*HEADER    STRUCTURAL GENOMICS, UNKNOWN FUNCTION   21-JUN-06   2HEP              
*TITLE     SOLUTION NMR STRUCTURE OF THE UPF0291 PROTEIN YNZC FROM               
*TITLE    2 BACILLUS SUBTILIS. NORTHEAST STRUCTURAL GENOMICS TARGET              
*TITLE    3 SR384.                                                               
*COMPND    MOL_ID: 1;                                                            
*COMPND   2 MOLECULE: UPF0291 PROTEIN YNZC;                                      
*COMPND   3 CHAIN: A;                                                            
*COMPND   4 ENGINEERED: YES                                                      
*SOURCE    MOL_ID: 1;                                                            
*SOURCE   2 ORGANISM_SCIENTIFIC: BACILLUS SUBTILIS;                              
*SOURCE   3 ORGANISM_COMMON: BACTERIA;                                           
*SOURCE   4 GENE: YNZC;                                                          
*SOURCE   5 EXPRESSION_SYSTEM: ESCHERICHIA COLI;                                 
*SOURCE   6 EXPRESSION_SYSTEM_COMMON: BACTERIA;                                  
*SOURCE   7 EXPRESSION_SYSTEM_STRAIN: BL21(DE3)MGK;                              
*SOURCE   8 EXPRESSION_SYSTEM_VECTOR_TYPE: PLASMID;                              
*SOURCE   9 EXPRESSION_SYSTEM_PLASMID: PET21, SR384-21.4                         
*KEYWDS    SR384, NMR STRUCTURE, AUTOSTRUCTURE, NORTHEAST STRUCTURAL             
*KEYWDS   2 GENOMICS CONSORTIUM, PSI-1, PROTEIN STRUCTURE INITIATIVE,            
*KEYWDS   3 NESG                                                                 
*EXPDTA    NMR, 20 STRUCTURES                                                    
*AUTHOR    J.M.ARAMINI, G.V.T.SWAPNA, C.K.HO, K.SHETTY, K.CUNNINGHAM,            
*AUTHOR   2 L.-C.MA, R.XIAO, J.LIU, M.BARAN, T.B.ACTON, B.ROST,                  
*AUTHOR   3 G.T.MONTELIONE, NORTHEAST STRUCTURAL GENOMICS CONSORTIUM             
*AUTHOR   4 (NESG)                                                               
*REVDAT   1   15-AUG-06 2HEP    0                                                


! final combined constraints used in the XPLOR structure calculations for SR384

! distance constraints; sum averaging
assign (resid 2 and name HA )(resid 2 and name HG1# ) 4.0 2.2 1
assign (resid 2 and name HA )(resid 2 and name HG2# ) 4.0 2.2 1
assign (resid 2 and name HA )(resid 2 and name HD1# ) 4.0 2.2 1
assign (resid 2 and name HA )(resid 3 and name HN ) 4.0 2.2 1
assign (resid 2 and name HB )(resid 2 and name HD1# ) 4.0 2.2 1
assign (resid 2 and name HB )(resid 3 and name HN ) 4.0 2.2 1
assign (resid 2 and name HG1# )(resid 2 and name HG2# ) 4.0 2.2 1
assign (resid 2 and name HG12 )(resid 3 and name HN ) 4.0 2.2 1
assign (resid 2 and name HG11 )(resid 3 and name HN ) 4.0 2.2 1
assign (resid 2 and name HG1# )(resid 6 and name HB# ) 4.0 2.2 1
assign (resid 2 and name HG2# )(resid 3 and name HN ) 4.0 2.2 1
assign (resid 2 and name HG2# )(resid 4 and name HD22 ) 4.0 2.2 1
assign (resid 2 and name HG2# )(resid 6 and name HB# ) 4.0 2.2 1
assign (resid 2 and name HG2# )(resid 6 and name HD# ) 4.0 2.2 1
assign (resid 2 and name HG2# )(resid 7 and name HN ) 4.0 2.2 1
assign (resid 2 and name HG2# )(resid 7 and name HG1# ) 4.0 2.2 1
assign (resid 2 and name HD1# )(resid 4 and name HD22 ) 4.0 2.2 1
assign (resid 2 and name HD1# )(resid 6 and name HB# ) 4.0 2.2 1
assign (resid 3 and name HN )(resid 3 and name HA ) 4.0 2.2 1
assign (resid 3 and name HN )(resid 3 and name HB2 ) 4.0 2.2 1
assign (resid 3 and name HN )(resid 3 and name HB1 ) 4.0 2.2 1
assign (resid 4 and name HA )(resid 7 and name HN ) 4.0 2.2 1
assign (resid 4 and name HB# )(resid 4 and name HD21 ) 4.0 2.2 1
assign (resid 4 and name HB# )(resid 4 and name HD22 ) 4.0 2.2 1
assign (resid 4 and name HD22 )(resid 7 and name HD1# ) 4.0 2.2 1
assign (resid 5 and name HA )(resid 8 and name HN ) 4.0 2.2 1
assign (resid 5 and name HA )(resid 8 and name HB# ) 4.0 2.2 1
assign (resid 5 and name HA )(resid 9 and name HN ) 4.0 2.2 1
assign (resid 5 and name HB# )(resid 6 and name HN ) 4.0 2.2 1
assign (resid 6 and name HN )(resid 6 and name HA ) 4.0 2.2 1
assign (resid 6 and name HN )(resid 6 and name HB2 ) 4.0 2.2 1
assign (resid 6 and name HN )(resid 6 and name HB1 ) 4.0 2.2 1
assign (resid 6 and name HN )(resid 6 and name HG2 ) 4.0 2.2 1
assign (resid 6 and name HN )(resid 6 and name HG1 ) 4.0 2.2 1
assign (resid 6 and name HN )(resid 7 and name HN ) 3.0 1.2 0.5
assign (resid 6 and name HN )(resid 7 and name HB ) 4.0 2.2 1
assign (resid 6 and name HA )(resid 6 and name HG2 ) 4.0 2.2 1
assign (resid 6 and name HA )(resid 6 and name HG1 ) 4.0 2.2 1
assign (resid 6 and name HA )(resid 6 and name HD2 ) 4.0 2.2 1
assign (resid 6 and name HA )(resid 6 and name HD1 ) 4.0 2.2 1
assign (resid 6 and name HA )(resid 9 and name HN ) 4.0 2.2 1
assign (resid 6 and name HA )(resid 9 and name HB2 ) 4.0 2.2 1
assign (resid 6 and name HA )(resid 9 and name HB1 ) 4.0 2.2 1
assign (resid 6 and name HA )(resid 10 and name HN ) 4.0 2.2 1
assign (resid 6 and name HB# )(resid 6 and name HD# ) 4.0 2.2 1
assign (resid 6 and name HB# )(resid 7 and name HN ) 4.0 2.2 1
assign (resid 6 and name HB# )(resid 7 and name HB ) 4.0 2.2 1
assign (resid 6 and name HB# )(resid 7 and name HD1# ) 4.0 2.2 1
assign (resid 6 and name HG2 )(resid 6 and name HE# ) 4.0 2.2 1
assign (resid 6 and name HG1 )(resid 6 and name HE# ) 4.0 2.2 1
assign (resid 7 and name HN )(resid 7 and name HA ) 4.0 2.2 1
assign (resid 7 and name HN )(resid 7 and name HB ) 4.0 2.2 1
assign (resid 7 and name HN )(resid 7 and name HG12 ) 4.0 2.2 1
assign (resid 7 and name HN )(resid 7 and name HG11 ) 4.0 2.2 1
assign (resid 7 and name HN )(resid 7 and name HG2# ) 4.0 2.2 1
assign (resid 7 and name HN )(resid 7 and name HD1# ) 4.0 2.2 1
assign (resid 7 and name HN )(resid 8 and name HN ) 4.0 2.2 1
assign (resid 7 and name HN )(resid 9 and name HN ) 4.0 2.2 1
assign (resid 7 and name HA )(resid 7 and name HG12 ) 4.0 2.2 1
assign (resid 7 and name HA )(resid 7 and name HG11 ) 4.0 2.2 1
assign (resid 7 and name HA )(resid 7 and name HG2# ) 4.0 2.2 1
assign (resid 7 and name HA )(resid 7 and name HD1# ) 4.0 2.2 1
assign (resid 7 and name HA )(resid 8 and name HN ) 4.0 2.2 1
assign (resid 7 and name HA )(resid 10 and name HN ) 4.0 2.2 1
assign (resid 7 and name HA )(resid 10 and name HB ) 4.0 2.2 1
assign (resid 7 and name HA )(resid 10 and name HD1# ) 4.0 2.2 1
assign (resid 7 and name HA )(resid 11 and name HN ) 4.0 2.2 1
assign (resid 7 and name HB )(resid 7 and name HD1# ) 4.0 2.2 1
assign (resid 7 and name HB )(resid 8 and name HN ) 4.0 2.2 1
assign (resid 7 and name HG12 )(resid 7 and name HG2# ) 4.0 2.2 1
assign (resid 7 and name HG11 )(resid 7 and name HG2# ) 4.0 2.2 1
assign (resid 7 and name HG2# )(resid 7 and name HD1# ) 4.0 2.2 1
assign (resid 7 and name HG2# )(resid 8 and name HN ) 4.0 2.2 1
assign (resid 7 and name HG2# )(resid 8 and name HA ) 4.0 2.2 1
assign (resid 7 and name HG2# )(resid 9 and name HN ) 4.0 2.2 1
assign (resid 7 and name HG2# )(resid 11 and name HN ) 4.0 2.2 1
assign (resid 7 and name HG2# )(resid 11 and name HD21 ) 4.0 2.2 1
assign (resid 7 and name HG2# )(resid 11 and name HD22 ) 4.0 2.2 1
assign (resid 7 and name HD1# )(resid 37 and name HE# ) 4.0 2.2 1
assign (resid 8 and name HN )(resid 8 and name HA ) 4.0 2.2 1
assign (resid 8 and name HN )(resid 8 and name HB# ) 4.0 2.2 1
assign (resid 8 and name HN )(resid 9 and name HN ) 3.0 1.2 0.5
assign (resid 8 and name HA )(resid 9 and name HN ) 4.0 2.2 1
assign (resid 8 and name HA )(resid 11 and name HN ) 4.0 2.2 1
assign (resid 8 and name HA )(resid 11 and name HB2 ) 4.0 2.2 1
assign (resid 8 and name HA )(resid 11 and name HB1 ) 4.0 2.2 1
assign (resid 8 and name HA )(resid 11 and name HD21 ) 4.0 2.2 1
assign (resid 8 and name HA )(resid 11 and name HD22 ) 4.0 2.2 1
assign (resid 8 and name HB# )(resid 9 and name HN ) 4.0 2.2 1
assign (resid 9 and name HN )(resid 9 and name HA ) 4.0 2.2 1
assign (resid 9 and name HN )(resid 9 and name HB2 ) 4.0 2.2 1
assign (resid 9 and name HN )(resid 9 and name HB1 ) 4.0 2.2 1
assign (resid 9 and name HN )(resid 9 and name HG# ) 4.0 2.2 1
assign (resid 9 and name HN )(resid 10 and name HN ) 3.0 1.2 0.5
assign (resid 9 and name HN )(resid 10 and name HG1# ) 4.0 2.2 1
assign (resid 9 and name HA )(resid 9 and name HD2 ) 4.0 2.2 1
assign (resid 9 and name HA )(resid 9 and name HD1 ) 4.0 2.2 1
assign (resid 9 and name HA )(resid 10 and name HN ) 4.0 2.2 1
assign (resid 9 and name HA )(resid 12 and name HN ) 4.0 2.2 1
assign (resid 9 and name HA )(resid 12 and name HB# ) 4.0 2.2 1
assign (resid 9 and name HB2 )(resid 9 and name HD2 ) 4.0 2.2 1
assign (resid 9 and name HB2 )(resid 9 and name HD1 ) 4.0 2.2 1
assign (resid 9 and name HB1 )(resid 9 and name HD2 ) 4.0 2.2 1
assign (resid 9 and name HB1 )(resid 9 and name HD1 ) 4.0 2.2 1
assign (resid 9 and name HB# )(resid 10 and name HN ) 4.0 2.2 1
assign (resid 9 and name HG# )(resid 10 and name HG1# ) 4.0 2.2 1
assign (resid 9 and name HD# )(resid 10 and name HA ) 4.0 2.2 1
assign (resid 10 and name HN )(resid 10 and name HA ) 4.0 2.2 1
assign (resid 10 and name HN )(resid 10 and name HB ) 4.0 2.2 1
assign (resid 10 and name HN )(resid 10 and name HG12 ) 4.0 2.2 1
assign (resid 10 and name HN )(resid 10 and name HG11 ) 4.0 2.2 1
assign (resid 10 and name HN )(resid 10 and name HG2# ) 4.0 2.2 1
assign (resid 10 and name HN )(resid 10 and name HD1# ) 4.0 2.2 1
assign (resid 10 and name HN )(resid 11 and name HN ) 3.0 1.2 0.5
assign (resid 10 and name HA )(resid 10 and name HG12 ) 4.0 2.2 1
assign (resid 10 and name HA )(resid 10 and name HG11 ) 4.0 2.2 1
assign (resid 10 and name HA )(resid 10 and name HG2# ) 4.0 2.2 1
assign (resid 10 and name HA )(resid 10 and name HD1# ) 4.0 2.2 1
assign (resid 10 and name HA )(resid 11 and name HN ) 4.0 2.2 1
assign (resid 10 and name HA )(resid 13 and name HN ) 4.0 2.2 1
assign (resid 10 and name HA )(resid 13 and name HB# ) 4.0 2.2 1
assign (resid 10 and name HA )(resid 33 and name HD1# ) 4.0 2.2 1
assign (resid 10 and name HB )(resid 10 and name HD1# ) 4.0 2.2 1
assign (resid 10 and name HB )(resid 11 and name HN ) 4.0 2.2 1
assign (resid 10 and name HG12 )(resid 10 and name HG2# ) 4.0 2.2 1
assign (resid 10 and name HG11 )(resid 10 and name HG2# ) 4.0 2.2 1
assign (resid 10 and name HG12 )(resid 33 and name HB2 ) 4.0 2.2 1
assign (resid 10 and name HG12 )(resid 33 and name HB1 ) 4.0 2.2 1
assign (resid 10 and name HG11 )(resid 33 and name HB2 ) 4.0 2.2 1
assign (resid 10 and name HG11 )(resid 33 and name HB1 ) 4.0 2.2 1
assign (resid 10 and name HG12 )(resid 33 and name HD1# ) 4.0 2.2 1
assign (resid 10 and name HG11 )(resid 33 and name HD1# ) 4.0 2.2 1
assign (resid 10 and name HG2# )(resid 10 and name HD1# ) 4.0 2.2 1
assign (resid 10 and name HG2# )(resid 11 and name HN ) 4.0 2.2 1
assign (resid 10 and name HG2# )(resid 14 and name HB# ) 4.0 2.2 1
assign (resid 10 and name HD1# )(resid 33 and name HB2 ) 4.0 2.2 1
assign (resid 10 and name HD1# )(resid 33 and name HB1 ) 4.0 2.2 1
assign (resid 10 and name HD1# )(resid 34 and name HA ) 4.0 2.2 1
assign (resid 10 and name HD1# )(resid 37 and name HB2 ) 4.0 2.2 1
assign (resid 10 and name HD1# )(resid 37 and name HB1 ) 4.0 2.2 1
assign (resid 10 and name HD1# )(resid 37 and name HD# ) 4.0 2.2 1
assign (resid 11 and name HN )(resid 11 and name HA ) 4.0 2.2 1
assign (resid 11 and name HN )(resid 11 and name HB2 ) 4.0 2.2 1
assign (resid 11 and name HN )(resid 11 and name HB1 ) 4.0 2.2 1
assign (resid 11 and name HN )(resid 12 and name HN ) 3.0 1.2 0.5
assign (resid 11 and name HA )(resid 12 and name HN ) 4.0 2.2 1
assign (resid 11 and name HA )(resid 14 and name HN ) 4.0 2.2 1
assign (resid 11 and name HA )(resid 14 and name HB# ) 4.0 2.2 1
assign (resid 11 and name HB2 )(resid 11 and name HD21 ) 4.0 2.2 1
assign (resid 11 and name HB2 )(resid 11 and name HD22 ) 4.0 2.2 1
assign (resid 11 and name HB1 )(resid 11 and name HD21 ) 4.0 2.2 1
assign (resid 11 and name HB1 )(resid 11 and name HD22 ) 4.0 2.2 1
assign (resid 11 and name HB2 )(resid 12 and name HN ) 4.0 2.2 1
assign (resid 11 and name HB1 )(resid 12 and name HN ) 4.0 2.2 1
assign (resid 11 and name HD21 )(resid 12 and name HB# ) 4.0 2.2 1
assign (resid 11 and name HD22 )(resid 12 and name HB# ) 4.0 2.2 1
assign (resid 12 and name HN )(resid 12 and name HA ) 4.0 2.2 1
assign (resid 12 and name HN )(resid 12 and name HB2 ) 4.0 2.2 1
assign (resid 12 and name HN )(resid 12 and name HB1 ) 4.0 2.2 1
assign (resid 12 and name HN )(resid 12 and name HG2 ) 4.0 2.2 1
assign (resid 12 and name HN )(resid 12 and name HG1 ) 4.0 2.2 1
assign (resid 12 and name HN )(resid 13 and name HN ) 3.0 1.2 0.5
assign (resid 12 and name HA )(resid 12 and name HG2 ) 4.0 2.2 1
assign (resid 12 and name HA )(resid 12 and name HG1 ) 4.0 2.2 1
assign (resid 12 and name HA )(resid 13 and name HN ) 4.0 2.2 1
assign (resid 12 and name HA )(resid 15 and name HN ) 4.0 2.2 1
assign (resid 12 and name HA )(resid 15 and name HB# ) 4.0 2.2 1
assign (resid 12 and name HB2 )(resid 13 and name HN ) 4.0 2.2 1
assign (resid 12 and name HB1 )(resid 13 and name HN ) 4.0 2.2 1
assign (resid 12 and name HB# )(resid 13 and name HB# ) 4.0 2.2 1
assign (resid 12 and name HG# )(resid 16 and name HD# ) 4.0 2.2 1
assign (resid 13 and name HN )(resid 13 and name HA ) 4.0 2.2 1
assign (resid 13 and name HN )(resid 13 and name HB2 ) 4.0 2.2 1
assign (resid 13 and name HN )(resid 13 and name HB1 ) 4.0 2.2 1
assign (resid 13 and name HN )(resid 13 and name HG ) 4.0 2.2 1
assign (resid 13 and name HN )(resid 13 and name HD1# ) 4.0 2.2 1
assign (resid 13 and name HN )(resid 13 and name HD2# ) 4.0 2.2 1
assign (resid 13 and name HN )(resid 14 and name HN ) 3.0 1.2 0.5
assign (resid 13 and name HA )(resid 13 and name HD1# ) 4.0 2.2 1
assign (resid 13 and name HA )(resid 13 and name HD2# ) 4.0 2.2 1
assign (resid 13 and name HA )(resid 14 and name HN ) 4.0 2.2 1
assign (resid 13 and name HA )(resid 16 and name HN ) 4.0 2.2 1
assign (resid 13 and name HA )(resid 16 and name HB# ) 4.0 2.2 1
assign (resid 13 and name HB2 )(resid 13 and name HD1# ) 4.0 2.2 1
assign (resid 13 and name HB2 )(resid 13 and name HD2# ) 4.0 2.2 1
assign (resid 13 and name HB1 )(resid 13 and name HD1# ) 4.0 2.2 1
assign (resid 13 and name HB1 )(resid 13 and name HD2# ) 4.0 2.2 1
assign (resid 13 and name HB2 )(resid 14 and name HN ) 4.0 2.2 1
assign (resid 13 and name HB1 )(resid 14 and name HN ) 4.0 2.2 1
assign (resid 13 and name HD2# )(resid 14 and name HN ) 4.0 2.2 1
assign (resid 13 and name HD2# )(resid 14 and name HA ) 4.0 2.2 1
assign (resid 13 and name HD2# )(resid 17 and name HB# ) 4.0 2.2 1
assign (resid 13 and name HD2# )(resid 26 and name HB2 ) 4.0 2.2 1
assign (resid 13 and name HD2# )(resid 26 and name HB1 ) 4.0 2.2 1
assign (resid 13 and name HD2# )(resid 26 and name HG# ) 4.0 2.2 1
assign (resid 13 and name HD1# )(resid 29 and name HB# ) 4.0 2.2 1
assign (resid 13 and name HD1# )(resid 29 and name HG# ) 4.0 2.2 1
assign (resid 13 and name HD1# )(resid 30 and name HN ) 4.0 2.2 1
assign (resid 13 and name HD1# )(resid 30 and name HA ) 4.0 2.2 1
assign (resid 13 and name HD1# )(resid 30 and name HG# ) 4.0 2.2 1
assign (resid 13 and name HD1# )(resid 30 and name HE22 ) 4.0 2.2 1
assign (resid 14 and name HN )(resid 14 and name HA ) 4.0 2.2 1
assign (resid 14 and name HN )(resid 14 and name HB# ) 4.0 2.2 1
assign (resid 14 and name HN )(resid 15 and name HN ) 3.0 1.2 0.5
assign (resid 14 and name HN )(resid 16 and name HN ) 4.0 2.2 1
assign (resid 14 and name HN )(resid 30 and name HE21 ) 4.0 2.2 1
assign (resid 14 and name HA )(resid 15 and name HN ) 4.0 2.2 1
assign (resid 14 and name HA )(resid 17 and name HN ) 4.0 2.2 1
assign (resid 14 and name HA )(resid 17 and name HB# ) 4.0 2.2 1
assign (resid 14 and name HA )(resid 18 and name HN ) 4.0 2.2 1
assign (resid 14 and name HA )(resid 30 and name HE21 ) 4.0 2.2 1
assign (resid 14 and name HA )(resid 30 and name HE22 ) 4.0 2.2 1
assign (resid 14 and name HB# )(resid 15 and name HN ) 4.0 2.2 1
assign (resid 14 and name HB# )(resid 30 and name HE21 ) 4.0 2.2 1
assign (resid 14 and name HB# )(resid 30 and name HE22 ) 4.0 2.2 1
assign (resid 15 and name HN )(resid 15 and name HA ) 4.0 2.2 1
assign (resid 15 and name HN )(resid 15 and name HB# ) 4.0 2.2 1
assign (resid 15 and name HN )(resid 16 and name HN ) 3.0 1.2 0.5
assign (resid 15 and name HN )(resid 17 and name HN ) 4.0 2.2 1
assign (resid 15 and name HA )(resid 18 and name HN ) 4.0 2.2 1
assign (resid 15 and name HA )(resid 18 and name HB# ) 4.0 2.2 1
assign (resid 15 and name HA )(resid 18 and name HD# ) 4.0 2.2 1
assign (resid 15 and name HA )(resid 19 and name HN ) 4.0 2.2 1
assign (resid 15 and name HB# )(resid 16 and name HN ) 4.0 2.2 1
assign (resid 16 and name HN )(resid 16 and name HA ) 4.0 2.2 1
assign (resid 16 and name HN )(resid 16 and name HB2 ) 4.0 2.2 1
assign (resid 16 and name HN )(resid 16 and name HB1 ) 4.0 2.2 1
assign (resid 16 and name HN )(resid 16 and name HG2 ) 4.0 2.2 1
assign (resid 16 and name HN )(resid 16 and name HG1 ) 4.0 2.2 1
assign (resid 16 and name HN )(resid 16 and name HD# ) 4.0 2.2 1
assign (resid 16 and name HN )(resid 17 and name HN ) 3.0 1.2 0.5
assign (resid 16 and name HN )(resid 18 and name HN ) 3.0 1.2 0.5
assign (resid 16 and name HA )(resid 16 and name HG2 ) 4.0 2.2 1
assign (resid 16 and name HA )(resid 16 and name HG1 ) 4.0 2.2 1
assign (resid 16 and name HA )(resid 16 and name HD# ) 4.0 2.2 1
assign (resid 16 and name HA )(resid 17 and name HN ) 4.0 2.2 1
assign (resid 16 and name HA )(resid 19 and name HN ) 4.0 2.2 1
assign (resid 16 and name HA )(resid 19 and name HB# ) 4.0 2.2 1
assign (resid 16 and name HA )(resid 20 and name HN ) 4.0 2.2 1
assign (resid 16 and name HB2 )(resid 16 and name HD2 ) 4.0 2.2 1
assign (resid 16 and name HB2 )(resid 16 and name HD1 ) 4.0 2.2 1
assign (resid 16 and name HB1 )(resid 16 and name HD2 ) 4.0 2.2 1
assign (resid 16 and name HB1 )(resid 16 and name HD1 ) 4.0 2.2 1
assign (resid 16 and name HB# )(resid 16 and name HE2 ) 4.0 2.2 1
assign (resid 16 and name HB2 )(resid 17 and name HN ) 4.0 2.2 1
assign (resid 16 and name HB1 )(resid 17 and name HN ) 4.0 2.2 1
assign (resid 16 and name HB# )(resid 18 and name HN ) 4.0 2.2 1
assign (resid 16 and name HG2 )(resid 16 and name HE2 ) 4.0 2.2 1
assign (resid 16 and name HG1 )(resid 16 and name HE2 ) 4.0 2.2 1
assign (resid 16 and name HG1 )(resid 16 and name HE# ) 4.0 2.2 1
assign (resid 16 and name HG2 )(resid 17 and name HN ) 4.0 2.2 1
assign (resid 16 and name HG1 )(resid 17 and name HN ) 4.0 2.2 1
assign (resid 16 and name HD# )(resid 17 and name HN ) 4.0 2.2 1
assign (resid 17 and name HN )(resid 17 and name HA ) 4.0 2.2 1
assign (resid 17 and name HN )(resid 17 and name HB# ) 4.0 2.2 1
assign (resid 17 and name HN )(resid 18 and name HN ) 3.0 1.2 0.5
assign (resid 17 and name HN )(resid 19 and name HN ) 4.0 2.2 1
assign (resid 17 and name HN )(resid 20 and name HN ) 4.0 2.2 1
assign (resid 17 and name HN )(resid 22 and name HD1# ) 4.0 2.2 1
assign (resid 17 and name HA )(resid 18 and name HN ) 4.0 2.2 1
assign (resid 17 and name HA )(resid 20 and name HN ) 4.0 2.2 1
assign (resid 17 and name HA )(resid 21 and name HN ) 4.0 2.2 1
assign (resid 17 and name HA )(resid 21 and name HG2# ) 4.0 2.2 1
assign (resid 17 and name HA )(resid 22 and name HN ) 4.0 2.2 1
assign (resid 17 and name HA )(resid 22 and name HB ) 4.0 2.2 1
assign (resid 17 and name HB# )(resid 18 and name HN ) 4.0 2.2 1
assign (resid 17 and name HB# )(resid 21 and name HN ) 4.0 2.2 1
assign (resid 17 and name HB# )(resid 22 and name HN ) 4.0 2.2 1
assign (resid 17 and name HB# )(resid 22 and name HA ) 4.0 2.2 1
assign (resid 17 and name HB# )(resid 22 and name HD1# ) 4.0 2.2 1
assign (resid 17 and name HB# )(resid 30 and name HE22 ) 4.0 2.2 1
assign (resid 18 and name HN )(resid 18 and name HA ) 4.0 2.2 1
assign (resid 18 and name HN )(resid 18 and name HB# ) 3.0 1.2 0.5
assign (resid 18 and name HN )(resid 18 and name HG2 ) 4.0 2.2 1
assign (resid 18 and name HN )(resid 18 and name HG1 ) 4.0 2.2 1
assign (resid 18 and name HN )(resid 18 and name HD# ) 4.0 2.2 1
assign (resid 18 and name HN )(resid 19 and name HN ) 3.0 1.2 0.5
assign (resid 18 and name HN )(resid 20 and name HN ) 4.0 2.2 1
assign (resid 18 and name HA )(resid 18 and name HG2 ) 4.0 2.2 1
assign (resid 18 and name HA )(resid 18 and name HG1 ) 4.0 2.2 1
assign (resid 18 and name HA )(resid 18 and name HD# ) 4.0 2.2 1
assign (resid 18 and name HA )(resid 19 and name HN ) 4.0 2.2 1
assign (resid 18 and name HB# )(resid 18 and name HD# ) 4.0 2.2 1
assign (resid 18 and name HB# )(resid 19 and name HN ) 3.0 1.2 0.5
assign (resid 18 and name HG# )(resid 18 and name HE# ) 4.0 2.2 1
assign (resid 18 and name HG# )(resid 19 and name HN ) 4.0 2.2 1
assign (resid 18 and name HD# )(resid 19 and name HN ) 4.0 2.2 1
assign (resid 19 and name HN )(resid 19 and name HA ) 4.0 2.2 1
assign (resid 19 and name HN )(resid 19 and name HB# ) 4.0 2.2 1
assign (resid 19 and name HN )(resid 20 and name HN ) 3.0 1.2 0.5
assign (resid 19 and name HA )(resid 20 and name HN ) 4.0 2.2 1
assign (resid 19 and name HB# )(resid 20 and name HN ) 4.0 2.2 1
assign (resid 20 and name HN )(resid 20 and name HA2 ) 4.0 2.2 1
assign (resid 20 and name HN )(resid 20 and name HA1 ) 4.0 2.2 1
assign (resid 20 and name HN )(resid 21 and name HN ) 3.0 1.2 0.5
assign (resid 20 and name HN )(resid 22 and name HN ) 4.0 2.2 1
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assign (resid 53 and name HA )(resid 54 and name HN ) 2.5 0.7 0.4
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assign (resid 55 and name HN )(resid 55 and name HA ) 4.0 2.2 1
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assign (resid 55 and name HG2# )(resid 56 and name HN ) 4.0 2.2 1
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assign (resid 62 and name HA )(resid 62 and name HG1# ) 4.0 2.2 1
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assign (resid 65 and name HN )(resid 65 and name HG# ) 4.0 2.2 1
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assign (resid 65 and name HA )(resid 65 and name HG# ) 4.0 2.2 1
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assign (resid 67 and name HN )(resid 67 and name HA ) 4.0 2.2 1
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assign (resid 68 and name HA )(resid 69 and name HN ) 4.0 2.2 1
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assign (resid 69 and name HN )(resid 69 and name HA ) 4.0 2.2 1
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assign (resid 70 and name HA )(resid 71 and name HN ) 3.0 1.2 0.5
assign (resid 70 and name HB2 )(resid 71 and name HN ) 4.0 2.2 1
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assign (resid 71 and name HA )(resid 71 and name HG# ) 4.0 2.2 1
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assign (resid 79 and name HN )(resid 79 and name HB1 ) 4.0 2.2 1
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assign (resid 80 and name HA )(resid 81 and name HN ) 4.0 2.2 1

! dihedral angle constraints
!  -- Angle constraint file built by HYPER -- X-Plor | Cns format 
!  -- from data in file  SR384.hyp
!  -- Version: 3.2 2002/04/18[Linux] (Compiled on: troberto.quifis.uv.es) 
assign (segid    A and resid   4 and name C   ) (segid    A and resid   5 and name N   )
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assign (segid    A and resid   5 and name N   ) (segid    A and resid   5 and name CA  )
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assign (segid    A and resid   5 and name C   ) (segid    A and resid   6 and name N   )
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assign (segid    A and resid   6 and name N   ) (segid    A and resid   6 and name CA  )
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assign (segid    A and resid   6 and name C   ) (segid    A and resid   7 and name N   )
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assign (segid    A and resid   7 and name N   ) (segid    A and resid   7 and name CA  )
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assign (segid    A and resid   7 and name C   ) (segid    A and resid   8 and name N   )
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assign (segid    A and resid   8 and name N   ) (segid    A and resid   8 and name CA  )
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assign (segid    A and resid   8 and name C   ) (segid    A and resid   9 and name N   )
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assign (segid    A and resid   9 and name C   ) (segid    A and resid  10 and name N   )
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assign (segid    A and resid  10 and name N   ) (segid    A and resid  10 and name CA  )
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assign (segid    A and resid  10 and name C   ) (segid    A and resid  11 and name N   )
       (segid    A and resid  11 and name CA  ) (segid    A and resid  11 and name C   )  1    -60.00     20.00   2 
assign (segid    A and resid  11 and name N   ) (segid    A and resid  11 and name CA  )
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assign (segid    A and resid  11 and name C   ) (segid    A and resid  12 and name N   )
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assign (segid    A and resid  12 and name N   ) (segid    A and resid  12 and name CA  )
       (segid    A and resid  12 and name C   ) (segid    A and resid  13 and name N   )  1    -35.00     40.00   2 
assign (segid    A and resid  12 and name C   ) (segid    A and resid  13 and name N   )
       (segid    A and resid  13 and name CA  ) (segid    A and resid  13 and name C   )  1    -60.00     20.00   2 
assign (segid    A and resid  13 and name N   ) (segid    A and resid  13 and name CA  )
       (segid    A and resid  13 and name C   ) (segid    A and resid  14 and name N   )  1    -35.00     40.00   2 
assign (segid    A and resid  13 and name C   ) (segid    A and resid  14 and name N   )
       (segid    A and resid  14 and name CA  ) (segid    A and resid  14 and name C   )  1    -52.50     22.50   2 
assign (segid    A and resid  14 and name N   ) (segid    A and resid  14 and name CA  )
       (segid    A and resid  14 and name C   ) (segid    A and resid  15 and name N   )  1    -35.00     40.00   2 
assign (segid    A and resid  14 and name C   ) (segid    A and resid  15 and name N   )
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assign (segid    A and resid  15 and name N   ) (segid    A and resid  15 and name CA  )
       (segid    A and resid  15 and name C   ) (segid    A and resid  16 and name N   )  1    -35.00     40.00   2 
assign (segid    A and resid  15 and name C   ) (segid    A and resid  16 and name N   )
       (segid    A and resid  16 and name CA  ) (segid    A and resid  16 and name C   )  1    -52.50     22.50   2 
assign (segid    A and resid  16 and name N   ) (segid    A and resid  16 and name CA  )
       (segid    A and resid  16 and name C   ) (segid    A and resid  17 and name N   )  1    -35.00     40.00   2 
assign (segid    A and resid  16 and name C   ) (segid    A and resid  17 and name N   )
       (segid    A and resid  17 and name CA  ) (segid    A and resid  17 and name C   )  1    -52.50     22.50   2 
assign (segid    A and resid  17 and name N   ) (segid    A and resid  17 and name CA  )
       (segid    A and resid  17 and name C   ) (segid    A and resid  18 and name N   )  1    -35.00     40.00   2 
assign (segid    A and resid  17 and name C   ) (segid    A and resid  18 and name N   )
       (segid    A and resid  18 and name CA  ) (segid    A and resid  18 and name C   )  1    -65.00     35.00   2 
assign (segid    A and resid  18 and name N   ) (segid    A and resid  18 and name CA  )
       (segid    A and resid  18 and name C   ) (segid    A and resid  19 and name N   )  1    -35.00     40.00   2 
assign (segid    A and resid  18 and name C   ) (segid    A and resid  19 and name N   )
       (segid    A and resid  19 and name CA  ) (segid    A and resid  19 and name C   )  1    -72.50     17.50   2 
assign (segid    A and resid  19 and name N   ) (segid    A and resid  19 and name CA  )
       (segid    A and resid  19 and name C   ) (segid    A and resid  20 and name N   )  1    -35.00     40.00   2 
assign (segid    A and resid  19 and name C   ) (segid    A and resid  20 and name N   )
       (segid    A and resid  20 and name CA  ) (segid    A and resid  20 and name C   )  1    -65.00     35.00   2 
assign (segid    A and resid  20 and name N   ) (segid    A and resid  20 and name CA  )
       (segid    A and resid  20 and name C   ) (segid    A and resid  21 and name N   )  1    -35.00     40.00   2 
assign (segid    A and resid  23 and name C   ) (segid    A and resid  24 and name N   )
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assign (segid    A and resid  24 and name N   ) (segid    A and resid  24 and name CA  )
       (segid    A and resid  24 and name C   ) (segid    A and resid  25 and name N   )  1    -35.00     40.00   2 
assign (segid    A and resid  24 and name C   ) (segid    A and resid  25 and name N   )
       (segid    A and resid  25 and name CA  ) (segid    A and resid  25 and name C   )  1    -55.00     20.00   2 
assign (segid    A and resid  25 and name N   ) (segid    A and resid  25 and name CA  )
       (segid    A and resid  25 and name C   ) (segid    A and resid  26 and name N   )  1    -35.00     40.00   2 
assign (segid    A and resid  25 and name C   ) (segid    A and resid  26 and name N   )
       (segid    A and resid  26 and name CA  ) (segid    A and resid  26 and name C   )  1    -62.50     17.50   2 
assign (segid    A and resid  26 and name N   ) (segid    A and resid  26 and name CA  )
       (segid    A and resid  26 and name C   ) (segid    A and resid  27 and name N   )  1    -35.00     40.00   2 
assign (segid    A and resid  26 and name C   ) (segid    A and resid  27 and name N   )
       (segid    A and resid  27 and name CA  ) (segid    A and resid  27 and name C   )  1    -52.50     22.50   2 
assign (segid    A and resid  27 and name N   ) (segid    A and resid  27 and name CA  )
       (segid    A and resid  27 and name C   ) (segid    A and resid  28 and name N   )  1    -35.00     40.00   2 
assign (segid    A and resid  27 and name C   ) (segid    A and resid  28 and name N   )
       (segid    A and resid  28 and name CA  ) (segid    A and resid  28 and name C   )  1    -60.00     20.00   2 
assign (segid    A and resid  28 and name N   ) (segid    A and resid  28 and name CA  )
       (segid    A and resid  28 and name C   ) (segid    A and resid  29 and name N   )  1    -35.00     40.00   2 
assign (segid    A and resid  28 and name C   ) (segid    A and resid  29 and name N   )
       (segid    A and resid  29 and name CA  ) (segid    A and resid  29 and name C   )  1    -52.50     22.50   2 
assign (segid    A and resid  29 and name N   ) (segid    A and resid  29 and name CA  )
       (segid    A and resid  29 and name C   ) (segid    A and resid  30 and name N   )  1    -35.00     40.00   2 
assign (segid    A and resid  29 and name C   ) (segid    A and resid  30 and name N   )
       (segid    A and resid  30 and name CA  ) (segid    A and resid  30 and name C   )  1    -47.50     17.50   2 
assign (segid    A and resid  30 and name N   ) (segid    A and resid  30 and name CA  )
       (segid    A and resid  30 and name C   ) (segid    A and resid  31 and name N   )  1    -35.00     40.00   2 
assign (segid    A and resid  30 and name C   ) (segid    A and resid  31 and name N   )
       (segid    A and resid  31 and name CA  ) (segid    A and resid  31 and name C   )  1    -55.00     20.00   2 
assign (segid    A and resid  31 and name N   ) (segid    A and resid  31 and name CA  )
       (segid    A and resid  31 and name C   ) (segid    A and resid  32 and name N   )  1    -35.00     40.00   2 
assign (segid    A and resid  31 and name C   ) (segid    A and resid  32 and name N   )
       (segid    A and resid  32 and name CA  ) (segid    A and resid  32 and name C   )  1    -60.00     20.00   2 
assign (segid    A and resid  32 and name N   ) (segid    A and resid  32 and name CA  )
       (segid    A and resid  32 and name C   ) (segid    A and resid  33 and name N   )  1    -35.00     40.00   2 
assign (segid    A and resid  32 and name C   ) (segid    A and resid  33 and name N   )
       (segid    A and resid  33 and name CA  ) (segid    A and resid  33 and name C   )  1    -52.50     22.50   2 
assign (segid    A and resid  33 and name N   ) (segid    A and resid  33 and name CA  )
       (segid    A and resid  33 and name C   ) (segid    A and resid  34 and name N   )  1    -35.00     40.00   2 
assign (segid    A and resid  33 and name C   ) (segid    A and resid  34 and name N   )
       (segid    A and resid  34 and name CA  ) (segid    A and resid  34 and name C   )  1    -65.00     35.00   2 
assign (segid    A and resid  34 and name N   ) (segid    A and resid  34 and name CA  )
       (segid    A and resid  34 and name C   ) (segid    A and resid  35 and name N   )  1    -35.00     40.00   2 
assign (segid    A and resid  34 and name C   ) (segid    A and resid  35 and name N   )
       (segid    A and resid  35 and name CA  ) (segid    A and resid  35 and name C   )  1    -62.50     17.50   2 
assign (segid    A and resid  35 and name N   ) (segid    A and resid  35 and name CA  )
       (segid    A and resid  35 and name C   ) (segid    A and resid  36 and name N   )  1    -35.00     40.00   2 
assign (segid    A and resid  35 and name C   ) (segid    A and resid  36 and name N   )
       (segid    A and resid  36 and name CA  ) (segid    A and resid  36 and name C   )  1    -65.00     20.00   2 
assign (segid    A and resid  36 and name N   ) (segid    A and resid  36 and name CA  )
       (segid    A and resid  36 and name C   ) (segid    A and resid  37 and name N   )  1    -35.00     40.00   2 
assign (segid    A and resid  36 and name C   ) (segid    A and resid  37 and name N   )
       (segid    A and resid  37 and name CA  ) (segid    A and resid  37 and name C   )  1    -50.00     20.00   2 
assign (segid    A and resid  37 and name N   ) (segid    A and resid  37 and name CA  )
       (segid    A and resid  37 and name C   ) (segid    A and resid  38 and name N   )  1    -35.00     40.00   2 
assign (segid    A and resid  37 and name C   ) (segid    A and resid  38 and name N   )
       (segid    A and resid  38 and name CA  ) (segid    A and resid  38 and name C   )  1    -55.00     20.00   2 
assign (segid    A and resid  38 and name N   ) (segid    A and resid  38 and name CA  )
       (segid    A and resid  38 and name C   ) (segid    A and resid  39 and name N   )  1    -35.00     40.00   2 
assign (segid    A and resid  38 and name C   ) (segid    A and resid  39 and name N   )
       (segid    A and resid  39 and name CA  ) (segid    A and resid  39 and name C   )  1    -62.50     17.50   2 
assign (segid    A and resid  39 and name N   ) (segid    A and resid  39 and name CA  )
       (segid    A and resid  39 and name C   ) (segid    A and resid  40 and name N   )  1    -35.00     40.00   2 
assign (segid    A and resid  39 and name C   ) (segid    A and resid  40 and name N   )
       (segid    A and resid  40 and name CA  ) (segid    A and resid  40 and name C   )  1    -65.00     35.00   2 
assign (segid    A and resid  40 and name N   ) (segid    A and resid  40 and name CA  )
       (segid    A and resid  40 and name C   ) (segid    A and resid  41 and name N   )  1    -35.00     40.00   2 
assign (segid    A and resid  40 and name C   ) (segid    A and resid  41 and name N   )
       (segid    A and resid  41 and name CA  ) (segid    A and resid  41 and name C   )  1     60.00    140.00   2 

! H-bond constraints
! created by  NOESY_Assign Version 2.1.1 Copyright(C) 2005

assign (resid 5    and name O     )(resid 9    and name N     )    2.80  0.4  0.5
assign (resid 5    and name O     )(resid 9    and name HN    )     1.8  0.3  0.5
assign (resid 6    and name O     )(resid 10   and name N     )    2.80  0.4  0.5
assign (resid 6    and name O     )(resid 10   and name HN    )     1.8  0.3  0.5
assign (resid 7    and name O     )(resid 11   and name N     )    2.80  0.4  0.5
assign (resid 7    and name O     )(resid 11   and name HN    )     1.8  0.3  0.5
assign (resid 8    and name O     )(resid 12   and name N     )    2.80  0.4  0.5
assign (resid 8    and name O     )(resid 12   and name HN    )     1.8  0.3  0.5
assign (resid 9    and name O     )(resid 13   and name N     )    2.80  0.4  0.5
assign (resid 9    and name O     )(resid 13   and name HN    )     1.8  0.3  0.5
assign (resid 10   and name O     )(resid 14   and name N     )    2.80  0.4  0.5
assign (resid 10   and name O     )(resid 14   and name HN    )     1.8  0.3  0.5
assign (resid 11   and name O     )(resid 15   and name N     )    2.80  0.4  0.5
assign (resid 11   and name O     )(resid 15   and name HN    )     1.8  0.3  0.5
assign (resid 12   and name O     )(resid 16   and name N     )    2.80  0.4  0.5
assign (resid 12   and name O     )(resid 16   and name HN    )     1.8  0.3  0.5
assign (resid 13   and name O     )(resid 17   and name N     )    2.80  0.4  0.5
assign (resid 13   and name O     )(resid 17   and name HN    )     1.8  0.3  0.5
assign (resid 14   and name O     )(resid 18   and name N     )    2.80  0.4  0.5
assign (resid 14   and name O     )(resid 18   and name HN    )     1.8  0.3  0.5
assign (resid 15   and name O     )(resid 19   and name N     )    2.80  0.4  0.5
assign (resid 15   and name O     )(resid 19   and name HN    )     1.8  0.3  0.5
assign (resid 16   and name O     )(resid 20   and name N     )    2.80  0.4  0.5
assign (resid 16   and name O     )(resid 20   and name HN    )     1.8  0.3  0.5
assign (resid 24   and name O     )(resid 28   and name N     )    2.80  0.4  0.5
assign (resid 24   and name O     )(resid 28   and name HN    )     1.8  0.3  0.5
assign (resid 25   and name O     )(resid 29   and name N     )    2.80  0.4  0.5
assign (resid 25   and name O     )(resid 29   and name HN    )     1.8  0.3  0.5
assign (resid 26   and name O     )(resid 30   and name N     )    2.80  0.4  0.5
assign (resid 26   and name O     )(resid 30   and name HN    )     1.8  0.3  0.5
assign (resid 27   and name O     )(resid 31   and name N     )    2.80  0.4  0.5
assign (resid 27   and name O     )(resid 31   and name HN    )     1.8  0.3  0.5
assign (resid 30   and name O     )(resid 34   and name N     )    2.80  0.4  0.5
assign (resid 30   and name O     )(resid 34   and name HN    )     1.8  0.3  0.5
assign (resid 31   and name O     )(resid 35   and name N     )    2.80  0.4  0.5
assign (resid 31   and name O     )(resid 35   and name HN    )     1.8  0.3  0.5
assign (resid 32   and name O     )(resid 36   and name N     )    2.80  0.4  0.5
assign (resid 32   and name O     )(resid 36   and name HN    )     1.8  0.3  0.5
assign (resid 33   and name O     )(resid 37   and name N     )    2.80  0.4  0.5
assign (resid 33   and name O     )(resid 37   and name HN    )     1.8  0.3  0.5
assign (resid 36   and name O     )(resid 40   and name N     )    2.80  0.4  0.5
assign (resid 36   and name O     )(resid 40   and name HN    )     1.8  0.3  0.5

!CACBshifts constraints
! created by  NOESY_Assign Version 2.1.1 Copyright(C) 2005

! ILE 2
 assign (resid   1 and name C ) (resid   2 and name N ) (resid   2 and name CA )
        (resid   2 and name C ) (resid   3 and name N ) 61.108 39.238
! SER 3
 assign (resid   2 and name C ) (resid   3 and name N ) (resid   3 and name CA )
        (resid   3 and name C ) (resid   4 and name N ) 57.627 64.697
! ASN 4
 assign (resid   3 and name C ) (resid   4 and name N ) (resid   4 and name CA )
        (resid   4 and name C ) (resid   5 and name N ) 55.66 37.92
! ALA 5
 assign (resid   4 and name C ) (resid   5 and name N ) (resid   5 and name CA )
        (resid   5 and name C ) (resid   6 and name N ) 54.955 18.294
! LYS 6
 assign (resid   5 and name C ) (resid   6 and name N ) (resid   6 and name CA )
        (resid   6 and name C ) (resid   7 and name N ) 59.567 32.672
! ILE 7
 assign (resid   6 and name C ) (resid   7 and name N ) (resid   7 and name CA )
        (resid   7 and name C ) (resid   8 and name N ) 64.532 37.555
! ALA 8
 assign (resid   7 and name C ) (resid   8 and name N ) (resid   8 and name CA )
        (resid   8 and name C ) (resid   9 and name N ) 55.098 17.539
! ARG 9
 assign (resid   8 and name C ) (resid   9 and name N ) (resid   9 and name CA )
        (resid   9 and name C ) (resid  10 and name N ) 57.353 29.759
! ILE 10
 assign (resid   9 and name C ) (resid  10 and name N ) (resid  10 and name CA )
        (resid  10 and name C ) (resid  11 and name N ) 66.444 37.753
! ASN 11
 assign (resid  10 and name C ) (resid  11 and name N ) (resid  11 and name CA )
        (resid  11 and name C ) (resid  12 and name N ) 55.796 37.618
! GLU 12
 assign (resid  11 and name C ) (resid  12 and name N ) (resid  12 and name CA )
        (resid  12 and name C ) (resid  13 and name N ) 59.414 30.016
! LEU 13
 assign (resid  12 and name C ) (resid  13 and name N ) (resid  13 and name CA )
        (resid  13 and name C ) (resid  14 and name N ) 57.789 41.083
! ALA 14
 assign (resid  13 and name C ) (resid  14 and name N ) (resid  14 and name CA )
        (resid  14 and name C ) (resid  15 and name N ) 54.977 17.664
! ALA 15
 assign (resid  14 and name C ) (resid  15 and name N ) (resid  15 and name CA )
        (resid  15 and name C ) (resid  16 and name N ) 55.126 17.654
! LYS 16
 assign (resid  15 and name C ) (resid  16 and name N ) (resid  16 and name CA )
        (resid  16 and name C ) (resid  17 and name N ) 59.692 32.599
! ALA 17
 assign (resid  16 and name C ) (resid  17 and name N ) (resid  17 and name CA )
        (resid  17 and name C ) (resid  18 and name N ) 55.018 17.902
! LYS 18
 assign (resid  17 and name C ) (resid  18 and name N ) (resid  18 and name CA )
        (resid  18 and name C ) (resid  19 and name N ) 59.041 32.352
! ALA 19
 assign (resid  18 and name C ) (resid  19 and name N ) (resid  19 and name CA )
        (resid  19 and name C ) (resid  20 and name N ) 52.497 19.521
! GLY 20
 assign (resid  19 and name C ) (resid  20 and name N ) (resid  20 and name CA )
        (resid  20 and name C ) (resid  21 and name N ) 45.938  $noexpectation
! VAL 21
 assign (resid  20 and name C ) (resid  21 and name N ) (resid  21 and name CA )
        (resid  21 and name C ) (resid  22 and name N ) 60.306 32.452
! ILE 22
 assign (resid  21 and name C ) (resid  22 and name N ) (resid  22 and name CA )
        (resid  22 and name C ) (resid  23 and name N ) 61.241 40.059
! THR 23
 assign (resid  22 and name C ) (resid  23 and name N ) (resid  23 and name CA )
        (resid  23 and name C ) (resid  24 and name N ) 60.983 71.518
! GLU 24
 assign (resid  23 and name C ) (resid  24 and name N ) (resid  24 and name CA )
        (resid  24 and name C ) (resid  25 and name N ) 59.991 29.159
! GLU 25
 assign (resid  24 and name C ) (resid  25 and name N ) (resid  25 and name CA )
        (resid  25 and name C ) (resid  26 and name N ) 60.172 29.181
! GLU 26
 assign (resid  25 and name C ) (resid  26 and name N ) (resid  26 and name CA )
        (resid  26 and name C ) (resid  27 and name N ) 58.695 30.452
! LYS 27
 assign (resid  26 and name C ) (resid  27 and name N ) (resid  27 and name CA )
        (resid  27 and name C ) (resid  28 and name N ) 60.049 32.502
! ALA 28
 assign (resid  27 and name C ) (resid  28 and name N ) (resid  28 and name CA )
        (resid  28 and name C ) (resid  29 and name N ) 55.143 17.615
! GLU 29
 assign (resid  28 and name C ) (resid  29 and name N ) (resid  29 and name CA )
        (resid  29 and name C ) (resid  30 and name N ) 59.304 29.504
! GLN 30
 assign (resid  29 and name C ) (resid  30 and name N ) (resid  30 and name CA )
        (resid  30 and name C ) (resid  31 and name N ) 59.58 29.331
! GLN 31
 assign (resid  30 and name C ) (resid  31 and name N ) (resid  31 and name CA )
        (resid  31 and name C ) (resid  32 and name N ) 58.903 28.239
! LYS 32
 assign (resid  31 and name C ) (resid  32 and name N ) (resid  32 and name CA )
        (resid  32 and name C ) (resid  33 and name N ) 59.546 32.446
! LEU 33
 assign (resid  32 and name C ) (resid  33 and name N ) (resid  33 and name CA )
        (resid  33 and name C ) (resid  34 and name N ) 57.86 42.595
! ARG 34
 assign (resid  33 and name C ) (resid  34 and name N ) (resid  34 and name CA )
        (resid  34 and name C ) (resid  35 and name N ) 59.662 29.778
! GLN 35
 assign (resid  34 and name C ) (resid  35 and name N ) (resid  35 and name CA )
        (resid  35 and name C ) (resid  36 and name N ) 58.834 28.32
! GLU 36
 assign (resid  35 and name C ) (resid  36 and name N ) (resid  36 and name CA )
        (resid  36 and name C ) (resid  37 and name N ) 59.463 29.762
! TYR 37
 assign (resid  36 and name C ) (resid  37 and name N ) (resid  37 and name CA )
