -17.068  43.763 -28.536
  243   HD21  ASN   5          1HD2      ASN   5 -16.773  42.584 -30.357
  244   HD22  ASN   5          2HD2      ASN   5 -18.052  41.448 -31.035
  245    H    LYS   6           HN       LYS   6 -15.163  41.702 -25.654
  246    HA   LYS   6           HA       LYS   6 -14.536  44.546 -24.718
  247    HB2  LYS   6           HB1      LYS   6 -14.686  41.969 -23.034
  248    HB3  LYS   6           HB2      LYS   6 -13.594  43.258 -22.567
  249    HG2  LYS   6           HG2      LYS   6 -15.535  44.913 -22.580
  250    HG3  LYS   6           HG1      LYS   6 -16.632  43.574 -22.927
  251    HD2  LYS   6           HD2      LYS   6 -15.918  42.425 -20.783
  252    HD3  LYS   6           HD1      LYS   6 -14.749  43.704 -20.479
  253    HE2  LYS   6           HE2      LYS   6 -16.666  44.159 -19.077
  254    HE3  LYS   6           HE1      LYS   6 -16.644  45.408 -20.328
  255    HZ1  LYS   6           HZ1      LYS   6 -18.914  44.339 -20.017
  256    HZ2  LYS   6           HZ2      LYS   6 -18.293  42.884 -20.524
  257    HZ3  LYS   6           HZ3      LYS   6 -18.354  44.114 -21.561
  258    HA   PRO   7           HA       PRO   7 -10.457  43.609 -26.291
  259    HB2  PRO   7           HB1      PRO   7  -8.729  44.955 -24.563
  260    HB3  PRO   7           HB2      PRO   7  -9.798  45.749 -25.735
  261    HG2  PRO   7           HG2      PRO   7 -10.327  45.294 -22.757
  262    HG3  PRO   7           HG1      PRO   7 -10.512  46.806 -23.679
  263    HD2  PRO   7           HD1      PRO   7 -12.667  45.198 -23.133
  264    HD3  PRO   7           HD2      PRO   7 -12.553  46.034 -24.715
  265    H    ARG   8           HN       ARG   8 -10.085  41.507 -26.194
  266    HA   ARG   8           HA       ARG   8  -9.593  40.047 -23.593
  267    HB2  ARG   8           HB1      ARG   8  -9.640  38.985 -26.480
  268    HB3  ARG   8           HB2      ARG   8  -9.585  38.003 -25.023
  269    HG2  ARG   8           HG2      ARG   8 -11.848  38.933 -24.310
  270    HG3  ARG   8           HG1      ARG   8 -11.884  39.920 -25.770
  271    HD2  ARG   8           HD1      ARG   8 -11.703  37.756 -27.166
  272    HD3  ARG   8           HD2      ARG   8 -11.906  36.851 -25.648
  273    HE   ARG   8           HE       ARG   8 -14.049  38.879 -25.923
  274   HH11  ARG   8          1HH1      ARG   8 -13.035  35.742 -27.103
  275   HH12  ARG   8          2HH1      ARG   8 -14.758  35.288 -27.528
  276   HH21  ARG   8          1HH2      ARG   8 -16.026  38.294 -26.392
  277   HH22  ARG   8          2HH2      ARG   8 -16.343  36.655 -27.135
  278    H    ARG   9           HN       ARG   9  -7.716  41.282 -23.146
  279    HA   ARG   9           HA       ARG   9  -5.269  40.726 -24.770
  280    HB2  ARG   9           HB1      ARG   9  -4.219  42.482 -23.674
  281    HB3  ARG   9           HB2      ARG   9  -5.841  43.004 -23.993
  282    HG2  ARG   9           HG2      ARG   9  -4.748  42.137 -21.230
  283    HG3  ARG   9           HG1      ARG   9  -4.959  43.784 -21.806
  284    HD2  ARG   9           HD1      ARG   9  -7.454  43.318 -22.104
  285    HD3  ARG   9           HD2      ARG   9  -7.227  41.758 -21.295
  286    HE   ARG   9           HE       ARG   9  -6.153  43.261 -19.326
  287   HH11  ARG   9          1HH1      ARG   9  -8.870  44.197 -21.372
  288   HH12  ARG   9          2HH1      ARG   9  -9.412  45.404 -20.080
  289   HH21  ARG   9          2HH2      ARG   9  -6.969  44.598 -17.883
  290   HH22  ARG   9          1HH2      ARG   9  -8.471  45.571 -18.322
  291    HA   PRO  10           HA       PRO  10  -4.019  37.530 -21.701
  292    HB2  PRO  10           HB2      PRO  10  -2.142  36.225 -23.194
  293    HB3  PRO  10           HB1      PRO  10  -3.858  36.200 -23.647