        (resid  37 and name C ) (resid  38 and name N ) 60.799 38.637
! LEU 38
 assign (resid  37 and name C ) (resid  38 and name N ) (resid  38 and name CA )
        (resid  38 and name C ) (resid  39 and name N ) 57.12 42.036
! LYS 39
 assign (resid  38 and name C ) (resid  39 and name N ) (resid  39 and name CA )
        (resid  39 and name C ) (resid  40 and name N ) 58.273 32.443
! GLY 40
 assign (resid  39 and name C ) (resid  40 and name N ) (resid  40 and name CA )
        (resid  40 and name C ) (resid  41 and name N ) 45.771  $noexpectation
! PHE 41
 assign (resid  40 and name C ) (resid  41 and name N ) (resid  41 and name CA )
        (resid  41 and name C ) (resid  42 and name N ) 58.9 39.375
! ASN 47
 assign (resid  46 and name C ) (resid  47 and name N ) (resid  47 and name CA )
        (resid  47 and name C ) (resid  48 and name N ) 53.466 38.855
! THR 48
 assign (resid  47 and name C ) (resid  48 and name N ) (resid  48 and name CA )
        (resid  48 and name C ) (resid  49 and name N ) 62.147 69.712
! LEU 49
 assign (resid  48 and name C ) (resid  49 and name N ) (resid  49 and name CA )
        (resid  49 and name C ) (resid  50 and name N ) 55.615 42.159
! LYS 50
 assign (resid  49 and name C ) (resid  50 and name N ) (resid  50 and name CA )
        (resid  50 and name C ) (resid  51 and name N ) 56.296 32.909
! SER 51
 assign (resid  50 and name C ) (resid  51 and name N ) (resid  51 and name CA )
        (resid  51 and name C ) (resid  52 and name N ) 58.234 63.743
! VAL 52
 assign (resid  51 and name C ) (resid  52 and name N ) (resid  52 and name CA )
        (resid  52 and name C ) (resid  53 and name N ) 62.075 32.884
! LYS 53
 assign (resid  52 and name C ) (resid  53 and name N ) (resid  53 and name CA )
        (resid  53 and name C ) (resid  54 and name N ) 56.004 33.149
! ILE 54
 assign (resid  53 and name C ) (resid  54 and name N ) (resid  54 and name CA )
        (resid  54 and name C ) (resid  55 and name N ) 60.813 38.554
! ILE 55
 assign (resid  54 and name C ) (resid  55 and name N ) (resid  55 and name CA )
        (resid  55 and name C ) (resid  56 and name N ) 60.272 38.687
! ASP 56
 assign (resid  55 and name C ) (resid  56 and name N ) (resid  56 and name CA )
        (resid  56 and name C ) (resid  57 and name N ) 52.337 41.125
! PRO 57
 assign (resid  56 and name C ) (resid  57 and name N ) (resid  57 and name CA )
        (resid  57 and name C ) (resid  58 and name N ) 63.983 32.063
! GLU 58
 assign (resid  57 and name C ) (resid  58 and name N ) (resid  58 and name CA )
        (resid  58 and name C ) (resid  59 and name N ) 56.604 30.028
! GLY 59
 assign (resid  58 and name C ) (resid  59 and name N ) (resid  59 and name CA )
        (resid  59 and name C ) (resid  60 and name N ) 45.503  $noexpectation
! ASN 60
 assign (resid  59 and name C ) (resid  60 and name N ) (resid  60 and name CA )
        (resid  60 and name C ) (resid  61 and name N ) 53.342 39.164
! ASP 61
 assign (resid  60 and name C ) (resid  61 and name N ) (resid  61 and name CA )
        (resid  61 and name C ) (resid  62 and name N ) 54.464 41.033
! VAL 62
 assign (resid  61 and name C ) (resid  62 and name N ) (resid  62 and name CA )
        (resid  62 and name C ) (resid  63 and name N ) 61.908 32.372
! THR 63
 assign (resid  62 and name C ) (resid  63 and name N ) (resid  63 and name CA )
        (resid  63 and name C ) (resid  64 and name N ) 60.43 69.42
! PRO 64
 assign (resid  63 and name C ) (resid  64 and name N ) (resid  64 and name CA )
        (resid  64 and name C ) (resid  65 and name N ) 64.025 32.118
! GLU 65
 assign (resid  64 and name C ) (resid  65 and name N ) (resid  65 and name CA )
        (resid  65 and name C ) (resid  66 and name N ) 58.228 29.71
! LYS 66
 assign (resid  65 and name C ) (resid  66 and name N ) (resid  66 and name CA )
        (resid  66 and name C ) (resid  67 and name N ) 57.66 32.818
! LEU 67
 assign (resid  66 and name C ) (resid  67 and name N ) (resid  67 and name CA )
        (resid  67 and name C ) (resid  68 and name N ) 55.856 42.087
! LYS 68
 assign (resid  67 and name C ) (resid  68 and name N ) (resid  68 and name CA )
        (resid  68 and name C ) (resid  69 and name N ) 57.285 32.765
! ARG 69
 assign (resid  68 and name C ) (resid  69 and name N ) (resid  69 and name CA )
        (resid  69 and name C ) (resid  70 and name N ) 57.168 30.574
! GLU 70
 assign (resid  69 and name C ) (resid  70 and name N ) (resid  70 and name CA )
        (resid  70 and name C ) (resid  71 and name N ) 57.25 30.016
! GLN 71
 assign (resid  70 and name C ) (resid  71 and name N ) (resid  71 and name CA )
        (resid  71 and name C ) (resid  72 and name N ) 56.538 29.244
! ARG 72
 assign (resid  71 and name C ) (resid  72 and name N ) (resid  72 and name CA )
        (resid  72 and name C ) (resid  73 and name N ) 56.661 30.699
! ASN 73
 assign (resid  72 and name C ) (resid  73 and name N ) (resid  73 and name CA )
        (resid  73 and name C ) (resid  74 and name N ) 53.535 38.683
! ASN 74
 assign (resid  73 and name C ) (resid  74 and name N ) (resid  74 and name CA )
        (resid  74 and name C ) (resid  75 and name N ) 53.672 38.64
! LYS 75
 assign (resid  74 and name C ) (resid  75 and name N ) (resid  75 and name CA )
        (resid  75 and name C ) (resid  76 and name N ) 56.819 32.747
! LEU 76
 assign (resid  75 and name C ) (resid  76 and name N ) (resid  76 and name CA )
        (resid  76 and name C ) (resid  77 and name N ) 55.578 42.202
! HIS 77
 assign (resid  76 and name C ) (resid  77 and name N ) (resid  77 and name CA )
        (resid  77 and name C ) (resid  78 and name N ) 56.227 30.081
! LEU 78
 assign (resid  77 and name C ) (resid  78 and name N ) (resid  78 and name CA )
        (resid  78 and name C ) (resid  79 and name N ) 55.294 42.286
! GLU 79
 assign (resid  78 and name C ) (resid  79 and name N ) (resid  79 and name CA )
        (resid  79 and name C ) (resid  80 and name N ) 56.672 30.244
! HIS 80
 assign (resid  79 and name C ) (resid  80 and name N ) (resid  80 and name CA )
        (resid  80 and name C ) (resid  81 and name N ) 56.255 30.448

! J constraints
! created by  NOESY_Assign Version 2.1.1 Copyright(C) 2005

! LYS 6
 assign (resid   5 and name C ) (resid   6 and name N )
        (resid   6 and name CA) (resid   6 and name C ) 5.5 2
! ILE 7
 assign (resid   6 and name C ) (resid   7 and name N )
        (resid   7 and name CA) (resid   7 and name C ) 3.4 2
! ALA 8
 assign (resid   7 and name C ) (resid   8 and name N )
        (resid   8 and name CA) (resid   8 and name C ) 3.9 2
! ARG 9
 assign (resid   8 and name C ) (resid   9 and name N )
        (resid   9 and name CA) (resid   9 and name C ) 4.1 2
! ILE 10
 assign (resid   9 and name C ) (resid  10 and name N )
        (resid  10 and name CA) (resid  10 and name C ) 3 2
! ASN 11
 assign (resid  10 and name C ) (resid  11 and name N )
        (resid  11 and name CA) (resid  11 and name C ) 4.1 2
! GLU 12
 assign (resid  11 and name C ) (resid  12 and name N )
        (resid  12 and name CA) (resid  12 and name C ) 4 2
! LEU 13
 assign (resid  12 and name C ) (resid  13 and name N )
        (resid  13 and name CA) (resid  13 and name C ) 4.2 2
! ALA 14
 assign (resid  13 and name C ) (resid  14 and name N )
        (resid  14 and name CA) (resid  14 and name C ) 3.5 2
! ALA 15
 assign (resid  14 and name C ) (resid  15 and name N )
        (resid  15 and name CA) (resid  15 and name C ) 4.4 2
! LYS 16
 assign (resid  15 and name C ) (resid  16 and name N )
        (resid  16 and name CA) (resid  16 and name C ) 3.7 2
! ALA 17
 assign (resid  16 and name C ) (resid  17 and name N )
        (resid  17 and name CA) (resid  17 and name C ) 3.7 2
! ALA 19
 assign (resid  18 and name C ) (resid  19 and name N )
        (resid  19 and name CA) (resid  19 and name C ) 5.7 2
! GLU 24
 assign (resid  23 and name C ) (resid  24 and name N )
        (resid  24 and name CA) (resid  24 and name C ) 2.9 2
! GLU 25
 assign (resid  24 and name C ) (resid  25 and name N )
        (resid  25 and name CA) (resid  25 and name C ) 4 2
! GLU 26
 assign (resid  25 and name C ) (resid  26 and name N )
        (resid  26 and name CA) (resid  26 and name C ) 4.6 2
! LYS 27
 assign (resid  26 and name C ) (resid  27 and name N )
        (resid  27 and name CA) (resid  27 and name C ) 3.4 2
! ALA 28
 assign (resid  27 and name C ) (resid  28 and name N )
        (resid  28 and name CA) (resid  28 and name C ) 4.3 2
! GLU 29
 assign (resid  28 and name C ) (resid  29 and name N )
        (resid  29 and name CA) (resid  29 and name C ) 3.5 2
! GLN 30
 assign (resid  29 and name C ) (resid  30 and name N )
        (resid  30 and name CA) (resid  30 and name C ) 2.5 2
! GLN 31
 assign (resid  30 and name C ) (resid  31 and name N )
        (resid  31 and name CA) (resid  31 and name C ) 3.9 2
! LYS 32
 assign (resid  31 and name C ) (resid  32 and name N )
        (resid  32 and name CA) (resid  32 and name C ) 4.1 2
! LEU 33
 assign (resid  32 and name C ) (resid  33 and name N )
        (resid  33 and name CA) (resid  33 and name C ) 3.4 2
! GLN 35
 assign (resid  34 and name C ) (resid  35 and name N )
        (resid  35 and name CA) (resid  35 and name C ) 4.4 2
! GLU 36
 assign (resid  35 and name C ) (resid  36 and name N )
        (resid  36 and name CA) (resid  36 and name C ) 4.8 2
! TYR 37
 assign (resid  36 and name C ) (resid  37 and name N )
        (resid  37 and name CA) (resid  37 and name C ) 3.1 2
! LEU 38
 assign (resid  37 and name C ) (resid  38 and name N )
        (resid  38 and name CA) (resid  38 and name C ) 3.8 2
! LYS 39
 assign (resid  38 and name C ) (resid  39 and name N )
        (resid  39 and name CA) (resid  39 and name C ) 4.7 2
! PHE 41
 assign (resid  40 and name C ) (resid  41 and name N )
        (resid  41 and name CA) (resid  41 and name C ) 4.5 2

  Entry H atom name         Submitted Coord H atom name
  Start of MODEL    1
    1   1H    MET   1          1HT       MET   1   4.185  -2.677 -15.979
    2   2H    MET   1          2HT       MET   1   4.412  -3.448 -14.483
    3   3H    MET   1          3HT       MET   1   2.892  -2.807 -14.889
    4    HA   MET   1           HA       MET   1   2.517  -4.432 -16.537
    5   1HB   MET   1          2HB       MET   1   4.442  -6.226 -16.737
    6   2HB   MET   1          1HB       MET   1   4.530  -4.731 -17.666
    7   1HG   MET   1          2HG       MET   1   6.119  -3.774 -16.204
    8   2HG   MET   1          1HG       MET   1   5.748  -4.916 -14.912
    9   1HE   MET   1          1HE       MET   1   6.599  -5.984 -18.907
   10   2HE   MET   1          2HE       MET   1   8.212  -5.323 -18.655
   11   3HE   MET   1          3HE       MET   1   6.799  -4.319 -18.344
   12    H    ILE   2           H        ILE   2   3.731  -4.370 -13.368
   13    HA   ILE   2           HA       ILE   2   3.206  -7.093 -12.635
   14    HB   ILE   2           HB       ILE   2   3.430  -4.624 -10.892
   15   1HG1  ILE   2          2HG1      ILE   2   5.460  -4.977 -12.225
   16   2HG1  ILE   2          1HG1      ILE   2   5.763  -5.417 -10.545
   17   1HG2  ILE   2          1HG2      ILE   2   2.394  -6.362  -9.624
   18   2HG2  ILE   2          2HG2      ILE   2   4.101  -6.405  -9.186
   19   3HG2  ILE   2          3HG2      ILE   2   3.450  -7.591 -10.317
   20   1HD1  ILE   2          1HD1      ILE   2   5.078  -7.825 -11.314
   21   2HD1  ILE   2          2HD1      ILE   2   6.689  -7.228 -11.709
   22   3HD1  ILE   2          3HD1      ILE   2   5.422  -7.215 -12.934
   23    H    SER   3           H        SER   3   1.481  -7.905 -11.423
   24    HA   SER   3           HA       SER   3  -0.793  -6.359 -10.669
   25   1HB   SER   3          2HB       SER   3  -2.397  -7.180 -12.311
   26   2HB   SER   3          1HB       SER   3  -1.099  -6.322 -13.134
   27    HG   SER   3           HG       SER   3  -0.480  -8.929 -12.791
   28    H    ASN   4           H        ASN   4   1.106  -8.667  -9.949
   29    HA   ASN   4           HA       ASN   4  -0.633 -10.942  -9.617
   30   1HB   ASN   4          2HB       ASN   4   1.262 -11.883  -8.313
   31   2HB   ASN   4          1HB       ASN   4   1.747 -11.312  -9.906
   32   1HD2  ASN   4          1HD2      ASN   4   1.977 -10.630  -6.433
   33   2HD2  ASN   4          2HD2      ASN   4   3.207  -9.468  -6.573
   34    H    ALA   5           H        ALA   5   0.202 -11.672  -6.960
   35    HA   ALA   5           HA       ALA   5  -1.933 -10.714  -5.443
   36   1HB   ALA   5          1HB       ALA   5   0.657 -11.721  -4.265
   37   2HB   ALA   5          2HB       ALA   5  -0.515 -12.789  -5.037
   38   3HB   ALA   5          3HB       ALA   5  -0.971 -11.869  -3.603
   39    H    LYS   6           H        LYS   6   0.909  -9.082  -6.275
   40    HA   LYS   6           HA       LYS   6   1.330  -7.539  -3.920
   41   1HB   LYS   6          2HB       LYS   6   3.072  -7.723  -5.609
   42   2HB   LYS   6          1HB       LYS   6   2.026  -6.970  -6.813
   43   1HG   LYS   6          2HG       LYS   6   2.034  -4.875  -5.635
   44   2HG   LYS   6          1HG       LYS   6   2.812  -5.599  -4.228
   45   1HD   LYS   6          2HD       LYS   6   4.127  -5.592  -6.951
   46   2HD   LYS   6          1HD       LYS   6   4.321  -4.255  -5.819
   47   1HE   LYS   6          2HE       LYS   6   4.873  -6.295  -4.150
   48   2HE   LYS   6          1HE       LYS   6   5.383  -7.034  -5.669
   49   1HZ   LYS   6          1HZ       LYS   6   6.869  -5.339  -4.170
   50   2HZ   LYS   6          2HZ       LYS   6   6.250  -4.311  -5.373
   51   3HZ   LYS   6          3HZ       LYS   6   7.139  -5.693  -5.806
   52    H    ILE   7           H        ILE   7  -0.165  -6.652  -7.045
   53    HA   ILE   7           HA       ILE   7  -1.179  -4.165  -6.263
   54    HB   ILE   7           HB       ILE   7  -1.937  -6.158  -8.381
   55   1HG1  ILE   7          2HG1      ILE   7  -1.297  -4.217  -9.830
   56   2HG1  ILE   7          1HG1      ILE   7  -0.930  -3.292  -8.375
   57   1HG2  ILE   7          1HG2      ILE   7  -3.475  -3.677  -7.580
   58   2HG2  ILE   7          2HG2      ILE   7  -4.099  -5.304  -7.851
   59   3HG2  ILE   7          3HG2      ILE   7  -3.545  -4.335  -9.215
   60   1HD1  ILE   7          1HD1      ILE   7   0.916  -4.635  -7.833
   61   2HD1  ILE   7          2HD1      ILE   7   1.012  -4.549  -9.591
   62   3HD1  ILE   7          3HD1      ILE   7   0.346  -5.985  -8.815
   63    H    ALA   8           H        ALA   8  -2.693  -7.375  -6.165
   64    HA   ALA   8           HA       ALA   8  -5.202  -6.607  -5.182
   65   1HB   ALA   8          1HB       ALA   8  -5.320  -8.971  -4.333
   66   2HB   ALA   8          2HB       ALA   8  -3.638  -9.168  -4.826
   67   3HB   ALA   8          3HB       ALA   8  -4.877  -8.831  -6.035
   68    H    ARG   9           H        ARG   9  -2.276  -7.627  -3.427
   69    HA   ARG   9           HA       ARG   9  -3.331  -7.474  -0.827
   70   1HB   ARG   9          2HB       ARG   9  -1.203  -8.576  -1.319
   71   2HB   ARG   9          1HB       ARG   9  -0.488  -7.032  -1.778
   72   1HG   ARG   9          2HG       ARG   9   0.156  -7.595   0.518
   73   2HG   ARG   9          1HG       ARG   9  -0.896  -6.181   0.525
   74   1HD   ARG   9          2HD       ARG   9  -2.713  -7.369   1.382
   75   2HD   ARG   9          1HD       ARG   9  -2.103  -8.917   0.802
   76    HE   ARG   9           HE       ARG   9  -0.413  -7.707   2.807
   77   1HH1  ARG   9          1HH2      ARG   9  -3.221  -9.645   2.194
   78   2HH1  ARG   9          2HH2      ARG   9  -3.155 -10.461   3.720
   79   1HH2  ARG   9          1HH1      ARG   9  -0.332  -8.768   4.806
   80   2HH2  ARG   9          2HH1      ARG   9  -1.523  -9.963   5.199
   81    H    ILE  10           H        ILE  10  -1.491  -5.056  -2.688
   82    HA   ILE  10           HA       ILE  10  -1.385  -3.021  -0.815
   83    HB   ILE  10           HB       ILE  10  -1.633  -2.898  -3.825
   84   1HG1  ILE  10          2HG1      ILE  10   0.753  -2.320  -2.055
   85   2HG1  ILE  10          1HG1      ILE  10   0.398  -3.947  -2.635
   86   1HG2  ILE  10          1HG2      ILE  10  -1.230  -0.708  -1.780
   87   2HG2  ILE  10          2HG2      ILE  10  -2.378  -0.753  -3.118
   88   3HG2  ILE  10          3HG2      ILE  10  -0.657  -0.544  -3.439
   89   1HD1  ILE  10          1HD1      ILE  10   0.732  -1.531  -4.438
   90   2HD1  ILE  10          2HD1      ILE  10   0.538  -3.208  -4.948
   91   3HD1  ILE  10          3HD1      ILE  10   2.004  -2.707  -4.106
   92    H    ASN  11           H        ASN  11  -3.906  -3.461  -3.320
   93    HA   ASN  11           HA       ASN  11  -5.535  -1.331  -2.486
   94   1HB   ASN  11          2HB       ASN  11  -6.909  -1.993  -4.159
   95   2HB   ASN  11          1HB       ASN  11  -5.591  -3.079  -4.571
   96   1HD2  ASN  11          1HD2      ASN  11  -6.230  -5.211  -4.799
   97   2HD2  ASN  11          2HD2      ASN  11  -7.570  -5.922  -4.038
   98    H    GLU  12           H        GLU  12  -5.465  -4.724  -1.490
   99    HA   GLU  12           HA       GLU  12  -7.795  -4.719   0.083
  100   1HB   GLU  12          2HB       GLU  12  -5.300  -6.376   0.029
  101   2HB   GLU  12          1HB       GLU  12  -6.426  -6.562   1.373
  102   1HG   GLU  12          2HG       GLU  12  -7.167  -6.782  -1.561
  103   2HG   GLU  12          1HG       GLU  12  -6.915  -8.148  -0.476
  104    H    LEU  13           H        LEU  13  -4.408  -4.451   1.193
  105    HA   LEU  13           HA       LEU  13  -4.999  -3.790   3.852
  106   1HB   LEU  13          2HB       LEU  13  -2.717  -4.322   2.505
  107   2HB   LEU  13          1HB       LEU  13  -2.572  -2.572   2.659
  108    HG   LEU  13           HG       LEU  13  -3.204  -4.389   5.000
  109   1HD1  LEU  13          1HD1      LEU  13  -0.990  -4.960   4.087
  110   2HD1  LEU  13          2HD1      LEU  13  -0.825  -4.111   5.624
  111   3HD1  LEU  13          3HD1      LEU  13  -0.533  -3.256   4.109
  112   1HD2  LEU  13          1HD2      LEU  13  -2.100  -2.234   6.098
  113   2HD2  LEU  13          2HD2      LEU  13  -3.810  -2.245   5.668
  114   3HD2  LEU  13          3HD2      LEU  13  -2.638  -1.470   4.603
  115    H    ALA  14           H        ALA  14  -4.317  -1.670   1.075
  116    HA   ALA  14           HA       ALA  14  -4.402   0.791   2.371
  117   1HB   ALA  14          1HB       ALA  14  -3.697   0.543   0.040
  118   2HB   ALA  14          2HB       ALA  14  -4.987   1.737   0.168
  119   3HB   ALA  14          3HB       ALA  14  -5.343   0.115  -0.425
  120    H    ALA  15           H        ALA  15  -7.089  -0.812   0.649
  121    HA   ALA  15           HA       ALA  15  -9.078   1.032   1.381
  122   1HB   ALA  15          1HB       ALA  15  -9.297  -1.903   0.678
  123   2HB   ALA  15          2HB       ALA  15  -9.436  -0.536  -0.428
  124   3HB   ALA  15          3HB       ALA  15 -10.669  -0.802   0.804
  125    H    LYS  16           H        LYS  16  -7.921  -1.891   2.996
  126    HA   LYS  16           HA       LYS  16  -9.931  -2.045   4.978
  127   1HB   LYS  16          2HB       LYS  16  -7.303  -3.269   4.491
  128   2HB   LYS  16          1HB       LYS  16  -7.691  -3.080   6.199
  129   1HG   LYS  16          2HG       LYS  16  -8.573  -5.212   5.540
  130   2HG   LYS  16          1HG       LYS  16  -9.951  -4.124   5.694
  131   1HD   LYS  16          2HD       LYS  16  -9.463  -3.684   3.116
  132   2HD   LYS  16          1HD       LYS  16  -8.708  -5.274   3.221
  133   1HE   LYS  16          2HE       LYS  16 -11.547  -4.635   4.082
  134   2HE   LYS  16          1HE       LYS  16 -11.100  -5.429   2.571
  135   1HZ   LYS  16          1HZ       LYS  16 -11.326  -6.529   5.188
  136   2HZ   LYS  16          2HZ       LYS  16  -9.790  -6.832   4.528
  137   3HZ   LYS  16          3HZ       LYS  16 -11.188  -7.322   3.696
  138    H    ALA  17           H        ALA  17  -6.566  -0.923   5.330
  139    HA   ALA  17           HA       ALA  17  -6.881   0.283   7.837
  140   1HB   ALA  17          1HB       ALA  17  -4.767   1.281   7.465
  141   2HB   ALA  17          2HB       ALA  17  -4.992   1.299   5.715
  142   3HB   ALA  17          3HB       ALA  17  -4.716  -0.228   6.553
  143    H    LYS  18           H        LYS  18  -7.755   1.350   4.639
  144    HA   LYS  18           HA       LYS  18  -7.989   4.144   5.300
  145   1HB   LYS  18          2HB       LYS  18  -7.676   3.584   2.990
  146   2HB   LYS  18          1HB       LYS  18  -9.061   2.494   3.004
  147   1HG   LYS  18          2HG       LYS  18 -10.612   4.245   3.077
  148   2HG   LYS  18          1HG       LYS  18  -9.437   5.390   3.725
  149   1HD   LYS  18          2HD       LYS  18  -8.241   5.397   1.570
  150   2HD   LYS  18          1HD       LYS  18  -9.399   4.238   0.918
  151   1HE   LYS  18          2HE       LYS  18 -10.196   6.950   2.013
  152   2HE   LYS  18          1HE       LYS  18  -9.873   6.647   0.305
  153   1HZ   LYS  18          1HZ       LYS  18 -11.631   5.082   0.213
  154   2HZ   LYS  18          2HZ       LYS  18 -12.253   6.469   0.971
  155   3HZ   LYS  18          3HZ       LYS  18 -11.843   5.103   1.895
  156    H    ALA  19           H        ALA  19 -10.435   1.622   4.635
  157    HA   ALA  19           HA       ALA  19 -12.594   3.221   5.638
  158   1HB   ALA  19          1HB       ALA  19 -13.977   1.324   5.195
  159   2HB   ALA  19          2HB       ALA  19 -12.597   0.226   5.229
  160   3HB   ALA  19          3HB       ALA  19 -12.777   1.376   3.904
  161    H    GLY  20           H        GLY  20 -10.117   1.753   7.238
  162   1HA   GLY  20          2HA       GLY  20 -11.737   0.899   9.545
  163   2HA   GLY  20          1HA       GLY  20 -10.032   0.543   9.293
  164    H    VAL  21           H        VAL  21  -8.516   2.390   9.409
  165    HA   VAL  21           HA       VAL  21  -9.407   4.801  10.756
  166    HB   VAL  21           HB       VAL  21  -7.771   4.427  12.668
  167   1HG1  VAL  21          1HG1      VAL  21 -10.025   2.417  12.695
  168   2HG1  VAL  21          2HG1      VAL  21 -10.336   4.153  12.734
  169   3HG1  VAL  21          3HG1      VAL  21  -9.410   3.394  14.028
  170   1HG2  VAL  21          1HG2      VAL  21  -7.382   1.986  13.205
  171   2HG2  VAL  21          2HG2      VAL  21  -6.491   2.573  11.803
  172   3HG2  VAL  21          3HG2      VAL  21  -7.945   1.602  11.578
  173    H    ILE  22           H        ILE  22  -6.752   2.762   9.664
  174    HA   ILE  22           HA       ILE  22  -4.843   3.227   8.501
  175    HB   ILE  22           HB       ILE  22  -6.621   5.279   7.720
  176   1HG1  ILE  22          2HG1      ILE  22  -5.551   3.718   6.198
  177   2HG1  ILE  22          1HG1      ILE  22  -5.102   5.354   5.724
  178   1HG2  ILE  22          1HG2      ILE  22  -5.348   6.908   9.023
  179   2HG2  ILE  22          2HG2      ILE  22  -5.044   7.163   7.308
  180   3HG2  ILE  22          3HG2      ILE  22  -3.839   6.348   8.302
  181   1HD1  ILE  22          1HD1      ILE  22  -3.009   4.393   5.697
  182   2HD1  ILE  22          2HD1      ILE  22  -3.426   3.196   6.923
  183   3HD1  ILE  22          3HD1      ILE  22  -3.064   4.855   7.398
  184    H    THR  23           H        THR  23  -2.840   3.521   9.242
  185    HA   THR  23           HA       THR  23  -2.390   5.511  11.380
  186    HB   THR  23           HB       THR  23  -1.091   3.924  12.648
  187    HG1  THR  23           HG1      THR  23  -0.524   2.010  11.869
  188   1HG2  THR  23          1HG2      THR  23  -2.821   2.339  13.293
  189   2HG2  THR  23          2HG2      THR  23  -3.652   2.570  11.756
  190   3HG2  THR  23          3HG2      THR  23  -3.577   3.888  12.925
  191    H    GLU  24           H        GLU  24  -0.273   6.330  11.522
  192    HA   GLU  24           HA       GLU  24   1.045   6.928   9.171
  193   1HB   GLU  24          2HB       GLU  24   1.396   8.055  11.375
  194   2HB   GLU  24          1HB       GLU  24   2.344   6.662  11.895
  195   1HG   GLU  24          2HG       GLU  24   3.747   7.068   9.757
  196   2HG   GLU  24          1HG       GLU  24   2.976   8.650   9.712
  197    H    GLU  25           H        GLU  25   1.676   4.266  11.429
  198    HA   GLU  25           HA       GLU  25   3.988   3.231  10.217
  199   1HB   GLU  25          2HB       GLU  25   1.865   1.560  11.570
  200   2HB   GLU  25          1HB       GLU  25   3.599   1.250  11.484
  201   1HG   GLU  25          2HG       GLU  25   2.183   3.424  13.045
  202   2HG   GLU  25          1HG       GLU  25   3.176   2.114  13.679
  203    H    GLU  26           H        GLU  26   0.583   2.239   9.795
  204    HA   GLU  26           HA       GLU  26   1.063   0.343   7.758
  205   1HB   GLU  26          2HB       GLU  26  -1.388   1.965   8.475
  206   2HB   GLU  26          1HB       GLU  26  -1.388   0.730   7.218
  207   1HG   GLU  26          2HG       GLU  26  -0.697  -0.968   8.839
  208   2HG   GLU  26          1HG       GLU  26  -0.596   0.253  10.107
  209    H    LYS  27           H        LYS  27  -0.059   3.722   7.559
  210    HA   LYS  27           HA       LYS  27  -0.225   3.982   4.805
  211   1HB   LYS  27          2HB       LYS  27  -0.913   5.668   6.561
  212   2HB   LYS  27          1HB       LYS  27   0.783   6.140   6.667
  213   1HG   LYS  27          2HG       LYS  27   0.771   6.636   4.227
  214   2HG   LYS  27          1HG       LYS  27  -0.947   6.235   4.176
  215   1HD   LYS  27          2HD       LYS  27  -1.336   8.006   5.926
  216   2HD   LYS  27          1HD       LYS  27   0.355   8.476   5.749
  217   1HE   LYS  27          2HE       LYS  27  -1.629   8.403   3.458
  218   2HE   LYS  27          1HE       LYS  27  -1.225   9.858   4.367
  219   1HZ   LYS  27          1HZ       LYS  27   0.642   8.185   2.778
  220   2HZ   LYS  27          2HZ       LYS  27   1.118   9.488   3.759
  221   3HZ   LYS  27          3HZ       LYS  27   0.122   9.757   2.409
  222    H    ALA  28           H        ALA  28   2.622   4.252   6.901
  223    HA   ALA  28           HA       ALA  28   4.440   5.212   4.970
  224   1HB   ALA  28          1HB       ALA  28   4.977   3.442   7.370
  225   2HB   ALA  28          2HB       ALA  28   4.936   5.205   7.378
  226   3HB   ALA  28          3HB       ALA  28   6.190   4.357   6.474
  227    H    GLU  29           H        GLU  29   3.545   1.905   5.910
  228    HA   GLU  29           HA       GLU  29   5.397   0.520   4.324
  229   1HB   GLU  29          2HB       GLU  29   2.811  -0.113   5.626
  230   2HB   GLU  29          1HB       GLU  29   3.288  -1.173   4.301
  231   1HG   GLU  29          2HG       GLU  29   4.231  -2.136   6.274
  232   2HG   GLU  29          1HG       GLU  29   5.567  -1.352   5.435
  233    H    GLN  30           H        GLN  30   1.962   1.178   3.574
  234    HA   GLN  30           HA       GLN  30   1.917   0.275   0.959
  235   1HB   GLN  30          2HB       GLN  30   0.437   2.797   1.558
  236   2HB   GLN  30          1HB       GLN  30  -0.115   1.332   0.751
  237   1HG   GLN  30          2HG       GLN  30   0.109   0.178   3.035
  238   2HG   GLN  30          1HG       GLN  30   0.250   1.798   3.708
  239   1HE2  GLN  30          1HE2      GLN  30  -1.911   0.634   4.694
  240   2HE2  GLN  30          2HE2      GLN  30  -3.339   1.089   3.897
  241    H    GLN  31           H        GLN  31   3.273   3.228   2.241
  242    HA   GLN  31           HA       GLN  31   3.457   4.779  -0.075
  243   1HB   GLN  31          2HB       GLN  31   4.097   5.296   2.419
  244   2HB   GLN  31          1HB       GLN  31   5.698   4.753   1.916
  245   1HG   GLN  31          2HG       GLN  31   5.435   6.371  -0.068
  246   2HG   GLN  31          1HG       GLN  31   4.081   7.059   0.825
  247   1HE2  GLN  31          1HE2      GLN  31   6.600   8.456   0.231
  248   2HE2  GLN  31          2HE2      GLN  31   7.321   8.815   1.724
  249    H    LYS  32           H        LYS  32   6.052   2.729   1.311
  250    HA   LYS  32           HA       LYS  32   7.786   2.955  -0.880
  251   1HB   LYS  32          2HB       LYS  32   9.116   1.391   0.183
  252   2HB   LYS  32          1HB       LYS  32   8.140   1.963   1.533
  253   1HG   LYS  32          2HG       LYS  32   6.553   0.049   1.094
  254   2HG   LYS  32          1HG       LYS  32   7.711  -0.565  -0.085
  255   1HD   LYS  32          2HD       LYS  32   9.442  -0.664   1.687
  256   2HD   LYS  32          1HD       LYS  32   8.253  -0.102   2.863
  257   1HE   LYS  32          2HE       LYS  32   7.586  -2.497   1.189
  258   2HE   LYS  32          1HE       LYS  32   8.703  -2.697   2.538
  259   1HZ   LYS  32          1HZ       LYS  32   6.084  -1.349   2.836
  260   2HZ   LYS  32          2HZ       LYS  32   7.101  -1.950   4.057
  261   3HZ   LYS  32          3HZ       LYS  32   6.268  -3.022   3.036
  262    H    LEU  33           H        LEU  33   5.223   0.606  -0.207
  263    HA   LEU  33           HA       LEU  33   5.728  -1.197  -2.285
  264   1HB   LEU  33          2HB       LEU  33   3.184  -0.376  -0.888
  265   2HB   LEU  33          1HB       LEU  33   3.201  -1.614  -2.144
  266    HG   LEU  33           HG       LEU  33   4.993  -1.704   0.299
  267   1HD1  LEU  33          1HD1      LEU  33   3.389  -3.459   1.105
  268   2HD1  LEU  33          2HD1      LEU  33   2.298  -3.003  -0.204
  269   3HD1  LEU  33          3HD1      LEU  33   2.691  -1.840   1.063
  270   1HD2  LEU  33          1HD2      LEU  33   5.954  -3.140  -1.261
  271   2HD2  LEU  33          2HD2      LEU  33   4.411  -3.498  -2.036
  272   3HD2  LEU  33          3HD2      LEU  33   4.810  -4.234  -0.484
  273    H    ARG  34           H        ARG  34   3.373   1.492  -2.284
  274    HA   ARG  34           HA       ARG  34   2.799   1.301  -5.056
  275   1HB   ARG  34          2HB       ARG  34   2.332   3.417  -2.966
  276   2HB   ARG  34          1HB       ARG  34   1.920   3.705  -4.657
  277   1HG   ARG  34          2HG       ARG  34   0.968   1.268  -3.133
  278   2HG   ARG  34          1HG       ARG  34   0.038   2.764  -3.218
  279   1HD   ARG  34          2HD       ARG  34   0.438   2.507  -5.817
  280   2HD   ARG  34          1HD       ARG  34   0.699   0.815  -5.403
  281    HE   ARG  34           HE       ARG  34  -1.575   0.618  -4.964
  282   1HH1  ARG  34          1HH2      ARG  34  -0.640   3.951  -5.165
  283   2HH1  ARG  34          2HH2      ARG  34  -2.265   4.548  -5.135
  284   1HH2  ARG  34          1HH1      ARG  34  -3.704   1.402  -4.928
  285   2HH2  ARG  34          2HH1      ARG  34  -3.997   3.107  -5.002
  286    H    GLN  35           H        GLN  35   5.028   3.345  -3.204
  287    HA   GLN  35           HA       GLN  35   5.867   5.004  -5.317
  288   1HB   GLN  35          2HB       GLN  35   6.396   5.576  -3.028
  289   2HB   GLN  35          1HB       GLN  35   7.321   4.090  -2.825
  290   1HG   GLN  35          2HG       GLN  35   8.792   6.051  -3.226
  291   2HG   GLN  35          1HG       GLN  35   8.950   4.837  -4.493
  292   1HE2  GLN  35          1HE2      GLN  35   9.430   6.160  -6.299
  293   2HE2  GLN  35          2HE2      GLN  35   8.415   7.405  -6.848
  294    H    GLU  36           H        GLU  36   7.001   1.836  -4.222
  295    HA   GLU  36           HA       GLU  36   9.272   1.674  -5.908
  296   1HB   GLU  36          2HB       GLU  36   9.032   0.171  -4.021
  297   2HB   GLU  36          1HB       GLU  36   7.545  -0.496  -4.692
  298   1HG   GLU  36          2HG       GLU  36   8.740  -1.439  -6.576
  299   2HG   GLU  36          1HG       GLU  36  10.228  -0.626  -6.096
  300    H    TYR  37           H        TYR  37   6.002   0.273  -6.264
  301    HA   TYR  37           HA       TYR  37   6.316  -0.846  -8.790
  302   1HB   TYR  37          2HB       TYR  37   4.330  -1.317  -7.513
  303   2HB   TYR  37          1HB       TYR  37   3.866   0.385  -7.510
  304    HD1  TYR  37           HD1      TYR  37   2.332   1.114  -9.115
  305    HD2  TYR  37           HD2      TYR  37   4.754  -2.337  -9.948
  306    HE1  TYR  37           HE1      TYR  37   1.153   0.806 -11.273
  307    HE2  TYR  37           HE2      TYR  37   3.572  -2.644 -12.106
  308    HH   TYR  37           HH       TYR  37   2.293  -1.266 -13.709
  309    H    LEU  38           H        LEU  38   5.285   2.445  -7.922
  310    HA   LEU  38           HA       LEU  38   4.798   3.400 -10.515
  311   1HB   LEU  38          2HB       LEU  38   5.237   4.557  -7.849
  312   2HB   LEU  38          1HB       LEU  38   5.757   5.605  -9.166
  313    HG   LEU  38           HG       LEU  38   3.368   5.959  -8.517
  314   1HD1  LEU  38          1HD1      LEU  38   4.425   6.083 -10.958
  315   2HD1  LEU  38          2HD1      LEU  38   2.699   6.332 -10.698
  316   3HD1  LEU  38          3HD1      LEU  38   3.288   4.768 -11.260
  317   1HD2  LEU  38          1HD2      LEU  38   3.211   3.291  -8.200
  318   2HD2  LEU  38          2HD2      LEU  38   2.607   3.402  -9.852
  319   3HD2  LEU  38          3HD2      LEU  38   1.795   4.279  -8.555
  320    H    LYS  39           H        LYS  39   7.779   3.176  -8.642
  321    HA   LYS  39           HA       LYS  39   9.426   4.694 -10.373
  322   1HB   LYS  39          2HB       LYS  39   9.848   3.876  -7.946
  323   2HB   LYS  39          1HB       LYS  39  10.450   2.407  -8.714
  324   1HG   LYS  39          2HG       LYS  39  12.047   3.743 -10.036
  325   2HG   LYS  39          1HG       LYS  39  11.440   5.218  -9.284
  326   1HD   LYS  39          2HD       LYS  39  13.290   4.761  -7.942
  327   2HD   LYS  39          1HD       LYS  39  12.007   3.958  -7.038
  328   1HE   LYS  39          2HE       LYS  39  12.613   1.878  -8.499
  329   2HE   LYS  39          1HE       LYS  39  14.126   2.735  -8.794
  330   1HZ   LYS  39          1HZ       LYS  39  13.772   1.139  -6.725
  331   2HZ   LYS  39          2HZ       LYS  39  13.212   2.585  -6.031
  332   3HZ   LYS  39          3HZ       LYS  39  14.786   2.497  -6.662
  333    H    GLY  40           H        GLY  40   8.412   1.326 -10.419
  334   1HA   GLY  40          2HA       GLY  40  10.260   0.756 -12.644
  335   2HA   GLY  40          1HA       GLY  40   9.370  -0.441 -11.711
  336    H    PHE  41           H        PHE  41   6.879   1.131 -11.880
  337    HA   PHE  41           HA       PHE  41   4.985   0.521 -13.174
  338   1HB   PHE  41          2HB       PHE  41   5.468   2.970 -13.199
  339   2HB   PHE  41          1HB       PHE  41   6.314   2.753 -14.728
  340    HD1  PHE  41           HD1      PHE  41   5.070   3.199 -16.651
  341    HD2  PHE  41           HD2      PHE  41   3.059   1.698 -13.161
  342    HE1  PHE  41           HE1      PHE  41   2.902   3.321 -17.846
  343    HE2  PHE  41           HE2      PHE  41   0.893   1.819 -14.360
  344    HZ   PHE  41           HZ       PHE  41   0.812   2.631 -16.702
  345    H    ARG  42           H        ARG  42   6.275   1.679 -16.122
  346    HA   ARG  42           HA       ARG  42   5.938  -0.954 -17.334
  347   1HB   ARG  42          2HB       ARG  42   6.005   0.204 -19.448
  348   2HB   ARG  42          1HB       ARG  42   4.965   1.123 -18.362
  349   1HG   ARG  42          2HG       ARG  42   7.035   2.519 -17.791
  350   2HG   ARG  42          1HG       ARG  42   7.813   1.744 -19.171
  351   1HD   ARG  42          2HD       ARG  42   5.943   2.529 -20.620
  352   2HD   ARG  42          1HD       ARG  42   5.263   3.380 -19.235
  353    HE   ARG  42           HE       ARG  42   7.952   4.178 -19.572
  354   1HH1  ARG  42          1HH2      ARG  42   4.841   4.411 -21.084
  355   2HH1  ARG  42          2HH2      ARG  42   5.173   5.937 -21.834
  356   1HH2  ARG  42          1HH1      ARG  42   8.383   6.172 -20.551
  357   2HH2  ARG  42          2HH1      ARG  42   7.176   6.933 -21.532
  Start of MODEL    2
    1   1H    MET   1          1HT       MET   1   4.330  -7.456 -14.596
    2   2H    MET   1          2HT       MET   1   5.313  -8.233 -15.743
    3   3H    MET   1          3HT       MET   1   5.227  -6.536 -15.703
    4    HA   MET   1           HA       MET   1   7.209  -7.884 -14.605
    5   1HB   MET   1          2HB       MET   1   5.860  -5.320 -13.742
    6   2HB   MET   1          1HB       MET   1   7.370  -5.859 -13.008
    7   1HG   MET   1          2HG       MET   1   8.427  -5.941 -15.242
    8   2HG   MET   1          1HG       MET   1   6.921  -5.387 -15.972
    9   1HE   MET   1          1HE       MET   1   8.447  -3.668 -17.109
   10   2HE   MET   1          2HE       MET   1   9.908  -3.978 -16.175
   11   3HE   MET   1          3HE       MET   1   9.290  -2.335 -16.308
   12    H    ILE   2           H        ILE   2   4.790  -6.510 -12.379
   13    HA   ILE   2           HA       ILE   2   5.237  -8.817 -10.585
   14    HB   ILE   2           HB       ILE   2   4.352  -5.979 -10.014
   15   1HG1  ILE   2          2HG1      ILE   2   6.734  -7.541  -8.974
   16   2HG1  ILE   2          1HG1      ILE   2   6.813  -6.506 -10.401
   17   1HG2  ILE   2          1HG2      ILE   2   3.081  -7.381  -8.535
   18   2HG2  ILE   2          2HG2      ILE   2   4.447  -6.781  -7.599
   19   3HG2  ILE   2          3HG2      ILE   2   4.469  -8.426  -8.232
   20   1HD1  ILE   2          1HD1      ILE   2   6.112  -5.662  -7.575
   21   2HD1  ILE   2          2HD1      ILE   2   5.950  -4.611  -8.982
   22   3HD1  ILE   2          3HD1      ILE   2   7.541  -5.199  -8.500
   23    H    SER   3           H        SER   3   2.615  -6.438 -11.014
   24    HA   SER   3           HA       SER   3   0.332  -6.703 -10.887
   25   1HB   SER   3          2HB       SER   3  -0.543  -8.343 -12.582
   26   2HB   SER   3          1HB       SER   3   0.637  -7.200 -13.214
   27    HG   SER   3           HG       SER   3   0.833  -9.941 -12.775
   28    H    ASN   4           H        ASN   4  -0.039  -9.950 -11.602
   29    HA   ASN   4           HA       ASN   4  -1.048 -11.626 -10.398
   30   1HB   ASN   4          2HB       ASN   4   0.432 -12.714  -8.914
   31   2HB   ASN   4          1HB       ASN   4   1.468 -11.876 -10.065
   32   1HD2  ASN   4          1HD2      ASN   4   2.670  -9.997  -9.295
   33   2HD2  ASN   4          2HD2      ASN   4   2.821  -9.662  -7.638
   34    H    ALA   5           H        ALA   5  -0.954 -12.185  -7.624
   35    HA   ALA   5           HA       ALA   5  -3.258 -10.830  -6.731
   36   1HB   ALA   5          1HB       ALA   5  -2.991 -12.056  -4.686
   37   2HB   ALA   5          2HB       ALA   5  -1.275 -12.316  -5.001
   38   3HB   ALA   5          3HB       ALA   5  -2.486 -13.114  -6.004
   39    H    LYS   6           H        LYS   6  -0.126  -9.672  -6.885
   40    HA   LYS   6           HA       LYS   6   0.107  -8.270  -4.431
   41   1HB   LYS   6          2HB       LYS   6   1.915  -8.725  -6.222
   42   2HB   LYS   6          1HB       LYS   6   1.269  -7.299  -7.035
   43   1HG   LYS   6          2HG       LYS   6   2.888  -6.309  -5.702
   44   2HG   LYS   6          1HG       LYS   6   1.500  -6.224  -4.618
   45   1HD   LYS   6          2HD       LYS   6   2.213  -8.196  -3.427
   46   2HD   LYS   6          1HD       LYS   6   3.475  -8.522  -4.617
   47   1HE   LYS   6          2HE       LYS   6   4.721  -6.580  -3.958
   48   2HE   LYS   6          1HE       LYS   6   3.385  -5.982  -2.972
   49   1HZ   LYS   6          1HZ       LYS   6   5.408  -7.355  -1.972
   50   2HZ   LYS   6          2HZ       LYS   6   4.372  -8.647  -2.349
   51   3HZ   LYS   6          3HZ       LYS   6   3.848  -7.408  -1.310
   52    H    ILE   7           H        ILE   7  -1.339  -7.458  -7.560
   53    HA   ILE   7           HA       ILE   7  -1.846  -4.734  -7.113
   54    HB   ILE   7           HB       ILE   7  -3.622  -6.673  -8.622
   55   1HG1  ILE   7          2HG1      ILE   7  -1.395  -6.941  -9.487
   56   2HG1  ILE   7          1HG1      ILE   7  -2.240  -5.874 -10.604
   57   1HG2  ILE   7          1HG2      ILE   7  -4.056  -4.576  -9.986
   58   2HG2  ILE   7          2HG2      ILE   7  -3.222  -3.671  -8.723
   59   3HG2  ILE   7          3HG2      ILE   7  -4.707  -4.545  -8.348
   60   1HD1  ILE   7          1HD1      ILE   7  -0.087  -5.214  -8.617
   61   2HD1  ILE   7          2HD1      ILE   7  -1.254  -3.969  -9.066
   62   3HD1  ILE   7          3HD1      ILE   7  -0.240  -4.714 -10.302
   63    H    ALA   8           H        ALA   8  -3.987  -7.529  -6.559
   64    HA   ALA   8           HA       ALA   8  -6.076  -6.120  -5.318
   65   1HB   ALA   8          1HB       ALA   8  -6.274  -8.444  -6.153
   66   2HB   ALA   8          2HB       ALA   8  -6.807  -8.295  -4.479
   67   3HB   ALA   8          3HB       ALA   8  -5.226  -8.986  -4.843
   68    H    ARG   9           H        ARG   9  -3.103  -7.509  -4.045
   69    HA   ARG   9           HA       ARG   9  -3.648  -7.337  -1.298
   70   1HB   ARG   9          2HB       ARG   9  -1.657  -8.445  -2.458
   71   2HB   ARG   9          1HB       ARG   9  -0.940  -6.837  -2.537
   72   1HG   ARG   9          2HG       ARG   9  -1.194  -6.641  -0.060
   73   2HG   ARG   9          1HG       ARG   9  -1.794  -8.300  -0.022
   74   1HD   ARG   9          2HD       ARG   9   0.338  -9.040  -1.107
   75   2HD   ARG   9          1HD       ARG   9   0.936  -7.387  -0.972
   76    HE   ARG   9           HE       ARG   9   0.096  -8.205   1.579
   77   1HH1  ARG   9          1HH2      ARG   9   2.480  -8.987  -0.816
   78   2HH1  ARG   9          2HH2      ARG   9   3.647  -9.543   0.337
   79   1HH2  ARG   9          1HH1      ARG   9   1.623  -8.932   3.084
   80   2HH2  ARG   9          2HH1      ARG   9   3.162  -9.511   2.543
   81    H    ILE  10           H        ILE  10  -2.037  -5.000  -3.451
   82    HA   ILE  10           HA       ILE  10  -1.514  -2.979  -1.627
   83    HB   ILE  10           HB       ILE  10  -2.238  -2.848  -4.559
   84   1HG1  ILE  10          2HG1      ILE  10   0.447  -2.215  -3.392
   85   2HG1  ILE  10          1HG1      ILE  10  -0.038  -3.907  -3.474
   86   1HG2  ILE  10          1HG2      ILE  10  -2.771  -0.672  -3.765
   87   2HG2  ILE  10          2HG2      ILE  10  -1.119  -0.536  -4.366
   88   3HG2  ILE  10          3HG2      ILE  10  -1.417  -0.667  -2.633
   89   1HD1  ILE  10          1HD1      ILE  10   1.121  -3.415  -5.522
   90   2HD1  ILE  10          2HD1      ILE  10   0.179  -1.946  -5.770
   91   3HD1  ILE  10          3HD1      ILE  10  -0.593  -3.523  -5.920
   92    H    ASN  11           H        ASN  11  -4.367  -3.132  -3.790
   93    HA   ASN  11           HA       ASN  11  -5.735  -0.994  -2.565
   94   1HB   ASN  11          2HB       ASN  11  -7.362  -1.393  -4.103
   95   2HB   ASN  11          1HB       ASN  11  -6.126  -2.411  -4.825
   96   1HD2  ASN  11          1HD2      ASN  11  -6.800  -4.501  -5.255
   97   2HD2  ASN  11          2HD2      ASN  11  -8.070  -5.304  -4.463
   98    H    GLU  12           H        GLU  12  -5.789  -4.471  -1.925
   99    HA   GLU  12           HA       GLU  12  -7.979  -4.547  -0.174
  100   1HB   GLU  12          2HB       GLU  12  -6.975  -6.580  -1.068
  101   2HB   GLU  12          1HB       GLU  12  -5.479  -6.255  -0.194
  102   1HG   GLU  12          2HG       GLU  12  -6.549  -6.555   1.930
  103   2HG   GLU  12          1HG       GLU  12  -8.151  -6.556   1.195
  104    H    LEU  13           H        LEU  13  -4.502  -4.318   0.627
  105    HA   LEU  13           HA       LEU  13  -4.766  -4.056   3.391
  106   1HB   LEU  13          2HB       LEU  13  -2.656  -4.199   1.744
  107   2HB   LEU  13          1HB       LEU  13  -2.642  -2.463   2.043
  108    HG   LEU  13           HG       LEU  13  -2.773  -4.528   4.259
  109   1HD1  LEU  13          1HD1      LEU  13  -0.365  -4.063   4.588
  110   2HD1  LEU  13          2HD1      LEU  13  -0.368  -3.045   3.147
  111   3HD1  LEU  13          3HD1      LEU  13  -0.667  -4.777   3.005
  112   1HD2  LEU  13          1HD2      LEU  13  -2.573  -1.542   4.085
  113   2HD2  LEU  13          2HD2      LEU  13  -1.721  -2.354   5.398
  114   3HD2  LEU  13          3HD2      LEU  13  -3.466  -2.540   5.233
  115    H    ALA  14           H        ALA  14  -4.703  -1.535   0.884
  116    HA   ALA  14           HA       ALA  14  -4.805   0.713   2.530
  117   1HB   ALA  14          1HB       ALA  14  -6.194   0.395  -0.141
  118   2HB   ALA  14          2HB       ALA  14  -4.473   0.730   0.052
  119   3HB   ALA  14          3HB       ALA  14  -5.667   1.903   0.608
  120    H    ALA  15           H        ALA  15  -7.559  -0.956   0.978
  121    HA   ALA  15           HA       ALA  15  -9.585   0.522   2.260
  122   1HB   ALA  15          1HB       ALA  15 -11.053  -1.409   1.618
  123   2HB   ALA  15          2HB       ALA  15  -9.606  -2.263   1.081
  124   3HB   ALA  15          3HB       ALA  15 -10.091  -0.764   0.287
  125    H    LYS  16           H        LYS  16  -7.873  -2.406   3.223
  126    HA   LYS  16           HA       LYS  16  -9.543  -3.190   5.350
  127   1HB   LYS  16          2HB       LYS  16  -6.583  -3.573   4.865
  128   2HB   LYS  16          1HB       LYS  16  -7.427  -4.284   6.240
  129   1HG   LYS  16          2HG       LYS  16  -8.671  -4.689   3.565
  130   2HG   LYS  16          1HG       LYS  16  -7.170  -5.561   3.876
  131   1HD   LYS  16          2HD       LYS  16  -8.138  -6.488   5.951
  132   2HD   LYS  16          1HD       LYS  16  -9.643  -5.623   5.634
  133   1HE   LYS  16          2HE       LYS  16  -8.441  -7.605   3.685
  134   2HE   LYS  16          1HE       LYS  16  -9.629  -8.057   4.907
  135   1HZ   LYS  16          1HZ       LYS  16 -10.150  -5.808   3.075
  136   2HZ   LYS  16          2HZ       LYS  16 -11.259  -6.773   3.925
  137   3HZ   LYS  16          3HZ       LYS  16 -10.440  -7.403   2.576
  138    H    ALA  17           H        ALA  17  -6.395  -1.542   5.578
  139    HA   ALA  17           HA       ALA  17  -6.657  -0.734   8.252
  140   1HB   ALA  17          1HB       ALA  17  -5.081   0.612   6.044
  141   2HB   ALA  17          2HB       ALA  17  -4.518  -0.754   7.007
  142   3HB   ALA  17          3HB       ALA  17  -4.818   0.803   7.777
  143    H    LYS  18           H        LYS  18  -8.099   0.487   5.361
  144    HA   LYS  18           HA       LYS  18  -8.541   3.178   6.158
  145   1HB   LYS  18          2HB       LYS  18  -8.852   2.190   3.825
  146   2HB   LYS  18          1HB       LYS  18 -10.394   1.565   4.402
  147   1HG   LYS  18          2HG       LYS  18 -10.909   3.968   5.146
  148   2HG   LYS  18          1HG       LYS  18  -9.525   4.448   4.162
  149   1HD   LYS  18          2HD       LYS  18 -10.584   3.259   2.213
  150   2HD   LYS  18          1HD       LYS  18 -12.014   3.001   3.214
  151   1HE   LYS  18          2HE       LYS  18 -12.496   4.981   2.005
  152   2HE   LYS  18          1HE       LYS  18 -11.989   5.552   3.594
  153   1HZ   LYS  18          1HZ       LYS  18 -10.401   6.704   2.602
  154   2HZ   LYS  18          2HZ       LYS  18 -10.825   6.072   1.083
  155   3HZ   LYS  18          3HZ       LYS  18  -9.694   5.261   2.058
  156    H    ALA  19           H        ALA  19 -10.925   0.520   6.038
  157    HA   ALA  19           HA       ALA  19 -12.721   1.863   7.829
  158   1HB   ALA  19          1HB       ALA  19 -12.712  -1.038   6.962
  159   2HB   ALA  19          2HB       ALA  19 -13.470   0.274   6.062
  160   3HB   ALA  19          3HB       ALA  19 -14.068  -0.155   7.664
  161    H    GLY  20           H        GLY  20  -9.838   0.331   8.375
  162   1HA   GLY  20          2HA       GLY  20 -10.606  -0.915  10.915
  163   2HA   GLY  20          1HA       GLY  20  -9.026  -1.008  10.144
  164    H    VAL  21           H        VAL  21  -7.746   1.035  10.086
  165    HA   VAL  21           HA       VAL  21  -8.420   3.046  12.084
  166    HB   VAL  21           HB       VAL  21  -6.020   1.222  12.368
  167   1HG1  VAL  21          1HG1      VAL  21  -5.150   3.356  12.870
  168   2HG1  VAL  21          2HG1      VAL  21  -5.664   2.750  14.444
  169   3HG1  VAL  21          3HG1      VAL  21  -6.669   3.911  13.574
  170   1HG2  VAL  21          1HG2      VAL  21  -8.454   1.807  14.078
  171   2HG2  VAL  21          2HG2      VAL  21  -7.025   0.983  14.699
  172   3HG2  VAL  21          3HG2      VAL  21  -7.964   0.255  13.396
  173    H    ILE  22           H        ILE  22  -5.527   1.855  10.395
  174    HA   ILE  22           HA       ILE  22  -4.101   2.836   8.901
  175    HB   ILE  22           HB       ILE  22  -6.616   3.876   8.193
  176   1HG1  ILE  22          2HG1      ILE  22  -3.918   4.070   6.814
  177   2HG1  ILE  22          1HG1      ILE  22  -5.027   2.702   6.729
  178   1HG2  ILE  22          1HG2      ILE  22  -6.185   6.171   7.540
  179   2HG2  ILE  22          2HG2      ILE  22  -4.524   6.074   8.120
  180   3HG2  ILE  22          3HG2      ILE  22  -5.863   6.031   9.267
  181   1HD1  ILE  22          1HD1      ILE  22  -6.721   4.628   5.949
  182   2HD1  ILE  22          2HD1      ILE  22  -5.672   3.789   4.807
  183   3HD1  ILE  22          3HD1      ILE  22  -5.212   5.376   5.424
  184    H    THR  23           H        THR  23  -2.433   4.332   8.946
  185    HA   THR  23           HA       THR  23  -2.476   6.729  10.476
  186    HB   THR  23           HB       THR  23  -0.512   5.332  11.942
  187    HG1  THR  23           HG1      THR  23  -1.691   3.438  11.281
  188   1HG2  THR  23          1HG2      THR  23  -1.800   6.025  13.826
  189   2HG2  THR  23          2HG2      THR  23  -3.296   6.029  12.892
  190   3HG2  THR  23          3HG2      THR  23  -2.063   7.252  12.587
  191    H    GLU  24           H        GLU  24  -0.188   7.578  10.776
  192    HA   GLU  24           HA       GLU  24   1.137   7.784   8.367
  193   1HB   GLU  24          2HB       GLU  24   2.362   7.994  11.131
  194   2HB   GLU  24          1HB       GLU  24   3.058   8.641   9.647
  195   1HG   GLU  24          2HG       GLU  24   1.958  10.505  10.562
  196   2HG   GLU  24          1HG       GLU  24   0.794   9.894   9.389
  197    H    GLU  25           H        GLU  25   1.588   5.421  10.935
  198    HA   GLU  25           HA       GLU  25   3.969   4.224  10.051
  199   1HB   GLU  25          2HB       GLU  25   2.880   3.816  12.257
  200   2HB   GLU  25          1HB       GLU  25   1.636   2.875  11.434
  201   1HG   GLU  25          2HG       GLU  25   3.338   1.318  10.596
  202   2HG   GLU  25          1HG       GLU  25   4.608   2.274  11.357
  203    H    GLU  26           H        GLU  26   0.605   3.151   9.498
  204    HA   GLU  26           HA       GLU  26   1.277   1.118   7.642
  205   1HB   GLU  26          2HB       GLU  26  -1.261   2.572   8.340
  206   2HB   GLU  26          1HB       GLU  26  -1.219   1.461   6.972
  207   1HG   GLU  26          2HG       GLU  26  -1.940   0.331   9.062
  208   2HG   GLU  26          1HG       GLU  26  -0.443  -0.350   8.427
  209    H    LYS  27           H        LYS  27  -0.027   4.403   7.153
  210    HA   LYS  27           HA       LYS  27  -0.160   4.448   4.395
  211   1HB   LYS  27          2HB       LYS  27   0.551   6.653   6.340
  212   2HB   LYS  27          1HB       LYS  27   0.198   6.923   4.635
  213   1HG   LYS  27          2HG       LYS  27  -1.996   5.628   5.070
  214   2HG   LYS  27          1HG       LYS  27  -1.652   5.881   6.781
  215   1HD   LYS  27          2HD       LYS  27  -2.820   7.819   6.443
  216   2HD   LYS  27          1HD       LYS  27  -1.263   8.401   5.855
  217   1HE   LYS  27          2HE       LYS  27  -1.919   7.711   3.548
  218   2HE   LYS  27          1HE       LYS  27  -3.504   7.247   4.166
  219   1HZ   LYS  27          1HZ       LYS  27  -2.359   9.905   3.786
  220   2HZ   LYS  27          2HZ       LYS  27  -3.379   9.684   5.128
  221   3HZ   LYS  27          3HZ       LYS  27  -3.953   9.368   3.560
  222    H    ALA  28           H        ALA  28   2.648   5.098   6.480
  223    HA   ALA  28           HA       ALA  28   4.438   5.892   4.450
  224   1HB   ALA  28          1HB       ALA  28   4.935   4.533   7.110
  225   2HB   ALA  28          2HB       ALA  28   5.017   6.261   6.763
  226   3HB   ALA  28          3HB       ALA  28   6.215   5.165   6.074
  227    H    GLU  29           H        GLU  29   3.708   2.708   5.838
  228    HA   GLU  29           HA       GLU  29   5.583   1.187   4.419
  229   1HB   GLU  29          2HB       GLU  29   3.997   0.480   6.338
  230   2HB   GLU  29          1HB       GLU  29   2.816   0.181   5.064
  231   1HG   GLU  29          2HG       GLU  29   3.962  -1.897   5.461
  232   2HG   GLU  29          1HG       GLU  29   4.545  -1.269   3.921
  233    H    GLN  30           H        GLN  30   2.131   1.698   3.656
  234    HA   GLN  30           HA       GLN  30   2.002   0.438   1.204
  235   1HB   GLN  30          2HB       GLN  30   0.608   3.050   1.828
  236   2HB   GLN  30          1HB       GLN  30   0.069   1.780   0.730
  237   1HG   GLN  30          2HG       GLN  30   0.346   0.348   3.027
  238   2HG   GLN  30          1HG       GLN  30  -0.098   1.922   3.686
  239   1HE2  GLN  30          1HE2      GLN  30  -1.302  -0.871   1.988
  240   2HE2  GLN  30          2HE2      GLN  30  -2.896  -0.317   1.800
  241    H    GLN  31           H        GLN  31   3.046   3.757   1.902
  242    HA   GLN  31           HA       GLN  31   3.360   4.658  -0.730
  243   1HB   GLN  31          2HB       GLN  31   3.455   6.185   1.162
  244   2HB   GLN  31          1HB       GLN  31   4.916   5.401   1.759
  245   1HG   GLN  31          2HG       GLN  31   5.358   7.524   0.485
  246   2HG   GLN  31          1HG       GLN  31   6.173   6.112  -0.183
  247   1HE2  GLN  31          1HE2      GLN  31   2.822   7.434  -0.536
  248   2HE2  GLN  31          2HE2      GLN  31   2.842   7.408  -2.233
  249    H    LYS  32           H        LYS  32   5.606   2.903   1.383
  250    HA   LYS  32           HA       LYS  32   7.875   3.007  -0.276
  251   1HB   LYS  32          2HB       LYS  32   7.431   2.029   2.189
  252   2HB   LYS  32          1HB       LYS  32   7.384   0.518   1.282
  253   1HG   LYS  32          2HG       LYS  32   9.623   2.549   1.041
  254   2HG   LYS  32          1HG       LYS  32   9.681   1.156   2.119
  255   1HD   LYS  32          2HD       LYS  32   9.056  -0.184  -0.072
  256   2HD   LYS  32          1HD       LYS  32   9.730   1.232  -0.880
  257   1HE   LYS  32          2HE       LYS  32  11.773   0.952   0.631
  258   2HE   LYS  32          1HE       LYS  32  11.111  -0.623   1.070
  259   1HZ   LYS  32          1HZ       LYS  32  10.942  -0.587  -1.640
  260   2HZ   LYS  32          2HZ       LYS  32  12.151  -1.364  -0.733
  261   3HZ   LYS  32          3HZ       LYS  32  12.417   0.197  -1.345
  262    H    LEU  33           H        LEU  33   5.363   0.491  -0.004
  263    HA   LEU  33           HA       LEU  33   6.310  -1.226  -1.999
  264   1HB   LEU  33          2HB       LEU  33   3.364  -0.770  -1.536
  265   2HB   LEU  33          1HB       LEU  33   4.198  -2.266  -1.942
  266    HG   LEU  33           HG       LEU  33   4.327  -0.782   0.696
  267   1HD1  LEU  33          1HD1      LEU  33   3.477  -3.633   0.200
  268   2HD1  LEU  33          2HD1      LEU  33   2.330  -2.299   0.073
  269   3HD1  LEU  33          3HD1      LEU  33   3.147  -2.616   1.603
  270   1HD2  LEU  33          1HD2      LEU  33   5.942  -3.083  -0.410
  271   2HD2  LEU  33          2HD2      LEU  33   5.696  -2.895   1.326
  272   3HD2  LEU  33          3HD2      LEU  33   6.519  -1.633   0.412
  273    H    ARG  34           H        ARG  34   3.893   1.380  -2.249
  274    HA   ARG  34           HA       ARG  34   3.469   1.221  -5.029
  275   1HB   ARG  34          2HB       ARG  34   2.151   2.539  -3.245
  276   2HB   ARG  34          1HB       ARG  34   3.368   3.796  -3.461
  277   1HG   ARG  34          2HG       ARG  34   2.866   3.622  -5.977
  278   2HG   ARG  34          1HG       ARG  34   1.438   2.697  -5.512
  279   1HD   ARG  34          2HD       ARG  34   2.107   5.565  -4.836
  280   2HD   ARG  34          1HD       ARG  34   0.687   4.947  -5.676
  281    HE   ARG  34           HE       ARG  34   0.759   3.816  -3.094
  282   1HH1  ARG  34          1HH2      ARG  34   0.332   6.866  -4.685
  283   2HH1  ARG  34          2HH2      ARG  34  -0.682   7.523  -3.443
  284   1HH2  ARG  34          1HH1      ARG  34  -0.566   4.675  -1.470
  285   2HH2  ARG  34          2HH1      ARG  34  -1.189   6.283  -1.626
  286    H    GLN  35           H        GLN  35   5.795   3.088  -3.110
  287    HA   GLN  35           HA       GLN  35   6.921   4.592  -5.199
  288   1HB   GLN  35          2HB       GLN  35   7.388   5.050  -2.829
  289   2HB   GLN  35          1HB       GLN  35   8.248   3.517  -2.694
  290   1HG   GLN  35          2HG       GLN  35   9.945   4.243  -4.243
  291   2HG   GLN  35          1HG       GLN  35   9.026   5.691  -4.652
  292   1HE2  GLN  35          1HE2      GLN  35  10.567   4.099  -1.805
  293   2HE2  GLN  35          2HE2      GLN  35  10.984   5.556  -1.039
  294    H    GLU  36           H        GLU  36   7.316   1.267  -4.223
  295    HA   GLU  36           HA       GLU  36   9.720   0.702  -5.616
  296   1HB   GLU  36          2HB       GLU  36   8.289  -0.703  -3.854
  297   2HB   GLU  36          1HB       GLU  36   7.632  -1.411  -5.330
  298   1HG   GLU  36          2HG       GLU  36   9.454  -2.789  -5.085
  299   2HG   GLU  36          1HG       GLU  36  10.238  -1.486  -5.973
  300    H    TYR  37           H        TYR  37   6.369  -0.219  -6.481
  301    HA   TYR  37           HA       TYR  37   6.913  -0.992  -9.119
  302   1HB   TYR  37          2HB       TYR  37   4.323   0.377  -8.664
  303   2HB   TYR  37          1HB       TYR  37   4.654  -1.178  -9.400
  304    HD1  TYR  37           HD1      TYR  37   3.083   0.294  -6.760
  305    HD2  TYR  37           HD2      TYR  37   5.864  -2.873  -7.565
  306    HE1  TYR  37           HE1      TYR  37   2.391  -0.851  -4.661
  307    HE2  TYR  37           HE2      TYR  37   5.184  -4.015  -5.470
  308    HH   TYR  37           HH       TYR  37   3.634  -4.063  -3.829
  309    H    LEU  38           H        LEU  38   5.713   2.117  -7.903
  310    HA   LEU  38           HA       LEU  38   5.486   3.465 -10.296
  311   1HB   LEU  38          2HB       LEU  38   5.940   4.304  -7.472
  312   2HB   LEU  38          1HB       LEU  38   6.130   5.516  -8.735
  313    HG   LEU  38           HG       LEU  38   3.778   5.237  -7.689
  314   1HD1  LEU  38          1HD1      LEU  38   2.753   5.896  -9.722
  315   2HD1  LEU  38          2HD1      LEU  38   3.860   4.924 -10.692
  316   3HD1  LEU  38          3HD1      LEU  38   4.437   6.388  -9.897
  317   1HD2  LEU  38          1HD2      LEU  38   3.641   2.921  -9.638
  318   2HD2  LEU  38          2HD2      LEU  38   2.405   3.449  -8.498
  319   3HD2  LEU  38          3HD2      LEU  38   3.882   2.692  -7.907
  320    H    LYS  39           H        LYS  39   8.260   3.874  -8.061
  321    HA   LYS  39           HA       LYS  39   9.881   5.175  -9.992
  322   1HB   LYS  39          2HB       LYS  39  10.633   3.738  -7.436
  323   2HB   LYS  39          1HB       LYS  39  11.742   4.722  -8.390
  324   1HG   LYS  39          2HG       LYS  39   9.110   5.878  -7.504
  325   2HG   LYS  39          1HG       LYS  39  10.466   5.821  -6.379
  326   1HD   LYS  39          2HD       LYS  39  11.816   7.202  -7.752
  327   2HD   LYS  39          1HD       LYS  39  10.780   6.962  -9.158
  328   1HE   LYS  39          2HE       LYS  39   9.847   8.346  -6.631
  329   2HE   LYS  39          1HE       LYS  39  10.512   9.209  -8.017
  330   1HZ   LYS  39          1HZ       LYS  39   8.512   9.137  -8.929
  331   2HZ   LYS  39          2HZ       LYS  39   7.905   8.201  -7.649
  332   3HZ   LYS  39          3HZ       LYS  39   8.608   7.446  -8.998
  333    H    GLY  40           H        GLY  40   9.005   1.922  -9.645
  334   1HA   GLY  40          2HA       GLY  40  11.429   0.790 -10.778
  335   2HA   GLY  40          1HA       GLY  40   9.946  -0.076 -10.396
  336    H    PHE  41           H        PHE  41   8.860   2.509 -12.014
  337    HA   PHE  41           HA       PHE  41   8.172   1.098 -14.357
  338   1HB   PHE  41          2HB       PHE  41   6.996   3.128 -13.378
  339   2HB   PHE  41          1HB       PHE  41   8.277   4.107 -14.091
  340    HD1  PHE  41           HD1      PHE  41   5.612   1.624 -14.896
  341    HD2  PHE  41           HD2      PHE  41   8.267   4.645 -16.407
  342    HE1  PHE  41           HE1      PHE  41   4.451   1.550 -17.084
  343    HE2  PHE  41           HE2      PHE  41   7.105   4.571 -18.596
  344    HZ   PHE  41           HZ       PHE  41   5.197   3.023 -18.935
  345    H    ARG  42           H        ARG  42   9.142   0.859 -16.280
  346    HA   ARG  42           HA       ARG  42  10.701   0.970 -17.955
  347   1HB   ARG  42          2HB       ARG  42  10.113   3.466 -17.751
  348   2HB   ARG  42          1HB       ARG  42  11.616   3.620 -16.843
  349   1HG   ARG  42          2HG       ARG  42  12.432   4.003 -18.969
  350   2HG   ARG  42          1HG       ARG  42  12.583   2.247 -18.923
  351   1HD   ARG  42          2HD       ARG  42  11.464   2.586 -20.948
  352   2HD   ARG  42          1HD       ARG  42  10.135   2.262 -19.841
  353    HE   ARG  42           HE       ARG  42   9.430   4.457 -20.125
  354   1HH1  ARG  42          1HH2      ARG  42  12.690   4.054 -21.236
  355   2HH1  ARG  42          2HH2      ARG  42  12.788   5.634 -21.937
  356   1HH2  ARG  42          1HH1      ARG  42   9.562   6.528 -21.041
  357   2HH2  ARG  42          2HH1      ARG  42  11.021   7.033 -21.826
  Start of MODEL    3
    1   1H    MET   1          1HT       MET   1   6.116  -7.368  -5.508
    2   2H    MET   1          2HT       MET   1   7.666  -7.674  -4.883
    3   3H    MET   1          3HT       MET   1   6.903  -8.825  -5.874
    4    HA   MET   1           HA       MET   1   7.607  -6.100  -6.803
    5   1HB   MET   1          2HB       MET   1   9.477  -7.379  -8.021
    6   2HB   MET   1          1HB       MET   1   9.709  -7.090  -6.299
    7   1HG   MET   1          2HG       MET   1   8.284  -9.599  -7.005
    8   2HG   MET   1          1HG       MET   1   9.992  -9.534  -7.438
    9   1HE   MET   1          1HE       MET   1   8.737 -11.220  -3.787
   10   2HE   MET   1          2HE       MET   1   8.600 -11.516  -5.518
   11   3HE   MET   1          3HE       MET   1   7.506 -10.376  -4.737
   12    H    ILE   2           H        ILE   2   5.688  -8.776  -7.062
   13    HA   ILE   2           HA       ILE   2   5.703  -9.226  -9.888
   14    HB   ILE   2           HB       ILE   2   4.856 -10.811  -8.073
   15   1HG1  ILE   2          2HG1      ILE   2   3.011 -10.189 -10.407
   16   2HG1  ILE   2          1HG1      ILE   2   4.471 -11.173 -10.498
   17   1HG2  ILE   2          1HG2      ILE   2   2.784 -10.469  -7.072
   18   2HG2  ILE   2          2HG2      ILE   2   2.226  -9.391  -8.348
   19   3HG2  ILE   2          3HG2      ILE   2   3.385  -8.815  -7.153
   20   1HD1  ILE   2          1HD1      ILE   2   1.888 -11.773  -9.064
   21   2HD1  ILE   2          2HD1      ILE   2   3.388 -12.583  -8.611
   22   3HD1  ILE   2          3HD1      ILE   2   2.746 -12.763 -10.244
   23    H    SER   3           H        SER   3   3.939  -8.714 -11.349
   24    HA   SER   3           HA       SER   3   2.791  -6.052 -10.787
   25   1HB   SER   3          2HB       SER   3   2.644  -5.786 -13.212
   26   2HB   SER   3          1HB       SER   3   4.289  -6.215 -12.753
   27    HG   SER   3           HG       SER   3   3.866  -8.330 -13.370
   28    H    ASN   4           H        ASN   4   1.678  -8.600  -9.845
   29    HA   ASN   4           HA       ASN   4  -1.004  -8.305 -11.004
   30   1HB   ASN   4          2HB       ASN   4  -0.249 -10.172 -12.242
   31   2HB   ASN   4          1HB       ASN   4   0.588 -10.861 -10.855
   32   1HD2  ASN   4          1HD2      ASN   4  -0.735 -11.923  -9.192
   33   2HD2  ASN   4          2HD2      ASN   4  -2.332 -12.392  -9.521
   34    H    ALA   5           H        ALA   5   0.594 -10.505  -8.677
   35    HA   ALA   5           HA       ALA   5  -1.545 -10.527  -6.847
   36   1HB   ALA   5          1HB       ALA   5   1.218 -10.916  -5.809
   37   2HB   ALA   5          2HB       ALA   5   0.675 -12.007  -7.084
   38   3HB   ALA   5          3HB       ALA   5  -0.226 -11.900  -5.572
   39    H    LYS   6           H        LYS   6   0.916  -8.175  -7.413
   40    HA   LYS   6           HA       LYS   6   0.983  -6.977  -4.825
   41   1HB   LYS   6          2HB       LYS   6   1.914  -6.286  -7.553
   42   2HB   LYS   6          1HB       LYS   6   1.615  -4.920  -6.478
   43   1HG   LYS   6          2HG       LYS   6   3.180  -7.277  -5.460
   44   2HG   LYS   6          1HG       LYS   6   3.978  -6.084  -6.484
   45   1HD   LYS   6          2HD       LYS   6   3.232  -4.284  -4.936
   46   2HD   LYS   6          1HD       LYS   6   2.516  -5.509  -3.889
   47   1HE   LYS   6          2HE       LYS   6   5.434  -5.569  -4.683
   48   2HE   LYS   6          1HE       LYS   6   4.862  -4.721  -3.245
   49   1HZ   LYS   6          1HZ       LYS   6   4.565  -7.610  -3.849
   50   2HZ   LYS   6          2HZ       LYS   6   3.823  -6.830  -2.535
   51   3HZ   LYS   6          3HZ       LYS   6   5.516  -6.914  -2.630
   52    H    ILE   7           H        ILE   7  -1.088  -6.646  -7.631
   53    HA   ILE   7           HA       ILE   7  -2.385  -4.239  -7.044
   54    HB   ILE   7           HB       ILE   7  -3.524  -6.731  -8.337
   55   1HG1  ILE   7          2HG1      ILE   7  -2.492  -4.271  -9.747
   56   2HG1  ILE   7          1HG1      ILE   7  -1.388  -5.564  -9.285
   57   1HG2  ILE   7          1HG2      ILE   7  -4.439  -3.837  -8.350
   58   2HG2  ILE   7          2HG2      ILE   7  -5.309  -5.214  -7.675
   59   3HG2  ILE   7          3HG2      ILE   7  -5.078  -5.086  -9.418
   60   1HD1  ILE   7          1HD1      ILE   7  -2.963  -7.174 -10.472
   61   2HD1  ILE   7          2HD1      ILE   7  -2.090  -6.057 -11.522
   62   3HD1  ILE   7          3HD1      ILE   7  -3.783  -5.755 -11.126
   63    H    ALA   8           H        ALA   8  -3.676  -7.509  -6.414
   64    HA   ALA   8           HA       ALA   8  -5.782  -6.736  -4.759
   65   1HB   ALA   8          1HB       ALA   8  -5.787  -8.953  -5.607
   66   2HB   ALA   8          2HB       ALA   8  -5.592  -9.116  -3.863
   67   3HB   ALA   8          3HB       ALA   8  -4.197  -9.297  -4.927
   68    H    ARG   9           H        ARG   9  -2.389  -7.290  -3.997
   69    HA   ARG   9           HA       ARG   9  -2.593  -7.452  -1.197
   70   1HB   ARG   9          2HB       ARG   9  -0.437  -6.764  -3.133
   71   2HB   ARG   9          1HB       ARG   9  -0.190  -6.297  -1.451
   72   1HG   ARG   9          2HG       ARG   9  -1.104  -9.084  -2.148
   73   2HG   ARG   9          1HG       ARG   9   0.607  -8.658  -2.204
   74   1HD   ARG   9          2HD       ARG   9   0.320  -7.752   0.166
   75   2HD   ARG   9          1HD       ARG   9  -1.253  -8.543   0.179
   76    HE   ARG   9           HE       ARG   9   0.855 -10.339  -0.589
   77   1HH1  ARG   9          1HH2      ARG   9  -0.711  -8.770   2.074
   78   2HH1  ARG   9          2HH2      ARG   9  -0.296 -10.000   3.221
   79   1HH2  ARG   9          1HH1      ARG   9   1.399 -11.953   0.913
   80   2HH2  ARG   9          2HH1      ARG   9   0.899 -11.799   2.564
   81    H    ILE  10           H        ILE  10  -1.235  -4.613  -2.850
   82    HA   ILE  10           HA       ILE  10  -1.627  -2.793  -0.793
   83    HB   ILE  10           HB       ILE  10  -1.674  -2.210  -3.766
   84   1HG1  ILE  10          2HG1      ILE  10   0.692  -2.184  -1.867
   85   2HG1  ILE  10          1HG1      ILE  10   0.298  -3.570  -2.883
   86   1HG2  ILE  10          1HG2      ILE  10  -2.398  -0.293  -2.448
   87   2HG2  ILE  10          2HG2      ILE  10  -0.750  -0.006  -3.004
   88   3HG2  ILE  10          3HG2      ILE  10  -1.043  -0.502  -1.337
   89   1HD1  ILE  10          1HD1      ILE  10   1.037  -0.778  -3.783
   90   2HD1  ILE  10          2HD1      ILE  10   0.352  -1.985  -4.871
   91   3HD1  ILE  10          3HD1      ILE  10   1.911  -2.277  -4.098
   92    H    ASN  11           H        ASN  11  -3.832  -3.705  -3.409
   93    HA   ASN  11           HA       ASN  11  -5.793  -1.736  -3.029
   94   1HB   ASN  11          2HB       ASN  11  -5.804  -3.151  -4.991
   95   2HB   ASN  11          1HB       ASN  11  -6.051  -4.589  -4.003
   96   1HD2  ASN  11          1HD2      ASN  11  -8.168  -5.250  -4.424
   97   2HD2  ASN  11          2HD2      ASN  11  -9.522  -4.225  -4.390
   98    H    GLU  12           H        GLU  12  -5.911  -5.119  -1.868
   99    HA   GLU  12           HA       GLU  12  -8.146  -4.797  -0.206
  100   1HB   GLU  12          2HB       GLU  12  -6.824  -6.945  -0.982
  101   2HB   GLU  12          1HB       GLU  12  -5.978  -6.719   0.548
  102   1HG   GLU  12          2HG       GLU  12  -8.122  -6.728   1.753
  103   2HG   GLU  12          1HG       GLU  12  -8.988  -6.911   0.230
  104    H    LEU  13           H        LEU  13  -4.688  -4.404   0.472
  105    HA   LEU  13           HA       LEU  13  -4.850  -4.042   3.256
  106   1HB   LEU  13          2HB       LEU  13  -2.779  -4.261   1.668
  107   2HB   LEU  13          1HB       LEU  13  -2.885  -2.504   1.581
  108    HG   LEU  13           HG       LEU  13  -2.816  -4.018   4.206
  109   1HD1  LEU  13          1HD1      LEU  13  -0.554  -2.842   2.564
  110   2HD1  LEU  13          2HD1      LEU  13  -0.731  -4.512   3.104
  111   3HD1  LEU  13          3HD1      LEU  13  -0.407  -3.238   4.277
  112   1HD2  LEU  13          1HD2      LEU  13  -3.505  -1.912   4.814
  113   2HD2  LEU  13          2HD2      LEU  13  -2.868  -1.168   3.348
  114   3HD2  LEU  13          3HD2      LEU  13  -1.784  -1.559   4.680
  115    H    ALA  14           H        ALA  14  -4.959  -1.665   0.608
  116    HA   ALA  14           HA       ALA  14  -5.177   0.659   2.141
  117   1HB   ALA  14          1HB       ALA  14  -4.816   0.633  -0.308
  118   2HB   ALA  14          2HB       ALA  14  -6.153   1.687   0.151
  119   3HB   ALA  14          3HB       ALA  14  -6.481   0.095  -0.534
  120    H    ALA  15           H        ALA  15  -7.700  -1.547   0.973
  121    HA   ALA  15           HA       ALA  15  -9.928  -0.074   1.883
  122   1HB   ALA  15          1HB       ALA  15  -9.808  -3.085   1.709
  123   2HB   ALA  15          2HB       ALA  15  -9.902  -2.057   0.277
  124   3HB   ALA  15          3HB       ALA  15 -11.203  -2.031   1.468
  125    H    LYS  16           H        LYS  16  -7.812  -2.378   3.496
  126    HA   LYS  16           HA       LYS  16  -9.390  -2.851   5.789
  127   1HB   LYS  16          2HB       LYS  16  -6.379  -2.887   5.447
  128   2HB   LYS  16          1HB       LYS  16  -7.230  -3.487   6.870
  129   1HG   LYS  16          2HG       LYS  16  -8.131  -4.497   4.208
  130   2HG   LYS  16          1HG       LYS  16  -6.592  -5.097   4.822
  131   1HD   LYS  16          2HD       LYS  16  -9.118  -5.098   6.489
  132   2HD   LYS  16          1HD       LYS  16  -8.657  -6.459   5.466
  133   1HE   LYS  16          2HE       LYS  16  -6.317  -5.928   6.839
  134   2HE   LYS  16          1HE       LYS  16  -7.555  -5.610   8.054
  135   1HZ   LYS  16          1HZ       LYS  16  -7.123  -8.098   6.506
  136   2HZ   LYS  16          2HZ       LYS  16  -8.551  -7.798   7.377
  137   3HZ   LYS  16          3HZ       LYS  16  -7.061  -7.892   8.188
  138    H    ALA  17           H        ALA  17  -6.529  -0.754   5.487
  139    HA   ALA  17           HA       ALA  17  -6.919   0.637   7.910
  140   1HB   ALA  17          1HB       ALA  17  -4.804   1.088   7.221
  141   2HB   ALA  17          2HB       ALA  17  -5.554   2.424   6.350
  142   3HB   ALA  17          3HB       ALA  17  -5.216   0.910   5.515
  143    H    LYS  18           H        LYS  18  -8.464   0.907   4.826
  144    HA   LYS  18           HA       LYS  18  -9.272   3.618   4.925
  145   1HB   LYS  18          2HB       LYS  18  -9.522   2.045   2.949
  146   2HB   LYS  18          1HB       LYS  18 -10.903   1.337   3.782
  147   1HG   LYS  18          2HG       LYS  18 -11.955   3.598   3.883
  148   2HG   LYS  18          1HG       LYS  18 -10.604   4.237   2.947
  149   1HD   LYS  18          2HD       LYS  18 -12.321   1.937   1.982
  150   2HD   LYS  18          1HD       LYS  18 -12.681   3.620   1.600
  151   1HE   LYS  18          2HE       LYS  18 -10.160   3.680   0.831
  152   2HE   LYS  18          1HE       LYS  18 -10.362   1.933   0.713
  153   1HZ   LYS  18          1HZ       LYS  18 -12.453   3.596  -0.456
  154   2HZ   LYS  18          2HZ       LYS  18 -11.815   2.115  -0.991
  155   3HZ   LYS  18          3HZ       LYS  18 -10.963   3.559  -1.264
  156    H    ALA  19           H        ALA  19 -11.341   0.794   5.585
  157    HA   ALA  19           HA       ALA  19 -13.080   2.368   7.293
  158   1HB   ALA  19          1HB       ALA  19 -14.330   0.246   7.541
  159   2HB   ALA  19          2HB       ALA  19 -13.060  -0.594   6.649
  160   3HB   ALA  19          3HB       ALA  19 -14.036   0.636   5.846
  161    H    GLY  20           H        GLY  20 -10.177   0.743   7.687
  162   1HA   GLY  20          2HA       GLY  20 -10.678   0.024  10.499
  163   2HA   GLY  20          1HA       GLY  20  -9.303  -0.493   9.532
  164    H    VAL  21           H        VAL  21  -9.867   2.736   8.931
  165    HA   VAL  21           HA       VAL  21  -8.862   4.695   9.573
  166    HB   VAL  21           HB       VAL  21  -8.063   3.548  12.223
  167   1HG1  VAL  21          1HG1      VAL  21  -8.647   5.760  12.992
  168   2HG1  VAL  21          2HG1      VAL  21  -9.432   6.143  11.459
  169   3HG1  VAL  21          3HG1      VAL  21  -7.681   5.948  11.529
  170   1HG2  VAL  21          1HG2      VAL  21 -10.859   3.853  11.163
  171   2HG2  VAL  21          2HG2      VAL  21 -10.537   4.203  12.861
  172   3HG2  VAL  21          3HG2      VAL  21 -10.196   2.600  12.212
  173    H    ILE  22           H        ILE  22  -7.139   4.739   8.220
  174    HA   ILE  22           HA       ILE  22  -4.867   3.104   8.310
  175    HB   ILE  22           HB       ILE  22  -5.454   4.495   6.371
  176   1HG1  ILE  22          2HG1      ILE  22  -2.839   5.679   7.099
  177   2HG1  ILE  22          1HG1      ILE  22  -2.938   3.928   7.284
  178   1HG2  ILE  22          1HG2      ILE  22  -5.225   6.879   6.385
  179   2HG2  ILE  22          2HG2      ILE  22  -4.471   6.864   7.978
  180   3HG2  ILE  22          3HG2      ILE  22  -6.182   6.468   7.808
  181   1HD1  ILE  22          1HD1      ILE  22  -2.180   4.610   5.006
  182   2HD1  ILE  22          2HD1      ILE  22  -3.723   5.432   4.772
  183   3HD1  ILE  22          3HD1      ILE  22  -3.678   3.680   4.975
  184    H    THR  23           H        THR  23  -2.849   3.319   9.232
  185    HA   THR  23           HA       THR  23  -2.677   5.233  11.480
  186    HB   THR  23           HB       THR  23  -1.396   3.653  12.659
  187    HG1  THR  23           HG1      THR  23  -0.699   1.704  11.417
  188   1HG2  THR  23          1HG2      THR  23  -3.182   1.845  11.023
  189   2HG2  THR  23          2HG2      THR  23  -3.828   2.986  12.202
  190   3HG2  THR  23          3HG2      THR  23  -2.749   1.694  12.725
  191    H    GLU  24           H        GLU  24  -0.605   6.178  11.941
  192    HA   GLU  24           HA       GLU  24   0.677   7.381   9.789
  193   1HB   GLU  24          2HB       GLU  24   1.704   6.808  12.580
  194   2HB   GLU  24          1HB       GLU  24   2.535   7.848  11.423
  195   1HG   GLU  24          2HG       GLU  24   0.590   9.324  11.298
  196   2HG   GLU  24          1HG       GLU  24  -0.315   8.260  12.372
  197    H    GLU  25           H        GLU  25   1.709   4.544  11.673
  198    HA   GLU  25           HA       GLU  25   4.079   3.998  10.256
  199   1HB   GLU  25          2HB       GLU  25   2.244   2.017  11.632
  200   2HB   GLU  25          1HB       GLU  25   3.946   1.769  11.239
  201   1HG   GLU  25          2HG       GLU  25   2.863   3.896  13.113
  202   2HG   GLU  25          1HG       GLU  25   3.657   2.404  13.610
  203    H    GLU  26           H        GLU  26   0.743   2.918   9.760
  204    HA   GLU  26           HA       GLU  26   1.260   1.108   7.650
  205   1HB   GLU  26          2HB       GLU  26  -0.868   1.176   8.925
  206   2HB   GLU  26          1HB       GLU  26  -1.248   2.725   8.176
  207   1HG   GLU  26          2HG       GLU  26  -2.372   0.879   6.991
  208   2HG   GLU  26          1HG       GLU  26  -1.193   1.670   5.948
  209    H    LYS  27           H        LYS  27   0.329   4.545   7.648
  210    HA   LYS  27           HA       LYS  27   0.082   4.969   4.917
  211   1HB   LYS  27          2HB       LYS  27  -0.395   6.628   6.750
  212   2HB   LYS  27          1HB       LYS  27   1.342   6.911   6.866
  213   1HG   LYS  27          2HG       LYS  27   1.370   7.529   4.448
  214   2HG   LYS  27          1HG       LYS  27  -0.382   7.341   4.407
  215   1HD   LYS  27          2HD       LYS  27   0.797   9.117   6.511
  216   2HD   LYS  27          1HD       LYS  27   0.727   9.720   4.855
  217   1HE   LYS  27          2HE       LYS  27  -1.671   8.542   6.281
  218   2HE   LYS  27          1HE       LYS  27  -1.303  10.267   6.280
  219   1HZ   LYS  27          1HZ       LYS  27  -1.134   9.284   3.652
  220   2HZ   LYS  27          2HZ       LYS  27  -2.202  10.445   4.284
  221   3HZ   LYS  27          3HZ       LYS  27  -2.617   8.798   4.314
  222    H    ALA  28           H        ALA  28   3.015   5.159   6.925
  223    HA   ALA  28           HA       ALA  28   4.810   5.867   4.868
  224   1HB   ALA  28          1HB       ALA  28   5.319   4.291   7.406
  225   2HB   ALA  28          2HB       ALA  28   5.398   6.045   7.242
  226   3HB   ALA  28          3HB       ALA  28   6.563   5.027   6.395
  227    H    GLU  29           H        GLU  29   3.653   2.741   6.034
  228    HA   GLU  29           HA       GLU  29   5.390   1.045   4.638
  229   1HB   GLU  29          2HB       GLU  29   3.634   0.444   6.404
  230   2HB   GLU  29          1HB       GLU  29   2.463   0.464   5.088
  231   1HG   GLU  29          2HG       GLU  29   4.243  -1.094   3.901
  232   2HG   GLU  29          1HG       GLU  29   4.749  -1.414   5.560
  233    H    GLN  30           H        GLN  30   2.091   2.032   3.695
  234    HA   GLN  30           HA       GLN  30   2.009   0.956   1.151
  235   1HB   GLN  30          2HB       GLN  30   0.833   3.672   1.683
  236   2HB   GLN  30          1HB       GLN  30   0.169   2.341   0.736
  237   1HG   GLN  30          2HG       GLN  30   0.267   1.095   3.095
  238   2HG   GLN  30          1HG       GLN  30   0.171   2.748   3.696
  239   1HE2  GLN  30          1HE2      GLN  30  -1.709   0.138   2.566
  240   2HE2  GLN  30          2HE2      GLN  30  -3.155   0.988   2.306
  241    H    GLN  31           H        GLN  31   3.520   3.953   2.224
  242    HA   GLN  31           HA       GLN  31   4.006   5.167  -0.249
  243   1HB   GLN  31          2HB       GLN  31   4.393   6.137   2.070
  244   2HB   GLN  31          1HB       GLN  31   5.910   5.238   2.094
  245   1HG   GLN  31          2HG       GLN  31   6.548   6.367  -0.055
  246   2HG   GLN  31          1HG       GLN  31   5.095   7.356   0.086
  247   1HE2  GLN  31          1HE2      GLN  31   7.643   6.339   2.446
  248   2HE2  GLN  31          2HE2      GLN  31   7.944   7.912   3.008
  249    H    LYS  32           H        LYS  32   6.116   2.965   1.610
  250    HA   LYS  32           HA       LYS  32   8.228   2.856  -0.232
  251   1HB   LYS  32          2HB       LYS  32   8.401   2.002   2.068
  252   2HB   LYS  32          1HB       LYS  32   7.277   0.701   1.673
  253   1HG   LYS  32          2HG       LYS  32   8.810  -0.303   0.146
  254   2HG   LYS  32          1HG       LYS  32   9.843   1.128   0.127
  255   1HD   LYS  32          2HD       LYS  32  10.512   0.751   2.427
  256   2HD   LYS  32          1HD       LYS  32   9.355  -0.571   2.591
  257   1HE   LYS  32          2HE       LYS  32  10.574  -1.958   1.078
  258   2HE   LYS  32          1HE       LYS  32  11.562  -0.608   0.523
  259   1HZ   LYS  32          1HZ       LYS  32  11.737  -2.143   3.008
  260   2HZ   LYS  32          2HZ       LYS  32  12.163  -0.499   3.056
  261   3HZ   LYS  32          3HZ       LYS  32  12.976  -1.559   2.007
  262    H    LEU  33           H        LEU  33   5.461   0.639   0.167
  263    HA   LEU  33           HA       LEU  33   6.041  -1.104  -1.940
  264   1HB   LEU  33          2HB       LEU  33   3.308  -0.236  -0.958
  265   2HB   LEU  33          1HB       LEU  33   3.661  -1.693  -1.886
  266    HG   LEU  33           HG       LEU  33   4.863  -1.073   0.831
  267   1HD1  LEU  33          1HD1      LEU  33   2.449  -1.428   1.036
  268   2HD1  LEU  33          2HD1      LEU  33   3.312  -2.834   1.657
  269   3HD1  LEU  33          3HD1      LEU  33   2.560  -2.894   0.063
  270   1HD2  LEU  33          1HD2      LEU  33   4.954  -3.444  -1.047
  271   2HD2  LEU  33          2HD2      LEU  33   5.305  -3.611   0.673
  272   3HD2  LEU  33          3HD2      LEU  33   6.306  -2.565  -0.332
  273    H    ARG  34           H        ARG  34   4.303   1.976  -1.925
  274    HA   ARG  34           HA       ARG  34   3.492   1.873  -4.664
  275   1HB   ARG  34          2HB       ARG  34   3.615   4.004  -2.555
  276   2HB   ARG  34          1HB       ARG  34   3.295   4.446  -4.232
  277   1HG   ARG  34          2HG       ARG  34   1.311   3.152  -4.315
  278   2HG   ARG  34          1HG       ARG  34   1.736   2.255  -2.857
  279   1HD   ARG  34          2HD       ARG  34  -0.036   4.129  -2.636
  280   2HD   ARG  34          1HD       ARG  34   1.260   4.082  -1.445
  281    HE   ARG  34           HE       ARG  34   2.128   5.732  -3.525
  282   1HH1  ARG  34          1HH2      ARG  34  -0.418   5.604  -1.177
  283   2HH1  ARG  34          2HH2      ARG  34  -0.564   7.325  -1.045
  284   1HH2  ARG  34          1HH1      ARG  34   1.941   7.981  -3.347
  285   2HH2  ARG  34          2HH1      ARG  34   0.772   8.670  -2.271
  286    H    GLN  35           H        GLN  35   6.313   3.124  -2.969
  287    HA   GLN  35           HA       GLN  35   7.407   4.701  -5.018
  288   1HB   GLN  35          2HB       GLN  35   8.128   4.412  -2.528
  289   2HB   GLN  35          1HB       GLN  35   9.131   3.101  -3.146
  290   1HG   GLN  35          2HG       GLN  35  10.624   4.840  -3.401
  291   2HG   GLN  35          1HG       GLN  35   9.792   4.965  -4.949
  292   1HE2  GLN  35          1HE2      GLN  35  10.926   6.932  -2.611
  293   2HE2  GLN  35          2HE2      GLN  35   9.754   8.159  -2.639
  294    H    GLU  36           H        GLU  36   8.001   1.276  -4.209
  295    HA   GLU  36           HA       GLU  36   9.795   0.774  -6.344
  296   1HB   GLU  36          2HB       GLU  36   9.428  -0.653  -4.272
  297   2HB   GLU  36          1HB       GLU  36   7.966  -1.256  -5.052
  298   1HG   GLU  36          2HG       GLU  36   9.353  -1.960  -7.011
  299   2HG   GLU  36          1HG       GLU  36  10.794  -1.458  -6.128
  300    H    TYR  37           H        TYR  37   6.289   0.351  -6.006
  301    HA   TYR  37           HA       TYR  37   5.721  -0.912  -8.419
  302   1HB   TYR  37          2HB       TYR  37   4.092  -0.471  -6.562
  303   2HB   TYR  37          1HB       TYR  37   4.012   1.208  -7.096
  304    HD1  TYR  37           HD1      TYR  37   3.126  -2.268  -7.894
  305    HD2  TYR  37           HD2      TYR  37   3.006   1.805  -9.259
  306    HE1  TYR  37           HE1      TYR  37   1.463  -2.895  -9.623
  307    HE2  TYR  37           HE2      TYR  37   1.344   1.176 -10.987
  308    HH   TYR  37           HH       TYR  37  -0.121  -0.461 -11.620
  309    H    LEU  38           H        LEU  38   5.826   2.583  -7.729
  310    HA   LEU  38           HA       LEU  38   5.209   3.502 -10.300
  311   1HB   LEU  38          2HB       LEU  38   6.427   4.621  -7.859
  312   2HB   LEU  38          1HB       LEU  38   6.915   5.425  -9.349
  313    HG   LEU  38           HG       LEU  38   4.837   6.378  -8.251
  314   1HD1  LEU  38          1HD1      LEU  38   4.771   7.119 -10.393
  315   2HD1  LEU  38          2HD1      LEU  38   3.515   5.904 -10.614
  316   3HD1  LEU  38          3HD1      LEU  38   5.182   5.538 -11.054
  317   1HD2  LEU  38          1HD2      LEU  38   3.366   4.011  -9.385
  318   2HD2  LEU  38          2HD2      LEU  38   2.843   5.159  -8.154
  319   3HD2  LEU  38          3HD2      LEU  38   4.033   3.920  -7.755
  320    H    LYS  39           H        LYS  39   8.340   2.703  -8.841
  321    HA   LYS  39           HA       LYS  39   9.939   3.491 -11.044
  322   1HB   LYS  39          2HB       LYS  39  10.777   3.079  -8.718
  323   2HB   LYS  39          1HB       LYS  39  10.556   1.351  -8.993
  324   1HG   LYS  39          2HG       LYS  39  12.211   1.292 -10.687
  325   2HG   LYS  39          1HG       LYS  39  12.202   3.046 -10.874
  326   1HD   LYS  39          2HD       LYS  39  13.182   3.320  -8.649
  327   2HD   LYS  39          1HD       LYS  39  13.118   1.578  -8.383
  328   1HE   LYS  39          2HE       LYS  39  14.610   2.778 -10.720
  329   2HE   LYS  39          1HE       LYS  39  15.374   2.540  -9.148
  330   1HZ   LYS  39          1HZ       LYS  39  15.542   0.680 -10.884
  331   2HZ   LYS  39          2HZ       LYS  39  13.933   0.332 -10.468
  332   3HZ   LYS  39          3HZ       LYS  39  15.153   0.257  -9.289
  333    H    GLY  40           H        GLY  40   8.137   0.592 -10.304
  334   1HA   GLY  40          2HA       GLY  40   9.348  -0.928 -12.483
  335   2HA   GLY  40          1HA       GLY  40   8.117  -1.502 -11.363
  336    H    PHE  41           H        PHE  41   7.114   1.471 -12.352
  337    HA   PHE  41           HA       PHE  41   4.967   0.457 -13.903
  338   1HB   PHE  41          2HB       PHE  41   5.034   2.609 -12.513
  339   2HB   PHE  41          1HB       PHE  41   5.858   3.340 -13.889
  340    HD1  PHE  41           HD1      PHE  41   4.648   4.024 -15.821
  341    HD2  PHE  41           HD2      PHE  41   2.760   1.522 -12.880
  342    HE1  PHE  41           HE1      PHE  41   2.466   4.332 -16.957
  343    HE2  PHE  41           HE2      PHE  41   0.579   1.832 -14.018
  344    HZ   PHE  41           HZ       PHE  41   0.432   3.236 -16.056
  345    H    ARG  42           H        ARG  42   7.193   2.985 -15.054
  346    HA   ARG  42           HA       ARG  42   6.783   2.384 -17.782
  347   1HB   ARG  42          2HB       ARG  42   7.580   4.576 -16.797
  348   2HB   ARG  42          1HB       ARG  42   9.171   3.836 -16.630
  349   1HG   ARG  42          2HG       ARG  42   8.615   3.201 -19.217
  350   2HG   ARG  42          1HG       ARG  42   7.740   4.725 -19.075
  351   1HD   ARG  42          2HD       ARG  42  10.675   4.255 -18.492
  352   2HD   ARG  42          1HD       ARG  42   9.999   5.207 -19.811
  353    HE   ARG  42           HE       ARG  42   8.993   6.353 -17.510
  354   1HH1  ARG  42          1HH2      ARG  42  12.122   5.614 -18.803
  355   2HH1  ARG  42          2HH2      ARG  42  12.907   6.950 -18.029
  356   1HH2  ARG  42          1HH1      ARG  42  10.019   8.104 -16.497
  357   2HH2  ARG  42          2HH1      ARG  42  11.716   8.360 -16.727
  Start of MODEL    4
    1   1H    MET   1          1HT       MET   1  -9.802  -7.485 -14.882
    2   2H    MET   1          2HT       MET   1 -11.000  -8.151 -13.878
    3   3H    MET   1          3HT       MET   1  -9.876  -9.163 -14.651
    4    HA   MET   1           HA       MET   1  -9.588  -7.552 -12.247
    5   1HB   MET   1          2HB       MET   1  -7.922  -9.919 -13.062
    6   2HB   MET   1          1HB       MET   1  -8.477  -9.448 -11.456
    7   1HG   MET   1          2HG       MET   1 -10.861  -9.912 -12.381
    8   2HG   MET   1          1HG       MET   1 -10.029 -10.794 -13.663
    9   1HE   MET   1          1HE       MET   1 -10.828 -13.975 -11.946
   10   2HE   MET   1          2HE       MET   1 -10.468 -13.129 -13.450
   11   3HE   MET   1          3HE       MET   1 -11.839 -12.621 -12.467
   12    H    ILE   2           H        ILE   2  -6.777  -8.323 -12.030
   13    HA   ILE   2           HA       ILE   2  -5.509  -6.570 -14.041
   14    HB   ILE   2           HB       ILE   2  -5.928  -5.294 -11.933
   15   1HG1  ILE   2          2HG1      ILE   2  -2.977  -5.661 -11.933
   16   2HG1  ILE   2          1HG1      ILE   2  -3.702  -5.303 -13.502
   17   1HG2  ILE   2          1HG2      ILE   2  -3.901  -7.140 -10.655
   18   2HG2  ILE   2          2HG2      ILE   2  -5.636  -7.406 -10.488
   19   3HG2  ILE   2          3HG2      ILE   2  -4.909  -5.920  -9.878
   20   1HD1  ILE   2          1HD1      ILE   2  -4.654  -3.265 -12.709
   21   2HD1  ILE   2          2HD1      ILE   2  -2.995  -3.283 -12.107
   22   3HD1  ILE   2          3HD1      ILE   2  -4.328  -3.685 -11.026
   23    H    SER   3           H        SER   3  -5.495  -9.384 -12.109
   24    HA   SER   3           HA       SER   3  -4.168 -11.260 -12.167
   25   1HB   SER   3          2HB       SER   3  -2.269  -9.910 -14.070
   26   2HB   SER   3          1HB       SER   3  -2.646 -11.621 -13.912
   27    HG   SER   3           HG       SER   3  -3.702 -10.754 -15.711
   28    H    ASN   4           H        ASN   4  -2.378  -8.195 -12.214
   29    HA   ASN   4           HA       ASN   4  -0.120  -9.078 -10.774
   30   1HB   ASN   4          2HB       ASN   4  -1.175  -6.273 -10.548