  294    HG2  PRO  10           HG1      PRO  10  -1.671  38.035 -24.765
  295    HG3  PRO  10           HG2      PRO  10  -2.806  37.023 -25.690
  296    HD2  PRO  10           HD2      PRO  10  -3.266  39.727 -25.176
  297    HD3  PRO  10           HD1      PRO  10  -4.617  38.555 -25.316
  298    H    TYR  11           HN       TYR  11  -3.312  39.611 -20.573
  299    HA   TYR  11           HA       TYR  11  -0.240  39.648 -20.316
  300    HB2  TYR  11           HB2      TYR  11  -2.225  42.000 -20.157
  301    HB3  TYR  11           HB1      TYR  11  -0.579  42.102 -19.582
  302    HD1  TYR  11           HD1      TYR  11  -2.574  41.450 -22.662
  303    HD2  TYR  11           HD2      TYR  11   1.227  42.520 -21.084
  304    HE1  TYR  11           HE1      TYR  11  -1.813  42.059 -24.908
  305    HE2  TYR  11           HE2      TYR  11   1.979  43.138 -23.325
  306    HH   TYR  11           HH       TYR  11   1.423  43.360 -25.453
  307    H    ILE  12           HN       ILE  12   0.475  39.066 -18.432
  308    HA   ILE  12           HA       ILE  12  -1.366  38.836 -16.083
  309    HB   ILE  12           HB       ILE  12   0.471  37.802 -14.874
  310   HG12  ILE  12          2HG1      ILE  12   2.529  38.732 -15.785
  311   HG13  ILE  12          1HG1      ILE  12   2.513  36.989 -15.822
  312   HG21  ILE  12          2HG2      ILE  12  -1.129  36.417 -16.103
  313   HG22  ILE  12          3HG2      ILE  12   0.475  35.658 -16.129
  314   HG23  ILE  12          1HG2      ILE  12  -0.135  36.491 -17.580
  315   HD11  ILE  12          1HD1      ILE  12   3.561  37.750 -17.872
  316   HD12  ILE  12          2HD1      ILE  12   1.984  37.084 -18.351
  317   HD13  ILE  12          3HD1      ILE  12   2.233  38.854 -18.261
  318    H    LEU  13           HN       LEU  13  -1.882  40.952 -15.690
  319    HA   LEU  13           HA       LEU  13   0.230  42.904 -14.855
  320    HB2  LEU  13           HB1      LEU  13  -2.826  43.108 -14.621
  321    HB3  LEU  13           HB2      LEU  13  -1.697  44.421 -14.355
  322    HG   LEU  13           HG       LEU  13  -2.048  42.958 -17.046
  323   HD11  LEU  13          1HD2      LEU  13  -3.282  45.018 -17.750
  324   HD12  LEU  13          2HD2      LEU  13  -3.121  45.697 -16.110
  325   HD13  LEU  13          3HD2      LEU  13  -4.098  44.232 -16.376
  326   HD21  LEU  13          2HD1      LEU  13  -0.513  45.554 -16.345
  327   HD22  LEU  13          3HD1      LEU  13  -0.774  44.921 -17.991
  328   HD23  LEU  13          1HD1      LEU  13   0.221  44.007 -16.838
  Start of MODEL   10
    1    H1   VAL   1           HN1      VAL   1   2.540  31.547  -9.408
    2    H2   VAL   1           HN2      VAL   1   3.891  30.924  -8.691
    3    H3   VAL   1           HN3      VAL   1   3.674  32.561  -8.765
    4    HA   VAL   1           HA       VAL   1   5.329  31.877 -10.359
    5    HB   VAL   1           HB       VAL   1   3.098  30.149 -11.580
    6   HG11  VAL   1          3HG2      VAL   1   5.969  30.612 -12.632
    7   HG12  VAL   1          1HG2      VAL   1   4.792  29.447 -13.293
    8   HG13  VAL   1          2HG2      VAL   1   4.473  31.182 -13.406
    9   HG21  VAL   1          1HG1      VAL   1   4.174  28.998  -9.634
   10   HG22  VAL   1          2HG1      VAL   1   5.790  29.294 -10.318
   11   HG23  VAL   1          3HG1      VAL   1   4.642  28.210 -11.148
   12    H    ARG   2           HN       ARG   2   2.017  32.112 -11.762
   13    HA   ARG   2           HA       ARG   2   2.824  34.572 -13.282
   14    HB2  ARG   2           HB2      ARG   2   0.110  33.111 -13.170
   15    HB3  ARG   2           HB1      ARG   2   0.469  34.496 -14.186
   16    HG2  ARG   2           HG2      ARG   2   2.356  33.172 -15.296
   17    HG3  ARG   2           HG1      ARG   2   1.850  31.750 -14.398