   31   2HB   ASN   4          1HB       ASN   4   0.494  -6.827 -10.616
   32   1HD2  ASN   4          1HD2      ASN   4  -0.184  -8.680 -12.947
   33   2HD2  ASN   4          2HD2      ASN   4  -0.307  -7.644 -14.284
   34    H    ALA   5           H        ALA   5  -0.256 -10.034  -8.845
   35    HA   ALA   5           HA       ALA   5  -2.334  -9.667  -6.962
   36   1HB   ALA   5          1HB       ALA   5   0.470 -10.627  -6.352
   37   2HB   ALA   5          2HB       ALA   5  -0.755 -11.642  -7.112
   38   3HB   ALA   5          3HB       ALA   5  -1.015 -11.017  -5.484
   39    H    LYS   6           H        LYS   6   0.098  -7.592  -7.864
   40    HA   LYS   6           HA       LYS   6   0.880  -6.451  -5.381
   41   1HB   LYS   6          2HB       LYS   6   0.864  -5.335  -8.196
   42   2HB   LYS   6          1HB       LYS   6   1.597  -4.521  -6.813
   43   1HG   LYS   6          2HG       LYS   6   3.463  -5.669  -7.480
   44   2HG   LYS   6          1HG       LYS   6   2.723  -6.978  -6.558
   45   1HD   LYS   6          2HD       LYS   6   1.575  -7.724  -8.674
   46   2HD   LYS   6          1HD       LYS   6   2.511  -6.513  -9.548
   47   1HE   LYS   6          2HE       LYS   6   3.958  -8.451  -7.772
   48   2HE   LYS   6          1HE       LYS   6   3.399  -8.998  -9.352
   49   1HZ   LYS   6          1HZ       LYS   6   4.765  -7.546 -10.444
   50   2HZ   LYS   6          2HZ       LYS   6   5.724  -7.903  -9.090
   51   3HZ   LYS   6          3HZ       LYS   6   4.844  -6.451  -9.152
   52    H    ILE   7           H        ILE   7  -1.302  -5.165  -7.906
   53    HA   ILE   7           HA       ILE   7  -2.327  -3.037  -6.420
   54    HB   ILE   7           HB       ILE   7  -3.428  -4.637  -8.724
   55   1HG1  ILE   7          2HG1      ILE   7  -3.209  -2.200  -9.683
   56   2HG1  ILE   7          1HG1      ILE   7  -2.166  -1.936  -8.286
   57   1HG2  ILE   7          1HG2      ILE   7  -5.459  -3.995  -7.726
   58   2HG2  ILE   7          2HG2      ILE   7  -5.123  -2.640  -8.803
   59   3HG2  ILE   7          3HG2      ILE   7  -4.780  -2.502  -7.079
   60   1HD1  ILE   7          1HD1      ILE   7  -0.636  -3.628  -8.984
   61   2HD1  ILE   7          2HD1      ILE   7  -1.005  -2.702 -10.438
   62   3HD1  ILE   7          3HD1      ILE   7  -1.772  -4.268 -10.174
   63    H    ALA   8           H        ALA   8  -3.685  -6.314  -6.845
   64    HA   ALA   8           HA       ALA   8  -5.950  -6.013  -5.244
   65   1HB   ALA   8          1HB       ALA   8  -5.899  -8.463  -5.003
   66   2HB   ALA   8          2HB       ALA   8  -4.244  -8.489  -5.610
   67   3HB   ALA   8          3HB       ALA   8  -5.561  -7.979  -6.665
   68    H    ARG   9           H        ARG   9  -2.651  -6.968  -4.337
   69    HA   ARG   9           HA       ARG   9  -3.153  -7.500  -1.614
   70   1HB   ARG   9          2HB       ARG   9  -1.087  -8.228  -2.644
   71   2HB   ARG   9          1HB       ARG   9  -0.639  -6.567  -3.021
   72   1HG   ARG   9          2HG       ARG   9   0.560  -7.376  -1.020
   73   2HG   ARG   9          1HG       ARG   9  -0.517  -6.040  -0.614
   74   1HD   ARG   9          2HD       ARG   9  -0.558  -8.069   0.960
   75   2HD   ARG   9          1HD       ARG   9  -2.115  -7.487   0.381
   76    HE   ARG   9           HE       ARG   9  -2.357  -9.461  -0.841
   77   1HH1  ARG   9          1HH2      ARG   9   0.880  -9.120   0.360
   78   2HH1  ARG   9          2HH2      ARG   9   1.343 -10.739  -0.047
   79   1HH2  ARG   9          1HH1      ARG   9  -1.750 -11.583  -1.361
   80   2HH2  ARG   9          2HH1      ARG   9  -0.144 -12.131  -1.013
   81    H    ILE  10           H        ILE  10  -1.434  -4.648  -2.897
   82    HA   ILE  10           HA       ILE  10  -1.554  -3.077  -0.620
   83    HB   ILE  10           HB       ILE  10  -1.500  -2.297  -3.541
   84   1HG1  ILE  10          2HG1      ILE  10   0.700  -2.062  -1.485
   85   2HG1  ILE  10          1HG1      ILE  10   0.412  -3.586  -2.324
   86   1HG2  ILE  10          1HG2      ILE  10  -1.336  -0.603  -1.040
   87   2HG2  ILE  10          2HG2      ILE  10  -2.364  -0.362  -2.452
   88   3HG2  ILE  10          3HG2      ILE  10  -0.628  -0.081  -2.570
   89   1HD1  ILE  10          1HD1      ILE  10   0.910  -0.928  -3.700
   90   2HD1  ILE  10          2HD1      ILE  10   0.723  -2.495  -4.490
   91   3HD1  ILE  10          3HD1      ILE  10   2.125  -2.186  -3.468
   92    H    ASN  11           H        ASN  11  -3.924  -3.327  -3.250
   93    HA   ASN  11           HA       ASN  11  -5.660  -1.274  -2.451
   94   1HB   ASN  11          2HB       ASN  11  -5.929  -2.298  -4.610
   95   2HB   ASN  11          1HB       ASN  11  -6.202  -3.881  -3.884
   96   1HD2  ASN  11          1HD2      ASN  11  -8.377  -4.399  -4.073
   97   2HD2  ASN  11          2HD2      ASN  11  -9.661  -3.315  -3.835
   98    H    GLU  12           H        GLU  12  -5.782  -4.755  -1.688
   99    HA   GLU  12           HA       GLU  12  -8.027  -4.683  -0.010
  100   1HB   GLU  12          2HB       GLU  12  -7.137  -6.781  -0.838
  101   2HB   GLU  12          1HB       GLU  12  -5.617  -6.519   0.012
  102   1HG   GLU  12          2HG       GLU  12  -8.190  -6.527   1.564
  103   2HG   GLU  12          1HG       GLU  12  -7.471  -8.060   1.080
  104    H    LEU  13           H        LEU  13  -4.569  -4.346   0.740
  105    HA   LEU  13           HA       LEU  13  -4.789  -4.132   3.533
  106   1HB   LEU  13          2HB       LEU  13  -2.705  -4.245   1.846
  107   2HB   LEU  13          1HB       LEU  13  -2.720  -2.507   2.135
  108    HG   LEU  13           HG       LEU  13  -2.663  -4.633   4.301
  109   1HD1  LEU  13          1HD1      LEU  13  -0.496  -2.750   3.316
  110   2HD1  LEU  13          2HD1      LEU  13  -0.548  -4.489   3.020
  111   3HD1  LEU  13          3HD1      LEU  13  -0.346  -3.879   4.663
  112   1HD2  LEU  13          1HD2      LEU  13  -3.682  -2.774   5.297
  113   2HD2  LEU  13          2HD2      LEU  13  -2.787  -1.623   4.303
  114   3HD2  LEU  13          3HD2      LEU  13  -1.977  -2.468   5.622
  115    H    ALA  14           H        ALA  14  -4.644  -1.573   1.057
  116    HA   ALA  14           HA       ALA  14  -4.808   0.652   2.704
  117   1HB   ALA  14          1HB       ALA  14  -5.861   1.782   0.716
  118   2HB   ALA  14          2HB       ALA  14  -5.913   0.206  -0.074
  119   3HB   ALA  14          3HB       ALA  14  -4.361   0.923   0.361
  120    H    ALA  15           H        ALA  15  -7.553  -0.944   1.055
  121    HA   ALA  15           HA       ALA  15  -9.566   0.578   2.308
  122   1HB   ALA  15          1HB       ALA  15  -9.593  -2.149   1.015
  123   2HB   ALA  15          2HB       ALA  15 -10.143  -0.616   0.338
  124   3HB   ALA  15          3HB       ALA  15 -11.052  -1.380   1.643
  125    H    LYS  16           H        LYS  16  -7.995  -2.437   3.260
  126    HA   LYS  16           HA       LYS  16  -9.736  -3.139   5.369
  127   1HB   LYS  16          2HB       LYS  16  -7.980  -4.636   4.366
  128   2HB   LYS  16          1HB       LYS  16  -6.761  -3.698   5.231
  129   1HG   LYS  16          2HG       LYS  16  -8.220  -4.186   7.337
  130   2HG   LYS  16          1HG       LYS  16  -8.932  -5.464   6.352
  131   1HD   LYS  16          2HD       LYS  16  -6.770  -6.506   6.026
  132   2HD   LYS  16          1HD       LYS  16  -5.951  -5.156   6.810
  133   1HE   LYS  16          2HE       LYS  16  -6.158  -7.017   8.386
  134   2HE   LYS  16          1HE       LYS  16  -7.174  -5.677   8.918
  135   1HZ   LYS  16          1HZ       LYS  16  -8.198  -7.897   7.247
  136   2HZ   LYS  16          2HZ       LYS  16  -9.093  -6.737   8.107
  137   3HZ   LYS  16          3HZ       LYS  16  -8.232  -7.940   8.942
  138    H    ALA  17           H        ALA  17  -6.539  -1.570   5.504
  139    HA   ALA  17           HA       ALA  17  -6.606  -0.858   8.208
  140   1HB   ALA  17          1HB       ALA  17  -5.305   0.927   6.177
  141   2HB   ALA  17          2HB       ALA  17  -4.682  -0.703   6.432
  142   3HB   ALA  17          3HB       ALA  17  -4.725   0.443   7.771
  143    H    LYS  18           H        LYS  18  -8.173   0.516   5.418
  144    HA   LYS  18           HA       LYS  18  -8.710   3.104   6.458
  145   1HB   LYS  18          2HB       LYS  18  -9.098   2.050   4.048
  146   2HB   LYS  18          1HB       LYS  18 -10.711   1.751   4.692
  147   1HG   LYS  18          2HG       LYS  18  -9.308   4.441   4.612
  148   2HG   LYS  18          1HG       LYS  18 -10.629   3.934   3.559
  149   1HD   LYS  18          2HD       LYS  18 -11.976   3.533   5.714
  150   2HD   LYS  18          1HD       LYS  18 -10.710   4.445   6.538
  151   1HE   LYS  18          2HE       LYS  18 -11.101   6.300   4.843
  152   2HE   LYS  18          1HE       LYS  18 -12.531   5.410   4.321
  153   1HZ   LYS  18          1HZ       LYS  18 -13.414   6.767   5.916
  154   2HZ   LYS  18          2HZ       LYS  18 -12.010   6.764   6.873
  155   3HZ   LYS  18          3HZ       LYS  18 -13.037   5.411   6.862
  156    H    ALA  19           H        ALA  19 -10.927   0.313   6.200
  157    HA   ALA  19           HA       ALA  19 -12.789   1.422   8.078
  158   1HB   ALA  19          1HB       ALA  19 -12.651  -1.480   7.279
  159   2HB   ALA  19          2HB       ALA  19 -13.257  -0.250   6.173
  160   3HB   ALA  19          3HB       ALA  19 -14.068  -0.525   7.715
  161    H    GLY  20           H        GLY  20  -9.777   0.217   8.554
  162   1HA   GLY  20          2HA       GLY  20 -10.410  -1.199  11.058
  163   2HA   GLY  20          1HA       GLY  20  -8.852  -1.194  10.239
  164    H    VAL  21           H        VAL  21  -7.670   0.892  10.198
  165    HA   VAL  21           HA       VAL  21  -8.383   2.892  12.177
  166    HB   VAL  21           HB       VAL  21  -6.093   2.577  13.319
  167   1HG1  VAL  21          1HG1      VAL  21  -7.066   1.259  15.009
  168   2HG1  VAL  21          2HG1      VAL  21  -7.991   0.300  13.855
  169   3HG1  VAL  21          3HG1      VAL  21  -8.464   1.964  14.197
  170   1HG2  VAL  21          1HG2      VAL  21  -5.257   0.936  11.623
  171   2HG2  VAL  21          2HG2      VAL  21  -6.465  -0.216  12.190
  172   3HG2  VAL  21          3HG2      VAL  21  -5.177   0.317  13.272
  173    H    ILE  22           H        ILE  22  -6.041   1.579   9.907
  174    HA   ILE  22           HA       ILE  22  -4.369   2.542   8.664
  175    HB   ILE  22           HB       ILE  22  -6.190   3.009   7.212
  176   1HG1  ILE  22          2HG1      ILE  22  -5.482   5.106   6.155
  177   2HG1  ILE  22          1HG1      ILE  22  -4.642   5.586   7.624
  178   1HG2  ILE  22          1HG2      ILE  22  -7.757   3.968   8.846
  179   2HG2  ILE  22          2HG2      ILE  22  -7.605   5.021   7.442
  180   3HG2  ILE  22          3HG2      ILE  22  -6.778   5.431   8.942
  181   1HD1  ILE  22          1HD1      ILE  22  -3.234   4.506   5.745
  182   2HD1  ILE  22          2HD1      ILE  22  -3.994   2.990   6.226
  183   3HD1  ILE  22          3HD1      ILE  22  -3.011   3.889   7.382
  184    H    THR  23           H        THR  23  -2.736   3.150   9.947
  185    HA   THR  23           HA       THR  23  -2.799   5.864  11.116
  186    HB   THR  23           HB       THR  23  -1.019   5.087  12.611
  187    HG1  THR  23           HG1      THR  23  -0.044   3.244  12.289
  188   1HG2  THR  23          1HG2      THR  23  -3.115   4.719  13.587
  189   2HG2  THR  23          2HG2      THR  23  -2.381   3.118  13.663
  190   3HG2  THR  23          3HG2      THR  23  -3.560   3.489  12.405
  191    H    GLU  24           H        GLU  24  -0.752   7.069  11.079
  192    HA   GLU  24           HA       GLU  24   0.263   7.464   8.523
  193   1HB   GLU  24          2HB       GLU  24   0.491   8.861  10.766
  194   2HB   GLU  24          1HB       GLU  24   2.031   8.011  10.879
  195   1HG   GLU  24          2HG       GLU  24   1.111   9.611   8.468
  196   2HG   GLU  24          1HG       GLU  24   2.232  10.197   9.694
  197    H    GLU  25           H        GLU  25   1.539   5.462  11.156
  198    HA   GLU  25           HA       GLU  25   3.981   4.705  10.049
  199   1HB   GLU  25          2HB       GLU  25   3.120   4.189  12.374
  200   2HB   GLU  25          1HB       GLU  25   2.174   2.888  11.652
  201   1HG   GLU  25          2HG       GLU  25   4.357   2.033  10.647
  202   2HG   GLU  25          1HG       GLU  25   5.187   3.179  11.695
  203    H    GLU  26           H        GLU  26   0.868   2.961   9.846
  204    HA   GLU  26           HA       GLU  26   1.771   0.994   8.023
  205   1HB   GLU  26          2HB       GLU  26  -0.960   2.023   8.786
  206   2HB   GLU  26          1HB       GLU  26  -0.759   0.799   7.530
  207   1HG   GLU  26          2HG       GLU  26   0.224  -0.749   9.044
  208   2HG   GLU  26          1HG       GLU  26   0.491   0.494  10.265
  209    H    LYS  27           H        LYS  27   0.039   4.060   7.546
  210    HA   LYS  27           HA       LYS  27  -0.370   3.949   4.797
  211   1HB   LYS  27          2HB       LYS  27  -1.067   5.738   6.594
  212   2HB   LYS  27          1HB       LYS  27   0.426   6.533   6.099
  213   1HG   LYS  27          2HG       LYS  27  -0.335   6.509   3.751
  214   2HG   LYS  27          1HG       LYS  27  -1.828   5.706   4.240
  215   1HD   LYS  27          2HD       LYS  27  -0.983   8.344   5.449
  216   2HD   LYS  27          1HD       LYS  27  -1.912   8.271   3.952
  217   1HE   LYS  27          2HE       LYS  27  -3.605   6.844   5.172
  218   2HE   LYS  27          1HE       LYS  27  -2.722   7.179   6.662
  219   1HZ   LYS  27          1HZ       LYS  27  -4.511   8.736   6.428
  220   2HZ   LYS  27          2HZ       LYS  27  -3.994   9.176   4.870
  221   3HZ   LYS  27          3HZ       LYS  27  -3.044   9.563   6.224
  222    H    ALA  28           H        ALA  28   2.469   5.114   6.589
  223    HA   ALA  28           HA       ALA  28   3.956   6.011   4.373
  224   1HB   ALA  28          1HB       ALA  28   4.696   6.674   6.529
  225   2HB   ALA  28          2HB       ALA  28   5.944   5.589   5.918
  226   3HB   ALA  28          3HB       ALA  28   4.773   5.008   7.101
  227    H    GLU  29           H        GLU  29   3.739   2.840   5.929
  228    HA   GLU  29           HA       GLU  29   5.798   1.541   4.546
  229   1HB   GLU  29          2HB       GLU  29   4.309   0.745   6.540
  230   2HB   GLU  29          1HB       GLU  29   3.259   0.113   5.274
  231   1HG   GLU  29          2HG       GLU  29   4.799  -1.644   5.907
  232   2HG   GLU  29          1HG       GLU  29   5.249  -1.075   4.301
  233    H    GLN  30           H        GLN  30   2.318   1.103   3.879
  234    HA   GLN  30           HA       GLN  30   2.554  -0.129   1.416
  235   1HB   GLN  30          2HB       GLN  30   0.255   0.745   0.955
  236   2HB   GLN  30          1HB       GLN  30   0.419  -0.023   2.532
  237   1HG   GLN  30          2HG       GLN  30   0.647   2.168   3.602
  238   2HG   GLN  30          1HG       GLN  30   0.569   2.965   2.033
  239   1HE2  GLN  30          1HE2      GLN  30  -1.543   1.411   0.851
  240   2HE2  GLN  30          2HE2      GLN  30  -2.971   1.721   1.711
  241    H    GLN  31           H        GLN  31   2.674   3.310   2.170
  242    HA   GLN  31           HA       GLN  31   2.425   4.353  -0.420
  243   1HB   GLN  31          2HB       GLN  31   2.395   5.690   1.691
  244   2HB   GLN  31          1HB       GLN  31   4.139   5.464   1.813
  245   1HG   GLN  31          2HG       GLN  31   4.494   6.614  -0.292
  246   2HG   GLN  31          1HG       GLN  31   2.758   6.704  -0.583
  247   1HE2  GLN  31          1HE2      GLN  31   5.293   8.587   0.417
  248   2HE2  GLN  31          2HE2      GLN  31   4.459   9.676   1.417
  249    H    LYS  32           H        LYS  32   5.241   3.107   1.315
  250    HA   LYS  32           HA       LYS  32   7.231   3.888  -0.512
  251   1HB   LYS  32          2HB       LYS  32   7.595   2.956   1.804
  252   2HB   LYS  32          1HB       LYS  32   7.240   1.359   1.146
  253   1HG   LYS  32          2HG       LYS  32   9.148   1.362  -0.231
  254   2HG   LYS  32          1HG       LYS  32   9.328   3.114  -0.140
  255   1HD   LYS  32          2HD       LYS  32   9.524   1.499   2.384
  256   2HD   LYS  32          1HD       LYS  32  10.904   1.545   1.289
  257   1HE   LYS  32          2HE       LYS  32   9.511   4.048   2.268
  258   2HE   LYS  32          1HE       LYS  32  10.894   3.335   3.099
  259   1HZ   LYS  32          1HZ       LYS  32  10.959   4.005   0.218
  260   2HZ   LYS  32          2HZ       LYS  32  12.266   3.681   1.251
  261   3HZ   LYS  32          3HZ       LYS  32  11.390   5.127   1.414
  262    H    LEU  33           H        LEU  33   5.397   0.836  -0.269
  263    HA   LEU  33           HA       LEU  33   6.541  -0.513  -2.426
  264   1HB   LEU  33          2HB       LEU  33   3.748  -0.612  -1.280
  265   2HB   LEU  33          1HB       LEU  33   4.301  -1.707  -2.547
  266    HG   LEU  33           HG       LEU  33   5.678  -1.369   0.136
  267   1HD1  LEU  33          1HD1      LEU  33   3.638  -3.361  -0.865
  268   2HD1  LEU  33          2HD1      LEU  33   3.588  -2.397   0.612
  269   3HD1  LEU  33          3HD1      LEU  33   4.728  -3.736   0.468
  270   1HD2  LEU  33          1HD2      LEU  33   6.485  -3.760  -0.796
  271   2HD2  LEU  33          2HD2      LEU  33   7.334  -2.269  -1.198
  272   3HD2  LEU  33          3HD2      LEU  33   6.185  -2.964  -2.341
  273    H    ARG  34           H        ARG  34   3.743   1.680  -2.375
  274    HA   ARG  34           HA       ARG  34   2.943   1.484  -5.028
  275   1HB   ARG  34          2HB       ARG  34   1.764   2.763  -3.229
  276   2HB   ARG  34          1HB       ARG  34   2.996   4.015  -3.367
  277   1HG   ARG  34          2HG       ARG  34   1.304   4.821  -4.774
  278   2HG   ARG  34          1HG       ARG  34   2.377   4.003  -5.908
  279   1HD   ARG  34          2HD       ARG  34   0.963   2.032  -5.908
  280   2HD   ARG  34          1HD       ARG  34  -0.048   2.708  -4.635
  281    HE   ARG  34           HE       ARG  34  -0.197   4.571  -6.630
  282   1HH1  ARG  34          1HH2      ARG  34  -0.683   1.146  -6.425
  283   2HH1  ARG  34          2HH2      ARG  34  -1.877   1.103  -7.680
  284   1HH2  ARG  34          1HH1      ARG  34  -1.762   4.516  -8.275
  285   2HH2  ARG  34          2HH1      ARG  34  -2.483   3.009  -8.728
  286    H    GLN  35           H        GLN  35   5.189   3.879  -3.637
  287    HA   GLN  35           HA       GLN  35   5.967   5.029  -6.096
  288   1HB   GLN  35          2HB       GLN  35   6.305   6.170  -3.964
  289   2HB   GLN  35          1HB       GLN  35   7.431   4.913  -3.447
  290   1HG   GLN  35          2HG       GLN  35   9.038   5.529  -5.091
  291   2HG   GLN  35          1HG       GLN  35   7.870   6.511  -5.975
  292   1HE2  GLN  35          1HE2      GLN  35   9.540   6.350  -2.787
  293   2HE2  GLN  35          2HE2      GLN  35   9.557   8.031  -2.550
  294    H    GLU  36           H        GLU  36   7.285   2.346  -4.208
  295    HA   GLU  36           HA       GLU  36   9.683   1.991  -5.663
  296   1HB   GLU  36          2HB       GLU  36   8.985   0.977  -3.400
  297   2HB   GLU  36          1HB       GLU  36   8.156  -0.251  -4.355
  298   1HG   GLU  36          2HG       GLU  36  10.443  -0.443  -5.618
  299   2HG   GLU  36          1HG       GLU  36  11.102   0.337  -4.182
  300    H    TYR  37           H        TYR  37   6.470   0.513  -6.019
  301    HA   TYR  37           HA       TYR  37   7.020  -1.338  -8.011
  302   1HB   TYR  37          2HB       TYR  37   4.853  -1.192  -6.860
  303   2HB   TYR  37          1HB       TYR  37   4.511   0.327  -7.688
  304    HD1  TYR  37           HD1      TYR  37   5.368  -3.260  -8.343
  305    HD2  TYR  37           HD2      TYR  37   3.485   0.315  -9.808
  306    HE1  TYR  37           HE1      TYR  37   4.491  -4.518 -10.289
  307    HE2  TYR  37           HE2      TYR  37   2.608  -0.948 -11.755
  308    HH   TYR  37           HH       TYR  37   3.654  -3.452 -12.939
  309    H    LEU  38           H        LEU  38   6.556   2.141  -8.272
  310    HA   LEU  38           HA       LEU  38   6.187   2.351 -11.047
  311   1HB   LEU  38          2HB       LEU  38   7.745   4.333  -9.379
  312   2HB   LEU  38          1HB       LEU  38   6.790   4.649 -10.826
  313    HG   LEU  38           HG       LEU  38   5.722   3.753  -8.133
  314   1HD1  LEU  38          1HD1      LEU  38   6.395   6.135  -8.264
  315   2HD1  LEU  38          2HD1      LEU  38   4.647   5.958  -8.109
  316   3HD1  LEU  38          3HD1      LEU  38   5.360   6.338  -9.677
  317   1HD2  LEU  38          1HD2      LEU  38   3.499   4.340  -9.408
  318   2HD2  LEU  38          2HD2      LEU  38   4.240   2.759  -9.653
  319   3HD2  LEU  38          3HD2      LEU  38   4.462   4.033 -10.853
  320    H    LYS  39           H        LYS  39   9.212   2.502  -9.154
  321    HA   LYS  39           HA       LYS  39  10.931   2.712 -11.403
  322   1HB   LYS  39          2HB       LYS  39  11.615   3.301  -9.094
  323   2HB   LYS  39          1HB       LYS  39  11.537   1.595  -8.651
  324   1HG   LYS  39          2HG       LYS  39  13.366   1.026 -10.031
  325   2HG   LYS  39          1HG       LYS  39  13.223   2.505 -10.982
  326   1HD   LYS  39          2HD       LYS  39  15.147   2.663  -9.468
  327   2HD   LYS  39          1HD       LYS  39  13.911   3.829  -8.997
  328   1HE   LYS  39          2HE       LYS  39  13.813   1.111  -7.751
  329   2HE   LYS  39          1HE       LYS  39  15.060   2.228  -7.196
  330   1HZ   LYS  39          1HZ       LYS  39  12.836   3.772  -7.299
  331   2HZ   LYS  39          2HZ       LYS  39  13.472   3.056  -5.896
  332   3HZ   LYS  39          3HZ       LYS  39  12.224   2.287  -6.754
  333    H    GLY  40           H        GLY  40   9.563   0.004  -9.631
  334   1HA   GLY  40          2HA       GLY  40  11.110  -1.992 -11.047
  335   2HA   GLY  40          1HA       GLY  40   9.807  -2.292  -9.901
  336    H    PHE  41           H        PHE  41   8.790  -0.010 -12.103
  337    HA   PHE  41           HA       PHE  41   8.100  -1.594 -14.358
  338   1HB   PHE  41          2HB       PHE  41   6.612  -2.483 -12.375
  339   2HB   PHE  41          1HB       PHE  41   5.685  -1.015 -12.670
  340    HD1  PHE  41           HD1      PHE  41   4.264  -0.804 -14.569
  341    HD2  PHE  41           HD2      PHE  41   6.996  -4.107 -14.280
  342    HE1  PHE  41           HE1      PHE  41   3.177  -1.874 -16.523
  343    HE2  PHE  41           HE2      PHE  41   5.909  -5.176 -16.236
  344    HZ   PHE  41           HZ       PHE  41   4.000  -4.059 -17.357
  345    H    ARG  42           H        ARG  42   8.722   0.232 -15.495
  346    HA   ARG  42           HA       ARG  42   7.202   2.715 -15.051
  347   1HB   ARG  42          2HB       ARG  42   9.798   2.584 -15.234
  348   2HB   ARG  42          1HB       ARG  42   9.499   2.446 -16.967
  349   1HG   ARG  42          2HG       ARG  42   8.014   4.522 -16.726
  350   2HG   ARG  42          1HG       ARG  42   8.724   4.714 -15.123
  351   1HD   ARG  42          2HD       ARG  42  11.003   4.489 -16.384
  352   2HD   ARG  42          1HD       ARG  42  10.058   4.895 -17.813
  353    HE   ARG  42           HE       ARG  42   9.431   6.778 -15.840
  354   1HH1  ARG  42          1HH2      ARG  42  12.159   5.719 -17.699
  355   2HH1  ARG  42          2HH2      ARG  42  12.929   7.270 -17.700
  356   1HH2  ARG  42          1HH1      ARG  42  10.439   8.803 -15.840
  357   2HH2  ARG  42          2HH1      ARG  42  11.957   9.014 -16.646
  Start of MODEL    5
    1   1H    MET   1          1HT       MET   1   8.362  -9.959 -12.825
    2   2H    MET   1          2HT       MET   1   7.509 -11.327 -12.290
    3   3H    MET   1          3HT       MET   1   9.197 -11.250 -12.109
    4    HA   MET   1           HA       MET   1   8.573 -10.710 -10.002
    5   1HB   MET   1          2HB       MET   1   8.247  -7.985 -11.269
    6   2HB   MET   1          1HB       MET   1   8.972  -8.386  -9.714
    7   1HG   MET   1          2HG       MET   1  10.098  -8.969 -12.467
    8   2HG   MET   1          1HG       MET   1  10.777  -7.908 -11.234
    9   1HE   MET   1          1HE       MET   1  13.423  -9.570 -10.950
   10   2HE   MET   1          2HE       MET   1  12.508  -9.290 -12.429
   11   3HE   MET   1          3HE       MET   1  13.008 -10.926 -12.007
   12    H    ILE   2           H        ILE   2   6.323  -9.384 -12.385
   13    HA   ILE   2           HA       ILE   2   4.275  -8.765 -10.461
   14    HB   ILE   2           HB       ILE   2   4.357  -8.891 -13.474
   15   1HG1  ILE   2          2HG1      ILE   2   5.365  -6.984 -12.023
   16   2HG1  ILE   2          1HG1      ILE   2   4.305  -6.539 -13.357
   17   1HG2  ILE   2          1HG2      ILE   2   2.124  -9.575 -12.988
   18   2HG2  ILE   2          2HG2      ILE   2   2.026  -7.842 -13.299
   19   3HG2  ILE   2          3HG2      ILE   2   1.991  -8.443 -11.642
   20   1HD1  ILE   2          1HD1      ILE   2   2.553  -5.941 -11.950
   21   2HD1  ILE   2          2HD1      ILE   2   3.938  -5.492 -10.954
   22   3HD1  ILE   2          3HD1      ILE   2   3.091  -7.008 -10.655
   23    H    SER   3           H        SER   3   2.337  -9.853 -10.125
   24    HA   SER   3           HA       SER   3   1.841 -12.437 -11.347
   25   1HB   SER   3          2HB       SER   3   2.645 -12.184  -8.445
   26   2HB   SER   3          1HB       SER   3   1.746 -13.565  -9.071
   27    HG   SER   3           HG       SER   3   4.387 -12.911  -9.330
   28    H    ASN   4           H        ASN   4   0.696  -9.634 -10.579
   29    HA   ASN   4           HA       ASN   4  -1.401  -8.776 -10.228
   30   1HB   ASN   4          2HB       ASN   4  -2.503 -11.580 -10.156
   31   2HB   ASN   4          1HB       ASN   4  -3.289 -10.102 -10.700
   32   1HD2  ASN   4          1HD2      ASN   4  -0.675  -9.346 -12.167
   33   2HD2  ASN   4          2HD2      ASN   4  -0.717 -10.289 -13.576
   34    H    ALA   5           H        ALA   5   0.277 -10.605  -8.109
   35    HA   ALA   5           HA       ALA   5  -1.670 -10.784  -5.969
   36   1HB   ALA   5          1HB       ALA   5   1.327 -11.107  -5.759
   37   2HB   ALA   5          2HB       ALA   5   0.262 -12.399  -6.314
   38   3HB   ALA   5          3HB       ALA   5   0.091 -11.754  -4.681
   39    H    LYS   6           H        LYS   6   0.759  -8.564  -7.094
   40    HA   LYS   6           HA       LYS   6   1.098  -7.076  -4.689
   41   1HB   LYS   6          2HB       LYS   6   2.530  -7.080  -6.870
   42   2HB   LYS   6          1HB       LYS   6   1.375  -5.872  -7.433
   43   1HG   LYS   6          2HG       LYS   6   1.870  -4.441  -5.524
   44   2HG   LYS   6          1HG       LYS   6   2.917  -5.679  -4.827
   45   1HD   LYS   6          2HD       LYS   6   4.383  -5.528  -6.835
   46   2HD   LYS   6          1HD       LYS   6   3.368  -4.223  -7.450
   47   1HE   LYS   6          2HE       LYS   6   4.286  -3.834  -4.670
   48   2HE   LYS   6          1HE       LYS   6   5.580  -3.849  -5.869
   49   1HZ   LYS   6          1HZ       LYS   6   3.950  -2.299  -7.149
   50   2HZ   LYS   6          2HZ       LYS   6   4.944  -1.669  -5.923
   51   3HZ   LYS   6          3HZ       LYS   6   3.310  -2.008  -5.605
   52    H    ILE   7           H        ILE   7  -0.969  -6.655  -7.554
   53    HA   ILE   7           HA       ILE   7  -2.201  -4.251  -6.844
   54    HB   ILE   7           HB       ILE   7  -3.360  -6.617  -8.345
   55   1HG1  ILE   7          2HG1      ILE   7  -2.205  -4.037  -9.441
   56   2HG1  ILE   7          1HG1      ILE   7  -1.232  -5.493  -9.226
   57   1HG2  ILE   7          1HG2      ILE   7  -5.191  -5.222  -7.660
   58   2HG2  ILE   7          2HG2      ILE   7  -4.843  -4.792  -9.332
   59   3HG2  ILE   7          3HG2      ILE   7  -4.290  -3.749  -8.023
   60   1HD1  ILE   7          1HD1      ILE   7  -2.173  -5.268 -11.540
   61   2HD1  ILE   7          2HD1      ILE   7  -3.792  -5.381 -10.848
   62   3HD1  ILE   7          3HD1      ILE   7  -2.683  -6.746 -10.722
   63    H    ALA   8           H        ALA   8  -3.261  -7.590  -6.191
   64    HA   ALA   8           HA       ALA   8  -5.560  -6.993  -4.710
   65   1HB   ALA   8          1HB       ALA   8  -5.335  -9.273  -3.801
   66   2HB   ALA   8          2HB       ALA   8  -3.687  -9.356  -4.420
   67   3HB   ALA   8          3HB       ALA   8  -5.044  -9.248  -5.539
   68    H    ARG   9           H        ARG   9  -2.185  -7.336  -3.684
   69    HA   ARG   9           HA       ARG   9  -2.598  -7.232  -0.906
   70   1HB   ARG   9          2HB       ARG   9  -0.452  -7.891  -1.845
   71   2HB   ARG   9          1HB       ARG   9  -0.233  -6.291  -2.549
   72   1HG   ARG   9          2HG       ARG   9  -0.009  -5.264  -0.413
   73   2HG   ARG   9          1HG       ARG   9  -0.632  -6.686   0.420
   74   1HD   ARG   9          2HD       ARG   9   1.788  -7.094  -1.259
   75   2HD   ARG   9          1HD       ARG   9   2.008  -6.153   0.212
   76    HE   ARG   9           HE       ARG   9   1.371  -8.985   0.039
   77   1HH1  ARG   9          1HH2      ARG   9   1.405  -6.105   1.971
   78   2HH1  ARG   9          2HH2      ARG   9   1.440  -6.957   3.478
   79   1HH2  ARG   9          1HH1      ARG   9   1.411 -10.097   2.011
   80   2HH2  ARG   9          2HH1      ARG   9   1.439  -9.215   3.501
   81    H    ILE  10           H        ILE  10  -1.158  -4.561  -2.756
   82    HA   ILE  10           HA       ILE  10  -1.592  -2.544  -0.927
   83    HB   ILE  10           HB       ILE  10  -1.802  -2.100  -3.912
   84   1HG1  ILE  10          2HG1      ILE  10   0.668  -2.574  -2.204
   85   2HG1  ILE  10          1HG1      ILE  10   0.106  -3.587  -3.531
   86   1HG2  ILE  10          1HG2      ILE  10  -0.312  -0.397  -1.934
   87   2HG2  ILE  10          2HG2      ILE  10  -2.068  -0.272  -2.017
   88   3HG2  ILE  10          3HG2      ILE  10  -1.091   0.072  -3.444
   89   1HD1  ILE  10          1HD1      ILE  10   1.383  -0.878  -3.632
   90   2HD1  ILE  10          2HD1      ILE  10   0.260  -1.339  -4.911
   91   3HD1  ILE  10          3HD1      ILE  10   1.707  -2.303  -4.617
   92    H    ASN  11           H        ASN  11  -3.802  -3.707  -3.451
   93    HA   ASN  11           HA       ASN  11  -5.804  -1.753  -3.152
   94   1HB   ASN  11          2HB       ASN  11  -5.807  -3.241  -5.056
   95   2HB   ASN  11          1HB       ASN  11  -5.994  -4.647  -4.011
   96   1HD2  ASN  11          1HD2      ASN  11  -8.095  -5.376  -4.482
   97   2HD2  ASN  11          2HD2      ASN  11  -9.481  -4.399  -4.413
   98    H    GLU  12           H        GLU  12  -5.762  -5.072  -1.816
   99    HA   GLU  12           HA       GLU  12  -8.030  -4.788  -0.195
  100   1HB   GLU  12          2HB       GLU  12  -6.946  -6.954  -0.763
  101   2HB   GLU  12          1HB       GLU  12  -5.624  -6.549   0.333
  102   1HG   GLU  12          2HG       GLU  12  -7.019  -6.633   2.237
  103   2HG   GLU  12          1HG       GLU  12  -8.490  -6.513   1.274
  104    H    LEU  13           H        LEU  13  -4.615  -4.123   0.473
  105    HA   LEU  13           HA       LEU  13  -4.846  -3.612   3.233
  106   1HB   LEU  13          2HB       LEU  13  -2.754  -3.753   1.573
  107   2HB   LEU  13          1HB       LEU  13  -2.926  -2.000   1.616
  108    HG   LEU  13           HG       LEU  13  -2.750  -3.757   4.085
  109   1HD1  LEU  13          1HD1      LEU  13  -0.657  -3.669   2.636
  110   2HD1  LEU  13          2HD1      LEU  13  -0.458  -3.084   4.287
  111   3HD1  LEU  13          3HD1      LEU  13  -0.609  -1.935   2.956
  112   1HD2  LEU  13          1HD2      LEU  13  -3.767  -1.813   4.840
  113   2HD2  LEU  13          2HD2      LEU  13  -3.052  -0.818   3.570
  114   3HD2  LEU  13          3HD2      LEU  13  -2.076  -1.323   4.949
  115    H    ALA  14           H        ALA  14  -5.103  -1.447   0.422
  116    HA   ALA  14           HA       ALA  14  -5.420   0.979   1.756
  117   1HB   ALA  14          1HB       ALA  14  -6.570  -0.016  -0.853
  118   2HB   ALA  14          2HB       ALA  14  -5.156   1.009  -0.615
  119   3HB   ALA  14          3HB       ALA  14  -6.770   1.643  -0.291
  120    H    ALA  15           H        ALA  15  -7.954  -1.294   0.677
  121    HA   ALA  15           HA       ALA  15 -10.133   0.114   1.801
  122   1HB   ALA  15          1HB       ALA  15  -9.988  -2.879   1.415
  123   2HB   ALA  15          2HB       ALA  15 -10.227  -1.754   0.078
  124   3HB   ALA  15          3HB       ALA  15 -11.419  -1.850   1.374
  125    H    LYS  16           H        LYS  16  -7.901  -2.264   3.098
  126    HA   LYS  16           HA       LYS  16  -9.277  -2.913   5.471
  127   1HB   LYS  16          2HB       LYS  16  -7.281  -4.142   4.567
  128   2HB   LYS  16          1HB       LYS  16  -6.273  -2.791   5.084
  129   1HG   LYS  16          2HG       LYS  16  -6.776  -3.156   7.381
  130   2HG   LYS  16          1HG       LYS  16  -8.121  -4.230   6.995
  131   1HD   LYS  16          2HD       LYS  16  -5.383  -4.962   6.018
  132   2HD   LYS  16          1HD       LYS  16  -5.765  -5.218   7.720
  133   1HE   LYS  16          2HE       LYS  16  -7.834  -6.463   6.986
  134   2HE   LYS  16          1HE       LYS  16  -7.239  -6.355   5.328
  135   1HZ   LYS  16          1HZ       LYS  16  -6.380  -8.055   7.478
  136   2HZ   LYS  16          2HZ       LYS  16  -5.092  -7.267   6.697
  137   3HZ   LYS  16          3HZ       LYS  16  -6.167  -8.234   5.805
  138    H    ALA  17           H        ALA  17  -6.503  -0.717   5.051
  139    HA   ALA  17           HA       ALA  17  -6.695   0.508   7.583
  140   1HB   ALA  17          1HB       ALA  17  -4.648   0.869   6.539
  141   2HB   ALA  17          2HB       ALA  17  -5.448   2.419   6.279
  142   3HB   ALA  17          3HB       ALA  17  -5.389   1.231   4.979
  143    H    LYS  18           H        LYS  18  -8.634   0.853   4.760
  144    HA   LYS  18           HA       LYS  18  -9.493   3.542   5.143
  145   1HB   LYS  18          2HB       LYS  18  -9.914   2.061   3.089
  146   2HB   LYS  18          1HB       LYS  18 -11.226   1.335   4.017
  147   1HG   LYS  18          2HG       LYS  18 -12.232   3.576   4.336
  148   2HG   LYS  18          1HG       LYS  18 -10.934   4.287   3.378
  149   1HD   LYS  18          2HD       LYS  18 -11.680   2.530   1.570
  150   2HD   LYS  18          1HD       LYS  18 -13.187   2.507   2.485
  151   1HE   LYS  18          2HE       LYS  18 -13.327   4.983   2.269
  152   2HE   LYS  18          1HE       LYS  18 -11.866   4.957   1.282
  153   1HZ   LYS  18          1HZ       LYS  18 -14.055   3.188   0.505
  154   2HZ   LYS  18          2HZ       LYS  18 -12.939   4.026  -0.464
  155   3HZ   LYS  18          3HZ       LYS  18 -14.258   4.848   0.223
  156    H    ALA  19           H        ALA  19 -11.312   0.550   5.811
  157    HA   ALA  19           HA       ALA  19 -12.946   1.870   7.803
  158   1HB   ALA  19          1HB       ALA  19 -13.606  -0.086   6.208
  159   2HB   ALA  19          2HB       ALA  19 -14.191  -0.115   7.871
  160   3HB   ALA  19          3HB       ALA  19 -12.811  -1.110   7.406
  161    H    GLY  20           H        GLY  20  -9.867   0.614   7.752
  162   1HA   GLY  20          2HA       GLY  20  -9.899  -0.343  10.534
  163   2HA   GLY  20          1HA       GLY  20  -8.593  -0.570   9.376
  164    H    VAL  21           H        VAL  21  -9.477   2.518   8.897
  165    HA   VAL  21           HA       VAL  21  -8.685   4.570   9.527
  166    HB   VAL  21           HB       VAL  21  -7.795   3.523  12.188
  167   1HG1  VAL  21          1HG1      VAL  21  -9.538   5.910  11.684
  168   2HG1  VAL  21          2HG1      VAL  21  -7.835   5.997  11.234
  169   3HG1  VAL  21          3HG1      VAL  21  -8.290   5.676  12.908
  170   1HG2  VAL  21          1HG2      VAL  21 -10.535   3.379  11.036
  171   2HG2  VAL  21          2HG2      VAL  21 -10.411   4.027  12.672
  172   3HG2  VAL  21          3HG2      VAL  21  -9.801   2.411  12.314
  173    H    ILE  22           H        ILE  22  -7.004   4.651   8.098
  174    HA   ILE  22           HA       ILE  22  -4.583   3.309   8.179
  175    HB   ILE  22           HB       ILE  22  -5.382   4.714   6.293
  176   1HG1  ILE  22          2HG1      ILE  22  -3.065   5.932   5.996
  177   2HG1  ILE  22          1HG1      ILE  22  -2.638   5.075   7.475
  178   1HG2  ILE  22          1HG2      ILE  22  -4.376   7.092   7.864
  179   2HG2  ILE  22          2HG2      ILE  22  -6.076   6.613   7.883
  180   3HG2  ILE  22          3HG2      ILE  22  -5.307   7.085   6.365
  181   1HD1  ILE  22          1HD1      ILE  22  -2.051   3.807   5.393
  182   2HD1  ILE  22          2HD1      ILE  22  -3.769   3.737   5.001
  183   3HD1  ILE  22          3HD1      ILE  22  -3.160   2.935   6.449
  184    H    THR  23           H        THR  23  -2.727   3.501   9.291
  185    HA   THR  23           HA       THR  23  -2.591   5.604  11.369
  186    HB   THR  23           HB       THR  23  -1.368   4.063  12.737
  187    HG1  THR  23           HG1      THR  23  -0.415   3.153  10.621
  188   1HG2  THR  23          1HG2      THR  23  -3.456   2.314  11.445
  189   2HG2  THR  23          2HG2      THR  23  -3.911   3.736  12.383
  190   3HG2  THR  23          3HG2      THR  23  -3.014   2.424  13.148
  191    H    GLU  24           H        GLU  24  -0.511   6.518  11.820
  192    HA   GLU  24           HA       GLU  24   0.957   7.373   9.644
  193   1HB   GLU  24          2HB       GLU  24   2.173   6.942  12.381
  194   2HB   GLU  24          1HB       GLU  24   2.612   8.155  11.181
  195   1HG   GLU  24          2HG       GLU  24   1.278   9.451  12.551
  196   2HG   GLU  24          1HG       GLU  24   0.059   8.849  11.435
  197    H    GLU  25           H        GLU  25   1.476   4.545  11.693
  198    HA   GLU  25           HA       GLU  25   3.927   3.671  10.623
  199   1HB   GLU  25          2HB       GLU  25   2.587   2.837  12.700
  200   2HB   GLU  25          1HB       GLU  25   1.792   1.763  11.549
  201   1HG   GLU  25          2HG       GLU  25   3.968   0.857  10.861
  202   2HG   GLU  25          1HG       GLU  25   4.791   1.961  11.961
  203    H    GLU  26           H        GLU  26   0.587   2.741   9.794
  204    HA   GLU  26           HA       GLU  26   1.249   0.992   7.678
  205   1HB   GLU  26          2HB       GLU  26  -1.244   2.526   8.398
  206   2HB   GLU  26          1HB       GLU  26  -1.165   1.527   6.947
  207   1HG   GLU  26          2HG       GLU  26  -0.468  -0.406   8.374
  208   2HG   GLU  26          1HG       GLU  26  -0.705   0.605   9.798
  209    H    LYS  27           H        LYS  27   0.296   4.419   7.689
  210    HA   LYS  27           HA       LYS  27   0.220   4.923   4.975
  211   1HB   LYS  27          2HB       LYS  27  -0.023   6.463   7.191
  212   2HB   LYS  27          1HB       LYS  27   1.552   7.002   6.611
  213   1HG   LYS  27          2HG       LYS  27   0.594   7.467   4.393
  214   2HG   LYS  27          1HG       LYS  27  -0.983   6.896   4.944
  215   1HD   LYS  27          2HD       LYS  27  -0.702   8.683   6.827
  216   2HD   LYS  27          1HD       LYS  27   0.514   9.379   5.757
  217   1HE   LYS  27          2HE       LYS  27  -1.376  10.495   5.005
  218   2HE   LYS  27          1HE       LYS  27  -1.398   9.092   3.938
  219   1HZ   LYS  27          1HZ       LYS  27  -3.047   9.638   6.315
  220   2HZ   LYS  27          2HZ       LYS  27  -2.783   8.036   5.812
  221   3HZ   LYS  27          3HZ       LYS  27  -3.533   9.146   4.767
  222    H    ALA  28           H        ALA  28   3.058   4.951   7.124
  223    HA   ALA  28           HA       ALA  28   4.960   5.736   5.189
  224   1HB   ALA  28          1HB       ALA  28   5.394   3.950   7.598
  225   2HB   ALA  28          2HB       ALA  28   5.364   5.712   7.648
  226   3HB   ALA  28          3HB       ALA  28   6.626   4.877   6.741
  227    H    GLU  29           H        GLU  29   3.782   2.555   6.210
  228    HA   GLU  29           HA       GLU  29   5.517   0.950   4.701
  229   1HB   GLU  29          2HB       GLU  29   3.957   0.137   6.482
  230   2HB   GLU  29          1HB       GLU  29   2.620   0.365   5.355
  231   1HG   GLU  29          2HG       GLU  29   3.375  -1.974   5.324
  232   2HG   GLU  29          1HG       GLU  29   3.684  -1.205   3.770
  233    H    GLN  30           H        GLN  30   2.187   1.960   3.892
  234    HA   GLN  30           HA       GLN  30   1.962   0.914   1.356
  235   1HB   GLN  30          2HB       GLN  30   0.932   3.654   2.109
  236   2HB   GLN  30          1HB       GLN  30   0.240   2.521   0.948
  237   1HG   GLN  30          2HG       GLN  30   0.321   0.987   3.221
  238   2HG   GLN  30          1HG       GLN  30  -0.003   2.584   3.887
  239   1HE2  GLN  30          1HE2      GLN  30  -1.139   0.601   1.082
  240   2HE2  GLN  30          2HE2      GLN  30  -2.773   1.017   1.276
  241    H    GLN  31           H        GLN  31   3.574   3.912   2.321
  242    HA   GLN  31           HA       GLN  31   4.009   5.051  -0.188
  243   1HB   GLN  31          2HB       GLN  31   4.501   6.187   1.947
  244   2HB   GLN  31          1HB       GLN  31   5.861   5.099   2.208
  245   1HG   GLN  31          2HG       GLN  31   7.036   5.953   0.308
  246   2HG   GLN  31          1HG       GLN  31   5.614   6.824  -0.264
  247   1HE2  GLN  31          1HE2      GLN  31   4.714   8.263   1.849
  248   2HE2  GLN  31          2HE2      GLN  31   5.924   9.268   2.487
  249    H    LYS  32           H        LYS  32   5.856   2.552   1.514
  250    HA   LYS  32           HA       LYS  32   8.067   2.412  -0.216
  251   1HB   LYS  32          2HB       LYS  32   6.767   0.184   1.371
  252   2HB   LYS  32          1HB       LYS  32   8.387   0.141   0.681
  253   1HG   LYS  32          2HG       LYS  32   9.091   2.001   2.084
  254   2HG   LYS  32          1HG       LYS  32   7.451   2.198   2.703
  255   1HD   LYS  32          2HD       LYS  32   7.569  -0.130   3.620
  256   2HD   LYS  32          1HD       LYS  32   9.254  -0.208   3.107
  257   1HE   LYS  32          2HE       LYS  32   9.833   1.654   4.564
  258   2HE   LYS  32          1HE       LYS  32   8.140   1.886   4.998
  259   1HZ   LYS  32          1HZ       LYS  32   8.108  -0.284   6.009
  260   2HZ   LYS  32          2HZ       LYS  32   9.378   0.626   6.677
  261   3HZ   LYS  32          3HZ       LYS  32   9.709  -0.581   5.529
  262    H    LEU  33           H        LEU  33   5.102   0.421  -0.194
  263    HA   LEU  33           HA       LEU  33   5.646  -1.086  -2.483
  264   1HB   LEU  33          2HB       LEU  33   2.898  -0.175  -1.605
  265   2HB   LEU  33          1HB       LEU  33   3.302  -1.621  -2.527
  266    HG   LEU  33           HG       LEU  33   4.056  -1.041   0.353
  267   1HD1  LEU  33          1HD1      LEU  33   2.617  -2.912   0.873
  268   2HD1  LEU  33          2HD1      LEU  33   2.386  -3.274  -0.837
  269   3HD1  LEU  33          3HD1      LEU  33   1.703  -1.801  -0.147
  270   1HD2  LEU  33          1HD2      LEU  33   5.922  -2.220  -0.477
  271   2HD2  LEU  33          2HD2      LEU  33   4.943  -3.175  -1.588
  272   3HD2  LEU  33          3HD2      LEU  33   4.888  -3.505   0.143
  273    H    ARG  34           H        ARG  34   3.798   1.955  -2.196
  274    HA   ARG  34           HA       ARG  34   3.167   2.257  -4.911
  275   1HB   ARG  34          2HB       ARG  34   2.205   3.607  -3.032
  276   2HB   ARG  34          1HB       ARG  34   3.731   4.484  -2.939
  277   1HG   ARG  34          2HG       ARG  34   3.466   5.135  -5.333
  278   2HG   ARG  34          1HG       ARG  34   1.894   4.337  -5.349
  279   1HD   ARG  34          2HD       ARG  34   2.435   6.367  -3.216
  280   2HD   ARG  34          1HD       ARG  34   2.102   6.936  -4.849
  281    HE   ARG  34           HE       ARG  34   0.209   4.990  -3.782
  282   1HH1  ARG  34          1HH2      ARG  34   1.054   8.314  -4.295
  283   2HH1  ARG  34          2HH2      ARG  34  -0.572   8.889  -4.145
  284   1HH2  ARG  34          1HH1      ARG  34  -1.919   5.744  -3.591
  285   2HH2  ARG  34          2HH1      ARG  34  -2.252   7.436  -3.747
  286    H    GLN  35           H        GLN  35   6.034   3.180  -3.074
  287    HA   GLN  35           HA       GLN  35   7.323   4.718  -5.049
  288   1HB   GLN  35          2HB       GLN  35   7.995   4.575  -2.638
  289   2HB   GLN  35          1HB       GLN  35   8.636   2.965  -2.958
  290   1HG   GLN  35          2HG       GLN  35  10.327   3.783  -4.379
  291   2HG   GLN  35          1HG       GLN  35   9.506   5.323  -4.621
  292   1HE2  GLN  35          1HE2      GLN  35  12.136   4.055  -3.073
  293   2HE2  GLN  35          2HE2      GLN  35  12.241   5.125  -1.760
  294    H    GLU  36           H        GLU  36   7.342   1.244  -4.370
  295    HA   GLU  36           HA       GLU  36   9.295   0.534  -6.308
  296   1HB   GLU  36          2HB       GLU  36   7.109  -1.012  -4.915
  297   2HB   GLU  36          1HB       GLU  36   8.182  -1.762  -6.097
  298   1HG   GLU  36          2HG       GLU  36  10.116  -1.314  -4.777
  299   2HG   GLU  36          1HG       GLU  36   9.231  -0.209  -3.726
  300    H    TYR  37           H        TYR  37   5.755   0.737  -6.390
  301    HA   TYR  37           HA       TYR  37   5.231  -0.401  -8.862
  302   1HB   TYR  37          2HB       TYR  37   3.558   0.486  -7.162
  303   2HB   TYR  37          1HB       TYR  37   3.848   2.085  -7.846
  304    HD1  TYR  37           HD1      TYR  37   3.433   2.463 -10.323
  305    HD2  TYR  37           HD2      TYR  37   2.157  -1.089  -8.268
  306    HE1  TYR  37           HE1      TYR  37   1.862   1.957 -12.172
  307    HE2  TYR  37           HE2      TYR  37   0.585  -1.593 -10.117
  308    HH   TYR  37           HH       TYR  37  -0.316  -0.858 -12.015
  309    H    LEU  38           H        LEU  38   5.848   3.061  -8.204
  310    HA   LEU  38           HA       LEU  38   5.880   3.893 -10.890
  311   1HB   LEU  38          2HB       LEU  38   6.794   5.001  -8.294
  312   2HB   LEU  38          1HB       LEU  38   7.553   5.679  -9.732
  313    HG   LEU  38           HG       LEU  38   5.467   6.891  -9.010
  314   1HD1  LEU  38          1HD1      LEU  38   4.877   7.357 -11.194
  315   2HD1  LEU  38          2HD1      LEU  38   4.858   5.657 -11.665
  316   3HD1  LEU  38          3HD1      LEU  38   6.394   6.503 -11.479
  317   1HD2  LEU  38          1HD2      LEU  38   3.873   4.614 -10.136
  318   2HD2  LEU  38          2HD2      LEU  38   3.383   5.867  -8.995
  319   3HD2  LEU  38          3HD2      LEU  38   4.393   4.528  -8.452
  320    H    LYS  39           H        LYS  39   8.479   2.768  -8.759
  321    HA   LYS  39           HA       LYS  39  10.616   3.181 -10.581
  322   1HB   LYS  39          2HB       LYS  39  11.012   2.870  -8.190
  323   2HB   LYS  39          1HB       LYS  39  10.347   1.238  -8.270
  324   1HG   LYS  39          2HG       LYS  39  12.162   0.431  -9.547
  325   2HG   LYS  39          1HG       LYS  39  12.673   2.055 -10.010
  326   1HD   LYS  39          2HD       LYS  39  13.644   2.489  -7.929
  327   2HD   LYS  39          1HD       LYS  39  12.649   1.291  -7.102
  328   1HE   LYS  39          2HE       LYS  39  14.610   0.409  -9.208
  329   2HE   LYS  39          1HE       LYS  39  15.169   0.746  -7.570
  330   1HZ   LYS  39          1HZ       LYS  39  14.628  -1.483  -7.493
  331   2HZ   LYS  39          2HZ       LYS  39  13.263  -1.306  -8.490
  332   3HZ   LYS  39          3HZ       LYS  39  13.222  -0.755  -6.883
  333    H    GLY  40           H        GLY  40   8.077   0.898 -10.502
  334   1HA   GLY  40          2HA       GLY  40   9.527  -1.115 -12.062
  335   2HA   GLY  40          1HA       GLY  40   7.887  -1.261 -11.438
  336    H    PHE  41           H        PHE  41   7.487   1.606 -12.534
  337    HA   PHE  41           HA       PHE  41   6.173   0.883 -14.929
  338   1HB   PHE  41          2HB       PHE  41   5.584   2.858 -13.533
  339   2HB   PHE  41          1HB       PHE  41   7.076   3.640 -14.055
  340    HD1  PHE  41           HD1      PHE  41   7.245   4.691 -16.188
  341    HD2  PHE  41           HD2      PHE  41   3.841   2.238 -15.259
  342    HE1  PHE  41           HE1      PHE  41   6.113   5.480 -18.248
  343    HE2  PHE  41           HE2      PHE  41   2.711   3.027 -17.319
  344    HZ   PHE  41           HZ       PHE  41   3.846   4.648 -18.814
  345    H    ARG  42           H        ARG  42   6.915   0.612 -16.938
  346    HA   ARG  42           HA       ARG  42   9.484   1.860 -17.693
  347   1HB   ARG  42          2HB       ARG  42   9.717  -0.595 -17.074
  348   2HB   ARG  42          1HB       ARG  42   8.717  -0.953 -18.482
  349   1HG   ARG  42          2HG       ARG  42  10.351   0.330 -19.894
  350   2HG   ARG  42          1HG       ARG  42  11.382   0.493 -18.473
  351   1HD   ARG  42          2HD       ARG  42  12.159  -1.415 -19.747
  352   2HD   ARG  42          1HD       ARG  42  11.400  -2.010 -18.274
  353    HE   ARG  42           HE       ARG  42   9.393  -1.970 -20.182
  354   1HH1  ARG  42          1HH2      ARG  42  12.511  -3.427 -19.780
  355   2HH1  ARG  42          2HH2      ARG  42  12.126  -4.831 -20.716
  356   1HH2  ARG  42          1HH1      ARG  42   8.886  -3.808 -21.406
  357   2HH2  ARG  42          2HH1      ARG  42  10.073  -5.047 -21.636
  Start of MODEL    6
    1   1H    MET   1          1HT       MET   1   8.603  -4.562  -7.498
    2   2H    MET   1          2HT       MET   1   9.021  -4.983  -5.906
    3   3H    MET   1          3HT       MET   1   7.834  -5.868  -6.738
    4    HA   MET   1           HA       MET   1  10.324  -5.781  -8.149
    5   1HB   MET   1          2HB       MET   1  10.818  -5.792  -5.530
    6   2HB   MET   1          1HB       MET   1  10.404  -7.498  -5.698
    7   1HG   MET   1          2HG       MET   1  12.716  -7.492  -6.097
    8   2HG   MET   1          1HG       MET   1  12.045  -7.450  -7.727
    9   1HE   MET   1          1HE       MET   1  14.342  -6.905  -8.334
   10   2HE   MET   1          2HE       MET   1  14.852  -5.244  -8.632
   11   3HE   MET   1          3HE       MET   1  13.402  -5.866  -9.413
   12    H    ILE   2           H        ILE   2   7.503  -7.237  -6.773
   13    HA   ILE   2           HA       ILE   2   7.781  -9.520  -8.634
   14    HB   ILE   2           HB       ILE   2   7.768  -9.834  -5.976
   15   1HG1  ILE   2          2HG1      ILE   2   7.994 -11.624  -7.651
   16   2HG1  ILE   2          1HG1      ILE   2   6.885 -12.108  -6.371
   17   1HG2  ILE   2          1HG2      ILE   2   5.555  -8.684  -5.744
   18   2HG2  ILE   2          2HG2      ILE   2   5.548 -10.336  -5.133
   19   3HG2  ILE   2          3HG2      ILE   2   4.826  -9.975  -6.699
   20   1HD1  ILE   2          1HD1      ILE   2   5.687 -12.727  -8.273
   21   2HD1  ILE   2          2HD1      ILE   2   6.284 -11.363  -9.217
   22   3HD1  ILE   2          3HD1      ILE   2   5.051 -11.109  -7.983
   23    H    SER   3           H        SER   3   5.502  -7.341  -6.998
   24    HA   SER   3           HA       SER   3   3.456  -6.515  -7.617
   25   1HB   SER   3          2HB       SER   3   4.078  -7.288 -10.458
   26   2HB   SER   3          1HB       SER   3   3.168  -5.902  -9.863
   27    HG   SER   3           HG       SER   3   5.908  -6.309 -10.071
   28    H    ASN   4           H        ASN   4   2.179  -7.668 -10.187
   29    HA   ASN   4           HA       ASN   4   0.534  -9.180 -10.671
   30   1HB   ASN   4          2HB       ASN   4   2.364 -11.024  -9.111
   31   2HB   ASN   4          1HB       ASN   4   1.006 -11.551 -10.102
   32   1HD2  ASN   4          1HD2      ASN   4   3.807  -9.300 -10.514
   33   2HD2  ASN   4          2HD2      ASN   4   4.218  -9.873 -12.056
   34    H    ALA   5           H        ALA   5   0.954 -11.177  -7.919
   35    HA   ALA   5           HA       ALA   5  -1.678 -10.643  -6.967
   36   1HB   ALA   5          1HB       ALA   5  -0.269 -12.805  -6.763
   37   2HB   ALA   5          2HB       ALA   5  -1.290 -12.343  -5.403
   38   3HB   ALA   5          3HB       ALA   5   0.444 -12.030  -5.348
   39    H    LYS   6           H        LYS   6   1.488  -9.407  -6.173
   40    HA   LYS   6           HA       LYS   6   0.855  -8.341  -3.610
   41   1HB   LYS   6          2HB       LYS   6   3.185  -8.721  -4.586
   42   2HB   LYS   6          1HB       LYS   6   2.934  -7.233  -5.500
   43   1HG   LYS   6          2HG       LYS   6   2.629  -5.956  -3.463
   44   2HG   LYS   6          1HG       LYS   6   2.655  -7.424  -2.486
   45   1HD   LYS   6          2HD       LYS   6   5.004  -6.858  -4.258
   46   2HD   LYS   6          1HD       LYS   6   4.838  -5.933  -2.766
   47   1HE   LYS   6          2HE       LYS   6   4.676  -8.955  -2.840
   48   2HE   LYS   6          1HE       LYS   6   6.184  -8.084  -2.564
   49   1HZ   LYS   6          1HZ       LYS   6   3.780  -8.210  -0.872
   50   2HZ   LYS   6          2HZ       LYS   6   4.813  -6.864  -0.773
   51   3HZ   LYS   6          3HZ       LYS   6   5.407  -8.420  -0.440
   52    H    ILE   7           H        ILE   7   0.491  -7.169  -6.903
   53    HA   ILE   7           HA       ILE   7   0.088  -4.449  -6.460
   54    HB   ILE   7           HB       ILE   7  -1.234  -6.304  -8.455
   55   1HG1  ILE   7          2HG1      ILE   7   0.977  -4.256  -8.819
   56   2HG1  ILE   7          1HG1      ILE   7   1.284  -5.965  -8.512
   57   1HG2  ILE   7          1HG2      ILE   7  -1.549  -4.001  -9.666
   58   2HG2  ILE   7          2HG2      ILE   7  -1.416  -3.323  -8.043
   59   3HG2  ILE   7          3HG2      ILE   7  -2.703  -4.469  -8.417
   60   1HD1  ILE   7          1HD1      ILE   7  -0.530  -5.123 -10.768
   61   2HD1  ILE   7          2HD1      ILE   7   0.364  -6.630 -10.573
   62   3HD1  ILE   7          3HD1      ILE   7   1.220  -5.144 -10.984
   63    H    ALA   8           H        ALA   8  -2.472  -6.916  -6.766
   64    HA   ALA   8           HA       ALA   8  -4.605  -5.335  -5.886
   65   1HB   ALA   8          1HB       ALA   8  -4.828  -7.549  -6.998
   66   2HB   ALA   8          2HB       ALA   8  -5.790  -7.430  -5.525
   67   3HB   ALA   8          3HB       ALA   8  -4.270  -8.322  -5.515
   68    H    ARG   9           H        ARG   9  -2.270  -7.273  -4.057
   69    HA   ARG   9           HA       ARG   9  -3.546  -7.105  -1.543
   70   1HB   ARG   9          2HB       ARG   9  -1.633  -8.630  -2.088
   71   2HB   ARG   9          1HB       ARG   9  -0.565  -7.226  -2.058
   72   1HG   ARG   9          2HG       ARG   9  -1.721  -6.829   0.308
   73   2HG   ARG   9          1HG       ARG   9  -2.000  -8.566   0.205
   74   1HD   ARG   9          2HD       ARG   9   0.094  -8.398   1.276
   75   2HD   ARG   9          1HD       ARG   9   0.509  -8.732  -0.402
   76    HE   ARG   9           HE       ARG   9   1.408  -6.591  -0.562
   77   1HH1  ARG   9          1HH2      ARG   9  -0.501  -6.925   2.317
   78   2HH1  ARG   9          2HH2      ARG   9   0.030  -5.425   3.001
   79   1HH2  ARG   9          1HH1      ARG   9   2.095  -4.630   0.338
   80   2HH2  ARG   9          2HH1      ARG   9   1.493  -4.127   1.881
   81    H    ILE  10           H        ILE  10  -1.122  -5.033  -3.112
   82    HA   ILE  10           HA       ILE  10  -0.613  -3.259  -1.041
   83    HB   ILE  10           HB       ILE  10  -0.647  -2.871  -4.033
   84   1HG1  ILE  10          2HG1      ILE  10   1.707  -2.748  -2.153
   85   2HG1  ILE  10          1HG1      ILE  10   1.071  -4.308  -2.672
   86   1HG2  ILE  10          1HG2      ILE  10  -1.001  -0.655  -3.342
   87   2HG2  ILE  10          2HG2      ILE  10   0.759  -0.766  -3.348
   88   3HG2  ILE  10          3HG2      ILE  10  -0.126  -0.886  -1.828
   89   1HD1  ILE  10          1HD1      ILE  10   1.732  -4.009  -4.859
   90   2HD1  ILE  10          2HD1      ILE  10   2.966  -3.031  -4.066
   91   3HD1  ILE  10          3HD1      ILE  10   1.557  -2.255  -4.787
   92    H    ASN  11           H        ASN  11  -2.917  -2.620  -3.724
   93    HA   ASN  11           HA       ASN  11  -4.089  -0.379  -2.475
   94   1HB   ASN  11          2HB       ASN  11  -6.005  -0.790  -4.079
   95   2HB   ASN  11          1HB       ASN  11  -4.420  -0.610  -4.818
   96   1HD2  ASN  11          1HD2      ASN  11  -6.984  -2.197  -5.596
   97   2HD2  ASN  11          2HD2      ASN  11  -6.391  -3.747  -5.944
   98    H    GLU  12           H        GLU  12  -4.801  -3.815  -2.230
   99    HA   GLU  12           HA       GLU  12  -7.324  -3.641  -0.989
  100   1HB   GLU  12          2HB       GLU  12  -6.359  -5.754  -1.852
  101   2HB   GLU  12          1HB       GLU  12  -5.174  -5.734  -0.549
  102   1HG   GLU  12          2HG       GLU  12  -7.047  -7.189   0.058
  103   2HG   GLU  12          1HG       GLU  12  -7.027  -5.776   1.109
  104    H    LEU  13           H        LEU  13  -4.047  -3.755   0.395
  105    HA   LEU  13           HA       LEU  13  -4.778  -3.661   3.112
  106   1HB   LEU  13          2HB       LEU  13  -2.506  -4.219   2.365
  107   2HB   LEU  13          1HB       LEU  13  -2.294  -2.589   1.739
  108    HG   LEU  13           HG       LEU  13  -1.292  -3.124   4.063
  109   1HD1  LEU  13          1HD1      LEU  13  -3.030  -0.796   4.496
  110   2HD1  LEU  13          2HD1      LEU  13  -2.227  -0.794   2.927
  111   3HD1  LEU  13          3HD1      LEU  13  -1.272  -0.890   4.406
  112   1HD2  LEU  13          1HD2      LEU  13  -2.715  -3.177   5.945
  113   2HD2  LEU  13          2HD2      LEU  13  -3.530  -4.225   4.785
  114   3HD2  LEU  13          3HD2      LEU  13  -4.097  -2.574   5.033
  115    H    ALA  14           H        ALA  14  -4.024  -1.065   0.802
  116    HA   ALA  14           HA       ALA  14  -4.201   1.132   2.487
  117   1HB   ALA  14          1HB       ALA  14  -4.548   2.446   0.540
  118   2HB   ALA  14          2HB       ALA  14  -5.313   1.110  -0.320
  119   3HB   ALA  14          3HB       ALA  14  -3.582   1.072   0.007
  120    H    ALA  15           H        ALA  15  -6.828  -0.338   0.566
  121    HA   ALA  15           HA       ALA  15  -8.904   1.278   1.593
  122   1HB   ALA  15          1HB       ALA  15  -9.307   0.088  -0.429
  123   2HB   ALA  15          2HB       ALA  15 -10.377  -0.626   0.778
  124   3HB   ALA  15          3HB       ALA  15  -8.892  -1.457   0.315
  125    H    LYS  16           H        LYS  16  -7.515  -1.772   2.694
  126    HA   LYS  16           HA       LYS  16  -9.460  -2.462   4.610
  127   1HB   LYS  16          2HB       LYS  16  -7.768  -4.068   3.941
  128   2HB   LYS  16          1HB       LYS  16  -6.482  -3.024   4.544
  129   1HG   LYS  16          2HG       LYS  16  -7.269  -3.271   6.826
  130   2HG   LYS  16          1HG       LYS  16  -8.692  -4.161   6.283
  131   1HD   LYS  16          2HD       LYS  16  -6.209  -5.346   5.287
  132   2HD   LYS  16          1HD       LYS  16  -6.255  -5.281   7.049
  133   1HE   LYS  16          2HE       LYS  16  -7.271  -7.363   6.392
  134   2HE   LYS  16          1HE       LYS  16  -8.572  -6.301   6.928
  135   1HZ   LYS  16          1HZ       LYS  16  -7.966  -6.000   4.147
  136   2HZ   LYS  16          2HZ       LYS  16  -9.461  -6.272   4.908
  137   3HZ   LYS  16          3HZ       LYS  16  -8.445  -7.582   4.534
  138    H    ALA  17           H        ALA  17  -6.275  -0.964   5.149
  139    HA   ALA  17           HA       ALA  17  -6.715  -0.191   7.808
  140   1HB   ALA  17          1HB       ALA  17  -4.660   0.804   7.669
  141   2HB   ALA  17          2HB       ALA  17  -5.013   1.561   6.116
  142   3HB   ALA  17          3HB       ALA  17  -4.565  -0.144   6.185
  143    H    LYS  18           H        LYS  18  -7.847   1.151   4.819
  144    HA   LYS  18           HA       LYS  18  -8.333   3.806   5.778
  145   1HB   LYS  18          2HB       LYS  18  -8.174   3.074   3.342
  146   2HB   LYS  18          1HB       LYS  18  -9.811   2.446   3.522
  147   1HG   LYS  18          2HG       LYS  18 -10.220   4.607   2.740
  148   2HG   LYS  18          1HG       LYS  18 -10.328   4.834   4.485
  149   1HD   LYS  18          2HD       LYS  18  -8.027   5.637   4.572
  150   2HD   LYS  18          1HD       LYS  18  -7.813   5.297   2.854
  151   1HE   LYS  18          2HE       LYS  18  -9.673   6.917   2.366
  152   2HE   LYS  18          1HE       LYS  18  -9.692   7.336   4.079
  153   1HZ   LYS  18          1HZ       LYS  18  -7.535   8.194   3.962
  154   2HZ   LYS  18          2HZ       LYS  18  -8.299   8.781   2.563
  155   3HZ   LYS  18          3HZ       LYS  18  -7.221   7.473   2.461
  156    H    ALA  19           H        ALA  19 -10.725   1.304   4.874
  157    HA   ALA  19           HA       ALA  19 -12.792   2.550   6.425
  158   1HB   ALA  19          1HB       ALA  19 -12.700  -0.203   5.167
  159   2HB   ALA  19          2HB       ALA  19 -13.287   1.265   4.385
  160   3HB   ALA  19          3HB       ALA  19 -14.143   0.607   5.779
  161    H    GLY  20           H        GLY  20 -10.183   0.668   7.309
  162   1HA   GLY  20          2HA       GLY  20 -11.574  -0.606   9.577
  163   2HA   GLY  20          1HA       GLY  20  -9.951  -0.995   9.012
  164    H    VAL  21           H        VAL  21  -8.301   0.701   9.252
  165    HA   VAL  21           HA       VAL  21  -8.600   2.961  10.897
  166    HB   VAL  21           HB       VAL  21  -9.025   1.604  12.784
  167   1HG1  VAL  21          1HG1      VAL  21  -7.062  -0.248  11.489
  168   2HG1  VAL  21          2HG1      VAL  21  -8.632  -0.602  12.208
  169   3HG1  VAL  21          3HG1      VAL  21  -7.235  -0.304  13.244
  170   1HG2  VAL  21          1HG2      VAL  21  -7.169   2.030  14.209
  171   2HG2  VAL  21          2HG2      VAL  21  -7.077   3.274  12.963
  172   3HG2  VAL  21          3HG2      VAL  21  -6.014   1.869  12.886
  173    H    ILE  22           H        ILE  22  -7.185   3.989   9.574
  174    HA   ILE  22           HA       ILE  22  -4.621   2.750   8.938
  175    HB   ILE  22           HB       ILE  22  -5.844   3.919   7.156
  176   1HG1  ILE  22          2HG1      ILE  22  -3.517   5.720   7.659
  177   2HG1  ILE  22          1HG1      ILE  22  -3.193   3.988   7.602
  178   1HG2  ILE  22          1HG2      ILE  22  -5.393   6.399   8.845
  179   2HG2  ILE  22          2HG2      ILE  22  -6.951   5.619   8.580
  180   3HG2  ILE  22          3HG2      ILE  22  -6.098   6.363   7.230
  181   1HD1  ILE  22          1HD1      ILE  22  -4.339   3.863   5.402
  182   2HD1  ILE  22          2HD1      ILE  22  -2.953   4.950   5.363
  183   3HD1  ILE  22          3HD1      ILE  22  -4.586   5.609   5.452
  184    H    THR  23           H        THR  23  -2.676   3.382   9.690
  185    HA   THR  23           HA       THR  23  -2.541   5.690  11.520
  186    HB   THR  23           HB       THR  23  -1.283   4.418  13.147
  187    HG1  THR  23           HG1      THR  23  -1.721   2.105  11.596
  188   1HG2  THR  23          1HG2      THR  23  -3.866   4.275  13.030
  189   2HG2  THR  23          2HG2      THR  23  -3.022   3.099  14.035
  190   3HG2  THR  23          3HG2      THR  23  -3.606   2.633  12.438
  191    H    GLU  24           H        GLU  24  -0.246   6.307  11.966
  192    HA   GLU  24           HA       GLU  24   1.167   6.893   9.673
  193   1HB   GLU  24          2HB       GLU  24   1.487   7.790  12.061
  194   2HB   GLU  24          1HB       GLU  24   2.546   6.403  12.309
  195   1HG   GLU  24          2HG       GLU  24   3.659   7.212  10.063
  196   2HG   GLU  24          1HG       GLU  24   2.903   8.752  10.467
  197    H    GLU  25           H        GLU  25   1.373   4.029  11.714
  198    HA   GLU  25           HA       GLU  25   3.710   2.884  10.655
  199   1HB   GLU  25          2HB       GLU  25   1.241   1.574  11.820
  200   2HB   GLU  25          1HB       GLU  25   2.748   0.724  11.481
  201   1HG   GLU  25          2HG       GLU  25   2.551   3.152  13.285
  202   2HG   GLU  25          1HG       GLU  25   2.515   1.491  13.871
  203    H    GLU  26           H        GLU  26   0.336   1.981   9.885
  204    HA   GLU  26           HA       GLU  26   1.016   0.415   7.627
  205   1HB   GLU  26          2HB       GLU  26  -1.580   1.725   8.458
  206   2HB   GLU  26          1HB       GLU  26  -1.437   0.654   7.067
  207   1HG   GLU  26          2HG       GLU  26  -0.517  -0.169   9.828
  208   2HG   GLU  26          1HG       GLU  26  -2.171  -0.429   9.277
  209    H    LYS  27           H        LYS  27  -0.039   3.786   7.959
  210    HA   LYS  27           HA       LYS  27  -0.357   4.448   5.273
  211   1HB   LYS  27          2HB       LYS  27  -0.995   5.949   7.094
  212   2HB   LYS  27          1HB       LYS  27   0.700   6.176   7.525
  213   1HG   LYS  27          2HG       LYS  27   1.169   7.366   5.537
  214   2HG   LYS  27          1HG       LYS  27  -0.289   6.779   4.738
  215   1HD   LYS  27          2HD       LYS  27  -0.653   8.350   7.248
  216   2HD   LYS  27          1HD       LYS  27  -0.152   9.236   5.808
  217   1HE   LYS  27          2HE       LYS  27  -2.064   8.415   4.563
  218   2HE   LYS  27          1HE       LYS  27  -2.520   7.345   5.889
  219   1HZ   LYS  27          1HZ       LYS  27  -2.305  10.271   6.248
  220   2HZ   LYS  27          2HZ       LYS  27  -3.109   9.140   7.230
  221   3HZ   LYS  27          3HZ       LYS  27  -3.736   9.544   5.703
  222    H    ALA  28           H        ALA  28   2.599   4.465   7.254
  223    HA   ALA  28           HA       ALA  28   4.319   5.520   5.265
  224   1HB   ALA  28          1HB       ALA  28   6.137   4.683   6.657
  225   2HB   ALA  28          2HB       ALA  28   5.016   3.650   7.544
  226   3HB   ALA  28          3HB       ALA  28   4.895   5.403   7.680
  227    H    GLU  29           H        GLU  29   3.324   2.239   6.102
  228    HA   GLU  29           HA       GLU  29   5.110   0.796   4.499
  229   1HB   GLU  29          2HB       GLU  29   3.416  -0.054   6.250
  230   2HB   GLU  29          1HB       GLU  29   2.253  -0.050   4.925
  231   1HG   GLU  29          2HG       GLU  29   3.060  -2.180   4.634
  232   2HG   GLU  29          1HG       GLU  29   4.279  -1.322   3.692
  233    H    GLN  30           H        GLN  30   1.690   1.470   3.718
  234    HA   GLN  30           HA       GLN  30   1.699   0.658   1.090
  235   1HB   GLN  30          2HB       GLN  30  -0.154   2.343   0.750
  236   2HB   GLN  30          1HB       GLN  30  -0.378   1.244   2.109
  237   1HG   GLN  30          2HG       GLN  30   0.532   2.987   3.633
  238   2HG   GLN  30          1HG       GLN  30   0.658   4.090   2.267
  239   1HE2  GLN  30          1HE2      GLN  30  -1.918   1.834   3.433
  240   2HE2  GLN  30          2HE2      GLN  30  -3.153   2.999   3.384
  241    H    GLN  31           H        GLN  31   2.758   3.779   2.390
  242    HA   GLN  31           HA       GLN  31   3.080   5.159  -0.032
  243   1HB   GLN  31          2HB       GLN  31   3.224   6.194   2.226
  244   2HB   GLN  31          1HB       GLN  31   4.792   5.420   2.450
  245   1HG   GLN  31          2HG       GLN  31   5.620   6.581   0.401
  246   2HG   GLN  31          1HG       GLN  31   4.072   7.416   0.282
  247   1HE2  GLN  31          1HE2      GLN  31   6.432   8.931   0.599
  248   2HE2  GLN  31          2HE2      GLN  31   6.447   9.622   2.149
  249    H    LYS  32           H        LYS  32   5.401   3.148   1.779
  250    HA   LYS  32           HA       LYS  32   7.581   3.460   0.024
  251   1HB   LYS  32          2HB       LYS  32   7.702   2.467   2.321
  252   2HB   LYS  32          1HB       LYS  32   6.922   1.016   1.692
  253   1HG   LYS  32          2HG       LYS  32   8.760   0.636   0.143
  254   2HG   LYS  32          1HG       LYS  32   9.513   2.163   0.606
  255   1HD   LYS  32          2HD       LYS  32   9.995   1.368   2.810
  256   2HD   LYS  32          1HD       LYS  32   8.960  -0.045   2.600
  257   1HE   LYS  32          2HE       LYS  32  10.514  -1.167   1.316
  258   2HE   LYS  32          1HE       LYS  32  11.203   0.318   0.661
  259   1HZ   LYS  32          1HZ       LYS  32  11.901  -1.139   3.050
  260   2HZ   LYS  32          2HZ       LYS  32  11.756   0.538   3.283
  261   3HZ   LYS  32          3HZ       LYS  32  12.833  -0.071   2.118
  262    H    LEU  33           H        LEU  33   5.297   0.726   0.276
  263    HA   LEU  33           HA       LEU  33   6.121  -0.661  -2.003
  264   1HB   LEU  33          2HB       LEU  33   3.338  -0.493  -0.820
  265   2HB   LEU  33          1HB       LEU  33   3.909  -1.738  -1.933
  266    HG   LEU  33           HG       LEU  33   5.158  -1.167   0.773
  267   1HD1  LEU  33          1HD1      LEU  33   3.928  -2.936   1.682
  268   2HD1  LEU  33          2HD1      LEU  33   3.561  -3.625   0.100
  269   3HD1  LEU  33          3HD1      LEU  33   2.735  -2.163   0.638
  270   1HD2  LEU  33          1HD2      LEU  33   5.920  -3.668   0.125
  271   2HD2  LEU  33          2HD2      LEU  33   6.849  -2.249  -0.358
  272   3HD2  LEU  33          3HD2      LEU  33   5.742  -3.011  -1.501
  273    H    ARG  34           H        ARG  34   3.824   2.000  -1.658
  274    HA   ARG  34           HA       ARG  34   2.707   1.966  -4.232
  275   1HB   ARG  34          2HB       ARG  34   3.100   4.071  -2.139
  276   2HB   ARG  34          1HB       ARG  34   2.565   4.558  -3.746
  277   1HG   ARG  34          2HG       ARG  34   1.179   2.226  -2.510
  278   2HG   ARG  34          1HG       ARG  34   0.830   3.818  -1.835
  279   1HD   ARG  34          2HD       ARG  34   0.114   4.658  -3.964
  280   2HD   ARG  34          1HD       ARG  34   0.725   3.233  -4.800
  281    HE   ARG  34           HE       ARG  34  -1.266   2.572  -2.834
  282   1HH1  ARG  34          1HH2      ARG  34  -0.704   3.743  -6.047
  283   2HH1  ARG  34          2HH2      ARG  34  -2.240   3.222  -6.651
  284   1HH2  ARG  34          1HH1      ARG  34  -3.282   1.898  -3.619
  285   2HH2  ARG  34          2HH1      ARG  34  -3.702   2.179  -5.276
  286    H    GLN  35           H        GLN  35   5.641   3.505  -2.990
  287    HA   GLN  35           HA       GLN  35   6.351   4.922  -5.324
  288   1HB   GLN  35          2HB       GLN  35   7.348   5.314  -3.088
  289   2HB   GLN  35          1HB       GLN  35   8.173   3.762  -3.199
  290   1HG   GLN  35          2HG       GLN  35   9.589   4.490  -4.921
  291   2HG   GLN  35          1HG       GLN  35   8.510   5.806  -5.384
  292   1HE2  GLN  35          1HE2      GLN  35   8.700   7.819  -4.242
  293   2HE2  GLN  35          2HE2      GLN  35   9.901   8.099  -3.076
  294    H    GLU  36           H        GLU  36   7.064   1.632  -4.229
  295    HA   GLU  36           HA       GLU  36   8.874   0.953  -6.305
  296   1HB   GLU  36          2HB       GLU  36   8.555  -0.308  -4.144
  297   2HB   GLU  36          1HB       GLU  36   7.043  -0.928  -4.802
  298   1HG   GLU  36          2HG       GLU  36   8.664  -2.600  -5.298
  299   2HG   GLU  36          1HG       GLU  36   8.406  -1.738  -6.812
  300    H    TYR  37           H        TYR  37   5.366   0.552  -5.941
  301    HA   TYR  37           HA       TYR  37   4.800  -0.953  -8.197
  302   1HB   TYR  37          2HB       TYR  37   3.094  -0.428  -6.548
  303   2HB   TYR  37          1HB       TYR  37   3.172   1.284  -6.968
  304    HD1  TYR  37           HD1      TYR  37   2.744  -2.031  -8.694
  305    HD2  TYR  37           HD2      TYR  37   1.563   2.093  -8.447
  306    HE1  TYR  37           HE1      TYR  37   1.093  -2.393 -10.509
  307    HE2  TYR  37           HE2      TYR  37  -0.088   1.729 -10.261
  308    HH   TYR  37           HH       TYR  37  -1.399  -0.422 -11.146
  309    H    LEU  38           H        LEU  38   5.355   2.539  -7.956
  310    HA   LEU  38           HA       LEU  38   4.550   3.284 -10.534
  311   1HB   LEU  38          2HB       LEU  38   6.953   4.547  -9.242
  312   2HB   LEU  38          1HB       LEU  38   5.674   5.304 -10.189
  313    HG   LEU  38           HG       LEU  38   5.459   4.217  -7.369
  314   1HD1  LEU  38          1HD1      LEU  38   4.939   6.527  -6.792
  315   2HD1  LEU  38          2HD1      LEU  38   5.014   6.997  -8.490
  316   3HD1  LEU  38          3HD1      LEU  38   6.477   6.474  -7.654
  317   1HD2  LEU  38          1HD2      LEU  38   3.076   5.317  -7.688
  318   2HD2  LEU  38          2HD2      LEU  38   3.358   3.660  -8.218
  319   3HD2  LEU  38          3HD2      LEU  38   3.372   4.975  -9.392
  320    H    LYS  39           H        LYS  39   7.895   2.662  -9.442
  321    HA   LYS  39           HA       LYS  39   8.985   2.578 -12.060
  322   1HB   LYS  39          2HB       LYS  39  10.053   1.387  -9.486
  323   2HB   LYS  39          1HB       LYS  39  10.982   1.638 -10.964
  324   1HG   LYS  39          2HG       LYS  39  10.944   3.970 -10.752
  325   2HG   LYS  39          1HG       LYS  39   9.526   3.951  -9.705
  326   1HD   LYS  39          2HD       LYS  39  11.505   4.474  -8.373
  327   2HD   LYS  39          1HD       LYS  39  10.900   2.882  -7.919
  328   1HE   LYS  39          2HE       LYS  39  12.629   1.761  -9.076
  329   2HE   LYS  39          1HE       LYS  39  13.030   3.187 -10.034
  330   1HZ   LYS  39          1HZ       LYS  39  13.555   4.218  -7.747
  331   2HZ   LYS  39          2HZ       LYS  39  14.682   3.165  -8.456
  332   3HZ   LYS  39          3HZ       LYS  39  13.659   2.610  -7.218
  333    H    GLY  40           H        GLY  40   7.095   0.351 -10.328
  334   1HA   GLY  40          2HA       GLY  40   8.146  -2.011 -11.695
  335   2HA   GLY  40          1HA       GLY  40   6.875  -1.984 -10.476
  336    H    PHE  41           H        PHE  41   5.766   0.398 -12.183
  337    HA   PHE  41           HA       PHE  41   3.773  -1.096 -13.528
  338   1HB   PHE  41          2HB       PHE  41   3.439   1.214 -12.696
  339   2HB   PHE  41          1HB       PHE  41   4.539   1.807 -13.937
  340    HD1  PHE  41           HD1      PHE  41   3.612   2.532 -15.960
  341    HD2  PHE  41           HD2      PHE  41   1.512  -0.395 -13.618
  342    HE1  PHE  41           HE1      PHE  41   1.738   2.578 -17.582
  343    HE2  PHE  41           HE2      PHE  41  -0.361  -0.348 -15.242
  344    HZ   PHE  41           HZ       PHE  41  -0.248   1.137 -17.223
  345    H    ARG  42           H        ARG  42   5.551   1.354 -15.341
  346    HA   ARG  42           HA       ARG  42   5.816  -0.548 -17.563
  347   1HB   ARG  42          2HB       ARG  42   4.810   1.743 -17.917
  348   2HB   ARG  42          1HB       ARG  42   6.400   2.423 -17.566
  349   1HG   ARG  42          2HG       ARG  42   7.387   1.250 -19.446
  350   2HG   ARG  42          1HG       ARG  42   5.888   0.366 -19.736
  351   1HD   ARG  42          2HD       ARG  42   4.737   2.530 -20.188
  352   2HD   ARG  42          1HD       ARG  42   6.276   3.363 -19.986
  353    HE   ARG  42           HE       ARG  42   6.879   2.646 -22.107
  354   1HH1  ARG  42          1HH2      ARG  42   4.201   0.794 -20.909
  355   2HH1  ARG  42          2HH2      ARG  42   3.932  -0.035 -22.405
  356   1HH2  ARG  42          1HH1      ARG  42   6.525   1.561 -24.064
  357   2HH2  ARG  42          2HH1      ARG  42   5.246   0.399 -24.190
  Start of MODEL    7
    1   1H    MET   1          1HT       MET   1   2.101  -6.955 -17.957
    2   2H    MET   1          2HT       MET   1   2.992  -6.447 -16.602
    3   3H    MET   1          3HT       MET   1   1.940  -5.365 -17.387
    4    HA   MET   1           HA       MET   1   0.569  -5.926 -15.705
    5   1HB   MET   1          2HB       MET   1   0.324  -8.137 -17.754
    6   2HB   MET   1          1HB       MET   1  -0.795  -7.993 -16.398
    7   1HG   MET   1          2HG       MET   1  -1.385  -5.715 -17.099
    8   2HG   MET   1          1HG       MET   1  -0.235  -5.816 -18.435
    9   1HE   MET   1          1HE       MET   1  -4.100  -5.749 -18.932
   10   2HE   MET   1          2HE       MET   1  -3.084  -5.560 -20.359
   11   3HE   MET   1          3HE       MET   1  -2.603  -4.812 -18.840
   12    H    ILE   2           H        ILE   2   0.420  -6.917 -13.738
   13    HA   ILE   2           HA       ILE   2   2.243  -9.200 -13.243
   14    HB   ILE   2           HB       ILE   2   1.395  -7.036 -11.298
   15   1HG1  ILE   2          2HG1      ILE   2   3.005  -6.446 -13.273
   16   2HG1  ILE   2          1HG1      ILE   2   3.478  -5.995 -11.638
   17   1HG2  ILE   2          1HG2      ILE   2   1.865  -9.014 -10.072
   18   2HG2  ILE   2          2HG2      ILE   2   3.354  -8.074  -9.996
   19   3HG2  ILE   2          3HG2      ILE   2   3.225  -9.435 -11.111
   20   1HD1  ILE   2          1HD1      ILE   2   4.307  -8.685 -12.670
   21   2HD1  ILE   2          2HD1      ILE   2   5.117  -7.632 -11.510
   22   3HD1  ILE   2          3HD1      ILE   2   5.177  -7.258 -13.232
   23    H    SER   3           H        SER   3  -0.554  -7.615 -11.692
   24    HA   SER   3           HA       SER   3  -2.346  -8.480 -10.544
   25   1HB   SER   3          2HB       SER   3  -3.721  -9.984 -11.838
   26   2HB   SER   3          1HB       SER   3  -2.972  -8.828 -12.933
   27    HG   SER   3           HG       SER   3  -2.884 -11.417 -13.099
   28    H    ASN   4           H        ASN   4  -1.303  -9.205  -8.666
   29    HA   ASN   4           HA       ASN   4  -1.546 -12.017  -8.169
   30   1HB   ASN   4          2HB       ASN   4   0.773 -12.510  -7.669
   31   2HB   ASN   4          1HB       ASN   4   0.650 -11.951  -9.334
   32   1HD2  ASN   4          1HD2      ASN   4   0.208  -9.092  -8.035
   33   2HD2  ASN   4          2HD2      ASN   4   1.798  -8.593  -7.720
   34    H    ALA   5           H        ALA   5   0.329 -12.047  -5.974
   35    HA   ALA   5           HA       ALA   5  -1.269 -11.135  -3.881
   36   1HB   ALA   5          1HB       ALA   5   1.730 -11.455  -3.724
   37   2HB   ALA   5          2HB       ALA   5   0.621 -12.825  -3.771
   38   3HB   ALA   5          3HB       ALA   5   0.548 -11.678  -2.434
   39    H    LYS   6           H        LYS   6   1.185  -9.465  -5.732
   40    HA   LYS   6           HA       LYS   6   1.619  -7.309  -3.927
   41   1HB   LYS   6          2HB       LYS   6   2.965  -8.074  -6.051
   42   2HB   LYS   6          1HB       LYS   6   1.873  -6.977  -6.896
   43   1HG   LYS   6          2HG       LYS   6   2.524  -5.297  -4.982
   44   2HG   LYS   6          1HG       LYS   6   3.923  -6.353  -4.788
   45   1HD   LYS   6          2HD       LYS   6   4.500  -6.062  -7.158
   46   2HD   LYS   6          1HD       LYS   6   3.078  -5.045  -7.392
   47   1HE   LYS   6          2HE       LYS   6   4.021  -3.528  -5.572
   48   2HE   LYS   6          1HE       LYS   6   5.516  -4.453  -5.703
   49   1HZ   LYS   6          1HZ       LYS   6   5.215  -3.957  -8.220
   50   2HZ   LYS   6          2HZ       LYS   6   5.882  -2.775  -7.197
   51   3HZ   LYS   6          3HZ       LYS   6   4.252  -2.675  -7.668
   52    H    ILE   7           H        ILE   7  -0.257  -7.422  -6.974
   53    HA   ILE   7           HA       ILE   7  -1.455  -4.907  -6.733
   54    HB   ILE   7           HB       ILE   7  -2.605  -7.397  -8.019
   55   1HG1  ILE   7          2HG1      ILE   7  -0.398  -6.886  -8.926
   56   2HG1  ILE   7          1HG1      ILE   7  -1.620  -6.406 -10.103
   57   1HG2  ILE   7          1HG2      ILE   7  -3.691  -5.552  -9.482
   58   2HG2  ILE   7          2HG2      ILE   7  -3.304  -4.463  -8.149
   59   3HG2  ILE   7          3HG2      ILE   7  -4.374  -5.839  -7.882
   60   1HD1  ILE   7          1HD1      ILE   7  -1.457  -4.074  -8.868
   61   2HD1  ILE   7          2HD1      ILE   7  -0.258  -4.517 -10.081
   62   3HD1  ILE   7          3HD1      ILE   7   0.121  -4.683  -8.367
   63    H    ALA   8           H        ALA   8  -2.781  -8.088  -5.823
   64    HA   ALA   8           HA       ALA   8  -5.189  -7.197  -4.715
   65   1HB   ALA   8          1HB       ALA   8  -5.007  -9.362  -3.345
   66   2HB   ALA   8          2HB       ALA   8  -3.476  -9.623  -4.178
   67   3HB   ALA   8          3HB       ALA   8  -4.975  -9.521  -5.101
   68    H    ARG   9           H        ARG   9  -1.956  -7.367  -3.297
   69    HA   ARG   9           HA       ARG   9  -2.748  -6.935  -0.605
   70   1HB   ARG   9          2HB       ARG   9  -0.517  -7.737  -1.059
   71   2HB   ARG   9          1HB       ARG   9  -0.151  -6.314  -2.035
   72   1HG   ARG   9          2HG       ARG   9  -0.217  -4.871  -0.123
   73   2HG   ARG   9          1HG       ARG   9  -0.927  -6.131   0.886
   74   1HD   ARG   9          2HD       ARG   9   1.809  -6.364  -0.389
   75   2HD   ARG   9          1HD       ARG   9   1.550  -5.759   1.246
   76    HE   ARG   9           HE       ARG   9   0.244  -8.238   1.022
   77   1HH1  ARG   9          1HH2      ARG   9   3.435  -6.883   0.963
   78   2HH1  ARG   9          2HH2      ARG   9   4.198  -8.313   1.569
   79   1HH2  ARG   9          1HH1      ARG   9   1.243 -10.109   1.816
   80   2HH2  ARG   9          2HH1      ARG   9   2.959 -10.141   2.047
   81    H    ILE  10           H        ILE  10  -1.572  -4.692  -3.106
   82    HA   ILE  10           HA       ILE  10  -1.669  -2.319  -1.698
   83    HB   ILE  10           HB       ILE  10  -2.234  -2.858  -4.617
   84   1HG1  ILE  10          2HG1      ILE  10   0.214  -1.584  -3.396
   85   2HG1  ILE  10          1HG1      ILE  10   0.055  -3.339  -3.447
   86   1HG2  ILE  10          1HG2      ILE  10  -1.636  -0.384  -4.840
   87   2HG2  ILE  10          2HG2      ILE  10  -1.895  -0.257  -3.099
   88   3HG2  ILE  10          3HG2      ILE  10  -3.226  -0.725  -4.158
   89   1HD1  ILE  10          1HD1      ILE  10   1.270  -2.382  -5.427
   90   2HD1  ILE  10          2HD1      ILE  10  -0.216  -1.549  -5.878
   91   3HD1  ILE  10          3HD1      ILE  10  -0.163  -3.312  -5.860
   92    H    ASN  11           H        ASN  11  -4.268  -3.314  -3.963
   93    HA   ASN  11           HA       ASN  11  -6.102  -1.381  -3.117
   94   1HB   ASN  11          2HB       ASN  11  -7.837  -2.869  -4.157
   95   2HB   ASN  11          1HB       ASN  11  -6.472  -2.501  -5.201
   96   1HD2  ASN  11          1HD2      ASN  11  -8.119  -4.808  -5.617
   97   2HD2  ASN  11          2HD2      ASN  11  -7.182  -6.189  -5.311
   98    H    GLU  12           H        GLU  12  -5.769  -4.764  -2.037
   99    HA   GLU  12           HA       GLU  12  -7.975  -4.799  -0.294
  100   1HB   GLU  12          2HB       GLU  12  -6.717  -6.814  -1.010
  101   2HB   GLU  12          1HB       GLU  12  -5.369  -6.306   0.007
  102   1HG   GLU  12          2HG       GLU  12  -6.752  -6.452   2.000
  103   2HG   GLU  12          1HG       GLU  12  -8.179  -6.804   1.028
  104    H    LEU  13           H        LEU  13  -4.534  -4.465   0.613
  105    HA   LEU  13           HA       LEU  13  -4.973  -3.758   3.287
  106   1HB   LEU  13          2HB       LEU  13  -2.775  -4.302   1.813
  107   2HB   LEU  13          1HB       LEU  13  -2.622  -2.551   1.935
  108    HG   LEU  13           HG       LEU  13  -2.983  -4.453   4.274
  109   1HD1  LEU  13          1HD1      LEU  13  -0.756  -4.596   3.168
  110   2HD1  LEU  13          2HD1      LEU  13  -0.650  -3.922   4.793
  111   3HD1  LEU  13          3HD1      LEU  13  -0.557  -2.857   3.391
  112   1HD2  LEU  13          1HD2      LEU  13  -2.238  -2.272   5.497
  113   2HD2  LEU  13          2HD2      LEU  13  -3.915  -2.405   4.972
  114   3HD2  LEU  13          3HD2      LEU  13  -2.767  -1.455   4.028
  115    H    ALA  14           H        ALA  14  -4.509  -1.672   0.434
  116    HA   ALA  14           HA       ALA  14  -4.501   0.802   1.712
  117   1HB   ALA  14          1HB       ALA  14  -5.282   1.729  -0.448
  118   2HB   ALA  14          2HB       ALA  14  -5.630   0.093  -1.005
  119   3HB   ALA  14          3HB       ALA  14  -3.969   0.570  -0.655
  120    H    ALA  15           H        ALA  15  -7.328  -0.687   0.106
  121    HA   ALA  15           HA       ALA  15  -9.217   1.143   1.073
  122   1HB   ALA  15          1HB       ALA  15 -10.860  -0.321   0.236
  123   2HB   ALA  15          2HB       ALA  15  -9.860  -1.745   0.515
  124   3HB   ALA  15          3HB       ALA  15  -9.454  -0.624  -0.784
  125    H    LYS  16           H        LYS  16  -8.030  -1.884   2.468
  126    HA   LYS  16           HA       LYS  16  -9.910  -2.102   4.562
  127   1HB   LYS  16          2HB       LYS  16  -8.327  -3.912   3.826
  128   2HB   LYS  16          1HB       LYS  16  -7.027  -3.025   4.625
  129   1HG   LYS  16          2HG       LYS  16  -8.452  -3.088   6.739
  130   2HG   LYS  16          1HG       LYS  16  -9.493  -4.236   5.897
  131   1HD   LYS  16          2HD       LYS  16  -7.619  -5.772   5.592
  132   2HD   LYS  16          1HD       LYS  16  -6.513  -4.607   6.322
  133   1HE   LYS  16          2HE       LYS  16  -7.891  -4.712   8.423
  134   2HE   LYS  16          1HE       LYS  16  -8.833  -6.007   7.683
  135   1HZ   LYS  16          1HZ       LYS  16  -5.886  -6.122   7.942
  136   2HZ   LYS  16          2HZ       LYS  16  -6.954  -7.392   7.580
  137   3HZ   LYS  16          3HZ       LYS  16  -6.929  -6.717   9.139
  138    H    ALA  17           H        ALA  17  -6.503  -1.088   4.829
  139    HA   ALA  17           HA       ALA  17  -6.706   0.026   7.387
  140   1HB   ALA  17          1HB       ALA  17  -4.551   0.886   7.033
  141   2HB   ALA  17          2HB       ALA  17  -4.817   1.096   5.302
  142   3HB   ALA  17          3HB       ALA  17  -4.607  -0.521   5.973
  143    H    LYS  18           H        LYS  18  -7.779   1.204   4.331
  144    HA   LYS  18           HA       LYS  18  -7.827   4.001   5.086
  145   1HB   LYS  18          2HB       LYS  18  -7.605   3.346   2.727
  146   2HB   LYS  18          1HB       LYS  18  -9.183   2.562   2.789
  147   1HG   LYS  18          2HG       LYS  18 -10.266   4.699   3.267
  148   2HG   LYS  18          1HG       LYS  18  -8.699   5.507   3.338
  149   1HD   LYS  18          2HD       LYS  18  -8.289   4.903   0.969
  150   2HD   LYS  18          1HD       LYS  18  -9.873   4.132   0.899
  151   1HE   LYS  18          2HE       LYS  18  -9.313   7.069   1.409
  152   2HE   LYS  18          1HE       LYS  18 -10.064   6.370  -0.026
  153   1HZ   LYS  18          1HZ       LYS  18 -11.756   7.228   1.409
  154   2HZ   LYS  18          2HZ       LYS  18 -11.154   6.350   2.734
  155   3HZ   LYS  18          3HZ       LYS  18 -11.854   5.535   1.418
  156    H    ALA  19           H        ALA  19 -10.306   1.496   4.541
  157    HA   ALA  19           HA       ALA  19 -12.442   3.113   5.559
  158   1HB   ALA  19          1HB       ALA  19 -13.110   1.468   4.020
  159   2HB   ALA  19          2HB       ALA  19 -13.631   0.819   5.574
  160   3HB   ALA  19          3HB       ALA  19 -12.162   0.211   4.813
  161    H    GLY  20           H        GLY  20  -9.900   1.674   7.128
  162   1HA   GLY  20          2HA       GLY  20 -11.458   0.933   9.516
  163   2HA   GLY  20          1HA       GLY  20  -9.759   0.567   9.237
  164    H    VAL  21           H        VAL  21  -8.246   2.422   9.234
  165    HA   VAL  21           HA       VAL  21  -9.087   4.908  10.446
  166    HB   VAL  21           HB       VAL  21  -7.475   4.616  12.399
  167   1HG1  VAL  21          1HG1      VAL  21  -9.167   3.786  13.808
  168   2HG1  VAL  21          2HG1      VAL  21  -9.785   2.688  12.576
  169   3HG1  VAL  21          3HG1      VAL  21 -10.061   4.424  12.429
  170   1HG2  VAL  21          1HG2      VAL  21  -6.237   2.677  11.754
  171   2HG2  VAL  21          2HG2      VAL  21  -7.706   1.749  11.452
  172   3HG2  VAL  21          3HG2      VAL  21  -7.250   2.166  13.103
  173    H    ILE  22           H        ILE  22  -6.364   2.753   9.768
  174    HA   ILE  22           HA       ILE  22  -4.371   3.074   8.708
  175    HB   ILE  22           HB       ILE  22  -6.125   4.856   7.397
  176   1HG1  ILE  22          2HG1      ILE  22  -3.296   4.091   6.615
  177   2HG1  ILE  22          1HG1      ILE  22  -4.673   2.996   6.492
  178   1HG2  ILE  22          1HG2      ILE  22  -4.550   6.691   6.759
  179   2HG2  ILE  22          2HG2      ILE  22  -3.445   6.143   8.019
  180   3HG2  ILE  22          3HG2      ILE  22  -5.036   6.770   8.452
  181   1HD1  ILE  22          1HD1      ILE  22  -5.815   4.772   5.074
  182   2HD1  ILE  22          2HD1      ILE  22  -4.411   4.006   4.331
  183   3HD1  ILE  22          3HD1      ILE  22  -4.268   5.616   5.032
  184    H    THR  23           H        THR  23  -2.564   3.401   9.784
  185    HA   THR  23           HA       THR  23  -2.302   5.840  11.442
  186    HB   THR  23           HB       THR  23  -1.235   4.590  13.158
  187    HG1  THR  23           HG1      THR  23  -0.159   2.864  12.696
  188   1HG2  THR  23          1HG2      THR  23  -3.804   4.269  12.733
  189   2HG2  THR  23          2HG2      THR  23  -2.991   3.244  13.915
  190   3HG2  THR  23          3HG2      THR  23  -3.341   2.622  12.303
  191    H    GLU  24           H        GLU  24   0.070   6.246  12.005
  192    HA   GLU  24           HA       GLU  24   1.540   6.841   9.736
  193   1HB   GLU  24          2HB       GLU  24   2.634   6.242  12.496
  194   2HB   GLU  24          1HB       GLU  24   3.461   7.146  11.230
  195   1HG   GLU  24          2HG       GLU  24   2.106   9.001  11.471
  196   2HG   GLU  24          1HG       GLU  24   0.726   8.055  12.024
  197    H    GLU  25           H        GLU  25   1.741   3.968  11.805