   18    HD2  ARG   2           HD2      ARG   2   0.064  33.342 -16.360
   19    HD3  ARG   2           HD1      ARG   2   0.954  31.899 -16.789
   20    HE   ARG   2           HE       ARG   2  -1.563  32.032 -15.118
   21   HH11  ARG   2          1HH1      ARG   2   1.100  29.938 -16.178
   22   HH12  ARG   2          2HH1      ARG   2   0.115  28.443 -15.773
   23   HH21  ARG   2          1HH2      ARG   2  -2.600  30.274 -14.689
   24   HH22  ARG   2          2HH2      ARG   2  -1.846  28.627 -14.983
   25    H    ARG   3           HN       ARG   3   1.783  36.542 -13.172
   26    HA   ARG   3           HA       ARG   3   1.057  37.485 -10.411
   27    HB2  ARG   3           HB1      ARG   3   1.245  39.022 -13.060
   28    HB3  ARG   3           HB2      ARG   3   0.891  39.758 -11.506
   29    HG2  ARG   3           HG1      ARG   3   3.093  39.119 -10.588
   30    HG3  ARG   3           HG2      ARG   3   3.503  38.228 -12.058
   31    HD2  ARG   3           HD2      ARG   3   3.402  40.310 -13.424
   32    HD3  ARG   3           HD1      ARG   3   2.924  41.264 -12.006
   33    HE   ARG   3           HE       ARG   3   5.398  39.952 -11.296
   34   HH11  ARG   3          1HH1      ARG   3   4.357  42.343 -13.706
   35   HH12  ARG   3          2HH1      ARG   3   6.031  43.089 -13.725
   36   HH21  ARG   3          2HH2      ARG   3   7.276  40.883 -11.400
   37   HH22  ARG   3          1HH2      ARG   3   7.557  42.318 -12.513
   38    H    LEU   4           HN       LEU   4  -0.910  38.055  -9.741
   39    HA   LEU   4           HA       LEU   4  -3.273  36.979 -11.204
   40    HB2  LEU   4           HB1      LEU   4  -3.070  38.342  -8.464
   41    HB3  LEU   4           HB2      LEU   4  -4.542  37.667  -9.121
   42    HG   LEU   4           HG       LEU   4  -2.014  36.012  -8.553
   43   HD11  LEU   4          1HD1      LEU   4  -3.270  35.160  -6.562
   44   HD12  LEU   4          2HD1      LEU   4  -4.624  36.264  -6.917
   45   HD13  LEU   4          3HD1      LEU   4  -3.031  36.915  -6.456
   46   HD21  LEU   4          3HD2      LEU   4  -3.393  34.915 -10.324
   47   HD22  LEU   4          1HD2      LEU   4  -4.865  35.092  -9.340
   48   HD23  LEU   4          2HD2      LEU   4  -3.549  34.013  -8.810
   49    H    MET   5           HN       MET   5  -3.626  38.233 -12.938
   50    HA   MET   5           HA       MET   5  -4.311  41.180 -12.597
   51    HB2  MET   5           HB2      MET   5  -2.645  40.425 -14.333
   52    HB3  MET   5           HB1      MET   5  -3.919  39.584 -15.200
   53    HG2  MET   5           HG1      MET   5  -3.873  42.627 -14.603
   54    HG3  MET   5           HG2      MET   5  -3.339  41.870 -16.111
   55    HE1  MET   5           HE1      MET   5  -4.957  43.030 -17.800
   56    HE2  MET   5           HE2      MET   5  -6.663  43.403 -17.405
   57    HE3  MET   5           HE3      MET   5  -5.344  44.102 -16.418
   58    H    PHE   6           HN       PHE   6  -6.327  41.177 -11.761
   59    HA   PHE   6           HA       PHE   6  -8.559  39.535 -13.030
   60    HB2  PHE   6           HB2      PHE   6  -8.694  41.198 -10.461
   61    HB3  PHE   6           HB1      PHE   6  -9.964  40.197 -11.113
   62    HD1  PHE   6           HD2      PHE   6  -9.182  37.591 -11.618
   63    HD2  PHE   6           HD1      PHE   6  -7.384  40.227  -8.729
   64    HE1  PHE   6           HE2      PHE   6  -8.353  35.653 -10.352
   65    HE2  PHE   6           HE1      PHE   6  -6.588  38.278  -7.461
   66    HZ   PHE   6           HZ       PHE   6  -7.065  35.989  -8.266
   67    H    SER   7           HN       SER   7  -8.587  42.883 -11.741
   68    HA   SER   7           HA       SER   7  -9.761  43.870 -14.401
   69    HB2  SER   7           HB1      SER   7 -11.668  43.354 -12.881
   70    HB3  SER   7           HB2      SER   7 -10.981  44.375 -11.610
   71    HG   SER   7           HG       SER   7 -11.111  46.128 -13.059
   72    H    TYR   8           HN       TYR   8  -7.590  44.544 -14.655
   73    HA   TYR   8           HA       TYR   8  -6.876  47.133 -13.156
   74    HB2  TYR   8           HB2      TYR   8  -4.907  45.015 -14.244
   75    HB3  TYR   8           HB1      TYR   8  -4.448  46.572 -13.613
   76    HD1  TYR   8           HD1      TYR   8  -4.882  47.150 -11.139
   77    HD2  TYR   8           HD2      TYR   8  -5.443  43.186 -12.699
   78    HE1  TYR   8           HE1      TYR   8  -4.749  46.231  -8.862
   79    HE2  TYR   8           HE2      TYR   8  -5.300  42.272 -10.418
   80    HH   TYR   8           HH       TYR   8  -4.950  42.717  -8.278
   81    H    ILE   9           HN       ILE   9  -6.059  48.772 -14.308
   82    HA   ILE   9           HA       ILE   9  -6.838  48.896 -17.210
   83    HB   ILE   9           HB       ILE   9  -5.694  51.102 -15.421
   84   HG12  ILE   9          2HG1      ILE   9  -8.615  50.724 -16.366
   85   HG13  ILE   9          1HG1      ILE   9  -8.048  50.208 -14.793
   86   HG21  ILE   9          1HG2      ILE   9  -6.946  51.326 -18.249
   87   HG22  ILE   9          2HG2      ILE   9  -5.225  51.545 -17.866
   88   HG23  ILE   9          3HG2      ILE   9  -6.406  52.692 -17.240
   89   HD11  ILE   9          3HD1      ILE   9  -9.131  52.374 -14.533
   90   HD12  ILE   9          1HD1      ILE   9  -7.396  52.566 -14.184
   91   HD13  ILE   9          2HD1      ILE   9  -8.068  53.134 -15.737
   92    H    SER  10           HN       SER  10  -5.467  47.736 -18.357
   93    HA   SER  10           HA       SER  10  -2.445  48.117 -18.142
   94    HB2  SER  10           HB2      SER  10  -3.342  45.770 -18.046
   95    HB3  SER  10           HB1      SER  10  -4.054  45.966 -19.654
   96    HG   SER  10           HG       SER  10  -1.843  46.613 -20.287
   97    H    ASP  11           HN       ASP  11  -1.275  48.803 -19.820
   98    HA   ASP  11           HA       ASP  11  -2.424  50.593 -21.832
   99    HB2  ASP  11           HB1      ASP  11   0.452  49.489 -21.643
  100    HB3  ASP  11           HB2      ASP  11  -0.062  50.764 -22.728
  101    H    GLU  12           HN       GLU  12  -3.619  49.800 -23.424
  102    HA   GLU  12           HA       GLU  12  -3.005  47.199 -24.821
  103    HB2  GLU  12           HB2      GLU  12  -5.352  47.803 -24.132
  104    HB3  GLU  12           HB1      GLU  12  -5.322  49.161 -25.238
  105    HG2  GLU  12           HG1      GLU  12  -6.518  47.493 -26.404
  106    HG3  GLU  12           HG2      GLU  12  -4.950  47.483 -27.186
  107    H    GLN  13           HN       GLN  13  -1.053  47.736 -25.805
  108    HA   GLN  13           HA       GLN  13  -0.829  49.911 -27.835
  109    HB2  GLN  13           HB2      GLN  13   1.122  49.116 -26.464
  110    HB3  GLN  13           HB1      GLN  13   1.080  47.564 -27.293
  111    HG2  GLN  13           HG2      GLN  13   1.454  48.825 -29.522
  112    HG3  GLN  13           HG1      GLN  13   1.578  50.319 -28.609
  113   HE21  GLN  13          1HE2      GLN  13   3.263  47.540 -29.674
  114   HE22  GLN  13          2HE2      GLN  13   4.846  47.893 -28.815
  115    H    TRP  14           HN       TRP  14  -0.755  46.325 -28.136
  116    HA   TRP  14           HA       TRP  14  -1.601  46.551 -31.063
  117    HB2  TRP  14           HB1      TRP  14  -0.306  44.264 -29.434
  118    HB3  TRP  14           HB2      TRP  14  -1.145  43.932 -30.930
  119    HD1  TRP  14           HD1      TRP  14   2.226  45.294 -29.737
  120    HE1  TRP  14           HE1      TRP  14   3.776  45.937 -31.779
  121    HE3  TRP  14           HE3      TRP  14  -1.398  44.998 -33.306