  198    HA   GLU  25           HA       GLU  25   3.935   2.722  10.569
  199   1HB   GLU  25          2HB       GLU  25   1.535   1.441  11.904
  200   2HB   GLU  25          1HB       GLU  25   3.068   0.641  11.561
  201   1HG   GLU  25          2HG       GLU  25   3.398   1.294  13.769
  202   2HG   GLU  25          1HG       GLU  25   4.092   2.665  12.907
  203    H    GLU  26           H        GLU  26   0.445   2.306   9.986
  204    HA   GLU  26           HA       GLU  26   0.709   0.479   7.836
  205   1HB   GLU  26          2HB       GLU  26  -1.570   2.425   8.256
  206   2HB   GLU  26          1HB       GLU  26  -1.624   0.866   7.433
  207   1HG   GLU  26          2HG       GLU  26  -1.032   1.274  10.380
  208   2HG   GLU  26          1HG       GLU  26  -2.565   0.715   9.717
  209    H    LYS  27           H        LYS  27   0.068   3.978   7.872
  210    HA   LYS  27           HA       LYS  27   0.003   4.452   5.135
  211   1HB   LYS  27          2HB       LYS  27  -0.485   6.050   7.078
  212   2HB   LYS  27          1HB       LYS  27   1.252   6.354   7.114
  213   1HG   LYS  27          2HG       LYS  27   1.109   6.917   4.648
  214   2HG   LYS  27          1HG       LYS  27  -0.647   6.837   4.803
  215   1HD   LYS  27          2HD       LYS  27   1.174   8.667   6.401
  216   2HD   LYS  27          1HD       LYS  27   0.168   9.161   5.040
  217   1HE   LYS  27          2HE       LYS  27  -1.317   9.659   6.717
  218   2HE   LYS  27          1HE       LYS  27  -1.714   7.949   6.551
  219   1HZ   LYS  27          1HZ       LYS  27   0.279   9.061   8.451
  220   2HZ   LYS  27          2HZ       LYS  27  -0.177   7.429   8.314
  221   3HZ   LYS  27          3HZ       LYS  27  -1.295   8.584   8.860
  222    H    ALA  28           H        ALA  28   2.802   4.349   7.323
  223    HA   ALA  28           HA       ALA  28   4.760   5.164   5.469
  224   1HB   ALA  28          1HB       ALA  28   5.462   5.147   7.709
  225   2HB   ALA  28          2HB       ALA  28   6.300   3.759   7.013
  226   3HB   ALA  28          3HB       ALA  28   4.849   3.516   7.986
  227    H    GLU  29           H        GLU  29   3.465   1.960   6.260
  228    HA   GLU  29           HA       GLU  29   5.213   0.391   4.736
  229   1HB   GLU  29          2HB       GLU  29   3.259  -0.259   6.377
  230   2HB   GLU  29          1HB       GLU  29   2.297  -0.299   4.900
  231   1HG   GLU  29          2HG       GLU  29   4.832  -1.874   5.443
  232   2HG   GLU  29          1HG       GLU  29   3.198  -2.524   5.334
  233    H    GLN  30           H        GLN  30   1.938   1.456   3.812
  234    HA   GLN  30           HA       GLN  30   1.908   0.658   1.181
  235   1HB   GLN  30          2HB       GLN  30   0.752   3.281   2.137
  236   2HB   GLN  30          1HB       GLN  30   0.170   2.263   0.820
  237   1HG   GLN  30          2HG       GLN  30   0.114   0.477   2.871
  238   2HG   GLN  30          1HG       GLN  30  -0.212   1.973   3.745
  239   1HE2  GLN  30          1HE2      GLN  30  -1.246   0.532   0.589
  240   2HE2  GLN  30          2HE2      GLN  30  -2.888   0.904   0.802
  241    H    GLN  31           H        GLN  31   3.389   3.557   2.546
  242    HA   GLN  31           HA       GLN  31   3.925   4.979   0.209
  243   1HB   GLN  31          2HB       GLN  31   4.293   5.693   2.637
  244   2HB   GLN  31          1HB       GLN  31   5.831   4.834   2.543
  245   1HG   GLN  31          2HG       GLN  31   6.531   6.220   0.657
  246   2HG   GLN  31          1HG       GLN  31   4.966   7.033   0.642
  247   1HE2  GLN  31          1HE2      GLN  31   8.093   6.923   2.203
  248   2HE2  GLN  31          2HE2      GLN  31   7.812   8.198   3.289
  249    H    LYS  32           H        LYS  32   5.876   2.459   1.796
  250    HA   LYS  32           HA       LYS  32   8.101   2.568   0.096
  251   1HB   LYS  32          2HB       LYS  32   7.866   1.286   2.282
  252   2HB   LYS  32          1HB       LYS  32   7.031   0.040   1.357
  253   1HG   LYS  32          2HG       LYS  32   9.184  -0.765   1.171
  254   2HG   LYS  32          1HG       LYS  32   9.179   0.315  -0.224
  255   1HD   LYS  32          2HD       LYS  32  10.016   2.129   1.419
  256   2HD   LYS  32          1HD       LYS  32  10.373   0.788   2.509
  257   1HE   LYS  32          2HE       LYS  32  11.598  -0.248   0.453
  258   2HE   LYS  32          1HE       LYS  32  11.573   1.395  -0.187
  259   1HZ   LYS  32          1HZ       LYS  32  13.359   1.775   1.045
  260   2HZ   LYS  32          2HZ       LYS  32  13.220   0.282   1.844
  261   3HZ   LYS  32          3HZ       LYS  32  12.384   1.643   2.427
  262    H    LEU  33           H        LEU  33   5.420   0.194  -0.038
  263    HA   LEU  33           HA       LEU  33   6.138  -0.950  -2.492
  264   1HB   LEU  33          2HB       LEU  33   3.284  -0.685  -1.557
  265   2HB   LEU  33          1HB       LEU  33   4.008  -1.982  -2.502
  266    HG   LEU  33           HG       LEU  33   4.505  -1.343   0.419
  267   1HD1  LEU  33          1HD1      LEU  33   2.492  -2.651   0.001
  268   2HD1  LEU  33          2HD1      LEU  33   3.727  -3.706   0.686
  269   3HD1  LEU  33          3HD1      LEU  33   3.386  -3.754  -1.045
  270   1HD2  LEU  33          1HD2      LEU  33   6.003  -3.424   0.255
  271   2HD2  LEU  33          2HD2      LEU  33   6.655  -1.939  -0.436
  272   3HD2  LEU  33          3HD2      LEU  33   5.974  -3.177  -1.492
  273    H    ARG  34           H        ARG  34   3.608   1.503  -1.884
  274    HA   ARG  34           HA       ARG  34   2.796   1.979  -4.476
  275   1HB   ARG  34          2HB       ARG  34   3.035   3.831  -2.109
  276   2HB   ARG  34          1HB       ARG  34   2.366   4.369  -3.648
  277   1HG   ARG  34          2HG       ARG  34   0.654   2.626  -3.560
  278   2HG   ARG  34          1HG       ARG  34   1.352   1.982  -2.073
  279   1HD   ARG  34          2HD       ARG  34  -0.673   3.524  -1.794
  280   2HD   ARG  34          1HD       ARG  34   0.745   3.915  -0.826
  281    HE   ARG  34           HE       ARG  34   0.977   5.352  -3.206
  282   1HH1  ARG  34          1HH2      ARG  34  -1.187   5.110  -0.510
  283   2HH1  ARG  34          2HH2      ARG  34  -1.676   6.770  -0.582
  284   1HH2  ARG  34          1HH1      ARG  34   0.340   7.525  -3.299
  285   2HH2  ARG  34          2HH1      ARG  34  -0.815   8.136  -2.161
  286    H    GLN  35           H        GLN  35   5.576   3.384  -2.780
  287    HA   GLN  35           HA       GLN  35   6.347   5.220  -4.773
  288   1HB   GLN  35          2HB       GLN  35   7.241   5.291  -2.492
  289   2HB   GLN  35          1HB       GLN  35   8.062   3.752  -2.751
  290   1HG   GLN  35          2HG       GLN  35   8.576   5.989  -4.679
  291   2HG   GLN  35          1HG       GLN  35   9.345   6.052  -3.095
  292   1HE2  GLN  35          1HE2      GLN  35  10.145   5.214  -6.111
  293   2HE2  GLN  35          2HE2      GLN  35  11.131   3.863  -5.823
  294    H    GLU  36           H        GLU  36   7.233   1.820  -4.254
  295    HA   GLU  36           HA       GLU  36   9.129   1.661  -6.360
  296   1HB   GLU  36          2HB       GLU  36   8.705   0.012  -4.407
  297   2HB   GLU  36          1HB       GLU  36   7.460  -0.672  -5.454
  298   1HG   GLU  36          2HG       GLU  36   9.303  -0.736  -7.273
  299   2HG   GLU  36          1HG       GLU  36  10.433  -0.505  -5.941
  300    H    TYR  37           H        TYR  37   5.635   1.140  -6.214
  301    HA   TYR  37           HA       TYR  37   5.184  -0.049  -8.683
  302   1HB   TYR  37          2HB       TYR  37   3.444   0.372  -6.939
  303   2HB   TYR  37          1HB       TYR  37   3.445   2.074  -7.401
  304    HD1  TYR  37           HD1      TYR  37   2.915  -1.375  -8.741
  305    HD2  TYR  37           HD2      TYR  37   2.196   2.830  -9.262
  306    HE1  TYR  37           HE1      TYR  37   1.351  -1.872 -10.599
  307    HE2  TYR  37           HE2      TYR  37   0.635   2.332 -11.121
  308    HH   TYR  37           HH       TYR  37   0.502   0.025 -12.841
  309    H    LEU  38           H        LEU  38   5.798   3.328  -7.899
  310    HA   LEU  38           HA       LEU  38   5.144   4.484 -10.377
  311   1HB   LEU  38          2HB       LEU  38   7.421   5.444  -8.649
  312   2HB   LEU  38          1HB       LEU  38   6.326   6.396  -9.650
  313    HG   LEU  38           HG       LEU  38   5.646   4.939  -7.080
  314   1HD1  LEU  38          1HD1      LEU  38   5.246   7.116  -6.184
  315   2HD1  LEU  38          2HD1      LEU  38   5.333   7.864  -7.779
  316   3HD1  LEU  38          3HD1      LEU  38   6.793   7.220  -7.026
  317   1HD2  LEU  38          1HD2      LEU  38   3.891   6.231  -9.176
  318   2HD2  LEU  38          2HD2      LEU  38   3.366   6.077  -7.500
  319   3HD2  LEU  38          3HD2      LEU  38   3.724   4.634  -8.446
  320    H    LYS  39           H        LYS  39   8.060   2.866  -9.241
  321    HA   LYS  39           HA       LYS  39   9.732   3.540 -11.439
  322   1HB   LYS  39          2HB       LYS  39  10.507   2.634  -9.215
  323   2HB   LYS  39          1HB       LYS  39   9.901   1.056  -9.719
  324   1HG   LYS  39          2HG       LYS  39  11.352   1.379 -11.832
  325   2HG   LYS  39          1HG       LYS  39  12.144   2.673 -10.932
  326   1HD   LYS  39          2HD       LYS  39  12.801   1.135  -9.178
  327   2HD   LYS  39          1HD       LYS  39  11.856  -0.166  -9.905
  328   1HE   LYS  39          2HE       LYS  39  14.000  -0.655 -10.690
  329   2HE   LYS  39          1HE       LYS  39  13.349   0.306 -12.018
  330   1HZ   LYS  39          1HZ       LYS  39  15.156   1.210  -9.849
  331   2HZ   LYS  39          2HZ       LYS  39  14.359   2.281 -10.903
  332   3HZ   LYS  39          3HZ       LYS  39  15.480   1.160 -11.513
  333    H    GLY  40           H        GLY  40   7.739   0.678 -10.720
  334   1HA   GLY  40          2HA       GLY  40   8.331  -0.631 -13.203
  335   2HA   GLY  40          1HA       GLY  40   7.089  -1.099 -12.047
  336    H    PHE  41           H        PHE  41   6.569   2.094 -12.618
  337    HA   PHE  41           HA       PHE  41   4.173   1.702 -14.057
  338   1HB   PHE  41          2HB       PHE  41   4.573   3.664 -12.619
  339   2HB   PHE  41          1HB       PHE  41   5.799   4.238 -13.748
  340    HD1  PHE  41           HD1      PHE  41   5.205   5.299 -15.819
  341    HD2  PHE  41           HD2      PHE  41   2.180   3.523 -13.340
  342    HE1  PHE  41           HE1      PHE  41   3.446   6.381 -17.190
  343    HE2  PHE  41           HE2      PHE  41   0.422   4.606 -14.710
  344    HZ   PHE  41           HZ       PHE  41   1.054   6.036 -16.636
  345    H    ARG  42           H        ARG  42   3.666   1.827 -16.195
  346    HA   ARG  42           HA       ARG  42   5.828   1.547 -18.096
  347   1HB   ARG  42          2HB       ARG  42   2.872   1.759 -18.701
  348   2HB   ARG  42          1HB       ARG  42   4.130   1.032 -19.700
  349   1HG   ARG  42          2HG       ARG  42   4.514  -0.679 -17.935
  350   2HG   ARG  42          1HG       ARG  42   3.197   0.024 -16.994
  351   1HD   ARG  42          2HD       ARG  42   2.339  -1.875 -18.249
  352   2HD   ARG  42          1HD       ARG  42   1.658  -0.394 -18.913
  353    HE   ARG  42           HE       ARG  42   4.080  -1.384 -20.209
  354   1HH1  ARG  42          1HH2      ARG  42   0.617  -1.196 -20.142
  355   2HH1  ARG  42          2HH2      ARG  42   0.432  -1.594 -21.818
  356   1HH2  ARG  42          1HH1      ARG  42   3.833  -1.907 -22.398
  357   2HH2  ARG  42          2HH1      ARG  42   2.249  -1.996 -23.093
  Start of MODEL    8
    1   1H    MET   1          1HT       MET   1   8.512  -9.337  -1.500
    2   2H    MET   1          2HT       MET   1   7.570 -10.719  -1.201
    3   3H    MET   1          3HT       MET   1   7.017  -9.187  -0.715
    4    HA   MET   1           HA       MET   1   5.947  -8.987  -2.620
    5   1HB   MET   1          2HB       MET   1   7.276  -8.575  -4.644
    6   2HB   MET   1          1HB       MET   1   8.020  -7.787  -3.254
    7   1HG   MET   1          2HG       MET   1   9.295 -10.144  -3.096
    8   2HG   MET   1          1HG       MET   1   8.963 -10.138  -4.829
    9   1HE   MET   1          1HE       MET   1   9.854  -7.893  -1.931
   10   2HE   MET   1          2HE       MET   1  11.360  -7.102  -2.385
   11   3HE   MET   1          3HE       MET   1  11.349  -8.830  -2.044
   12    H    ILE   2           H        ILE   2   5.552 -10.037  -4.869
   13    HA   ILE   2           HA       ILE   2   6.309 -12.803  -5.164
   14    HB   ILE   2           HB       ILE   2   4.600 -12.990  -3.386
   15   1HG1  ILE   2          2HG1      ILE   2   3.564 -13.950  -6.076
   16   2HG1  ILE   2          1HG1      ILE   2   4.816 -14.766  -5.139
   17   1HG2  ILE   2          1HG2      ILE   2   2.520 -12.047  -5.326
   18   2HG2  ILE   2          2HG2      ILE   2   3.401 -10.858  -4.369
   19   3HG2  ILE   2          3HG2      ILE   2   2.456 -12.109  -3.567
   20   1HD1  ILE   2          1HD1      ILE   2   2.935 -15.919  -4.415
   21   2HD1  ILE   2          2HD1      ILE   2   1.882 -14.514  -4.580
   22   3HD1  ILE   2          3HD1      ILE   2   2.992 -14.629  -3.214
   23    H    SER   3           H        SER   3   4.934  -9.888  -6.225
   24    HA   SER   3           HA       SER   3   4.470  -9.095  -8.332
   25   1HB   SER   3          2HB       SER   3   6.371 -10.848  -8.891
   26   2HB   SER   3          1HB       SER   3   5.033 -11.757  -9.588
   27    HG   SER   3           HG       SER   3   5.185 -10.454 -11.215
   28    H    ASN   4           H        ASN   4   2.638 -10.791  -6.586
   29    HA   ASN   4           HA       ASN   4   0.423 -10.865  -8.470
   30   1HB   ASN   4          2HB       ASN   4   1.010 -13.086  -8.851
   31   2HB   ASN   4          1HB       ASN   4   1.606 -13.318  -7.210
   32   1HD2  ASN   4          1HD2      ASN   4  -1.552 -11.859  -8.036
   33   2HD2  ASN   4          2HD2      ASN   4  -2.476 -13.096  -7.337
   34    H    ALA   5           H        ALA   5   0.827 -12.484  -5.327
   35    HA   ALA   5           HA       ALA   5  -1.555 -11.458  -4.236
   36   1HB   ALA   5          1HB       ALA   5   0.652 -12.147  -2.370
   37   2HB   ALA   5          2HB       ALA   5   0.126 -13.412  -3.479
   38   3HB   ALA   5          3HB       ALA   5  -1.030 -12.674  -2.371
   39    H    LYS   6           H        LYS   6   1.527 -10.018  -4.646
   40    HA   LYS   6           HA       LYS   6   1.461  -8.163  -2.481
   41   1HB   LYS   6          2HB       LYS   6   3.550  -8.665  -3.648
   42   2HB   LYS   6          1HB       LYS   6   2.887  -8.028  -5.153
   43   1HG   LYS   6          2HG       LYS   6   2.658  -5.803  -4.134
   44   2HG   LYS   6          1HG       LYS   6   3.270  -6.428  -2.603
   45   1HD   LYS   6          2HD       LYS   6   5.428  -6.902  -3.574
   46   2HD   LYS   6          1HD       LYS   6   4.835  -6.541  -5.195
   47   1HE   LYS   6          2HE       LYS   6   4.290  -4.189  -4.270
   48   2HE   LYS   6          1HE       LYS   6   5.328  -4.625  -2.913
   49   1HZ   LYS   6          1HZ       LYS   6   7.178  -4.753  -4.251
   50   2HZ   LYS   6          2HZ       LYS   6   6.340  -3.460  -4.968
   51   3HZ   LYS   6          3HZ       LYS   6   6.285  -5.006  -5.671
   52    H    ILE   7           H        ILE   7   0.553  -7.956  -5.914
   53    HA   ILE   7           HA       ILE   7  -0.264  -5.286  -5.987
   54    HB   ILE   7           HB       ILE   7  -1.481  -7.624  -7.483
   55   1HG1  ILE   7          2HG1      ILE   7   0.650  -5.772  -8.536
   56   2HG1  ILE   7          1HG1      ILE   7   1.102  -7.175  -7.568
   57   1HG2  ILE   7          1HG2      ILE   7  -2.859  -5.638  -7.683
   58   2HG2  ILE   7          2HG2      ILE   7  -1.959  -5.831  -9.187
   59   3HG2  ILE   7          3HG2      ILE   7  -1.443  -4.633  -7.998
   60   1HD1  ILE   7          1HD1      ILE   7  -0.206  -8.624  -9.127
   61   2HD1  ILE   7          2HD1      ILE   7   1.131  -7.794  -9.925
   62   3HD1  ILE   7          3HD1      ILE   7  -0.519  -7.206 -10.130
   63    H    ALA   8           H        ALA   8  -2.245  -8.197  -5.435
   64    HA   ALA   8           HA       ALA   8  -4.676  -6.938  -4.906
   65   1HB   ALA   8          1HB       ALA   8  -4.437  -9.366  -5.257
   66   2HB   ALA   8          2HB       ALA   8  -5.313  -9.009  -3.768
   67   3HB   ALA   8          3HB       ALA   8  -3.623  -9.506  -3.700
   68    H    ARG   9           H        ARG   9  -1.911  -7.534  -2.791
   69    HA   ARG   9           HA       ARG   9  -3.191  -6.895  -0.348
   70   1HB   ARG   9          2HB       ARG   9  -0.986  -8.014  -0.459
   71   2HB   ARG   9          1HB       ARG   9  -0.276  -6.527  -1.090
   72   1HG   ARG   9          2HG       ARG   9  -0.858  -5.324   0.944
   73   2HG   ARG   9          1HG       ARG   9  -1.720  -6.729   1.569
   74   1HD   ARG   9          2HD       ARG   9   0.542  -7.972   1.286
   75   2HD   ARG   9          1HD       ARG   9   1.245  -6.359   1.194
   76    HE   ARG   9           HE       ARG   9  -0.390  -6.379   3.450
   77   1HH1  ARG   9          1HH2      ARG   9   2.403  -8.046   2.253
   78   2HH1  ARG   9          2HH2      ARG   9   3.059  -8.353   3.826
   79   1HH2  ARG   9          1HH1      ARG   9   0.472  -6.779   5.509
   80   2HH2  ARG   9          2HH1      ARG   9   1.971  -7.633   5.666
   81    H    ILE  10           H        ILE  10  -1.334  -4.928  -2.652
   82    HA   ILE  10           HA       ILE  10  -1.301  -2.504  -1.324
   83    HB   ILE  10           HB       ILE  10  -1.603  -3.031  -4.289
   84   1HG1  ILE  10          2HG1      ILE  10   0.868  -2.282  -2.704
   85   2HG1  ILE  10          1HG1      ILE  10   0.422  -3.956  -3.029
   86   1HG2  ILE  10          1HG2      ILE  10  -2.253  -0.744  -3.871
   87   2HG2  ILE  10          2HG2      ILE  10  -0.598  -0.717  -4.478
   88   3HG2  ILE  10          3HG2      ILE  10  -0.906  -0.512  -2.754
   89   1HD1  ILE  10          1HD1      ILE  10   1.856  -3.466  -4.817
   90   2HD1  ILE  10          2HD1      ILE  10   1.256  -1.815  -4.972
   91   3HD1  ILE  10          3HD1      ILE  10   0.266  -3.168  -5.519
   92    H    ASN  11           H        ASN  11  -3.693  -3.341  -3.863
   93    HA   ASN  11           HA       ASN  11  -5.414  -1.183  -3.288
   94   1HB   ASN  11          2HB       ASN  11  -7.163  -2.596  -4.493
   95   2HB   ASN  11          1HB       ASN  11  -5.698  -2.226  -5.396
   96   1HD2  ASN  11          1HD2      ASN  11  -7.607  -4.607  -5.596
   97   2HD2  ASN  11          2HD2      ASN  11  -6.599  -5.964  -5.433
   98    H    GLU  12           H        GLU  12  -5.315  -4.481  -2.014
   99    HA   GLU  12           HA       GLU  12  -7.764  -4.428  -0.612
  100   1HB   GLU  12          2HB       GLU  12  -6.494  -6.500  -0.985
  101   2HB   GLU  12          1HB       GLU  12  -5.215  -5.912   0.078
  102   1HG   GLU  12          2HG       GLU  12  -6.645  -5.965   1.989
  103   2HG   GLU  12          1HG       GLU  12  -8.086  -6.169   0.994
  104    H    LEU  13           H        LEU  13  -4.449  -3.761   0.528
  105    HA   LEU  13           HA       LEU  13  -5.115  -2.990   3.144
  106   1HB   LEU  13          2HB       LEU  13  -2.778  -3.333   1.811
  107   2HB   LEU  13          1HB       LEU  13  -2.847  -1.573   1.864
  108    HG   LEU  13           HG       LEU  13  -3.210  -3.359   4.289
  109   1HD1  LEU  13          1HD1      LEU  13  -0.946  -3.653   3.639
  110   2HD1  LEU  13          2HD1      LEU  13  -0.895  -2.379   4.857
  111   3HD1  LEU  13          3HD1      LEU  13  -0.782  -1.968   3.146
  112   1HD2  LEU  13          1HD2      LEU  13  -2.530  -1.011   5.318
  113   2HD2  LEU  13          2HD2      LEU  13  -4.202  -1.330   4.861
  114   3HD2  LEU  13          3HD2      LEU  13  -3.159  -0.398   3.789
  115    H    ALA  14           H        ALA  14  -4.860  -1.101   0.149
  116    HA   ALA  14           HA       ALA  14  -5.161   1.465   1.202
  117   1HB   ALA  14          1HB       ALA  14  -6.293   1.940  -1.065
  118   2HB   ALA  14          2HB       ALA  14  -5.983   0.242  -1.428
  119   3HB   ALA  14          3HB       ALA  14  -4.638   1.331  -1.096
  120    H    ALA  15           H        ALA  15  -7.696  -0.760   0.027
  121    HA   ALA  15           HA       ALA  15  -9.893   0.864   0.769
  122   1HB   ALA  15          1HB       ALA  15 -11.246  -1.089   0.398
  123   2HB   ALA  15          2HB       ALA  15  -9.858  -2.157   0.601
  124   3HB   ALA  15          3HB       ALA  15  -9.960  -1.103  -0.809
  125    H    LYS  16           H        LYS  16  -8.072  -1.634   2.470
  126    HA   LYS  16           HA       LYS  16  -9.730  -1.888   4.734
  127   1HB   LYS  16          2HB       LYS  16  -7.696  -3.328   4.004
  128   2HB   LYS  16          1HB       LYS  16  -6.731  -2.132   4.868
  129   1HG   LYS  16          2HG       LYS  16  -8.218  -2.510   6.878
  130   2HG   LYS  16          1HG       LYS  16  -8.955  -3.853   6.001
  131   1HD   LYS  16          2HD       LYS  16  -6.745  -4.937   5.795
  132   2HD   LYS  16          1HD       LYS  16  -6.006  -3.596   6.671
  133   1HE   LYS  16          2HE       LYS  16  -7.417  -4.101   8.636
  134   2HE   LYS  16          1HE       LYS  16  -8.149  -5.448   7.762
  135   1HZ   LYS  16          1HZ       LYS  16  -6.436  -6.354   9.075
  136   2HZ   LYS  16          2HZ       LYS  16  -5.327  -5.151   8.614
  137   3HZ   LYS  16          3HZ       LYS  16  -5.827  -6.322   7.492
  138    H    ALA  17           H        ALA  17  -6.667  -0.090   4.412
  139    HA   ALA  17           HA       ALA  17  -6.874   1.357   6.815
  140   1HB   ALA  17          1HB       ALA  17  -5.449   1.969   4.216
  141   2HB   ALA  17          2HB       ALA  17  -4.758   1.284   5.688
  142   3HB   ALA  17          3HB       ALA  17  -5.289   2.967   5.661
  143    H    LYS  18           H        LYS  18  -8.555   1.691   3.810
  144    HA   LYS  18           HA       LYS  18  -9.180   4.455   3.921
  145   1HB   LYS  18          2HB       LYS  18  -9.674   2.753   2.024
  146   2HB   LYS  18          1HB       LYS  18 -11.131   2.372   2.941
  147   1HG   LYS  18          2HG       LYS  18 -11.826   4.720   2.867
  148   2HG   LYS  18          1HG       LYS  18 -10.344   5.149   2.011
  149   1HD   LYS  18          2HD       LYS  18 -11.027   4.142   0.035
  150   2HD   LYS  18          1HD       LYS  18 -12.081   2.996   0.862
  151   1HE   LYS  18          2HE       LYS  18 -13.699   4.749   1.340
  152   2HE   LYS  18          1HE       LYS  18 -12.620   5.974   0.672
  153   1HZ   LYS  18          1HZ       LYS  18 -13.171   5.440  -1.412
  154   2HZ   LYS  18          2HZ       LYS  18 -14.533   4.696  -0.718
  155   3HZ   LYS  18          3HZ       LYS  18 -13.164   3.771  -1.107
  156    H    ALA  19           H        ALA  19 -11.292   1.715   4.802
  157    HA   ALA  19           HA       ALA  19 -12.886   3.377   6.554
  158   1HB   ALA  19          1HB       ALA  19 -13.633   1.297   5.164
  159   2HB   ALA  19          2HB       ALA  19 -14.286   1.511   6.787
  160   3HB   ALA  19          3HB       ALA  19 -12.972   0.368   6.509
  161    H    GLY  20           H        GLY  20  -9.920   1.878   6.783
  162   1HA   GLY  20          2HA       GLY  20 -10.108   1.319   9.669
  163   2HA   GLY  20          1HA       GLY  20  -8.806   0.803   8.601
  164    H    VAL  21           H        VAL  21  -9.613   3.925   7.842
  165    HA   VAL  21           HA       VAL  21  -8.791   6.010   8.294
  166    HB   VAL  21           HB       VAL  21  -7.356   5.026  10.741
  167   1HG1  VAL  21          1HG1      VAL  21  -7.173   7.391  10.028
  168   2HG1  VAL  21          2HG1      VAL  21  -8.021   7.248  11.568
  169   3HG1  VAL  21          3HG1      VAL  21  -8.930   7.538  10.085
  170   1HG2  VAL  21          1HG2      VAL  21  -9.713   5.630  11.825
  171   2HG2  VAL  21          2HG2      VAL  21  -9.370   3.997  11.255
  172   3HG2  VAL  21          3HG2      VAL  21 -10.310   5.102  10.252
  173    H    ILE  22           H        ILE  22  -6.399   3.751   9.547
  174    HA   ILE  22           HA       ILE  22  -4.522   3.101   8.008
  175    HB   ILE  22           HB       ILE  22  -4.755   5.123   6.560
  176   1HG1  ILE  22          2HG1      ILE  22  -2.186   5.664   6.628
  177   2HG1  ILE  22          1HG1      ILE  22  -2.133   4.382   7.836
  178   1HG2  ILE  22          1HG2      ILE  22  -4.880   6.579   8.819
  179   2HG2  ILE  22          2HG2      ILE  22  -4.313   7.265   7.297
  180   3HG2  ILE  22          3HG2      ILE  22  -3.149   6.722   8.506
  181   1HD1  ILE  22          1HD1      ILE  22  -1.736   3.617   5.451
  182   2HD1  ILE  22          2HD1      ILE  22  -3.415   4.038   5.115
  183   3HD1  ILE  22          3HD1      ILE  22  -3.040   2.778   6.291
  184    H    THR  23           H        THR  23  -2.651   2.598   9.047
  185    HA   THR  23           HA       THR  23  -2.245   3.846  11.695
  186    HB   THR  23           HB       THR  23  -1.230   1.795  12.405
  187    HG1  THR  23           HG1      THR  23  -1.555   0.815   9.775
  188   1HG2  THR  23          1HG2      THR  23  -3.731   1.832  12.248
  189   2HG2  THR  23          2HG2      THR  23  -3.047   0.213  12.107
  190   3HG2  THR  23          3HG2      THR  23  -3.601   1.062  10.667
  191    H    GLU  24           H        GLU  24  -0.112   4.344  12.372
  192    HA   GLU  24           HA       GLU  24   1.498   5.689  10.567
  193   1HB   GLU  24          2HB       GLU  24   2.163   4.405  13.220
  194   2HB   GLU  24          1HB       GLU  24   3.326   5.378  12.320
  195   1HG   GLU  24          2HG       GLU  24   2.245   6.857  13.871
  196   2HG   GLU  24          1HG       GLU  24   1.595   7.228  12.275
  197    H    GLU  25           H        GLU  25   1.839   2.365  11.759
  198    HA   GLU  25           HA       GLU  25   4.199   1.695  10.385
  199   1HB   GLU  25          2HB       GLU  25   2.007  -0.301  10.901
  200   2HB   GLU  25          1HB       GLU  25   3.754  -0.527  10.984
  201   1HG   GLU  25          2HG       GLU  25   3.708   1.181  12.913
  202   2HG   GLU  25          1HG       GLU  25   1.962   0.931  12.934
  203    H    GLU  26           H        GLU  26   0.785   1.213   9.475
  204    HA   GLU  26           HA       GLU  26   1.286  -0.017   6.979
  205   1HB   GLU  26          2HB       GLU  26  -1.083   1.469   8.102
  206   2HB   GLU  26          1HB       GLU  26  -1.090   0.809   6.467
  207   1HG   GLU  26          2HG       GLU  26  -0.717  -1.431   7.291
  208   2HG   GLU  26          1HG       GLU  26  -0.451  -0.838   8.928
  209    H    LYS  27           H        LYS  27   0.505   3.369   7.787
  210    HA   LYS  27           HA       LYS  27   0.477   4.472   5.256
  211   1HB   LYS  27          2HB       LYS  27   0.090   5.564   7.585
  212   2HB   LYS  27          1HB       LYS  27   1.820   5.906   7.532
  213   1HG   LYS  27          2HG       LYS  27   1.518   7.044   5.352
  214   2HG   LYS  27          1HG       LYS  27  -0.216   6.731   5.440
  215   1HD   LYS  27          2HD       LYS  27  -0.174   7.956   7.690
  216   2HD   LYS  27          1HD       LYS  27   1.446   8.495   7.248
  217   1HE   LYS  27          2HE       LYS  27   0.316   9.245   5.013
  218   2HE   LYS  27          1HE       LYS  27  -1.182   9.148   5.937
  219   1HZ   LYS  27          1HZ       LYS  27  -0.640  11.232   6.515
  220   2HZ   LYS  27          2HZ       LYS  27   1.008  11.031   6.152
  221   3HZ   LYS  27          3HZ       LYS  27   0.388  10.479   7.634
  222    H    ALA  28           H        ALA  28   3.306   4.021   7.381
  223    HA   ALA  28           HA       ALA  28   5.231   5.094   5.629
  224   1HB   ALA  28          1HB       ALA  28   5.684   4.651   8.007
  225   2HB   ALA  28          2HB       ALA  28   6.873   3.849   6.981
  226   3HB   ALA  28          3HB       ALA  28   5.564   2.918   7.711
  227    H    GLU  29           H        GLU  29   4.133   1.741   6.103
  228    HA   GLU  29           HA       GLU  29   5.820   0.507   4.231
  229   1HB   GLU  29          2HB       GLU  29   4.304  -0.613   5.946
  230   2HB   GLU  29          1HB       GLU  29   2.977  -0.339   4.818
  231   1HG   GLU  29          2HG       GLU  29   3.760  -2.534   4.336
  232   2HG   GLU  29          1HG       GLU  29   4.422  -1.516   3.060
  233    H    GLN  30           H        GLN  30   2.427   1.494   3.837
  234    HA   GLN  30           HA       GLN  30   2.044   0.960   1.171
  235   1HB   GLN  30          2HB       GLN  30   1.001   3.350   2.709
  236   2HB   GLN  30          1HB       GLN  30   0.321   2.715   1.211
  237   1HG   GLN  30          2HG       GLN  30   0.643   0.601   3.183
  238   2HG   GLN  30          1HG       GLN  30  -0.338   1.917   3.824
  239   1HE2  GLN  30          1HE2      GLN  30  -2.465   2.177   2.978
  240   2HE2  GLN  30          2HE2      GLN  30  -3.111   1.178   1.767
  241    H    GLN  31           H        GLN  31   3.768   3.697   2.582
  242    HA   GLN  31           HA       GLN  31   3.894   5.396   0.377
  243   1HB   GLN  31          2HB       GLN  31   4.716   5.899   2.701
  244   2HB   GLN  31          1HB       GLN  31   6.144   4.926   2.344
  245   1HG   GLN  31          2HG       GLN  31   6.664   6.394   0.423
  246   2HG   GLN  31          1HG       GLN  31   5.243   7.372   0.789
  247   1HE2  GLN  31          1HE2      GLN  31   8.584   7.008   1.457
  248   2HE2  GLN  31          2HE2      GLN  31   8.666   8.064   2.784
  249    H    LYS  32           H        LYS  32   6.285   2.921   1.336
  250    HA   LYS  32           HA       LYS  32   7.930   3.186  -0.931
  251   1HB   LYS  32          2HB       LYS  32   7.486   0.957   1.048
  252   2HB   LYS  32          1HB       LYS  32   8.606   0.775  -0.303
  253   1HG   LYS  32          2HG       LYS  32   9.815   2.805   0.428
  254   2HG   LYS  32          1HG       LYS  32   8.708   2.967   1.793
  255   1HD   LYS  32          2HD       LYS  32   9.422   0.770   2.650
  256   2HD   LYS  32          1HD       LYS  32  10.514   0.584   1.278
  257   1HE   LYS  32          2HE       LYS  32  11.935   1.401   2.959
  258   2HE   LYS  32          1HE       LYS  32  11.513   2.860   2.063
  259   1HZ   LYS  32          1HZ       LYS  32  11.292   2.753   4.655
  260   2HZ   LYS  32          2HZ       LYS  32   9.790   2.050   4.287
  261   3HZ   LYS  32          3HZ       LYS  32  10.164   3.606   3.718
  262    H    LEU  33           H        LEU  33   5.442   0.711  -0.244
  263    HA   LEU  33           HA       LEU  33   5.576  -0.655  -2.666
  264   1HB   LEU  33          2HB       LEU  33   3.027  -0.174  -1.114
  265   2HB   LEU  33          1HB       LEU  33   3.412  -1.550  -2.144
  266    HG   LEU  33           HG       LEU  33   4.698  -0.834   0.505
  267   1HD1  LEU  33          1HD1      LEU  33   2.494  -2.032   0.530
  268   2HD1  LEU  33          2HD1      LEU  33   3.810  -2.975   1.229
  269   3HD1  LEU  33          3HD1      LEU  33   3.239  -3.331  -0.400
  270   1HD2  LEU  33          1HD2      LEU  33   6.520  -1.621  -0.777
  271   2HD2  LEU  33          2HD2      LEU  33   5.516  -2.775  -1.655
  272   3HD2  LEU  33          3HD2      LEU  33   5.931  -3.073   0.033
  273    H    ARG  34           H        ARG  34   3.812   2.296  -1.856
  274    HA   ARG  34           HA       ARG  34   2.322   2.427  -4.287
  275   1HB   ARG  34          2HB       ARG  34   1.746   3.614  -2.146
  276   2HB   ARG  34          1HB       ARG  34   3.075   4.726  -2.471
  277   1HG   ARG  34          2HG       ARG  34   2.034   5.333  -4.631
  278   2HG   ARG  34          1HG       ARG  34   0.697   4.233  -4.290
  279   1HD   ARG  34          2HD       ARG  34   0.512   5.612  -2.055
  280   2HD   ARG  34          1HD       ARG  34   1.390   6.837  -2.966
  281    HE   ARG  34           HE       ARG  34  -0.504   7.155  -4.303
  282   1HH1  ARG  34          1HH2      ARG  34  -0.841   4.378  -2.250
  283   2HH1  ARG  34          2HH2      ARG  34  -2.532   4.183  -2.571
  284   1HH2  ARG  34          1HH1      ARG  34  -2.713   6.898  -4.717
  285   2HH2  ARG  34          2HH1      ARG  34  -3.591   5.609  -3.963
  286    H    GLN  35           H        GLN  35   5.079   4.419  -3.168
  287    HA   GLN  35           HA       GLN  35   5.530   5.666  -5.649
  288   1HB   GLN  35          2HB       GLN  35   7.512   6.534  -4.692
  289   2HB   GLN  35          1HB       GLN  35   6.392   6.360  -3.347
  290   1HG   GLN  35          2HG       GLN  35   8.252   5.357  -2.421
  291   2HG   GLN  35          1HG       GLN  35   7.517   3.952  -3.183
  292   1HE2  GLN  35          1HE2      GLN  35   9.928   3.231  -3.108
  293   2HE2  GLN  35          2HE2      GLN  35  10.895   3.663  -4.434
  294    H    GLU  36           H        GLU  36   6.590   2.586  -4.373
  295    HA   GLU  36           HA       GLU  36   8.704   2.098  -6.202
  296   1HB   GLU  36          2HB       GLU  36   8.607   0.745  -4.242
  297   2HB   GLU  36          1HB       GLU  36   6.942   0.267  -4.566
  298   1HG   GLU  36          2HG       GLU  36   9.087  -0.369  -6.579
  299   2HG   GLU  36          1HG       GLU  36   8.906  -1.384  -5.150
  300    H    TYR  37           H        TYR  37   5.263   1.197  -6.223
  301    HA   TYR  37           HA       TYR  37   5.154  -0.319  -8.531
  302   1HB   TYR  37          2HB       TYR  37   3.232   0.041  -7.019
  303   2HB   TYR  37          1HB       TYR  37   3.094   1.700  -7.603
  304    HD1  TYR  37           HD1      TYR  37   3.142  -1.848  -8.803
  305    HD2  TYR  37           HD2      TYR  37   1.818   2.175  -9.523
  306    HE1  TYR  37           HE1      TYR  37   1.792  -2.636 -10.729
  307    HE2  TYR  37           HE2      TYR  37   0.471   1.387 -11.448
  308    HH   TYR  37           HH       TYR  37  -0.441  -1.626 -11.944
  309    H    LEU  38           H        LEU  38   5.194   3.203  -8.210
  310    HA   LEU  38           HA       LEU  38   4.616   3.910 -10.856
  311   1HB   LEU  38          2HB       LEU  38   6.603   5.344  -9.081
  312   2HB   LEU  38          1HB       LEU  38   5.615   6.034 -10.369
  313    HG   LEU  38           HG       LEU  38   4.620   4.889  -7.741
  314   1HD1  LEU  38          1HD1      LEU  38   3.761   7.264  -7.500
  315   2HD1  LEU  38          2HD1      LEU  38   4.735   7.681  -8.910
  316   3HD1  LEU  38          3HD1      LEU  38   5.516   7.099  -7.440
  317   1HD2  LEU  38          1HD2      LEU  38   2.935   4.316  -9.296
  318   2HD2  LEU  38          2HD2      LEU  38   3.189   5.779 -10.249
  319   3HD2  LEU  38          3HD2      LEU  38   2.400   5.877  -8.674
  320    H    LYS  39           H        LYS  39   7.844   3.661  -9.351
  321    HA   LYS  39           HA       LYS  39   9.262   3.780 -11.810
  322   1HB   LYS  39          2HB       LYS  39   9.990   2.939  -9.009
  323   2HB   LYS  39          1HB       LYS  39  11.139   2.781 -10.335
  324   1HG   LYS  39          2HG       LYS  39  11.488   4.927  -9.228
  325   2HG   LYS  39          1HG       LYS  39  10.836   5.209 -10.841
  326   1HD   LYS  39          2HD       LYS  39   8.670   5.704 -10.000
  327   2HD   LYS  39          1HD       LYS  39   9.039   5.016  -8.419
  328   1HE   LYS  39          2HE       LYS  39  10.168   6.887  -7.714
  329   2HE   LYS  39          1HE       LYS  39  10.771   7.260  -9.330
  330   1HZ   LYS  39          1HZ       LYS  39   8.763   8.562  -8.106
  331   2HZ   LYS  39          2HZ       LYS  39   7.904   7.443  -9.055
  332   3HZ   LYS  39          3HZ       LYS  39   8.999   8.516  -9.786
  333    H    GLY  40           H        GLY  40   7.472   1.307 -10.309
  334   1HA   GLY  40          2HA       GLY  40   8.932  -0.883 -11.583
  335   2HA   GLY  40          1HA       GLY  40   7.556  -1.037 -10.498
  336    H    PHE  41           H        PHE  41   6.492   1.292 -12.418
  337    HA   PHE  41           HA       PHE  41   4.688  -0.328 -13.861
  338   1HB   PHE  41          2HB       PHE  41   4.240   2.034 -13.289
  339   2HB   PHE  41          1HB       PHE  41   5.501   2.539 -14.414
  340    HD1  PHE  41           HD1      PHE  41   2.132   1.066 -14.102
  341    HD2  PHE  41           HD2      PHE  41   5.186   2.368 -16.830
  342    HE1  PHE  41           HE1      PHE  41   0.506   0.968 -15.972
  343    HE2  PHE  41           HE2      PHE  41   3.559   2.270 -18.698
  344    HZ   PHE  41           HZ       PHE  41   1.219   1.569 -18.270
  345    H    ARG  42           H        ARG  42   5.066  -1.570 -15.567
  346    HA   ARG  42           HA       ARG  42   7.020  -0.678 -17.593
  347   1HB   ARG  42          2HB       ARG  42   6.847  -3.385 -16.264
  348   2HB   ARG  42          1HB       ARG  42   7.644  -3.146 -17.819
  349   1HG   ARG  42          2HG       ARG  42   9.365  -1.891 -16.906
  350   2HG   ARG  42          1HG       ARG  42   8.379  -1.319 -15.562
  351   1HD   ARG  42          2HD       ARG  42  10.135  -2.967 -14.872
  352   2HD   ARG  42          1HD       ARG  42   8.498  -3.483 -14.475
  353    HE   ARG  42           HE       ARG  42   9.104  -4.528 -16.997
  354   1HH1  ARG  42          1HH2      ARG  42  10.215  -4.754 -13.722
  355   2HH1  ARG  42          2HH2      ARG  42  10.763  -6.388 -13.878
  356   1HH2  ARG  42          1HH1      ARG  42   9.818  -6.671 -17.200
  357   2HH2  ARG  42          2HH1      ARG  42  10.534  -7.475 -15.843
  Start of MODEL    9
    1   1H    MET   1          1HT       MET   1   2.068  -7.028 -17.040
    2   2H    MET   1          2HT       MET   1   2.056  -5.801 -18.213
    3   3H    MET   1          3HT       MET   1   1.320  -7.296 -18.539
    4    HA   MET   1           HA       MET   1   0.291  -4.999 -17.146
    5   1HB   MET   1          2HB       MET   1  -0.979  -7.496 -18.317
    6   2HB   MET   1          1HB       MET   1  -1.839  -6.035 -17.836
    7   1HG   MET   1          2HG       MET   1  -1.562  -5.560 -20.075
    8   2HG   MET   1          1HG       MET   1  -0.042  -4.903 -19.472
    9   1HE   MET   1          1HE       MET   1  -0.021  -5.153 -22.132
   10   2HE   MET   1          2HE       MET   1  -1.058  -6.517 -22.544
   11   3HE   MET   1          3HE       MET   1   0.656  -6.570 -22.946
   12    H    ILE   2           H        ILE   2   0.935  -5.194 -14.976
   13    HA   ILE   2           HA       ILE   2   0.441  -7.603 -13.463
   14    HB   ILE   2           HB       ILE   2   1.047  -4.840 -12.386
   15   1HG1  ILE   2          2HG1      ILE   2   3.033  -7.006 -13.148
   16   2HG1  ILE   2          1HG1      ILE   2   2.683  -5.607 -14.159
   17   1HG2  ILE   2          1HG2      ILE   2   1.680  -5.926 -10.414
   18   2HG2  ILE   2          2HG2      ILE   2   1.926  -7.473 -11.224
   19   3HG2  ILE   2          3HG2      ILE   2   0.292  -6.885 -10.921
   20   1HD1  ILE   2          1HD1      ILE   2   3.955  -5.664 -11.423
   21   2HD1  ILE   2          2HD1      ILE   2   3.233  -4.190 -12.068
   22   3HD1  ILE   2          3HD1      ILE   2   4.584  -4.951 -12.908
   23    H    SER   3           H        SER   3  -1.213  -8.045 -12.094
   24    HA   SER   3           HA       SER   3  -3.102  -6.158 -11.129
   25   1HB   SER   3          2HB       SER   3  -3.898  -6.082 -13.427
   26   2HB   SER   3          1HB       SER   3  -3.978  -7.840 -13.494
   27    HG   SER   3           HG       SER   3  -5.621  -7.802 -12.000
   28    H    ASN   4           H        ASN   4  -1.987  -7.706  -9.491
   29    HA   ASN   4           HA       ASN   4  -3.977  -9.481  -8.507
   30   1HB   ASN   4          2HB       ASN   4  -2.466 -11.561  -8.645
   31   2HB   ASN   4          1HB       ASN   4  -3.327 -11.083 -10.103
   32   1HD2  ASN   4          1HD2      ASN   4  -0.664  -9.016  -9.228
   33   2HD2  ASN   4          2HD2      ASN   4   0.433  -9.608 -10.379
   34    H    ALA   5           H        ALA   5  -1.013 -10.879  -7.861
   35    HA   ALA   5           HA       ALA   5  -0.808 -10.685  -5.235
   36   1HB   ALA   5          1HB       ALA   5   0.889 -11.742  -6.696
   37   2HB   ALA   5          2HB       ALA   5   1.615 -10.794  -5.398
   38   3HB   ALA   5          3HB       ALA   5   1.559 -10.148  -7.039
   39    H    LYS   6           H        LYS   6   0.663  -8.115  -7.256
   40    HA   LYS   6           HA       LYS   6   1.235  -6.431  -5.033
   41   1HB   LYS   6          2HB       LYS   6   1.188  -6.013  -8.015
   42   2HB   LYS   6          1HB       LYS   6   1.506  -4.677  -6.907
   43   1HG   LYS   6          2HG       LYS   6   3.394  -5.891  -5.930
   44   2HG   LYS   6          1HG       LYS   6   3.050  -7.290  -6.946
   45   1HD   LYS   6          2HD       LYS   6   4.845  -6.073  -7.995
   46   2HD   LYS   6          1HD       LYS   6   3.397  -5.801  -8.964
   47   1HE   LYS   6          2HE       LYS   6   3.169  -3.594  -8.252
   48   2HE   LYS   6          1HE       LYS   6   4.052  -3.878  -6.753
   49   1HZ   LYS   6          1HZ       LYS   6   5.875  -4.448  -8.679
   50   2HZ   LYS   6          2HZ       LYS   6   5.778  -2.990  -7.815
   51   3HZ   LYS   6          3HZ       LYS   6   5.039  -3.125  -9.337
   52    H    ILE   7           H        ILE   7  -1.033  -5.777  -7.723
   53    HA   ILE   7           HA       ILE   7  -2.350  -3.633  -6.566
   54    HB   ILE   7           HB       ILE   7  -3.177  -5.672  -8.614
   55   1HG1  ILE   7          2HG1      ILE   7  -3.237  -3.520  -9.987
   56   2HG1  ILE   7          1HG1      ILE   7  -2.531  -2.709  -8.591
   57   1HG2  ILE   7          1HG2      ILE   7  -5.178  -4.100  -8.998
   58   2HG2  ILE   7          2HG2      ILE   7  -4.879  -3.506  -7.365
   59   3HG2  ILE   7          3HG2      ILE   7  -5.291  -5.201  -7.626
   60   1HD1  ILE   7          1HD1      ILE   7  -0.536  -3.988  -8.719
   61   2HD1  ILE   7          2HD1      ILE   7  -0.903  -3.577 -10.394
   62   3HD1  ILE   7          3HD1      ILE   7  -1.277  -5.188  -9.781
   63    H    ALA   8           H        ALA   8  -3.318  -7.068  -6.431
   64    HA   ALA   8           HA       ALA   8  -5.650  -6.770  -4.934
   65   1HB   ALA   8          1HB       ALA   8  -5.438  -9.100  -4.380
   66   2HB   ALA   8          2HB       ALA   8  -3.702  -9.069  -4.690
   67   3HB   ALA   8          3HB       ALA   8  -4.841  -8.886  -6.024
   68    H    ARG   9           H        ARG   9  -2.284  -7.055  -3.848
   69    HA   ARG   9           HA       ARG   9  -2.814  -7.264  -1.090
   70   1HB   ARG   9          2HB       ARG   9  -0.601  -7.720  -2.069
   71   2HB   ARG   9          1HB       ARG   9  -0.419  -6.010  -2.459
   72   1HG   ARG   9          2HG       ARG   9  -0.649  -5.463  -0.040
   73   2HG   ARG   9          1HG       ARG   9  -0.742  -7.188   0.318
   74   1HD   ARG   9          2HD       ARG   9   1.585  -5.974  -1.181
   75   2HD   ARG   9          1HD       ARG   9   1.557  -6.101   0.573
   76    HE   ARG   9           HE       ARG   9   1.674  -8.464   0.377
   77   1HH1  ARG   9          1HH2      ARG   9   1.577  -6.832  -2.684
   78   2HH1  ARG   9          2HH2      ARG   9   2.122  -8.208  -3.584
   79   1HH2  ARG   9          1HH1      ARG   9   2.384 -10.262  -0.804
   80   2HH2  ARG   9          2HH1      ARG   9   2.574 -10.148  -2.522
   81    H    ILE  10           H        ILE  10  -1.428  -4.366  -2.619
   82    HA   ILE  10           HA       ILE  10  -1.995  -2.529  -0.658
   83    HB   ILE  10           HB       ILE  10  -1.994  -2.138  -3.660
   84   1HG1  ILE  10          2HG1      ILE  10   0.186  -1.377  -1.727
   85   2HG1  ILE  10          1HG1      ILE  10   0.070  -3.035  -2.316
   86   1HG2  ILE  10          1HG2      ILE  10  -2.084  -0.176  -1.367
   87   2HG2  ILE  10          2HG2      ILE  10  -3.054  -0.195  -2.841
   88   3HG2  ILE  10          3HG2      ILE  10  -1.352   0.262  -2.910
   89   1HD1  ILE  10          1HD1      ILE  10   0.205  -0.580  -4.092
   90   2HD1  ILE  10          2HD1      ILE  10   0.199  -2.261  -4.628
   91   3HD1  ILE  10          3HD1      ILE  10   1.574  -1.629  -3.722
   92    H    ASN  11           H        ASN  11  -4.165  -3.772  -3.140
   93    HA   ASN  11           HA       ASN  11  -6.252  -1.915  -2.886
   94   1HB   ASN  11          2HB       ASN  11  -6.240  -3.496  -4.712
   95   2HB   ASN  11          1HB       ASN  11  -6.320  -4.857  -3.596
   96   1HD2  ASN  11          1HD2      ASN  11  -8.377  -5.609  -4.458
   97   2HD2  ASN  11          2HD2      ASN  11  -9.816  -4.751  -4.193
   98    H    GLU  12           H        GLU  12  -6.344  -5.228  -1.560
   99    HA   GLU  12           HA       GLU  12  -8.418  -4.714   0.270
  100   1HB   GLU  12          2HB       GLU  12  -7.698  -6.974  -0.532
  101   2HB   GLU  12          1HB       GLU  12  -6.276  -6.839   0.502