  122    HZ2  TRP  14           HZ2      TRP  14   3.274  46.260 -34.590
  123    HZ3  TRP  14           HZ3      TRP  14  -0.819  45.490 -35.657
  124    HH2  TRP  14           HH2      TRP  14   1.481  46.108 -36.292
  125    H    THR  15           HN       THR  15  -3.557  46.060 -31.646
  126    HA   THR  15           HA       THR  15  -5.703  45.472 -29.697
  127    HB   THR  15           HB       THR  15  -5.823  45.650 -32.754
  128    HG1  THR  15           HG1      THR  15  -5.266  47.470 -31.273
  129   HG21  THR  15          3HG2      THR  15  -8.295  46.003 -32.436
  130   HG22  THR  15          1HG2      THR  15  -8.140  45.621 -30.700
  131   HG23  THR  15          2HG2      THR  15  -7.824  44.368 -31.926
  132    HA   PRO  16           HA       PRO  16  -4.875  40.921 -29.902
  133    HB2  PRO  16           HB1      PRO  16  -7.679  40.848 -28.658
  134    HB3  PRO  16           HB2      PRO  16  -6.241  39.901 -28.226
  135    HG2  PRO  16           HG1      PRO  16  -6.900  42.093 -26.764
  136    HG3  PRO  16           HG2      PRO  16  -5.191  41.833 -27.197
  137    HD2  PRO  16           HD1      PRO  16  -7.180  43.770 -28.482
  138    HD3  PRO  16           HD2      PRO  16  -5.457  43.976 -28.095
  139    H    PHE  17           HN       PHE  17  -4.902  40.392 -31.989
  140    HA   PHE  17           HA       PHE  17  -7.394  40.193 -33.644
  141    HB2  PHE  17           HB2      PHE  17  -4.544  39.352 -34.420
  142    HB3  PHE  17           HB1      PHE  17  -5.910  39.455 -35.500
  143    HD1  PHE  17           HD2      PHE  17  -7.218  41.934 -35.323
  144    HD2  PHE  17           HD1      PHE  17  -3.046  41.204 -34.555
  145    HE1  PHE  17           HE2      PHE  17  -6.716  44.301 -35.749
  146    HE2  PHE  17           HE1      PHE  17  -2.560  43.569 -35.008
  147    HZ   PHE  17           HZ       PHE  17  -4.389  45.126 -35.596
  148    H    LEU  18           HN       LEU  18  -5.066  37.838 -32.308
  149    HA   LEU  18           HA       LEU  18  -6.623  35.471 -33.288
  150    HB2  LEU  18           HB1      LEU  18  -4.259  35.692 -31.317
  151    HB3  LEU  18           HB2      LEU  18  -4.950  34.170 -31.830
  152    HG   LEU  18           HG       LEU  18  -3.673  36.174 -33.789
  153   HD11  LEU  18          3HD2      LEU  18  -1.690  34.667 -33.785
  154   HD12  LEU  18          1HD2      LEU  18  -2.437  33.643 -32.531
  155   HD13  LEU  18          2HD2      LEU  18  -1.984  35.326 -32.164
  156   HD21  LEU  18          1HD1      LEU  18  -3.635  34.237 -35.391
  157   HD22  LEU  18          2HD1      LEU  18  -5.297  34.635 -34.930
  158   HD23  LEU  18          3HD1      LEU  18  -4.497  33.219 -34.207
  159    H    TYR  19           HN       TYR  19  -7.511  33.910 -31.915
  160    HA   TYR  19           HA       TYR  19  -9.358  35.074 -29.925
  161    HB2  TYR  19           HB2      TYR  19  -8.986  32.155 -30.834
  162    HB3  TYR  19           HB1      TYR  19 -10.158  32.633 -29.640
  163    HD1  TYR  19           HD2      TYR  19 -12.093  34.175 -30.234
  164    HD2  TYR  19           HD1      TYR  19  -9.371  32.746 -33.244
  165    HE1  TYR  19           HE2      TYR  19 -13.698  34.788 -31.974
  166    HE2  TYR  19           HE1      TYR  19 -10.980  33.387 -34.986
  167    HH   TYR  19           HH       TYR  19 -12.963  34.277 -35.426
  168    H    ASP  20           HN       ASP  20  -9.137  35.225 -27.903
  169    HA   ASP  20           HA       ASP  20  -6.806  34.277 -26.322
  170    HB2  ASP  20           HB1      ASP  20  -7.885  35.498 -24.434
  171    HB3  ASP  20           HB2      ASP  20  -7.673  36.468 -25.864
  172    H    PHE  21           HN       PHE  21  -7.136  33.177 -24.186
  173    HA   PHE  21           HA       PHE  21  -8.454  30.552 -24.674
  174    HB2  PHE  21           HB1      PHE  21  -6.170  30.784 -23.680
  175    HB3  PHE  21           HB2      PHE  21  -6.845  31.525 -22.248
  176    HD1  PHE  21           HD2      PHE  21  -6.999  28.364 -24.336
  177    HD2  PHE  21           HD1      PHE  21  -7.648  30.090 -20.447
  178    HE1  PHE  21           HE2      PHE  21  -7.354  26.121 -23.389
  179    HE2  PHE  21           HE1      PHE  21  -7.996  27.841 -19.517
  180    HZ   PHE  21           HZ       PHE  21  -7.846  25.853 -20.980
  181    H    TYR  22           HN       TYR  22 -10.615  31.049 -24.721
  182    HA   TYR  22           HA       TYR  22 -12.005  31.548 -22.035
  183    HB2  TYR  22           HB2      TYR  22 -13.760  32.803 -23.104
  184    HB3  TYR  22           HB1      TYR  22 -12.236  33.542 -23.467
  185    HD1  TYR  22           HD1      TYR  22 -11.382  33.600 -25.817
  186    HD2  TYR  22           HD2      TYR  22 -15.073  31.620 -24.921
  187    HE1  TYR  22           HE1      TYR  22 -11.828  33.376 -28.200
  188    HE2  TYR  22           HE2      TYR  22 -15.561  31.461 -27.334
  189    HH   TYR  22           HH       TYR  22 -14.840  31.846 -29.380
  190    H    HIS  23           HN       HIS  23 -14.116  30.644 -21.852
  191    HA   HIS  23           HA       HIS  23 -14.541  28.036 -23.428
  192    HB2  HIS  23           HB2      HIS  23 -15.387  26.917 -21.445
  193    HB3  HIS  23           HB1      HIS  23 -13.697  27.321 -21.363
  194    HD1  HIS  23           HD1      HIS  23 -12.880  29.014 -19.373
  195    HD2  HIS  23           HD2      HIS  23 -17.086  28.165 -19.624
  196    HE1  HIS  23           HE1      HIS  23 -14.085  29.784 -17.229
  197    HE2  HIS  23           HE2      HIS  23 -16.624  29.333 -17.287
  198    H    TYR  24           HN       TYR  24 -15.796  29.229 -24.858
  199    HA   TYR  24           HA       TYR  24 -18.686  29.292 -24.105
  200    HB2  TYR  24           HB1      TYR  24 -17.944  31.567 -23.334
  201    HB3  TYR  24           HB2      TYR  24 -17.279  31.920 -24.906
  202    HD1  TYR  24           HD1      TYR  24 -20.627  30.556 -23.647
  203    HD2  TYR  24           HD2      TYR  24 -18.603  33.505 -26.051
  204    HE1  TYR  24           HE1      TYR  24 -22.786  31.465 -24.365
  205    HE2  TYR  24           HE2      TYR  24 -20.773  34.432 -26.718
  206    HH   TYR  24           HH       TYR  24 -23.000  34.036 -26.759
  207    H1   PCA   1           HN       PCA   1 -27.584  32.497 -33.327
  208    HA   PCA   1           HA       PCA   1 -25.971  31.044 -31.679
  209    HB2  PCA   1           HB2      PCA   1 -24.131  30.068 -32.843
  210    HB3  PCA   1           HB1      PCA   1 -24.052  31.371 -34.044
  211    HG2  PCA   1           HG2      PCA   1 -25.263  29.867 -35.392
  212    HG3  PCA   1           HG1      PCA   1 -25.979  29.021 -33.985
  213    H    LEU   2           HN       LEU   2 -25.892  32.727 -30.344
  214    HA   LEU   2           HA       LEU   2 -24.693  35.402 -31.113
  215    HB2  LEU   2           HB2      LEU   2 -25.419  36.090 -28.759
  216    HB3  LEU   2           HB1      LEU   2 -26.594  35.842 -30.014
  217    HG   LEU   2           HG       LEU   2 -27.321  33.676 -29.051
  218   HD11  LEU   2          2HD1      LEU   2 -26.621  32.923 -26.781
  219   HD12  LEU   2          3HD1      LEU   2 -25.234  32.901 -27.882
  220   HD13  LEU   2          1HD1      LEU   2 -25.410  34.225 -26.698
  221   HD21  LEU   2          1HD2      LEU   2 -27.358  35.985 -27.007
  222   HD22  LEU   2          2HD2      LEU   2 -28.496  34.615 -27.073
  223   HD23  LEU   2          3HD2      LEU   2 -28.461  35.799 -28.394
  224    H    TYR   3           HN       TYR   3 -22.638  34.189 -31.497