  102   1HG   GLU  12          2HG       GLU  12  -7.696  -6.627   2.485
  103   2HG   GLU  12          1HG       GLU  12  -9.144  -6.659   1.478
  104    H    LEU  13           H        LEU  13  -4.918  -4.463   0.566
  105    HA   LEU  13           HA       LEU  13  -4.696  -4.252   3.351
  106   1HB   LEU  13          2HB       LEU  13  -2.844  -4.442   1.571
  107   2HB   LEU  13          1HB       LEU  13  -2.980  -2.691   1.422
  108    HG   LEU  13           HG       LEU  13  -2.549  -4.075   4.082
  109   1HD1  LEU  13          1HD1      LEU  13  -0.539  -3.051   2.061
  110   2HD1  LEU  13          2HD1      LEU  13  -0.625  -4.658   2.779
  111   3HD1  LEU  13          3HD1      LEU  13  -0.145  -3.277   3.765
  112   1HD2  LEU  13          1HD2      LEU  13  -1.474  -1.627   4.337
  113   2HD2  LEU  13          2HD2      LEU  13  -3.188  -1.922   4.619
  114   3HD2  LEU  13          3HD2      LEU  13  -2.650  -1.263   3.074
  115    H    ALA  14           H        ALA  14  -4.567  -1.518   1.049
  116    HA   ALA  14           HA       ALA  14  -4.871   0.521   2.925
  117   1HB   ALA  14          1HB       ALA  14  -4.171   0.959   0.629
  118   2HB   ALA  14          2HB       ALA  14  -5.599   1.921   1.014
  119   3HB   ALA  14          3HB       ALA  14  -5.755   0.463   0.030
  120    H    ALA  15           H        ALA  15  -7.332  -1.276   1.117
  121    HA   ALA  15           HA       ALA  15  -9.572   0.219   1.943
  122   1HB   ALA  15          1HB       ALA  15 -10.888  -1.708   1.253
  123   2HB   ALA  15          2HB       ALA  15  -9.455  -2.735   1.289
  124   3HB   ALA  15          3HB       ALA  15  -9.585  -1.444   0.094
  125    H    LYS  16           H        LYS  16  -7.856  -2.477   3.426
  126    HA   LYS  16           HA       LYS  16  -9.689  -3.075   5.474
  127   1HB   LYS  16          2HB       LYS  16  -7.651  -4.442   4.818
  128   2HB   LYS  16          1HB       LYS  16  -6.679  -3.275   5.713
  129   1HG   LYS  16          2HG       LYS  16  -7.105  -4.935   7.321
  130   2HG   LYS  16          1HG       LYS  16  -8.348  -3.731   7.663
  131   1HD   LYS  16          2HD       LYS  16 -10.014  -4.992   6.467
  132   2HD   LYS  16          1HD       LYS  16  -8.802  -6.105   5.835
  133   1HE   LYS  16          2HE       LYS  16  -9.933  -7.194   7.682
  134   2HE   LYS  16          1HE       LYS  16  -8.297  -6.791   8.203
  135   1HZ   LYS  16          1HZ       LYS  16  -9.756  -4.568   8.803
  136   2HZ   LYS  16          2HZ       LYS  16  -9.269  -5.767   9.904
  137   3HZ   LYS  16          3HZ       LYS  16 -10.809  -5.840   9.191
  138    H    ALA  17           H        ALA  17  -6.649  -1.247   5.764
  139    HA   ALA  17           HA       ALA  17  -7.192  -0.123   8.288
  140   1HB   ALA  17          1HB       ALA  17  -5.564   1.546   6.495
  141   2HB   ALA  17          2HB       ALA  17  -5.042  -0.138   6.566
  142   3HB   ALA  17          3HB       ALA  17  -5.147   0.817   8.045
  143    H    LYS  18           H        LYS  18  -8.368   0.685   5.127
  144    HA   LYS  18           HA       LYS  18  -8.951   3.424   5.545
  145   1HB   LYS  18          2HB       LYS  18  -9.133   2.187   3.342
  146   2HB   LYS  18          1HB       LYS  18 -10.641   1.493   3.936
  147   1HG   LYS  18          2HG       LYS  18 -11.419   3.369   2.791
  148   2HG   LYS  18          1HG       LYS  18 -11.272   4.001   4.431
  149   1HD   LYS  18          2HD       LYS  18  -8.793   4.551   3.616
  150   2HD   LYS  18          1HD       LYS  18  -9.565   4.531   2.030
  151   1HE   LYS  18          2HE       LYS  18 -10.424   6.217   4.402
  152   2HE   LYS  18          1HE       LYS  18  -9.599   6.804   2.958
  153   1HZ   LYS  18          1HZ       LYS  18 -12.150   6.974   3.098
  154   2HZ   LYS  18          2HZ       LYS  18 -12.133   5.318   2.719
  155   3HZ   LYS  18          3HZ       LYS  18 -11.445   6.446   1.649
  156    H    ALA  19           H        ALA  19 -11.297   0.742   5.618
  157    HA   ALA  19           HA       ALA  19 -13.096   2.233   7.318
  158   1HB   ALA  19          1HB       ALA  19 -13.320  -0.723   6.827
  159   2HB   ALA  19          2HB       ALA  19 -13.660   0.413   5.522
  160   3HB   ALA  19          3HB       ALA  19 -14.602   0.474   7.010
  161    H    GLY  20           H        GLY  20 -10.316   0.431   7.814
  162   1HA   GLY  20          2HA       GLY  20 -11.074  -0.482  10.507
  163   2HA   GLY  20          1HA       GLY  20  -9.642  -0.981   9.613
  164    H    VAL  21           H        VAL  21 -10.086   2.308   9.250
  165    HA   VAL  21           HA       VAL  21  -9.165   4.190  10.192
  166    HB   VAL  21           HB       VAL  21  -8.276   2.658  12.619
  167   1HG1  VAL  21          1HG1      VAL  21  -8.915   4.796  13.705
  168   2HG1  VAL  21          2HG1      VAL  21  -9.423   5.429  12.138
  169   3HG1  VAL  21          3HG1      VAL  21  -7.726   5.043  12.428
  170   1HG2  VAL  21          1HG2      VAL  21 -10.746   3.424  13.366
  171   2HG2  VAL  21          2HG2      VAL  21 -10.427   1.829  12.683
  172   3HG2  VAL  21          3HG2      VAL  21 -11.065   3.115  11.659
  173    H    ILE  22           H        ILE  22  -7.520   4.477   8.793
  174    HA   ILE  22           HA       ILE  22  -5.118   2.869   8.906
  175    HB   ILE  22           HB       ILE  22  -6.087   3.742   6.770
  176   1HG1  ILE  22          2HG1      ILE  22  -3.336   4.908   7.198
  177   2HG1  ILE  22          1HG1      ILE  22  -3.595   3.164   7.235
  178   1HG2  ILE  22          1HG2      ILE  22  -4.919   6.416   7.545
  179   2HG2  ILE  22          2HG2      ILE  22  -6.607   6.029   7.881
  180   3HG2  ILE  22          3HG2      ILE  22  -6.020   6.038   6.219
  181   1HD1  ILE  22          1HD1      ILE  22  -4.463   4.946   4.940
  182   2HD1  ILE  22          2HD1      ILE  22  -4.482   3.182   4.983
  183   3HD1  ILE  22          3HD1      ILE  22  -2.946   4.047   4.968
  184    H    THR  23           H        THR  23  -3.117   3.485   9.628
  185    HA   THR  23           HA       THR  23  -3.008   5.996  11.196
  186    HB   THR  23           HB       THR  23  -1.837   4.924  12.864
  187    HG1  THR  23           HG1      THR  23  -0.922   3.309  10.762
  188   1HG2  THR  23          1HG2      THR  23  -3.261   2.544  11.645
  189   2HG2  THR  23          2HG2      THR  23  -4.086   3.826  12.530
  190   3HG2  THR  23          3HG2      THR  23  -2.899   2.812  13.349
  191    H    GLU  24           H        GLU  24  -0.876   7.005  11.363
  192    HA   GLU  24           HA       GLU  24   0.309   7.543   8.908
  193   1HB   GLU  24          2HB       GLU  24   1.420   7.795  11.712
  194   2HB   GLU  24          1HB       GLU  24   2.253   8.409  10.283
  195   1HG   GLU  24          2HG       GLU  24   1.016  10.262  11.115
  196   2HG   GLU  24          1HG       GLU  24   0.082   9.667   9.746
  197    H    GLU  25           H        GLU  25   1.023   5.037  11.258
  198    HA   GLU  25           HA       GLU  25   3.517   4.171  10.304
  199   1HB   GLU  25          2HB       GLU  25   1.386   2.349  11.433
  200   2HB   GLU  25          1HB       GLU  25   3.136   2.165  11.532
  201   1HG   GLU  25          2HG       GLU  25   2.920   4.580  12.690
  202   2HG   GLU  25          1HG       GLU  25   1.325   3.949  13.094
  203    H    GLU  26           H        GLU  26   0.230   3.107   9.412
  204    HA   GLU  26           HA       GLU  26   1.040   1.156   7.528
  205   1HB   GLU  26          2HB       GLU  26  -1.492   2.624   8.119
  206   2HB   GLU  26          1HB       GLU  26  -1.363   1.791   6.571
  207   1HG   GLU  26          2HG       GLU  26  -2.336   0.327   8.318
  208   2HG   GLU  26          1HG       GLU  26  -0.805  -0.304   7.714
  209    H    LYS  27           H        LYS  27   0.253   4.600   7.207
  210    HA   LYS  27           HA       LYS  27   0.308   4.859   4.439
  211   1HB   LYS  27          2HB       LYS  27   0.849   6.668   6.741
  212   2HB   LYS  27          1HB       LYS  27   1.393   7.204   5.153
  213   1HG   LYS  27          2HG       LYS  27  -1.386   6.109   5.446
  214   2HG   LYS  27          1HG       LYS  27  -1.055   7.760   5.970
  215   1HD   LYS  27          2HD       LYS  27  -0.426   8.453   3.804
  216   2HD   LYS  27          1HD       LYS  27  -0.169   6.799   3.251
  217   1HE   LYS  27          2HE       LYS  27  -2.490   6.360   3.114
  218   2HE   LYS  27          1HE       LYS  27  -2.899   7.750   4.121
  219   1HZ   LYS  27          1HZ       LYS  27  -1.420   8.532   1.819
  220   2HZ   LYS  27          2HZ       LYS  27  -2.945   9.061   2.354
  221   3HZ   LYS  27          3HZ       LYS  27  -2.815   7.676   1.377
  222    H    ALA  28           H        ALA  28   2.996   4.921   6.754
  223    HA   ALA  28           HA       ALA  28   5.058   5.513   4.927
  224   1HB   ALA  28          1HB       ALA  28   5.248   5.580   7.432
  225   2HB   ALA  28          2HB       ALA  28   6.575   4.735   6.634
  226   3HB   ALA  28          3HB       ALA  28   5.291   3.817   7.423
  227    H    GLU  29           H        GLU  29   3.782   2.405   6.094
  228    HA   GLU  29           HA       GLU  29   5.555   0.701   4.765
  229   1HB   GLU  29          2HB       GLU  29   4.094  -0.181   6.453
  230   2HB   GLU  29          1HB       GLU  29   2.662   0.325   5.559
  231   1HG   GLU  29          2HG       GLU  29   2.948  -1.329   3.914
  232   2HG   GLU  29          1HG       GLU  29   4.652  -1.558   4.306
  233    H    GLN  30           H        GLN  30   2.223   1.470   3.739
  234    HA   GLN  30           HA       GLN  30   2.283   0.346   1.220
  235   1HB   GLN  30          2HB       GLN  30   0.883   2.946   1.864
  236   2HB   GLN  30          1HB       GLN  30   0.415   1.739   0.670
  237   1HG   GLN  30          2HG       GLN  30   0.517   0.207   2.930
  238   2HG   GLN  30          1HG       GLN  30   0.001   1.754   3.597
  239   1HE2  GLN  30          1HE2      GLN  30  -2.219   2.107   3.532
  240   2HE2  GLN  30          2HE2      GLN  30  -3.292   1.349   2.456
  241    H    GLN  31           H        GLN  31   3.697   3.381   2.268
  242    HA   GLN  31           HA       GLN  31   4.062   4.636  -0.213
  243   1HB   GLN  31          2HB       GLN  31   4.538   5.509   2.191
  244   2HB   GLN  31          1HB       GLN  31   6.130   4.787   1.968
  245   1HG   GLN  31          2HG       GLN  31   6.445   6.978   1.192
  246   2HG   GLN  31          1HG       GLN  31   6.149   6.077  -0.291
  247   1HE2  GLN  31          1HE2      GLN  31   3.158   5.986   0.921
  248   2HE2  GLN  31          2HE2      GLN  31   2.530   7.457   0.355
  249    H    LYS  32           H        LYS  32   5.969   2.171   1.432
  250    HA   LYS  32           HA       LYS  32   8.242   2.204  -0.209
  251   1HB   LYS  32          2HB       LYS  32   8.136   0.991   1.924
  252   2HB   LYS  32          1HB       LYS  32   6.976  -0.142   1.229
  253   1HG   LYS  32          2HG       LYS  32   8.657  -0.800  -0.474
  254   2HG   LYS  32          1HG       LYS  32   9.818   0.306   0.262
  255   1HD   LYS  32          2HD       LYS  32  10.411  -1.655   1.336
  256   2HD   LYS  32          1HD       LYS  32   9.193  -1.055   2.463
  257   1HE   LYS  32          2HE       LYS  32   7.475  -2.417   1.257
  258   2HE   LYS  32          1HE       LYS  32   8.761  -3.086   0.251
  259   1HZ   LYS  32          1HZ       LYS  32   8.150  -4.467   2.209
  260   2HZ   LYS  32          2HZ       LYS  32   8.742  -3.232   3.215
  261   3HZ   LYS  32          3HZ       LYS  32   9.790  -4.039   2.150
  262    H    LEU  33           H        LEU  33   5.535  -0.129  -0.354
  263    HA   LEU  33           HA       LEU  33   6.233  -1.346  -2.760
  264   1HB   LEU  33          2HB       LEU  33   3.508  -0.893  -1.523
  265   2HB   LEU  33          1HB       LEU  33   3.794  -1.943  -2.911
  266    HG   LEU  33           HG       LEU  33   5.486  -2.327  -0.467
  267   1HD1  LEU  33          1HD1      LEU  33   3.342  -2.270   0.578
  268   2HD1  LEU  33          2HD1      LEU  33   3.695  -3.979   0.316
  269   3HD1  LEU  33          3HD1      LEU  33   2.584  -3.132  -0.762
  270   1HD2  LEU  33          1HD2      LEU  33   5.836  -3.586  -2.615
  271   2HD2  LEU  33          2HD2      LEU  33   4.224  -4.277  -2.424
  272   3HD2  LEU  33          3HD2      LEU  33   5.483  -4.633  -1.240
  273    H    ARG  34           H        ARG  34   4.242   1.528  -2.175
  274    HA   ARG  34           HA       ARG  34   3.383   1.959  -4.821
  275   1HB   ARG  34          2HB       ARG  34   2.385   3.115  -2.910
  276   2HB   ARG  34          1HB       ARG  34   3.901   3.961  -2.609
  277   1HG   ARG  34          2HG       ARG  34   3.685   5.310  -4.496
  278   2HG   ARG  34          1HG       ARG  34   2.639   4.156  -5.327
  279   1HD   ARG  34          2HD       ARG  34   0.741   4.832  -4.174
  280   2HD   ARG  34          1HD       ARG  34   1.659   5.395  -2.780
  281    HE   ARG  34           HE       ARG  34   1.001   6.921  -5.146
  282   1HH1  ARG  34          1HH2      ARG  34   3.207   6.511  -2.501
  283   2HH1  ARG  34          2HH2      ARG  34   3.729   8.162  -2.507
  284   1HH2  ARG  34          1HH1      ARG  34   1.688   9.076  -5.156
  285   2HH2  ARG  34          2HH1      ARG  34   2.873   9.611  -4.012
  286    H    GLN  35           H        GLN  35   6.246   3.115  -3.070
  287    HA   GLN  35           HA       GLN  35   7.278   4.784  -5.088
  288   1HB   GLN  35          2HB       GLN  35   8.020   4.639  -2.657
  289   2HB   GLN  35          1HB       GLN  35   8.937   3.204  -3.117
  290   1HG   GLN  35          2HG       GLN  35   9.793   4.846  -5.053
  291   2HG   GLN  35          1HG       GLN  35   9.389   6.066  -3.849
  292   1HE2  GLN  35          1HE2      GLN  35  11.281   6.622  -2.768
  293   2HE2  GLN  35          2HE2      GLN  35  12.451   5.517  -2.227
  294    H    GLU  36           H        GLU  36   7.776   1.335  -4.414
  295    HA   GLU  36           HA       GLU  36   9.735   0.890  -6.410
  296   1HB   GLU  36          2HB       GLU  36   9.425  -0.717  -4.630
  297   2HB   GLU  36          1HB       GLU  36   7.752  -0.990  -5.109
  298   1HG   GLU  36          2HG       GLU  36   9.355  -2.769  -5.906
  299   2HG   GLU  36          1HG       GLU  36   8.434  -1.998  -7.195
  300    H    TYR  37           H        TYR  37   6.193   0.573  -6.427
  301    HA   TYR  37           HA       TYR  37   5.813  -0.544  -8.930
  302   1HB   TYR  37          2HB       TYR  37   3.988  -0.104  -7.322
  303   2HB   TYR  37          1HB       TYR  37   4.131   1.623  -7.643
  304    HD1  TYR  37           HD1      TYR  37   3.712  -1.627  -9.472
  305    HD2  TYR  37           HD2      TYR  37   2.804   2.570  -9.324
  306    HE1  TYR  37           HE1      TYR  37   2.252  -1.873 -11.462
  307    HE2  TYR  37           HE2      TYR  37   1.343   2.322 -11.313
  308    HH   TYR  37           HH       TYR  37   0.937   0.889 -13.127
  309    H    LEU  38           H        LEU  38   6.098   2.911  -8.111
  310    HA   LEU  38           HA       LEU  38   5.889   3.922 -10.729
  311   1HB   LEU  38          2HB       LEU  38   6.752   4.915  -8.100
  312   2HB   LEU  38          1HB       LEU  38   7.563   5.699  -9.455
  313    HG   LEU  38           HG       LEU  38   5.433   6.841  -8.778
  314   1HD1  LEU  38          1HD1      LEU  38   4.878   7.380 -10.959
  315   2HD1  LEU  38          2HD1      LEU  38   4.920   5.701 -11.499
  316   3HD1  LEU  38          3HD1      LEU  38   6.425   6.580 -11.238
  317   1HD2  LEU  38          1HD2      LEU  38   3.855   4.653 -10.053
  318   2HD2  LEU  38          2HD2      LEU  38   3.394   5.772  -8.769
  319   3HD2  LEU  38          3HD2      LEU  38   4.413   4.382  -8.403
  320    H    LYS  39           H        LYS  39   8.713   2.894  -8.834
  321    HA   LYS  39           HA       LYS  39  10.667   3.606 -10.763
  322   1HB   LYS  39          2HB       LYS  39  10.602   1.798  -8.372
  323   2HB   LYS  39          1HB       LYS  39  11.980   1.726  -9.473
  324   1HG   LYS  39          2HG       LYS  39  12.418   4.091  -9.178
  325   2HG   LYS  39          1HG       LYS  39  10.943   4.289  -8.231
  326   1HD   LYS  39          2HD       LYS  39  11.816   3.146  -6.383
  327   2HD   LYS  39          1HD       LYS  39  13.041   2.323  -7.346
  328   1HE   LYS  39          2HE       LYS  39  13.700   4.373  -5.800
  329   2HE   LYS  39          1HE       LYS  39  14.453   4.166  -7.381
  330   1HZ   LYS  39          1HZ       LYS  39  13.495   6.443  -6.797
  331   2HZ   LYS  39          2HZ       LYS  39  11.972   5.740  -7.066
  332   3HZ   LYS  39          3HZ       LYS  39  13.118   5.799  -8.320
  333    H    GLY  40           H        GLY  40   8.376   1.069 -10.611
  334   1HA   GLY  40          2HA       GLY  40   9.835  -0.624 -12.522
  335   2HA   GLY  40          1HA       GLY  40   8.350  -1.052 -11.675
  336    H    PHE  41           H        PHE  41   7.385   1.782 -12.377
  337    HA   PHE  41           HA       PHE  41   5.833   1.082 -14.636
  338   1HB   PHE  41          2HB       PHE  41   5.539   2.940 -12.742
  339   2HB   PHE  41          1HB       PHE  41   6.277   3.958 -13.977
  340    HD1  PHE  41           HD1      PHE  41   5.279   3.583 -16.442
  341    HD2  PHE  41           HD2      PHE  41   3.229   2.684 -12.776
  342    HE1  PHE  41           HE1      PHE  41   3.105   3.709 -17.627
  343    HE2  PHE  41           HE2      PHE  41   1.056   2.810 -13.960
  344    HZ   PHE  41           HZ       PHE  41   0.992   3.322 -16.385
  345    H    ARG  42           H        ARG  42   6.976   0.547 -16.435
  346    HA   ARG  42           HA       ARG  42   9.215   2.078 -17.387
  347   1HB   ARG  42          2HB       ARG  42   7.582  -0.189 -18.528
  348   2HB   ARG  42          1HB       ARG  42   8.843   0.612 -19.467
  349   1HG   ARG  42          2HG       ARG  42  10.509   0.067 -17.757
  350   2HG   ARG  42          1HG       ARG  42   9.261  -0.661 -16.743
  351   1HD   ARG  42          2HD       ARG  42   8.857  -2.400 -18.368
  352   2HD   ARG  42          1HD       ARG  42   9.894  -1.608 -19.552
  353    HE   ARG  42           HE       ARG  42  11.366  -2.174 -17.183
  354   1HH1  ARG  42          1HH2      ARG  42   9.917  -3.673 -19.958
  355   2HH1  ARG  42          2HH2      ARG  42  11.034  -4.997 -19.991
  356   1HH2  ARG  42          1HH1      ARG  42  12.824  -3.906 -17.231
  357   2HH2  ARG  42          2HH1      ARG  42  12.679  -5.126 -18.450
  Start of MODEL   10
    1   1H    MET   1          1HT       MET   1   4.756  -3.517 -14.035
    2   2H    MET   1          2HT       MET   1   4.141  -4.540 -12.826
    3   3H    MET   1          3HT       MET   1   3.233  -3.206 -13.355
    4    HA   MET   1           HA       MET   1   2.264  -4.424 -14.903
    5   1HB   MET   1          2HB       MET   1   3.671  -5.448 -16.705
    6   2HB   MET   1          1HB       MET   1   4.090  -3.767 -16.382
    7   1HG   MET   1          2HG       MET   1   6.218  -4.514 -16.177
    8   2HG   MET   1          1HG       MET   1   5.708  -5.132 -14.606
    9   1HE   MET   1          1HE       MET   1   7.946  -6.254 -17.148
   10   2HE   MET   1          2HE       MET   1   8.020  -7.814 -16.328
   11   3HE   MET   1          3HE       MET   1   7.982  -6.328 -15.382
   12    H    ILE   2           H        ILE   2   2.638  -5.576 -12.356
   13    HA   ILE   2           HA       ILE   2   3.148  -8.429 -12.907
   14    HB   ILE   2           HB       ILE   2   2.563  -7.409 -10.155
   15   1HG1  ILE   2          2HG1      ILE   2   5.175  -6.985 -11.651
   16   2HG1  ILE   2          1HG1      ILE   2   4.130  -5.731 -10.988
   17   1HG2  ILE   2          1HG2      ILE   2   3.034  -9.848 -10.863
   18   2HG2  ILE   2          2HG2      ILE   2   3.944  -9.216  -9.493
   19   3HG2  ILE   2          3HG2      ILE   2   4.706  -9.328 -11.080
   20   1HD1  ILE   2          1HD1      ILE   2   5.835  -5.977  -9.363
   21   2HD1  ILE   2          2HD1      ILE   2   5.818  -7.736  -9.493
   22   3HD1  ILE   2          3HD1      ILE   2   4.479  -6.898  -8.711
   23    H    SER   3           H        SER   3   0.789  -6.358 -11.210
   24    HA   SER   3           HA       SER   3  -1.404  -6.765 -10.594
   25   1HB   SER   3          2HB       SER   3  -1.329  -7.554 -13.508
   26   2HB   SER   3          1HB       SER   3  -2.820  -7.348 -12.599
   27    HG   SER   3           HG       SER   3  -2.176  -5.202 -12.180
   28    H    ASN   4           H        ASN   4  -0.856  -8.503  -9.106
   29    HA   ASN   4           HA       ASN   4  -2.266 -10.948  -9.782
   30   1HB   ASN   4          2HB       ASN   4  -0.393 -12.433  -9.169
   31   2HB   ASN   4          1HB       ASN   4  -0.006 -11.462 -10.586
   32   1HD2  ASN   4          1HD2      ASN   4   2.212 -12.388  -9.365
   33   2HD2  ASN   4          2HD2      ASN   4   2.963 -11.196  -8.418
   34    H    ALA   5           H        ALA   5  -0.746 -12.221  -7.461
   35    HA   ALA   5           HA       ALA   5  -2.571 -11.479  -5.410
   36   1HB   ALA   5          1HB       ALA   5  -1.161 -12.960  -3.979
   37   2HB   ALA   5          2HB       ALA   5  -0.024 -13.111  -5.319
   38   3HB   ALA   5          3HB       ALA   5  -1.669 -13.725  -5.484
   39    H    LYS   6           H        LYS   6   0.652 -10.444  -6.271
   40    HA   LYS   6           HA       LYS   6   1.366  -9.249  -3.796
   41   1HB   LYS   6          2HB       LYS   6   2.516  -9.517  -6.390
   42   2HB   LYS   6          1HB       LYS   6   2.524  -7.802  -5.984
   43   1HG   LYS   6          2HG       LYS   6   3.468  -9.911  -4.034
   44   2HG   LYS   6          1HG       LYS   6   4.552  -9.174  -5.213
   45   1HD   LYS   6          2HD       LYS   6   4.431  -7.071  -4.219
   46   2HD   LYS   6          1HD       LYS   6   2.861  -7.395  -3.484
   47   1HE   LYS   6          2HE       LYS   6   4.895  -7.368  -1.908
   48   2HE   LYS   6          1HE       LYS   6   3.814  -8.756  -1.788
   49   1HZ   LYS   6          1HZ       LYS   6   6.092  -9.488  -1.853
   50   2HZ   LYS   6          2HZ       LYS   6   6.369  -8.641  -3.297
   51   3HZ   LYS   6          3HZ       LYS   6   5.311  -9.969  -3.279
   52    H    ILE   7           H        ILE   7   0.199  -7.741  -6.830
   53    HA   ILE   7           HA       ILE   7  -0.194  -5.172  -5.772
   54    HB   ILE   7           HB       ILE   7  -1.379  -6.651  -8.111
   55   1HG1  ILE   7          2HG1      ILE   7  -0.159  -4.902  -9.357
   56   2HG1  ILE   7          1HG1      ILE   7   0.325  -4.150  -7.837
   57   1HG2  ILE   7          1HG2      ILE   7  -2.324  -4.280  -8.681
   58   2HG2  ILE   7          2HG2      ILE   7  -2.237  -4.008  -6.941
   59   3HG2  ILE   7          3HG2      ILE   7  -3.238  -5.312  -7.581
   60   1HD1  ILE   7          1HD1      ILE   7   2.050  -5.692  -8.920
   61   2HD1  ILE   7          2HD1      ILE   7   0.980  -7.028  -8.500
   62   3HD1  ILE   7          3HD1      ILE   7   1.678  -6.022  -7.230
   63    H    ALA   8           H        ALA   8  -2.377  -7.963  -5.960
   64    HA   ALA   8           HA       ALA   8  -4.725  -6.781  -5.015
   65   1HB   ALA   8          1HB       ALA   8  -5.215  -9.124  -4.110
   66   2HB   ALA   8          2HB       ALA   8  -3.623  -9.579  -4.717
   67   3HB   ALA   8          3HB       ALA   8  -4.863  -9.011  -5.835
   68    H    ARG   9           H        ARG   9  -1.842  -7.827  -3.313
   69    HA   ARG   9           HA       ARG   9  -2.903  -7.709  -0.674
   70   1HB   ARG   9          2HB       ARG   9  -0.712  -8.789  -1.473
   71   2HB   ARG   9          1HB       ARG   9  -0.034  -7.162  -1.417
   72   1HG   ARG   9          2HG       ARG   9  -0.596  -6.961   0.949
   73   2HG   ARG   9          1HG       ARG   9  -1.398  -8.532   0.921
   74   1HD   ARG   9          2HD       ARG   9   1.525  -8.137   0.233
   75   2HD   ARG   9          1HD       ARG   9   0.955  -8.568   1.843
   76    HE   ARG   9           HE       ARG   9   0.034 -10.321  -0.288
   77   1HH1  ARG   9          1HH2      ARG   9   2.437  -9.638   2.121
   78   2HH1  ARG   9          2HH2      ARG   9   2.996 -11.273   2.219
   79   1HH2  ARG   9          1HH1      ARG   9   0.772 -12.464  -0.162
   80   2HH2  ARG   9          2HH1      ARG   9   2.054 -12.873   0.928
   81    H    ILE  10           H        ILE  10  -0.780  -5.440  -2.429
   82    HA   ILE  10           HA       ILE  10  -0.759  -3.359  -0.595
   83    HB   ILE  10           HB       ILE  10  -0.552  -3.295  -3.609
   84   1HG1  ILE  10          2HG1      ILE  10   1.715  -2.831  -1.717
   85   2HG1  ILE  10          1HG1      ILE  10   1.119  -4.482  -1.882
   86   1HG2  ILE  10          1HG2      ILE  10  -0.252  -1.132  -1.528
   87   2HG2  ILE  10          2HG2      ILE  10  -1.065  -1.058  -3.091
   88   3HG2  ILE  10          3HG2      ILE  10   0.696  -1.078  -3.015
   89   1HD1  ILE  10          1HD1      ILE  10   1.857  -2.750  -4.253
   90   2HD1  ILE  10          2HD1      ILE  10   1.524  -4.481  -4.252
   91   3HD1  ILE  10          3HD1      ILE  10   2.985  -3.864  -3.482
   92    H    ASN  11           H        ASN  11  -2.805  -3.404  -3.550
   93    HA   ASN  11           HA       ASN  11  -4.278  -1.124  -2.937
   94   1HB   ASN  11          2HB       ASN  11  -5.889  -1.865  -4.576
   95   2HB   ASN  11          1HB       ASN  11  -4.277  -2.277  -5.144
   96   1HD2  ASN  11          1HD2      ASN  11  -6.982  -3.580  -5.709
   97   2HD2  ASN  11          2HD2      ASN  11  -6.749  -5.214  -5.312
   98    H    GLU  12           H        GLU  12  -4.884  -4.486  -1.995
   99    HA   GLU  12           HA       GLU  12  -7.428  -4.092  -0.828
  100   1HB   GLU  12          2HB       GLU  12  -6.608  -6.332  -1.285
  101   2HB   GLU  12          1HB       GLU  12  -5.255  -6.103  -0.179
  102   1HG   GLU  12          2HG       GLU  12  -6.718  -6.003   1.725
  103   2HG   GLU  12          1HG       GLU  12  -8.147  -5.910   0.698
  104    H    LEU  13           H        LEU  13  -4.168  -4.098   0.612
  105    HA   LEU  13           HA       LEU  13  -4.945  -3.457   3.246
  106   1HB   LEU  13          2HB       LEU  13  -2.597  -4.130   2.096
  107   2HB   LEU  13          1HB       LEU  13  -2.356  -2.392   2.246
  108    HG   LEU  13           HG       LEU  13  -3.122  -4.277   4.500
  109   1HD1  LEU  13          1HD1      LEU  13  -0.555  -2.829   3.803
  110   2HD1  LEU  13          2HD1      LEU  13  -0.799  -4.573   3.900
  111   3HD1  LEU  13          3HD1      LEU  13  -0.851  -3.592   5.364
  112   1HD2  LEU  13          1HD2      LEU  13  -2.405  -2.046   5.770
  113   2HD2  LEU  13          2HD2      LEU  13  -4.060  -2.271   5.207
  114   3HD2  LEU  13          3HD2      LEU  13  -2.934  -1.292   4.267
  115    H    ALA  14           H        ALA  14  -3.957  -1.405   0.516
  116    HA   ALA  14           HA       ALA  14  -3.991   1.079   1.783
  117   1HB   ALA  14          1HB       ALA  14  -3.145   0.789  -0.490
  118   2HB   ALA  14          2HB       ALA  14  -4.413   2.014  -0.476
  119   3HB   ALA  14          3HB       ALA  14  -4.764   0.389  -1.064
  120    H    ALA  15           H        ALA  15  -6.633  -0.657   0.154
  121    HA   ALA  15           HA       ALA  15  -8.637   1.285   0.549
  122   1HB   ALA  15          1HB       ALA  15  -8.640  -0.863  -0.923
  123   2HB   ALA  15          2HB       ALA  15 -10.151  -0.341  -0.178
  124   3HB   ALA  15          3HB       ALA  15  -9.227  -1.661   0.538
  125    H    LYS  16           H        LYS  16  -7.477  -1.365   2.551
  126    HA   LYS  16           HA       LYS  16  -9.492  -1.311   4.527
  127   1HB   LYS  16          2HB       LYS  16  -6.651  -2.282   4.451
  128   2HB   LYS  16          1HB       LYS  16  -7.528  -2.250   5.980
  129   1HG   LYS  16          2HG       LYS  16  -9.340  -3.597   4.949
  130   2HG   LYS  16          1HG       LYS  16  -8.418  -3.662   3.447
  131   1HD   LYS  16          2HD       LYS  16  -6.700  -4.973   4.416
  132   2HD   LYS  16          1HD       LYS  16  -7.216  -4.590   6.059
  133   1HE   LYS  16          2HE       LYS  16  -9.069  -6.031   5.950
  134   2HE   LYS  16          1HE       LYS  16  -9.076  -6.040   4.185
  135   1HZ   LYS  16          1HZ       LYS  16  -7.233  -7.435   4.107
  136   2HZ   LYS  16          2HZ       LYS  16  -8.165  -8.080   5.374
  137   3HZ   LYS  16          3HZ       LYS  16  -6.798  -7.129   5.718
  138    H    ALA  17           H        ALA  17  -6.171  -0.027   4.720
  139    HA   ALA  17           HA       ALA  17  -6.583   1.497   7.046
  140   1HB   ALA  17          1HB       ALA  17  -4.346   0.923   6.270
  141   2HB   ALA  17          2HB       ALA  17  -4.505   2.676   6.383
  142   3HB   ALA  17          3HB       ALA  17  -4.581   1.883   4.808
  143    H    LYS  18           H        LYS  18  -7.592   2.021   3.797
  144    HA   LYS  18           HA       LYS  18  -7.697   4.893   3.909
  145   1HB   LYS  18          2HB       LYS  18  -7.678   3.680   1.756
  146   2HB   LYS  18          1HB       LYS  18  -9.250   2.985   2.138
  147   1HG   LYS  18          2HG       LYS  18 -10.301   5.155   2.129
  148   2HG   LYS  18          1HG       LYS  18  -8.738   5.968   2.014
  149   1HD   LYS  18          2HD       LYS  18  -9.319   3.969  -0.106
  150   2HD   LYS  18          1HD       LYS  18 -10.293   5.438  -0.144
  151   1HE   LYS  18          2HE       LYS  18  -8.278   5.761  -1.490
  152   2HE   LYS  18          1HE       LYS  18  -8.202   6.793  -0.063
  153   1HZ   LYS  18          1HZ       LYS  18  -7.049   4.099   0.076
  154   2HZ   LYS  18          2HZ       LYS  18  -6.589   5.516   0.893
  155   3HZ   LYS  18          3HZ       LYS  18  -6.187   5.308  -0.744
  156    H    ALA  19           H        ALA  19 -10.392   2.570   3.725
  157    HA   ALA  19           HA       ALA  19 -12.206   4.432   4.985
  158   1HB   ALA  19          1HB       ALA  19 -12.533   1.527   4.195
  159   2HB   ALA  19          2HB       ALA  19 -13.032   2.933   3.256
  160   3HB   ALA  19          3HB       ALA  19 -13.834   2.563   4.782
  161    H    GLY  20           H        GLY  20  -9.860   2.378   6.154
  162   1HA   GLY  20          2HA       GLY  20 -11.299   1.749   8.646
  163   2HA   GLY  20          1HA       GLY  20  -9.780   1.030   8.125
  164    H    VAL  21           H        VAL  21  -8.656   3.650   7.348
  165    HA   VAL  21           HA       VAL  21  -7.192   5.149   8.304
  166    HB   VAL  21           HB       VAL  21  -9.518   5.603  10.194
  167   1HG1  VAL  21          1HG1      VAL  21  -7.523   6.746  10.953
  168   2HG1  VAL  21          2HG1      VAL  21  -8.568   7.944  10.191
  169   3HG1  VAL  21          3HG1      VAL  21  -7.168   7.314   9.321
  170   1HG2  VAL  21          1HG2      VAL  21  -8.917   6.719   7.437
  171   2HG2  VAL  21          2HG2      VAL  21 -10.153   7.362   8.517
  172   3HG2  VAL  21          3HG2      VAL  21 -10.297   5.720   7.890
  173    H    ILE  22           H        ILE  22  -5.886   3.290   8.996
  174    HA   ILE  22           HA       ILE  22  -6.064   2.540  11.803
  175    HB   ILE  22           HB       ILE  22  -4.135   1.039  11.223
  176   1HG1  ILE  22          2HG1      ILE  22  -4.670   2.076   8.417
  177   2HG1  ILE  22          1HG1      ILE  22  -3.242   2.467   9.372
  178   1HG2  ILE  22          1HG2      ILE  22  -6.481   0.282  11.085
  179   2HG2  ILE  22          2HG2      ILE  22  -5.494  -0.471   9.833
  180   3HG2  ILE  22          3HG2      ILE  22  -6.570   0.865   9.422
  181   1HD1  ILE  22          1HD1      ILE  22  -2.795  -0.024   9.539
  182   2HD1  ILE  22          2HD1      ILE  22  -2.630   0.652   7.919
  183   3HD1  ILE  22          3HD1      ILE  22  -4.077  -0.259   8.351
  184    H    THR  23           H        THR  23  -2.900   2.280  11.342
  185    HA   THR  23           HA       THR  23  -2.337   4.918  12.544
  186    HB   THR  23           HB       THR  23  -0.702   2.375  12.721
  187    HG1  THR  23           HG1      THR  23  -2.108   3.453  14.867
  188   1HG2  THR  23          1HG2      THR  23  -0.527   5.116  13.974
  189   2HG2  THR  23          2HG2      THR  23   0.736   4.199  13.157
  190   3HG2  THR  23          3HG2      THR  23   0.189   3.707  14.758
  191    H    GLU  24           H        GLU  24  -0.744   6.206  11.742
  192    HA   GLU  24           HA       GLU  24  -0.123   6.189   9.039
  193   1HB   GLU  24          2HB       GLU  24   1.164   7.516  11.414
  194   2HB   GLU  24          1HB       GLU  24   1.819   7.728   9.789
  195   1HG   GLU  24          2HG       GLU  24   0.196   9.520  10.391
  196   2HG   GLU  24          1HG       GLU  24  -0.329   8.584   8.993
  197    H    GLU  25           H        GLU  25   1.463   4.538  11.670
  198    HA   GLU  25           HA       GLU  25   3.977   4.039  10.557
  199   1HB   GLU  25          2HB       GLU  25   3.291   3.507  12.904
  200   2HB   GLU  25          1HB       GLU  25   2.348   2.153  12.282
  201   1HG   GLU  25          2HG       GLU  25   4.589   1.436  13.078
  202   2HG   GLU  25          1HG       GLU  25   4.372   1.128  11.358
  203    H    GLU  26           H        GLU  26   0.995   2.096  10.366
  204    HA   GLU  26           HA       GLU  26   2.045   0.105   8.642
  205   1HB   GLU  26          2HB       GLU  26  -0.747   1.009   9.329
  206   2HB   GLU  26          1HB       GLU  26  -0.463  -0.246   8.123
  207   1HG   GLU  26          2HG       GLU  26   0.958  -0.511  10.735
  208   2HG   GLU  26          1HG       GLU  26  -0.776  -0.829  10.718
  209    H    LYS  27           H        LYS  27   0.100   3.018   8.021
  210    HA   LYS  27           HA       LYS  27  -0.196   2.786   5.265
  211   1HB   LYS  27          2HB       LYS  27   0.154   5.301   6.919
  212   2HB   LYS  27          1HB       LYS  27  -0.503   5.231   5.287
  213   1HG   LYS  27          2HG       LYS  27  -2.283   3.679   6.127
  214   2HG   LYS  27          1HG       LYS  27  -1.674   3.940   7.762
  215   1HD   LYS  27          2HD       LYS  27  -2.021   6.416   7.406
  216   2HD   LYS  27          1HD       LYS  27  -2.833   6.023   5.891
  217   1HE   LYS  27          2HE       LYS  27  -4.594   4.888   6.999
  218   2HE   LYS  27          1HE       LYS  27  -3.684   4.771   8.504
  219   1HZ   LYS  27          1HZ       LYS  27  -4.019   7.471   7.609
  220   2HZ   LYS  27          2HZ       LYS  27  -4.340   6.786   9.128
  221   3HZ   LYS  27          3HZ       LYS  27  -5.501   6.694   7.889
  222    H    ALA  28           H        ALA  28   2.453   4.208   7.156
  223    HA   ALA  28           HA       ALA  28   3.952   5.244   5.015
  224   1HB   ALA  28          1HB       ALA  28   4.928   4.150   7.668
  225   2HB   ALA  28          2HB       ALA  28   4.412   5.807   7.362
  226   3HB   ALA  28          3HB       ALA  28   5.860   5.177   6.578
  227    H    GLU  29           H        GLU  29   3.896   2.048   6.507
  228    HA   GLU  29           HA       GLU  29   6.088   0.905   5.173
  229   1HB   GLU  29          2HB       GLU  29   4.909  -0.117   7.113
  230   2HB   GLU  29          1HB       GLU  29   3.542  -0.482   6.063
  231   1HG   GLU  29          2HG       GLU  29   4.958  -1.894   4.653
  232   2HG   GLU  29          1HG       GLU  29   6.374  -1.473   5.610
  233    H    GLN  30           H        GLN  30   2.675   0.187   4.440
  234    HA   GLN  30           HA       GLN  30   3.060  -0.928   1.930
  235   1HB   GLN  30          2HB       GLN  30   0.672  -0.367   1.507
  236   2HB   GLN  30          1HB       GLN  30   0.936  -1.114   3.082
  237   1HG   GLN  30          2HG       GLN  30   0.870   1.067   4.176
  238   2HG   GLN  30          1HG       GLN  30   0.737   1.877   2.618
  239   1HE2  GLN  30          1HE2      GLN  30  -1.073  -0.835   2.164
  240   2HE2  GLN  30          2HE2      GLN  30  -2.587  -0.266   2.672
  241    H    GLN  31           H        GLN  31   2.882   2.464   2.836
  242    HA   GLN  31           HA       GLN  31   2.371   3.622   0.347
  243   1HB   GLN  31          2HB       GLN  31   2.345   4.988   2.325
  244   2HB   GLN  31          1HB       GLN  31   4.038   4.627   2.660
  245   1HG   GLN  31          2HG       GLN  31   4.785   5.877   0.773
  246   2HG   GLN  31          1HG       GLN  31   3.157   5.972   0.099
  247   1HE2  GLN  31          1HE2      GLN  31   5.386   7.879   1.607
  248   2HE2  GLN  31          2HE2      GLN  31   4.350   8.943   2.431
  249    H    LYS  32           H        LYS  32   5.415   2.437   1.714
  250    HA   LYS  32           HA       LYS  32   7.182   3.496  -0.194
  251   1HB   LYS  32          2HB       LYS  32   7.251   1.035   1.539
  252   2HB   LYS  32          1HB       LYS  32   8.539   1.356   0.377
  253   1HG   LYS  32          2HG       LYS  32   9.125   3.405   1.434
  254   2HG   LYS  32          1HG       LYS  32   7.636   3.433   2.379
  255   1HD   LYS  32          2HD       LYS  32   9.500   2.743   3.806
  256   2HD   LYS  32          1HD       LYS  32   8.391   1.389   3.582
  257   1HE   LYS  32          2HE       LYS  32   9.840   0.299   2.068
  258   2HE   LYS  32          1HE       LYS  32  10.770   1.765   1.765
  259   1HZ   LYS  32          1HZ       LYS  32  10.775   0.055   4.176
  260   2HZ   LYS  32          2HZ       LYS  32  11.362   1.649   4.212
  261   3HZ   LYS  32          3HZ       LYS  32  12.083   0.496   3.193
  262    H    LEU  33           H        LEU  33   5.745   0.237  -0.091
  263    HA   LEU  33           HA       LEU  33   6.614  -0.619  -2.608
  264   1HB   LEU  33          2HB       LEU  33   4.010  -1.445  -1.315
  265   2HB   LEU  33          1HB       LEU  33   5.027  -2.390  -2.403
  266    HG   LEU  33           HG       LEU  33   5.694  -1.531   0.431
  267   1HD1  LEU  33          1HD1      LEU  33   5.985  -4.081   0.619
  268   2HD1  LEU  33          2HD1      LEU  33   5.139  -4.176  -0.926
  269   3HD1  LEU  33          3HD1      LEU  33   4.332  -3.480   0.481
  270   1HD2  LEU  33          1HD2      LEU  33   7.400  -2.734  -1.759
  271   2HD2  LEU  33          2HD2      LEU  33   7.798  -2.952  -0.056
  272   3HD2  LEU  33          3HD2      LEU  33   7.752  -1.332  -0.749
  273    H    ARG  34           H        ARG  34   3.827   1.321  -1.676
  274    HA   ARG  34           HA       ARG  34   2.440   1.165  -4.151
  275   1HB   ARG  34          2HB       ARG  34   1.455   1.962  -1.986
  276   2HB   ARG  34          1HB       ARG  34   2.388   3.448  -2.168
  277   1HG   ARG  34          2HG       ARG  34   1.278   3.889  -4.329
  278   2HG   ARG  34          1HG       ARG  34   0.347   2.402  -4.157
  279   1HD   ARG  34          2HD       ARG  34  -1.147   4.004  -3.342
  280   2HD   ARG  34          1HD       ARG  34  -0.388   3.423  -1.863
  281    HE   ARG  34           HE       ARG  34   1.108   5.607  -2.820
  282   1HH1  ARG  34          1HH2      ARG  34  -2.017   4.855  -1.524
  283   2HH1  ARG  34          2HH2      ARG  34  -2.257   6.421  -0.826
  284   1HH2  ARG  34          1HH1      ARG  34   0.800   7.662  -1.903
  285   2HH2  ARG  34          2HH1      ARG  34  -0.663   8.012  -1.042
  286    H    GLN  35           H        GLN  35   4.647   3.619  -2.811
  287    HA   GLN  35           HA       GLN  35   4.690   5.325  -5.055
  288   1HB   GLN  35          2HB       GLN  35   6.689   4.832  -2.840
  289   2HB   GLN  35          1HB       GLN  35   6.875   6.101  -4.047
  290   1HG   GLN  35          2HG       GLN  35   4.706   7.065  -3.385
  291   2HG   GLN  35          1HG       GLN  35   4.509   5.795  -2.179
  292   1HE2  GLN  35          1HE2      GLN  35   6.614   5.654  -0.647
  293   2HE2  GLN  35          2HE2      GLN  35   7.177   7.156  -0.089
  294    H    GLU  36           H        GLU  36   6.504   2.435  -4.230
  295    HA   GLU  36           HA       GLU  36   8.518   2.647  -6.217
  296   1HB   GLU  36          2HB       GLU  36   8.685   1.150  -4.261
  297   2HB   GLU  36          1HB       GLU  36   7.367   0.172  -4.901
  298   1HG   GLU  36          2HG       GLU  36   9.845   0.710  -6.536
  299   2HG   GLU  36          1HG       GLU  36   9.794  -0.609  -5.371
  300    H    TYR  37           H        TYR  37   5.402   0.923  -6.142
  301    HA   TYR  37           HA       TYR  37   5.478  -0.380  -8.569
  302   1HB   TYR  37          2HB       TYR  37   3.648  -0.551  -6.889
  303   2HB   TYR  37          1HB       TYR  37   3.060   1.027  -7.413
  304    HD1  TYR  37           HD1      TYR  37   1.615   1.206  -9.274
  305    HD2  TYR  37           HD2      TYR  37   3.892  -2.395  -8.694
  306    HE1  TYR  37           HE1      TYR  37   0.386   0.123 -11.135
  307    HE2  TYR  37           HE2      TYR  37   2.659  -3.473 -10.554
  308    HH   TYR  37           HH       TYR  37   1.408  -2.748 -12.583
  309    H    LEU  38           H        LEU  38   4.830   3.033  -7.951
  310    HA   LEU  38           HA       LEU  38   3.862   3.769 -10.484
  311   1HB   LEU  38          2HB       LEU  38   5.608   5.501  -8.721
  312   2HB   LEU  38          1HB       LEU  38   4.399   6.029  -9.891
  313    HG   LEU  38           HG       LEU  38   3.791   4.407  -7.398
  314   1HD1  LEU  38          1HD1      LEU  38   4.550   6.732  -6.917
  315   2HD1  LEU  38          2HD1      LEU  38   2.854   6.479  -6.504
  316   3HD1  LEU  38          3HD1      LEU  38   3.283   7.340  -7.982
  317   1HD2  LEU  38          1HD2      LEU  38   2.151   5.502  -9.672
  318   2HD2  LEU  38          2HD2      LEU  38   1.428   5.370  -8.069
  319   3HD2  LEU  38          3HD2      LEU  38   2.042   3.929  -8.880
  320    H    LYS  39           H        LYS  39   7.217   3.904  -9.239
  321    HA   LYS  39           HA       LYS  39   8.388   4.748 -11.668
  322   1HB   LYS  39          2HB       LYS  39   9.608   4.900  -9.564
  323   2HB   LYS  39          1HB       LYS  39   9.570   3.146  -9.382
  324   1HG   LYS  39          2HG       LYS  39  11.098   2.797 -11.123
  325   2HG   LYS  39          1HG       LYS  39  10.762   4.362 -11.862
  326   1HD   LYS  39          2HD       LYS  39  11.913   5.523 -10.064
  327   2HD   LYS  39          1HD       LYS  39  12.132   4.015  -9.178
  328   1HE   LYS  39          2HE       LYS  39  13.216   4.380 -11.972
  329   2HE   LYS  39          1HE       LYS  39  14.137   4.873 -10.552
  330   1HZ   LYS  39          1HZ       LYS  39  13.272   2.170 -11.345
  331   2HZ   LYS  39          2HZ       LYS  39  13.629   2.519  -9.722
  332   3HZ   LYS  39          3HZ       LYS  39  14.821   2.710 -10.920
  333    H    GLY  40           H        GLY  40   7.352   1.636 -10.495
  334   1HA   GLY  40          2HA       GLY  40   8.727   0.137 -12.571
  335   2HA   GLY  40          1HA       GLY  40   7.644  -0.513 -11.348
  336    H    PHE  41           H        PHE  41   6.181   2.158 -12.735
  337    HA   PHE  41           HA       PHE  41   5.171   1.070 -15.164
  338   1HB   PHE  41          2HB       PHE  41   4.092  -0.408 -13.333
  339   2HB   PHE  41          1HB       PHE  41   3.138   1.017 -12.939
  340    HD1  PHE  41           HD1      PHE  41   4.199  -0.970 -15.953
  341    HD2  PHE  41           HD2      PHE  41   1.124   1.342 -14.039
  342    HE1  PHE  41           HE1      PHE  41   2.660  -1.457 -17.836
  343    HE2  PHE  41           HE2      PHE  41  -0.415   0.852 -15.921
  344    HZ   PHE  41           HZ       PHE  41   0.353  -0.549 -17.819
  345    H    ARG  42           H        ARG  42   5.384   3.086 -16.016
  346    HA   ARG  42           HA       ARG  42   4.838   5.232 -16.584
  347   1HB   ARG  42          2HB       ARG  42   2.566   4.344 -16.745
  348   2HB   ARG  42          1HB       ARG  42   2.316   4.617 -15.022
  349   1HG   ARG  42          2HG       ARG  42   2.338   6.962 -15.263
  350   2HG   ARG  42          1HG       ARG  42   3.140   6.885 -16.832
  351   1HD   ARG  42          2HD       ARG  42   0.323   5.913 -16.278
  352   2HD   ARG  42          1HD       ARG  42   0.725   7.455 -17.028
  353    HE   ARG  42           HE       ARG  42   1.889   5.177 -18.379
  354   1HH1  ARG  42          1HH2      ARG  42  -0.892   7.223 -18.024
  355   2HH1  ARG  42          2HH2      ARG  42  -1.508   6.887 -19.608
  356   1HH2  ARG  42          1HH1      ARG  42   1.080   4.735 -20.447
  357   2HH2  ARG  42          2HH1      ARG  42  -0.393   5.477 -20.977
  Start of MODEL   11
    1   1H    MET   1          1HT       MET   1   6.263  -6.949 -15.949
    2   2H    MET   1          2HT       MET   1   5.045  -8.098 -15.659
    3   3H    MET   1          3HT       MET   1   6.011  -7.536 -14.377
    4    HA   MET   1           HA       MET   1   5.083  -5.225 -15.050
    5   1HB   MET   1          2HB       MET   1   2.929  -7.127 -16.029
    6   2HB   MET   1          1HB       MET   1   2.807  -5.369 -15.950