  225    HA   TYR   3           HA       TYR   3 -20.919  34.025 -28.940
  226    HB2  TYR   3           HB2      TYR   3 -20.633  32.404 -31.535
  227    HB3  TYR   3           HB1      TYR   3 -19.443  32.452 -30.260
  228    HD1  TYR   3           HD1      TYR   3 -22.864  31.269 -31.115
  229    HD2  TYR   3           HD2      TYR   3 -19.822  31.314 -28.081
  230    HE1  TYR   3           HE1      TYR   3 -24.068  29.521 -29.881
  231    HE2  TYR   3           HE2      TYR   3 -21.033  29.566 -26.850
  232    HH   TYR   3           HH       TYR   3 -24.068  28.188 -28.105
  233    H    GLU   4           HN       GLU   4 -20.585  36.227 -29.058
  234    HA   GLU   4           HA       GLU   4 -18.691  37.198 -31.276
  235    HB2  GLU   4           HB1      GLU   4 -20.882  38.487 -30.936
  236    HB3  GLU   4           HB2      GLU   4 -20.336  38.916 -29.321
  237    HG2  GLU   4           HG2      GLU   4 -18.159  39.857 -30.559
  238    HG3  GLU   4           HG1      GLU   4 -19.088  39.684 -32.040
  239    H    ASN   5           HN       ASN   5 -16.692  36.791 -30.583
  240    HA   ASN   5           HA       ASN   5 -15.915  36.924 -27.694
  241    HB2  ASN   5           HB2      ASN   5 -14.866  35.219 -29.205
  242    HB3  ASN   5           HB1      ASN   5 -14.079  36.494 -30.123
  243   HD21  ASN   5          1HD2      ASN   5 -12.009  36.860 -29.429
  244   HD22  ASN   5          2HD2      ASN   5 -11.402  36.584 -27.719
  245    H    LYS   6           HN       LYS   6 -15.099  38.581 -26.725
  246    HA   LYS   6           HA       LYS   6 -14.746  41.242 -28.108
  247    HB2  LYS   6           HB2      LYS   6 -14.536  40.628 -25.099
  248    HB3  LYS   6           HB1      LYS   6 -14.557  42.216 -25.836
  249    HG2  LYS   6           HG1      LYS   6 -16.884  40.208 -25.770
  250    HG3  LYS   6           HG2      LYS   6 -16.723  41.669 -24.809
  251    HD2  LYS   6           HD2      LYS   6 -16.828  43.070 -26.932
  252    HD3  LYS   6           HD1      LYS   6 -17.030  41.594 -27.886
  253    HE2  LYS   6           HE2      LYS   6 -19.159  41.037 -26.686
  254    HE3  LYS   6           HE1      LYS   6 -18.975  42.457 -25.640
  255    HZ1  LYS   6           HZ1      LYS   6 -19.271  42.537 -28.597
  256    HZ2  LYS   6           HZ2      LYS   6 -20.451  42.906 -27.504
  257    HZ3  LYS   6           HZ3      LYS   6 -19.105  43.864 -27.632
  258    HA   PRO   7           HA       PRO   7 -10.241  40.666 -28.268
  259    HB2  PRO   7           HB2      PRO   7  -9.328  43.255 -28.555
  260    HB3  PRO   7           HB1      PRO   7 -10.249  42.395 -29.794
  261    HG2  PRO   7           HG1      PRO   7 -11.320  44.372 -27.703
  262    HG3  PRO   7           HG2      PRO   7 -11.594  44.403 -29.463
  263    HD2  PRO   7           HD2      PRO   7 -13.442  43.293 -27.752
  264    HD3  PRO   7           HD1      PRO   7 -13.137  42.543 -29.349
  265    H    ARG   8           HN       ARG   8 -10.107  39.764 -26.200
  266    HA   ARG   8           HA       ARG   8  -9.350  41.494 -23.827
  267    HB2  ARG   8           HB1      ARG   8 -11.070  39.730 -23.552
  268    HB3  ARG   8           HB2      ARG   8  -9.932  38.492 -24.061
  269    HG2  ARG   8           HG2      ARG   8  -8.470  38.990 -22.051
  270    HG3  ARG   8           HG1      ARG   8  -9.565  40.276 -21.571
  271    HD2  ARG   8           HD1      ARG   8  -9.995  38.323 -20.203
  272    HD3  ARG   8           HD2      ARG   8 -11.415  38.614 -21.206
  273    HE   ARG   8           HE       ARG   8 -10.367  36.777 -22.831
  274   HH11  ARG   8          1HH1      ARG   8 -10.026  36.618 -19.295
  275   HH12  ARG   8          2HH1      ARG   8  -9.863  34.791 -19.400
  276   HH21  ARG   8          1HH2      ARG   8 -10.171  34.745 -22.817
  277   HH22  ARG   8          2HH2      ARG   8  -9.937  33.799 -21.263
  278    H    ARG   9           HN       ARG   9  -7.321  41.999 -23.717
  279    HA   ARG   9           HA       ARG   9  -5.104  40.724 -25.099
  280    HB2  ARG   9           HB2      ARG   9  -3.624  42.283 -23.952
  281    HB3  ARG   9           HB1      ARG   9  -4.981  43.029 -24.756
  282    HG2  ARG   9           HG1      ARG   9  -6.156  43.368 -22.556
  283    HG3  ARG   9           HG2      ARG   9  -4.829  42.616 -21.691
  284    HD2  ARG   9           HD2      ARG   9  -4.518  45.173 -23.413
  285    HD3  ARG   9           HD1      ARG   9  -4.912  45.171 -21.718
  286    HE   ARG   9           HE       ARG   9  -2.702  44.422 -21.091
  287   HH11  ARG   9          2HH1      ARG   9  -2.931  44.726 -24.623
  288   HH12  ARG   9          1HH1      ARG   9  -1.102  44.819 -24.742
  289   HH21  ARG   9          2HH2      ARG   9  -0.643  44.544 -21.354
  290   HH22  ARG   9          1HH2      ARG   9   0.095  44.728 -23.025
  291    HA   PRO  10           HA       PRO  10  -4.253  37.628 -21.721
  292    HB2  PRO  10           HB2      PRO  10  -2.111  36.624 -23.624
  293    HB3  PRO  10           HB1      PRO  10  -3.404  35.737 -22.802
  294    HG2  PRO  10           HG1      PRO  10  -3.578  36.303 -25.468
  295    HG3  PRO  10           HG2      PRO  10  -5.031  36.435 -24.445
  296    HD2  PRO  10           HD2      PRO  10  -3.167  38.724 -25.345
  297    HD3  PRO  10           HD1      PRO  10  -4.945  38.606 -25.436
  298    H    TYR  11           HN       TYR  11  -3.480  39.343 -20.426
  299    HA   TYR  11           HA       TYR  11  -0.442  39.654 -20.256
  300    HB2  TYR  11           HB2      TYR  11  -1.553  41.582 -21.451
  301    HB3  TYR  11           HB1      TYR  11  -2.560  41.895 -20.059
  302    HD1  TYR  11           HD2      TYR  11   1.077  41.624 -21.118
  303    HD2  TYR  11           HD1      TYR  11  -1.692  43.322 -18.294
  304    HE1  TYR  11           HE2      TYR  11   2.866  43.036 -20.202
  305    HE2  TYR  11           HE1      TYR  11   0.096  44.741 -17.404
  306    HH   TYR  11           HH       TYR  11   2.384  45.013 -17.349
  307    H    ILE  12           HN       ILE  12   0.403  39.611 -18.348
  308    HA   ILE  12           HA       ILE  12  -1.354  39.371 -15.837
  309    HB   ILE  12           HB       ILE  12   0.340  37.797 -14.929
  310   HG12  ILE  12          2HG1      ILE  12   1.411  37.426 -17.797
  311   HG13  ILE  12          1HG1      ILE  12   2.255  38.359 -16.586
  312   HG21  ILE  12          2HG2      ILE  12  -1.125  36.780 -17.437
  313   HG22  ILE  12          3HG2      ILE  12  -1.859  37.042 -15.836
  314   HG23  ILE  12          1HG2      ILE  12  -0.613  35.800 -16.041
  315   HD11  ILE  12          1HD1      ILE  12   2.443  36.336 -15.086
  316   HD12  ILE  12          2HD1      ILE  12   1.656  35.355 -16.354
  317   HD13  ILE  12          3HD1      ILE  12   3.227  36.120 -16.670
  318    H    LEU  13           HN       LEU  13  -1.062  41.730 -15.864
  319    HA   LEU  13           HA       LEU  13  -0.203  43.667 -14.926
  320    HB2  LEU  13           HB2      LEU  13   0.642  41.576 -12.879
  321    HB3  LEU  13           HB1      LEU  13   1.001  43.251 -12.572
  322    HG   LEU  13           HG       LEU  13  -1.861  42.316 -13.181
  323   HD11  LEU  13          1HD2      LEU  13  -0.525  42.641 -10.418
  324   HD12  LEU  13          2HD2      LEU  13  -1.079  41.116 -11.156
  325   HD13  LEU  13          3HD2      LEU  13  -2.261  42.360 -10.711
  326   HD21  LEU  13          2HD1      LEU  13  -1.510  44.780 -13.496
  327   HD22  LEU  13          3HD1      LEU  13  -0.762  44.906 -11.885
  328   HD23  LEU  13          1HD1      LEU  13  -2.479  44.489 -12.047