    7   1HG   MET   1          2HG       MET   1   3.419  -5.656 -18.175
    8   2HG   MET   1          1HG       MET   1   5.003  -5.465 -17.425
    9   1HE   MET   1          1HE       MET   1   5.558  -6.616 -19.948
   10   2HE   MET   1          2HE       MET   1   6.423  -8.102 -19.570
   11   3HE   MET   1          3HE       MET   1   6.677  -6.667 -18.579
   12    H    ILE   2           H        ILE   2   4.762  -8.175 -13.469
   13    HA   ILE   2           HA       ILE   2   3.910  -8.834 -11.448
   14    HB   ILE   2           HB       ILE   2   4.108  -5.853 -10.944
   15   1HG1  ILE   2          2HG1      ILE   2   5.910  -8.142 -10.092
   16   2HG1  ILE   2          1HG1      ILE   2   6.215  -7.130 -11.504
   17   1HG2  ILE   2          1HG2      ILE   2   4.163  -6.649  -8.508
   18   2HG2  ILE   2          2HG2      ILE   2   3.524  -8.182  -9.099
   19   3HG2  ILE   2          3HG2      ILE   2   2.590  -6.701  -9.301
   20   1HD1  ILE   2          1HD1      ILE   2   7.466  -6.341  -9.508
   21   2HD1  ILE   2          2HD1      ILE   2   5.938  -6.105  -8.662
   22   3HD1  ILE   2          3HD1      ILE   2   6.317  -5.134 -10.085
   23    H    SER   3           H        SER   3   1.942  -9.647 -12.064
   24    HA   SER   3           HA       SER   3  -0.379  -7.984 -11.384
   25   1HB   SER   3          2HB       SER   3  -1.579  -8.808 -13.414
   26   2HB   SER   3          1HB       SER   3  -0.225  -7.746 -13.792
   27    HG   SER   3           HG       SER   3  -0.017 -10.573 -13.688
   28    H    ASN   4           H        ASN   4  -0.007  -9.463  -9.496
   29    HA   ASN   4           HA       ASN   4  -1.567 -11.929  -9.889
   30   1HB   ASN   4          2HB       ASN   4  -0.025 -13.174  -8.432
   31   2HB   ASN   4          1HB       ASN   4   0.797 -12.590  -9.875
   32   1HD2  ASN   4          1HD2      ASN   4   2.270 -10.724  -9.621
   33   2HD2  ASN   4          2HD2      ASN   4   2.896 -10.331  -8.093
   34    H    ALA   5           H        ALA   5  -1.131 -12.746  -7.137
   35    HA   ALA   5           HA       ALA   5  -3.279 -11.452  -5.881
   36   1HB   ALA   5          1HB       ALA   5  -1.031 -13.091  -4.694
   37   2HB   ALA   5          2HB       ALA   5  -2.599 -13.688  -5.239
   38   3HB   ALA   5          3HB       ALA   5  -2.499 -12.630  -3.832
   39    H    LYS   6           H        LYS   6  -0.066 -10.400  -6.280
   40    HA   LYS   6           HA       LYS   6   0.283  -8.930  -3.869
   41   1HB   LYS   6          2HB       LYS   6   1.589  -9.013  -6.546
   42   2HB   LYS   6          1HB       LYS   6   1.841  -7.565  -5.569
   43   1HG   LYS   6          2HG       LYS   6   2.769  -8.824  -3.762
   44   2HG   LYS   6          1HG       LYS   6   2.225 -10.352  -4.455
   45   1HD   LYS   6          2HD       LYS   6   4.609 -10.113  -4.874
   46   2HD   LYS   6          1HD       LYS   6   3.748  -9.955  -6.404
   47   1HE   LYS   6          2HE       LYS   6   4.030  -7.599  -6.445
   48   2HE   LYS   6          1HE       LYS   6   4.469  -7.540  -4.739
   49   1HZ   LYS   6          1HZ       LYS   6   6.514  -7.429  -5.696
   50   2HZ   LYS   6          2HZ       LYS   6   6.072  -8.356  -7.048
   51   3HZ   LYS   6          3HZ       LYS   6   6.371  -9.112  -5.555
   52    H    ILE   7           H        ILE   7  -1.003  -8.095  -7.067
   53    HA   ILE   7           HA       ILE   7  -1.402  -5.349  -6.671
   54    HB   ILE   7           HB       ILE   7  -3.209  -7.212  -8.236
   55   1HG1  ILE   7          2HG1      ILE   7  -0.949  -7.646  -8.960
   56   2HG1  ILE   7          1HG1      ILE   7  -1.681  -6.583 -10.160
   57   1HG2  ILE   7          1HG2      ILE   7  -3.882  -5.307  -9.444
   58   2HG2  ILE   7          2HG2      ILE   7  -2.500  -4.357  -8.901
   59   3HG2  ILE   7          3HG2      ILE   7  -3.814  -4.721  -7.782
   60   1HD1  ILE   7          1HD1      ILE   7  -0.662  -4.668  -8.659
   61   2HD1  ILE   7          2HD1      ILE   7   0.366  -5.525  -9.805
   62   3HD1  ILE   7          3HD1      ILE   7   0.407  -5.953  -8.095
   63    H    ALA   8           H        ALA   8  -3.525  -8.111  -5.994
   64    HA   ALA   8           HA       ALA   8  -5.734  -6.686  -5.018
   65   1HB   ALA   8          1HB       ALA   8  -5.458  -9.224  -5.545
   66   2HB   ALA   8          2HB       ALA   8  -6.538  -8.738  -4.237
   67   3HB   ALA   8          3HB       ALA   8  -4.921  -9.342  -3.869
   68    H    ARG   9           H        ARG   9  -2.773  -7.781  -3.435
   69    HA   ARG   9           HA       ARG   9  -3.477  -7.256  -0.770
   70   1HB   ARG   9          2HB       ARG   9  -1.350  -8.386  -1.755
   71   2HB   ARG   9          1HB       ARG   9  -0.705  -6.746  -1.820
   72   1HG   ARG   9          2HG       ARG   9  -1.469  -6.568   0.653
   73   2HG   ARG   9          1HG       ARG   9  -1.571  -8.328   0.600
   74   1HD   ARG   9          2HD       ARG   9   0.898  -6.727  -0.129
   75   2HD   ARG   9          1HD       ARG   9   0.637  -7.510   1.426
   76    HE   ARG   9           HE       ARG   9   0.425  -9.251  -0.901
   77   1HH1  ARG   9          1HH2      ARG   9   2.407  -7.926   1.616
   78   2HH1  ARG   9          2HH2      ARG   9   3.566  -9.212   1.564
   79   1HH2  ARG   9          1HH1      ARG   9   1.943 -10.935  -0.967
   80   2HH2  ARG   9          2HH1      ARG   9   3.306 -10.910   0.102
   81    H    ILE  10           H        ILE  10  -1.903  -5.164  -3.187
   82    HA   ILE  10           HA       ILE  10  -1.508  -2.892  -1.645
   83    HB   ILE  10           HB       ILE  10  -2.227  -3.154  -4.575
   84   1HG1  ILE  10          2HG1      ILE  10   0.428  -2.445  -3.306
   85   2HG1  ILE  10          1HG1      ILE  10  -0.041  -4.118  -3.602
   86   1HG2  ILE  10          1HG2      ILE  10  -1.202  -0.810  -4.680
   87   2HG2  ILE  10          2HG2      ILE  10  -1.428  -0.741  -2.933
   88   3HG2  ILE  10          3HG2      ILE  10  -2.824  -0.915  -3.998
   89   1HD1  ILE  10          1HD1      ILE  10   1.160  -3.519  -5.548
   90   2HD1  ILE  10          2HD1      ILE  10   0.424  -1.918  -5.616
   91   3HD1  ILE  10          3HD1      ILE  10  -0.528  -3.345  -6.026
   92    H    ASN  11           H        ASN  11  -4.304  -3.452  -3.814
   93    HA   ASN  11           HA       ASN  11  -5.808  -1.278  -2.834
   94   1HB   ASN  11          2HB       ASN  11  -7.492  -1.980  -4.253
   95   2HB   ASN  11          1HB       ASN  11  -6.091  -2.731  -4.998
   96   1HD2  ASN  11          1HD2      ASN  11  -6.426  -4.878  -5.514
   97   2HD2  ASN  11          2HD2      ASN  11  -7.484  -5.929  -4.701
   98    H    GLU  12           H        GLU  12  -5.695  -4.674  -1.847
   99    HA   GLU  12           HA       GLU  12  -7.933  -4.661  -0.137
  100   1HB   GLU  12          2HB       GLU  12  -6.770  -6.721  -0.864
  101   2HB   GLU  12          1HB       GLU  12  -5.392  -6.283   0.146
  102   1HG   GLU  12          2HG       GLU  12  -6.763  -6.390   2.152
  103   2HG   GLU  12          1HG       GLU  12  -8.213  -6.663   1.187
  104    H    LEU  13           H        LEU  13  -4.484  -4.388   0.742
  105    HA   LEU  13           HA       LEU  13  -4.875  -3.746   3.438
  106   1HB   LEU  13          2HB       LEU  13  -2.684  -4.141   1.805
  107   2HB   LEU  13          1HB       LEU  13  -2.556  -2.429   2.209
  108    HG   LEU  13           HG       LEU  13  -2.962  -4.630   4.259
  109   1HD1  LEU  13          1HD1      LEU  13  -0.588  -4.327   4.798
  110   2HD1  LEU  13          2HD1      LEU  13  -0.433  -3.127   3.515
  111   3HD1  LEU  13          3HD1      LEU  13  -0.766  -4.812   3.112
  112   1HD2  LEU  13          1HD2      LEU  13  -2.506  -1.648   4.376
  113   2HD2  LEU  13          2HD2      LEU  13  -2.054  -2.683   5.731
  114   3HD2  LEU  13          3HD2      LEU  13  -3.735  -2.607   5.202
  115    H    ALA  14           H        ALA  14  -4.813  -1.704   0.560
  116    HA   ALA  14           HA       ALA  14  -4.650   0.817   1.746
  117   1HB   ALA  14          1HB       ALA  14  -4.572   0.397  -0.701
  118   2HB   ALA  14          2HB       ALA  14  -5.717   1.667  -0.274
  119   3HB   ALA  14          3HB       ALA  14  -6.301   0.053  -0.675
  120    H    ALA  15           H        ALA  15  -7.666  -0.771   0.664
  121    HA   ALA  15           HA       ALA  15  -9.391   0.990   2.040
  122   1HB   ALA  15          1HB       ALA  15  -9.997  -0.567   0.130
  123   2HB   ALA  15          2HB       ALA  15 -11.145  -0.524   1.469
  124   3HB   ALA  15          3HB       ALA  15 -10.020  -1.874   1.314
  125    H    LYS  16           H        LYS  16  -7.808  -2.002   2.988
  126    HA   LYS  16           HA       LYS  16  -9.281  -2.569   5.321
  127   1HB   LYS  16          2HB       LYS  16  -7.446  -3.978   4.108
  128   2HB   LYS  16          1HB       LYS  16  -6.323  -3.088   5.135
  129   1HG   LYS  16          2HG       LYS  16  -6.797  -4.915   6.493
  130   2HG   LYS  16          1HG       LYS  16  -8.016  -3.768   7.048
  131   1HD   LYS  16          2HD       LYS  16  -9.619  -4.780   5.389
  132   2HD   LYS  16          1HD       LYS  16  -8.408  -6.019   5.055
  133   1HE   LYS  16          2HE       LYS  16  -8.406  -6.616   7.480
  134   2HE   LYS  16          1HE       LYS  16  -9.703  -5.451   7.738
  135   1HZ   LYS  16          1HZ       LYS  16  -9.996  -7.521   5.673
  136   2HZ   LYS  16          2HZ       LYS  16 -11.195  -6.709   6.559
  137   3HZ   LYS  16          3HZ       LYS  16 -10.265  -7.924   7.298
  138    H    ALA  17           H        ALA  17  -6.130  -0.945   4.982
  139    HA   ALA  17           HA       ALA  17  -5.945  -0.025   7.631
  140   1HB   ALA  17          1HB       ALA  17  -4.182   1.396   6.853
  141   2HB   ALA  17          2HB       ALA  17  -4.796   1.359   5.199
  142   3HB   ALA  17          3HB       ALA  17  -4.087  -0.091   5.910
  143    H    LYS  18           H        LYS  18  -7.838   1.044   4.942
  144    HA   LYS  18           HA       LYS  18  -8.232   3.738   5.919
  145   1HB   LYS  18          2HB       LYS  18  -8.433   2.892   3.480
  146   2HB   LYS  18          1HB       LYS  18 -10.044   2.356   3.957
  147   1HG   LYS  18          2HG       LYS  18 -10.305   4.775   4.909
  148   2HG   LYS  18          1HG       LYS  18  -8.945   5.158   3.854
  149   1HD   LYS  18          2HD       LYS  18 -10.942   5.600   2.595
  150   2HD   LYS  18          1HD       LYS  18 -10.259   4.107   1.952
  151   1HE   LYS  18          2HE       LYS  18 -12.014   2.854   2.668
  152   2HE   LYS  18          1HE       LYS  18 -12.120   3.711   4.205
  153   1HZ   LYS  18          1HZ       LYS  18 -13.372   5.414   3.248
  154   2HZ   LYS  18          2HZ       LYS  18 -14.029   3.997   2.584
  155   3HZ   LYS  18          3HZ       LYS  18 -12.973   4.959   1.664
  156    H    ALA  19           H        ALA  19 -10.651   1.174   5.350
  157    HA   ALA  19           HA       ALA  19 -12.476   2.327   7.244
  158   1HB   ALA  19          1HB       ALA  19 -13.429   1.183   5.381
  159   2HB   ALA  19          2HB       ALA  19 -13.767   0.182   6.793
  160   3HB   ALA  19          3HB       ALA  19 -12.467  -0.263   5.686
  161    H    GLY  20           H        GLY  20  -9.725   0.506   7.668
  162   1HA   GLY  20          2HA       GLY  20 -10.740  -0.919  10.041
  163   2HA   GLY  20          1HA       GLY  20  -9.199  -1.216   9.242
  164    H    VAL  21           H        VAL  21  -7.691   0.752   9.246
  165    HA   VAL  21           HA       VAL  21  -7.905   2.718  11.276
  166    HB   VAL  21           HB       VAL  21  -7.603   1.042  12.916
  167   1HG1  VAL  21          1HG1      VAL  21  -5.483  -0.522  12.571
  168   2HG1  VAL  21          2HG1      VAL  21  -5.786  -0.179  10.869
  169   3HG1  VAL  21          3HG1      VAL  21  -7.038  -0.938  11.852
  170   1HG2  VAL  21          1HG2      VAL  21  -5.864   3.036  12.773
  171   2HG2  VAL  21          2HG2      VAL  21  -4.714   1.732  12.478
  172   3HG2  VAL  21          3HG2      VAL  21  -5.655   1.758  13.970
  173    H    ILE  22           H        ILE  22  -7.080   4.158   9.841
  174    HA   ILE  22           HA       ILE  22  -4.581   3.560   8.450
  175    HB   ILE  22           HB       ILE  22  -6.560   4.689   7.328
  176   1HG1  ILE  22          2HG1      ILE  22  -5.072   6.431   6.209
  177   2HG1  ILE  22          1HG1      ILE  22  -3.823   5.993   7.374
  178   1HG2  ILE  22          1HG2      ILE  22  -6.927   6.202   9.382
  179   2HG2  ILE  22          2HG2      ILE  22  -7.060   6.953   7.792
  180   3HG2  ILE  22          3HG2      ILE  22  -5.594   7.171   8.749
  181   1HD1  ILE  22          1HD1      ILE  22  -3.912   4.787   5.033
  182   2HD1  ILE  22          2HD1      ILE  22  -5.180   3.828   5.795
  183   3HD1  ILE  22          3HD1      ILE  22  -3.557   3.852   6.485
  184    H    THR  23           H        THR  23  -2.679   4.715   8.729
  185    HA   THR  23           HA       THR  23  -2.374   6.941  10.464
  186    HB   THR  23           HB       THR  23  -2.759   5.523  12.321
  187    HG1  THR  23           HG1      THR  23   0.040   5.415  11.906
  188   1HG2  THR  23          1HG2      THR  23  -2.804   3.339  11.504
  189   2HG2  THR  23          2HG2      THR  23  -1.310   3.331  12.441
  190   3HG2  THR  23          3HG2      THR  23  -1.249   3.504  10.687
  191    H    GLU  24           H        GLU  24  -0.060   7.446  10.840
  192    HA   GLU  24           HA       GLU  24   1.461   7.431   8.553
  193   1HB   GLU  24          2HB       GLU  24   2.372   7.527  11.438
  194   2HB   GLU  24          1HB       GLU  24   3.424   7.871  10.065
  195   1HG   GLU  24          2HG       GLU  24   0.825   9.323  10.645
  196   2HG   GLU  24          1HG       GLU  24   2.425   9.936  11.059
  197    H    GLU  25           H        GLU  25   1.283   4.965  11.048
  198    HA   GLU  25           HA       GLU  25   3.548   3.447  10.384
  199   1HB   GLU  25          2HB       GLU  25   0.883   2.434  11.407
  200   2HB   GLU  25          1HB       GLU  25   2.431   1.597  11.518
  201   1HG   GLU  25          2HG       GLU  25   3.259   3.059  13.133
  202   2HG   GLU  25          1HG       GLU  25   2.183   4.367  12.650
  203    H    GLU  26           H        GLU  26   0.181   2.624   9.538
  204    HA   GLU  26           HA       GLU  26   0.885   0.753   7.536
  205   1HB   GLU  26          2HB       GLU  26  -1.633   2.163   8.338
  206   2HB   GLU  26          1HB       GLU  26  -1.597   1.286   6.809
  207   1HG   GLU  26          2HG       GLU  26  -2.385  -0.105   8.749
  208   2HG   GLU  26          1HG       GLU  26  -0.975  -0.769   7.928
  209    H    LYS  27           H        LYS  27  -0.097   4.161   7.362
  210    HA   LYS  27           HA       LYS  27  -0.250   4.481   4.609
  211   1HB   LYS  27          2HB       LYS  27  -0.749   6.171   6.487
  212   2HB   LYS  27          1HB       LYS  27   0.968   6.566   6.413
  213   1HG   LYS  27          2HG       LYS  27   0.638   6.899   3.896
  214   2HG   LYS  27          1HG       LYS  27  -1.096   6.832   4.217
  215   1HD   LYS  27          2HD       LYS  27   0.819   8.760   5.571
  216   2HD   LYS  27          1HD       LYS  27  -0.195   9.168   4.186
  217   1HE   LYS  27          2HE       LYS  27  -2.150   8.260   5.681
  218   2HE   LYS  27          1HE       LYS  27  -1.021   8.536   7.009
  219   1HZ   LYS  27          1HZ       LYS  27  -1.664  10.644   6.945
  220   2HZ   LYS  27          2HZ       LYS  27  -2.523  10.423   5.496
  221   3HZ   LYS  27          3HZ       LYS  27  -0.864  10.790   5.457
  222    H    ALA  28           H        ALA  28   2.601   4.730   6.720
  223    HA   ALA  28           HA       ALA  28   4.466   5.455   4.735
  224   1HB   ALA  28          1HB       ALA  28   6.159   4.510   6.338
  225   2HB   ALA  28          2HB       ALA  28   4.816   3.962   7.341
  226   3HB   ALA  28          3HB       ALA  28   5.057   5.686   7.055
  227    H    GLU  29           H        GLU  29   3.398   2.290   5.917
  228    HA   GLU  29           HA       GLU  29   5.202   0.659   4.545
  229   1HB   GLU  29          2HB       GLU  29   3.572  -0.108   6.283
  230   2HB   GLU  29          1HB       GLU  29   2.285   0.049   5.090
  231   1HG   GLU  29          2HG       GLU  29   3.086  -2.278   5.205
  232   2HG   GLU  29          1HG       GLU  29   3.434  -1.575   3.627
  233    H    GLN  30           H        GLN  30   1.879   1.503   3.542
  234    HA   GLN  30           HA       GLN  30   1.896   0.395   1.007
  235   1HB   GLN  30          2HB       GLN  30   0.576   3.038   1.633
  236   2HB   GLN  30          1HB       GLN  30   0.046   1.798   0.497
  237   1HG   GLN  30          2HG       GLN  30   0.077   0.309   2.737
  238   2HG   GLN  30          1HG       GLN  30  -0.213   1.886   3.467
  239   1HE2  GLN  30          1HE2      GLN  30  -1.406   0.176   0.510
  240   2HE2  GLN  30          2HE2      GLN  30  -3.040   0.537   0.794
  241    H    GLN  31           H        GLN  31   3.070   3.573   2.037
  242    HA   GLN  31           HA       GLN  31   3.628   4.681  -0.468
  243   1HB   GLN  31          2HB       GLN  31   3.726   5.798   1.835
  244   2HB   GLN  31          1HB       GLN  31   5.346   5.115   1.972
  245   1HG   GLN  31          2HG       GLN  31   6.029   6.255  -0.091
  246   2HG   GLN  31          1HG       GLN  31   4.402   6.902  -0.291
  247   1HE2  GLN  31          1HE2      GLN  31   5.573   6.721   2.991
  248   2HE2  GLN  31          2HE2      GLN  31   5.912   8.374   3.169
  249    H    LYS  32           H        LYS  32   5.550   2.516   1.563
  250    HA   LYS  32           HA       LYS  32   7.965   2.616   0.130
  251   1HB   LYS  32          2HB       LYS  32   7.535   1.527   2.393
  252   2HB   LYS  32          1HB       LYS  32   6.871   0.156   1.506
  253   1HG   LYS  32          2HG       LYS  32   8.964  -0.240   0.387
  254   2HG   LYS  32          1HG       LYS  32   9.640   1.274   0.991
  255   1HD   LYS  32          2HD       LYS  32   9.392   0.396   3.322
  256   2HD   LYS  32          1HD       LYS  32   8.873  -1.148   2.646
  257   1HE   LYS  32          2HE       LYS  32  10.982  -1.604   1.729
  258   2HE   LYS  32          1HE       LYS  32  11.464   0.093   1.748
  259   1HZ   LYS  32          1HZ       LYS  32  12.420  -1.466   3.518
  260   2HZ   LYS  32          2HZ       LYS  32  10.897  -1.346   4.261
  261   3HZ   LYS  32          3HZ       LYS  32  11.840   0.048   4.016
  262    H    LEU  33           H        LEU  33   5.478   0.060  -0.019
  263    HA   LEU  33           HA       LEU  33   6.477  -1.255  -2.273
  264   1HB   LEU  33          2HB       LEU  33   3.515  -1.083  -1.784
  265   2HB   LEU  33          1HB       LEU  33   4.478  -2.457  -2.317
  266    HG   LEU  33           HG       LEU  33   4.410  -1.261   0.469
  267   1HD1  LEU  33          1HD1      LEU  33   3.619  -3.526   1.076
  268   2HD1  LEU  33          2HD1      LEU  33   3.664  -3.991  -0.625
  269   3HD1  LEU  33          3HD1      LEU  33   2.534  -2.751  -0.078
  270   1HD2  LEU  33          1HD2      LEU  33   6.666  -1.880   0.244
  271   2HD2  LEU  33          2HD2      LEU  33   6.291  -3.214  -0.848
  272   3HD2  LEU  33          3HD2      LEU  33   5.937  -3.357   0.874
  273    H    ARG  34           H        ARG  34   4.245   1.475  -2.001
  274    HA   ARG  34           HA       ARG  34   3.525   1.664  -4.728
  275   1HB   ARG  34          2HB       ARG  34   2.319   2.867  -2.952
  276   2HB   ARG  34          1HB       ARG  34   3.745   3.858  -2.646
  277   1HG   ARG  34          2HG       ARG  34   3.637   4.784  -4.904
  278   2HG   ARG  34          1HG       ARG  34   2.287   3.721  -5.304
  279   1HD   ARG  34          2HD       ARG  34   2.217   5.781  -3.083
  280   2HD   ARG  34          1HD       ARG  34   1.600   6.065  -4.705
  281    HE   ARG  34           HE       ARG  34  -0.126   4.462  -4.289
  282   1HH1  ARG  34          1HH2      ARG  34   1.958   5.052  -1.571
  283   2HH1  ARG  34          2HH2      ARG  34   0.854   4.385  -0.416
  284   1HH2  ARG  34          1HH1      ARG  34  -1.557   3.590  -2.770
  285   2HH2  ARG  34          2HH1      ARG  34  -1.129   3.563  -1.092
  286    H    GLN  35           H        GLN  35   6.207   3.041  -2.866
  287    HA   GLN  35           HA       GLN  35   7.281   4.676  -4.888
  288   1HB   GLN  35          2HB       GLN  35   7.930   4.437  -2.357
  289   2HB   GLN  35          1HB       GLN  35   9.052   3.215  -2.950
  290   1HG   GLN  35          2HG       GLN  35  10.253   5.291  -2.938
  291   2HG   GLN  35          1HG       GLN  35   9.877   4.941  -4.623
  292   1HE2  GLN  35          1HE2      GLN  35   9.188   6.798  -5.686
  293   2HE2  GLN  35          2HE2      GLN  35   8.245   8.026  -4.991
  294    H    GLU  36           H        GLU  36   7.430   1.243  -4.294
  295    HA   GLU  36           HA       GLU  36   9.602   0.597  -5.993
  296   1HB   GLU  36          2HB       GLU  36   8.214  -0.843  -4.244
  297   2HB   GLU  36          1HB       GLU  36   7.288  -1.277  -5.680
  298   1HG   GLU  36          2HG       GLU  36  10.291  -1.565  -5.353
  299   2HG   GLU  36          1HG       GLU  36   9.119  -2.881  -5.309
  300    H    TYR  37           H        TYR  37   6.098   0.121  -6.603
  301    HA   TYR  37           HA       TYR  37   6.320  -0.361  -9.347
  302   1HB   TYR  37          2HB       TYR  37   3.941   1.203  -8.557
  303   2HB   TYR  37          1HB       TYR  37   4.051  -0.318  -9.418
  304    HD1  TYR  37           HD1      TYR  37   2.733   1.063  -6.646
  305    HD2  TYR  37           HD2      TYR  37   5.280  -2.217  -7.728
  306    HE1  TYR  37           HE1      TYR  37   2.049  -0.148  -4.587
  307    HE2  TYR  37           HE2      TYR  37   4.610  -3.426  -5.667
  308    HH   TYR  37           HH       TYR  37   3.411  -3.346  -3.799
  309    H    LEU  38           H        LEU  38   5.377   2.694  -7.773
  310    HA   LEU  38           HA       LEU  38   5.304   4.291 -10.029
  311   1HB   LEU  38          2HB       LEU  38   5.784   4.834  -7.121
  312   2HB   LEU  38          1HB       LEU  38   6.034   6.140  -8.274
  313    HG   LEU  38           HG       LEU  38   3.692   5.977  -7.272
  314   1HD1  LEU  38          1HD1      LEU  38   3.590   5.652 -10.262
  315   2HD1  LEU  38          2HD1      LEU  38   4.428   7.030  -9.550
  316   3HD1  LEU  38          3HD1      LEU  38   2.710   6.785  -9.235
  317   1HD2  LEU  38          1HD2      LEU  38   3.627   3.446  -7.463
  318   2HD2  LEU  38          2HD2      LEU  38   3.422   3.653  -9.201
  319   3HD2  LEU  38          3HD2      LEU  38   2.201   4.273  -8.091
  320    H    LYS  39           H        LYS  39   8.137   3.277  -8.154
  321    HA   LYS  39           HA       LYS  39   9.988   5.136  -9.186
  322   1HB   LYS  39          2HB       LYS  39  10.717   3.741  -7.384
  323   2HB   LYS  39          1HB       LYS  39  10.331   2.270  -8.274
  324   1HG   LYS  39          2HG       LYS  39  12.192   2.455  -9.658
  325   2HG   LYS  39          1HG       LYS  39  12.292   4.205  -9.460
  326   1HD   LYS  39          2HD       LYS  39  13.269   4.029  -7.318
  327   2HD   LYS  39          1HD       LYS  39  12.771   2.348  -7.131
  328   1HE   LYS  39          2HE       LYS  39  14.644   3.140  -9.354
  329   2HE   LYS  39          1HE       LYS  39  15.261   2.845  -7.728
  330   1HZ   LYS  39          1HZ       LYS  39  14.737   0.653  -7.820
  331   2HZ   LYS  39          2HZ       LYS  39  15.027   0.917  -9.473
  332   3HZ   LYS  39          3HZ       LYS  39  13.433   0.875  -8.881
  333    H    GLY  40           H        GLY  40   8.816   2.025 -10.363
  334   1HA   GLY  40          2HA       GLY  40  10.270   2.331 -12.897
  335   2HA   GLY  40          1HA       GLY  40   9.328   0.925 -12.393
  336    H    PHE  41           H        PHE  41   7.390   3.252 -11.474
  337    HA   PHE  41           HA       PHE  41   5.712   4.579 -12.388
  338   1HB   PHE  41          2HB       PHE  41   7.271   4.522 -14.549
  339   2HB   PHE  41          1HB       PHE  41   6.010   3.433 -15.110
  340    HD1  PHE  41           HD1      PHE  41   6.269   6.688 -13.251
  341    HD2  PHE  41           HD2      PHE  41   4.232   4.396 -16.262
  342    HE1  PHE  41           HE1      PHE  41   4.808   8.630 -13.746
  343    HE2  PHE  41           HE2      PHE  41   2.773   6.338 -16.754
  344    HZ   PHE  41           HZ       PHE  41   3.061   8.456 -15.497
  345    H    ARG  42           H        ARG  42   3.854   3.737 -14.352
  346    HA   ARG  42           HA       ARG  42   2.013   2.398 -14.608
  347   1HB   ARG  42          2HB       ARG  42   3.821   0.218 -13.531
  348   2HB   ARG  42          1HB       ARG  42   2.309  -0.019 -14.405
  349   1HG   ARG  42          2HG       ARG  42   3.308   1.224 -16.346
  350   2HG   ARG  42          1HG       ARG  42   4.843   1.255 -15.478
  351   1HD   ARG  42          2HD       ARG  42   4.823  -1.220 -15.380
  352   2HD   ARG  42          1HD       ARG  42   3.314  -1.237 -16.287
  353    HE   ARG  42           HE       ARG  42   5.954  -0.823 -17.359
  354   1HH1  ARG  42          1HH2      ARG  42   2.583  -0.095 -17.725
  355   2HH1  ARG  42          2HH2      ARG  42   2.686   0.152 -19.436
  356   1HH2  ARG  42          1HH1      ARG  42   6.085  -0.498 -19.598
  357   2HH2  ARG  42          2HH1      ARG  42   4.664  -0.076 -20.493
  Start of MODEL   12
    1   1H    MET   1          1HT       MET   1   4.646 -10.589 -13.136
    2   2H    MET   1          2HT       MET   1   5.341  -9.208 -13.841
    3   3H    MET   1          3HT       MET   1   4.142  -9.045 -12.649
    4    HA   MET   1           HA       MET   1   6.189 -10.611 -11.570
    5   1HB   MET   1          2HB       MET   1   7.058  -8.232 -13.189
    6   2HB   MET   1          1HB       MET   1   7.904  -8.610 -11.689
    7   1HG   MET   1          2HG       MET   1   8.888  -9.669 -13.782
    8   2HG   MET   1          1HG       MET   1   8.513 -10.793 -12.477
    9   1HE   MET   1          1HE       MET   1   6.613 -10.379 -16.592
   10   2HE   MET   1          2HE       MET   1   8.303 -10.181 -16.134
   11   3HE   MET   1          3HE       MET   1   7.107  -9.006 -15.591
   12    H    ILE   2           H        ILE   2   4.401  -7.641 -11.949
   13    HA   ILE   2           HA       ILE   2   4.443  -7.266  -9.014
   14    HB   ILE   2           HB       ILE   2   4.635  -5.187 -11.196
   15   1HG1  ILE   2          2HG1      ILE   2   6.643  -6.424 -10.000
   16   2HG1  ILE   2          1HG1      ILE   2   6.714  -4.689 -10.290
   17   1HG2  ILE   2          1HG2      ILE   2   3.770  -4.906  -8.314
   18   2HG2  ILE   2          2HG2      ILE   2   2.983  -4.272  -9.760
   19   3HG2  ILE   2          3HG2      ILE   2   4.498  -3.563  -9.198
   20   1HD1  ILE   2          1HD1      ILE   2   7.325  -5.536  -7.922
   21   2HD1  ILE   2          2HD1      ILE   2   5.593  -5.792  -7.713
   22   3HD1  ILE   2          3HD1      ILE   2   6.214  -4.174  -8.039
   23    H    SER   3           H        SER   3   2.683  -7.154 -12.032
   24    HA   SER   3           HA       SER   3   0.210  -6.336 -10.712
   25   1HB   SER   3          2HB       SER   3  -0.747  -6.329 -12.951
   26   2HB   SER   3          1HB       SER   3   0.784  -5.460 -12.965
   27    HG   SER   3           HG       SER   3   0.157  -8.032 -13.941
   28    H    ASN   4           H        ASN   4  -0.277  -8.038  -9.351
   29    HA   ASN   4           HA       ASN   4  -1.747 -10.198 -10.457
   30   1HB   ASN   4          2HB       ASN   4  -0.279 -12.055  -9.668
   31   2HB   ASN   4          1HB       ASN   4   0.429 -11.136 -10.993
   32   1HD2  ASN   4          1HD2      ASN   4   1.663  -9.000  -9.899
   33   2HD2  ASN   4          2HD2      ASN   4   2.756  -9.442  -8.683
   34    H    ALA   5           H        ALA   5  -0.214 -11.512  -7.841
   35    HA   ALA   5           HA       ALA   5  -2.432 -11.131  -6.090
   36   1HB   ALA   5          1HB       ALA   5  -0.848 -12.257  -4.423
   37   2HB   ALA   5          2HB       ALA   5   0.308 -12.350  -5.751
   38   3HB   ALA   5          3HB       ALA   5  -1.247 -13.174  -5.876
   39    H    LYS   6           H        LYS   6   0.471  -9.374  -6.692
   40    HA   LYS   6           HA       LYS   6   0.797  -8.131  -4.154
   41   1HB   LYS   6          2HB       LYS   6   1.728  -7.542  -6.946
   42   2HB   LYS   6          1HB       LYS   6   1.919  -6.311  -5.698
   43   1HG   LYS   6          2HG       LYS   6   2.778  -9.125  -5.104
   44   2HG   LYS   6          1HG       LYS   6   3.821  -8.105  -6.096
   45   1HD   LYS   6          2HD       LYS   6   3.770  -6.365  -4.311
   46   2HD   LYS   6          1HD       LYS   6   2.806  -7.452  -3.312
   47   1HE   LYS   6          2HE       LYS   6   5.010  -7.828  -2.561
   48   2HE   LYS   6          1HE       LYS   6   4.724  -9.158  -3.681
   49   1HZ   LYS   6          1HZ       LYS   6   5.647  -7.229  -5.310
   50   2HZ   LYS   6          2HZ       LYS   6   6.606  -8.454  -4.627
   51   3HZ   LYS   6          3HZ       LYS   6   6.535  -6.921  -3.897
   52    H    ILE   7           H        ILE   7  -1.077  -7.350  -7.046
   53    HA   ILE   7           HA       ILE   7  -1.937  -4.767  -6.363
   54    HB   ILE   7           HB       ILE   7  -3.310  -6.967  -7.928
   55   1HG1  ILE   7          2HG1      ILE   7  -2.230  -4.431  -9.101
   56   2HG1  ILE   7          1HG1      ILE   7  -1.074  -5.674  -8.619
   57   1HG2  ILE   7          1HG2      ILE   7  -4.113  -4.108  -7.378
   58   2HG2  ILE   7          2HG2      ILE   7  -5.100  -5.566  -7.268
   59   3HG2  ILE   7          3HG2      ILE   7  -4.631  -4.936  -8.847
   60   1HD1  ILE   7          1HD1      ILE   7  -2.140  -7.312 -10.041
   61   2HD1  ILE   7          2HD1      ILE   7  -1.843  -5.868 -11.009
   62   3HD1  ILE   7          3HD1      ILE   7  -3.464  -6.205 -10.404
   63    H    ALA   8           H        ALA   8  -3.366  -7.945  -5.644
   64    HA   ALA   8           HA       ALA   8  -5.642  -7.077  -4.267
   65   1HB   ALA   8          1HB       ALA   8  -4.028  -9.579  -4.332
   66   2HB   ALA   8          2HB       ALA   8  -5.747  -9.337  -4.643
   67   3HB   ALA   8          3HB       ALA   8  -5.147  -9.374  -2.984
   68    H    ARG   9           H        ARG   9  -2.346  -7.709  -3.101
   69    HA   ARG   9           HA       ARG   9  -2.833  -7.324  -0.355
   70   1HB   ARG   9          2HB       ARG   9  -0.736  -8.283  -1.216
   71   2HB   ARG   9          1HB       ARG   9  -0.320  -6.733  -1.943
   72   1HG   ARG   9          2HG       ARG   9   0.842  -6.969   0.194
   73   2HG   ARG   9          1HG       ARG   9  -0.362  -5.688   0.321
   74   1HD   ARG   9          2HD       ARG   9  -1.787  -6.977   1.648
   75   2HD   ARG   9          1HD       ARG   9  -1.113  -8.499   1.069
   76    HE   ARG   9           HE       ARG   9   0.845  -6.985   2.500
   77   1HH1  ARG   9          1HH2      ARG   9  -1.977  -8.966   2.871
   78   2HH1  ARG   9          2HH2      ARG   9  -1.532  -9.536   4.445
   79   1HH2  ARG   9          1HH1      ARG   9   1.429  -7.738   4.556
   80   2HH2  ARG   9          2HH1      ARG   9   0.400  -8.853   5.392
   81    H    ILE  10           H        ILE  10  -1.322  -5.018  -2.620
   82    HA   ILE  10           HA       ILE  10  -1.379  -2.757  -1.023
   83    HB   ILE  10           HB       ILE  10  -1.820  -2.866  -4.018
   84   1HG1  ILE  10          2HG1      ILE  10   0.231  -4.086  -2.945
   85   2HG1  ILE  10          1HG1      ILE  10   0.508  -2.992  -4.298
   86   1HG2  ILE  10          1HG2      ILE  10  -0.588  -0.616  -3.826
   87   2HG2  ILE  10          2HG2      ILE  10  -0.963  -0.690  -2.104
   88   3HG2  ILE  10          3HG2      ILE  10  -2.267  -0.654  -3.291
   89   1HD1  ILE  10          1HD1      ILE  10   1.428  -1.337  -2.943
   90   2HD1  ILE  10          2HD1      ILE  10   1.990  -2.799  -2.135
   91   3HD1  ILE  10          3HD1      ILE  10   0.604  -1.918  -1.495
   92    H    ASN  11           H        ASN  11  -3.833  -3.799  -3.381
   93    HA   ASN  11           HA       ASN  11  -5.672  -1.727  -2.952
   94   1HB   ASN  11          2HB       ASN  11  -5.912  -3.097  -4.890
   95   2HB   ASN  11          1HB       ASN  11  -6.014  -4.565  -3.923
   96   1HD2  ASN  11          1HD2      ASN  11  -8.137  -5.228  -4.492
   97   2HD2  ASN  11          2HD2      ASN  11  -9.519  -4.295  -4.184
   98    H    GLU  12           H        GLU  12  -5.824  -5.065  -1.667
   99    HA   GLU  12           HA       GLU  12  -8.024  -4.664   0.012
  100   1HB   GLU  12          2HB       GLU  12  -6.984  -6.882  -0.630
  101   2HB   GLU  12          1HB       GLU  12  -5.749  -6.569   0.589
  102   1HG   GLU  12          2HG       GLU  12  -7.253  -7.720   1.902
  103   2HG   GLU  12          1HG       GLU  12  -7.908  -6.099   2.106
  104    H    LEU  13           H        LEU  13  -4.551  -4.564   0.857
  105    HA   LEU  13           HA       LEU  13  -4.872  -3.907   3.560
  106   1HB   LEU  13          2HB       LEU  13  -2.730  -4.493   2.098
  107   2HB   LEU  13          1HB       LEU  13  -2.578  -2.738   2.043
  108    HG   LEU  13           HG       LEU  13  -2.926  -4.313   4.611
  109   1HD1  LEU  13          1HD1      LEU  13  -0.473  -3.767   4.922
  110   2HD1  LEU  13          2HD1      LEU  13  -0.431  -3.292   3.224
  111   3HD1  LEU  13          3HD1      LEU  13  -0.804  -4.959   3.665
  112   1HD2  LEU  13          1HD2      LEU  13  -2.562  -1.436   3.873
  113   2HD2  LEU  13          2HD2      LEU  13  -1.778  -2.009   5.343
  114   3HD2  LEU  13          3HD2      LEU  13  -3.527  -2.148   5.166
  115    H    ALA  14           H        ALA  14  -4.296  -1.733   0.789
  116    HA   ALA  14           HA       ALA  14  -4.400   0.695   2.157
  117   1HB   ALA  14          1HB       ALA  14  -3.680   0.541  -0.171
  118   2HB   ALA  14          2HB       ALA  14  -5.013   1.687  -0.031
  119   3HB   ALA  14          3HB       ALA  14  -5.305   0.067  -0.663
  120    H    ALA  15           H        ALA  15  -7.066  -0.833   0.332
  121    HA   ALA  15           HA       ALA  15  -9.074   0.948   1.151
  122   1HB   ALA  15          1HB       ALA  15 -10.646  -0.877   0.478
  123   2HB   ALA  15          2HB       ALA  15  -9.254  -1.945   0.287
  124   3HB   ALA  15          3HB       ALA  15  -9.418  -0.519  -0.737
  125    H    LYS  16           H        LYS  16  -7.835  -1.980   2.652
  126    HA   LYS  16           HA       LYS  16  -9.862  -2.342   4.582
  127   1HB   LYS  16          2HB       LYS  16  -8.303  -4.128   4.157
  128   2HB   LYS  16          1HB       LYS  16  -6.932  -3.107   4.589
  129   1HG   LYS  16          2HG       LYS  16  -7.639  -3.007   6.896
  130   2HG   LYS  16          1HG       LYS  16  -9.166  -3.805   6.514
  131   1HD   LYS  16          2HD       LYS  16  -7.721  -5.480   7.461
  132   2HD   LYS  16          1HD       LYS  16  -7.809  -5.803   5.730
  133   1HE   LYS  16          2HE       LYS  16  -5.628  -5.167   5.359
  134   2HE   LYS  16          1HE       LYS  16  -5.642  -3.974   6.658
  135   1HZ   LYS  16          1HZ       LYS  16  -4.305  -5.666   7.469
  136   2HZ   LYS  16          2HZ       LYS  16  -5.292  -6.898   6.842
  137   3HZ   LYS  16          3HZ       LYS  16  -5.807  -5.997   8.186
  138    H    ALA  17           H        ALA  17  -6.569  -1.109   5.148
  139    HA   ALA  17           HA       ALA  17  -7.066   0.012   7.661
  140   1HB   ALA  17          1HB       ALA  17  -5.063   1.015   5.626
  141   2HB   ALA  17          2HB       ALA  17  -4.809  -0.408   6.636
  142   3HB   ALA  17          3HB       ALA  17  -4.975   1.183   7.380
  143    H    LYS  18           H        LYS  18  -7.765   1.174   4.455
  144    HA   LYS  18           HA       LYS  18  -8.154   3.932   5.247
  145   1HB   LYS  18          2HB       LYS  18  -7.510   3.222   2.928
  146   2HB   LYS  18          1HB       LYS  18  -9.123   2.537   2.739
  147   1HG   LYS  18          2HG       LYS  18  -9.189   4.739   1.783
  148   2HG   LYS  18          1HG       LYS  18 -10.044   4.833   3.323
  149   1HD   LYS  18          2HD       LYS  18  -8.331   6.018   4.362
  150   2HD   LYS  18          1HD       LYS  18  -7.096   5.396   3.267
  151   1HE   LYS  18          2HE       LYS  18  -7.608   6.924   1.598
  152   2HE   LYS  18          1HE       LYS  18  -9.277   7.112   2.136
  153   1HZ   LYS  18          1HZ       LYS  18  -8.510   8.328   4.055
  154   2HZ   LYS  18          2HZ       LYS  18  -7.912   9.061   2.643
  155   3HZ   LYS  18          3HZ       LYS  18  -6.891   8.101   3.603
  156    H    ALA  19           H        ALA  19 -10.169   1.084   4.776
  157    HA   ALA  19           HA       ALA  19 -12.668   2.471   5.042
  158   1HB   ALA  19          1HB       ALA  19 -11.927  -0.454   5.190
  159   2HB   ALA  19          2HB       ALA  19 -12.644   0.402   3.826
  160   3HB   ALA  19          3HB       ALA  19 -13.584   0.139   5.295
  161    H    GLY  20           H        GLY  20 -10.353   1.153   7.272
  162   1HA   GLY  20          2HA       GLY  20 -12.306   1.248   9.478
  163   2HA   GLY  20          1HA       GLY  20 -10.718   0.495   9.546
  164    H    VAL  21           H        VAL  21  -8.831   1.955   9.459
  165    HA   VAL  21           HA       VAL  21  -9.135   4.758   9.994
  166    HB   VAL  21           HB       VAL  21  -7.960   4.480  12.308
  167   1HG1  VAL  21          1HG1      VAL  21 -10.424   5.200  11.679
  168   2HG1  VAL  21          2HG1      VAL  21  -9.996   4.860  13.355
  169   3HG1  VAL  21          3HG1      VAL  21 -10.838   3.643  12.399
  170   1HG2  VAL  21          1HG2      VAL  21  -7.652   2.028  12.113
  171   2HG2  VAL  21          2HG2      VAL  21  -9.402   1.818  12.067
  172   3HG2  VAL  21          3HG2      VAL  21  -8.627   2.445  13.522
  173    H    ILE  22           H        ILE  22  -7.636   4.836   8.265
  174    HA   ILE  22           HA       ILE  22  -5.130   3.475   8.349
  175    HB   ILE  22           HB       ILE  22  -6.221   4.329   6.257
  176   1HG1  ILE  22          2HG1      ILE  22  -3.528   5.644   6.496
  177   2HG1  ILE  22          1HG1      ILE  22  -3.651   3.895   6.688
  178   1HG2  ILE  22          1HG2      ILE  22  -5.125   7.033   7.032
  179   2HG2  ILE  22          2HG2      ILE  22  -6.791   6.578   7.396
  180   3HG2  ILE  22          3HG2      ILE  22  -6.237   6.631   5.723
  181   1HD1  ILE  22          1HD1      ILE  22  -4.734   5.435   4.311
  182   2HD1  ILE  22          2HD1      ILE  22  -4.695   3.682   4.498
  183   3HD1  ILE  22          3HD1      ILE  22  -3.189   4.584   4.329
  184    H    THR  23           H        THR  23  -3.016   4.667   8.376
  185    HA   THR  23           HA       THR  23  -2.831   7.169   9.767
  186    HB   THR  23           HB       THR  23  -3.313   6.058  11.774
  187    HG1  THR  23           HG1      THR  23  -0.744   5.409  12.164
  188   1HG2  THR  23          1HG2      THR  23  -3.483   3.796  11.353
  189   2HG2  THR  23          2HG2      THR  23  -1.932   3.812  12.195
  190   3HG2  THR  23          3HG2      THR  23  -1.979   3.744  10.433
  191    H    GLU  24           H        GLU  24  -0.550   7.715  10.274
  192    HA   GLU  24           HA       GLU  24   1.137   7.426   8.111
  193   1HB   GLU  24          2HB       GLU  24   1.988   7.844  10.989
  194   2HB   GLU  24          1HB       GLU  24   2.921   8.266   9.553
  195   1HG   GLU  24          2HG       GLU  24   0.255   9.450  10.390
  196   2HG   GLU  24          1HG       GLU  24   1.817  10.267  10.399
  197    H    GLU  25           H        GLU  25   0.734   5.306  10.873
  198    HA   GLU  25           HA       GLU  25   3.072   3.772  10.674
  199   1HB   GLU  25          2HB       GLU  25   1.322   3.690  12.510
  200   2HB   GLU  25          1HB       GLU  25   0.343   2.703  11.424
  201   1HG   GLU  25          2HG       GLU  25   2.670   1.359  11.230
  202   2HG   GLU  25          1HG       GLU  25   2.867   2.021  12.851
  203    H    GLU  26           H        GLU  26  -0.164   2.931   9.414
  204    HA   GLU  26           HA       GLU  26   0.711   0.773   7.817
  205   1HB   GLU  26          2HB       GLU  26  -1.737   2.537   7.523
  206   2HB   GLU  26          1HB       GLU  26  -1.491   1.006   6.686
  207   1HG   GLU  26          2HG       GLU  26  -1.430   1.271   9.706
  208   2HG   GLU  26          1HG       GLU  26  -2.887   0.860   8.805
  209    H    LYS  27           H        LYS  27   0.089   4.183   7.072
  210    HA   LYS  27           HA       LYS  27   0.551   4.151   4.321
  211   1HB   LYS  27          2HB       LYS  27  -0.242   6.075   5.883
  212   2HB   LYS  27          1HB       LYS  27   1.477   6.428   6.054
  213   1HG   LYS  27          2HG       LYS  27   0.989   7.736   4.205
  214   2HG   LYS  27          1HG       LYS  27   1.437   6.232   3.404
  215   1HD   LYS  27          2HD       LYS  27  -0.586   6.601   2.361
  216   2HD   LYS  27          1HD       LYS  27  -1.162   5.702   3.763
  217   1HE   LYS  27          2HE       LYS  27  -1.255   8.676   3.267
  218   2HE   LYS  27          1HE       LYS  27  -2.570   7.593   3.713
  219   1HZ   LYS  27          1HZ       LYS  27  -1.679   7.359   5.889
  220   2HZ   LYS  27          2HZ       LYS  27  -1.750   9.022   5.548
  221   3HZ   LYS  27          3HZ       LYS  27  -0.265   8.200   5.477
  222    H    ALA  28           H        ALA  28   2.835   4.370   7.016
  223    HA   ALA  28           HA       ALA  28   5.158   4.954   5.544
  224   1HB   ALA  28          1HB       ALA  28   4.916   3.340   8.095
  225   2HB   ALA  28          2HB       ALA  28   5.032   5.098   8.004
  226   3HB   ALA  28          3HB       ALA  28   6.386   4.096   7.482
  227    H    GLU  29           H        GLU  29   3.781   1.820   6.539
  228    HA   GLU  29           HA       GLU  29   5.778   0.170   5.461
  229   1HB   GLU  29          2HB       GLU  29   3.944  -0.608   6.959
  230   2HB   GLU  29          1HB       GLU  29   2.813  -0.433   5.617
  231   1HG   GLU  29          2HG       GLU  29   5.309  -2.081   5.271
  232   2HG   GLU  29          1HG       GLU  29   3.907  -2.775   6.077
  233    H    GLN  30           H        GLN  30   2.576   0.784   4.009
  234    HA   GLN  30           HA       GLN  30   3.059  -0.278   1.504
  235   1HB   GLN  30          2HB       GLN  30   1.370   2.186   1.895
  236   2HB   GLN  30          1HB       GLN  30   1.136   0.865   0.751
  237   1HG   GLN  30          2HG       GLN  30   1.128  -0.466   3.161
  238   2HG   GLN  30          1HG       GLN  30   0.353   1.057   3.585
  239   1HE2  GLN  30          1HE2      GLN  30  -1.820   1.309   2.981
  240   2HE2  GLN  30          2HE2      GLN  30  -2.655   0.239   1.961
  241    H    GLN  31           H        GLN  31   4.314   2.650   2.827
  242    HA   GLN  31           HA       GLN  31   4.706   4.249   0.593
  243   1HB   GLN  31          2HB       GLN  31   5.286   4.751   3.030
  244   2HB   GLN  31          1HB       GLN  31   6.794   3.883   2.739
  245   1HG   GLN  31          2HG       GLN  31   6.996   5.451   0.656
  246   2HG   GLN  31          1HG       GLN  31   5.830   6.455   1.514
  247   1HE2  GLN  31          1HE2      GLN  31   7.131   5.335   4.145
  248   2HE2  GLN  31          2HE2      GLN  31   8.515   6.303   4.319
  249    H    LYS  32           H        LYS  32   6.691   1.544   1.760
  250    HA   LYS  32           HA       LYS  32   8.798   1.789  -0.082
  251   1HB   LYS  32          2HB       LYS  32   8.652   0.298   1.999
  252   2HB   LYS  32          1HB       LYS  32   7.783  -0.848   0.976
  253   1HG   LYS  32          2HG       LYS  32   9.695  -0.799  -0.633
  254   2HG   LYS  32          1HG       LYS  32  10.571   0.245   0.486
  255   1HD   LYS  32          2HD       LYS  32   9.456  -2.369   1.466
  256   2HD   LYS  32          1HD       LYS  32  10.963  -2.355   0.551
  257   1HE   LYS  32          2HE       LYS  32  10.465  -0.652   3.010
  258   2HE   LYS  32          1HE       LYS  32  11.296  -2.207   3.037
  259   1HZ   LYS  32          1HZ       LYS  32  12.201   0.365   2.020
  260   2HZ   LYS  32          2HZ       LYS  32  12.632  -0.995   1.098
  261   3HZ   LYS  32          3HZ       LYS  32  13.086  -0.895   2.732
  262    H    LEU  33           H        LEU  33   6.142  -0.600  -0.212
  263    HA   LEU  33           HA       LEU  33   6.597  -1.459  -2.828
  264   1HB   LEU  33          2HB       LEU  33   4.053  -1.361  -1.193
  265   2HB   LEU  33          1HB       LEU  33   4.166  -2.157  -2.763
  266    HG   LEU  33           HG       LEU  33   6.215  -2.828  -0.683
  267   1HD1  LEU  33          1HD1      LEU  33   4.018  -2.940   0.494
  268   2HD1  LEU  33          2HD1      LEU  33   4.755  -4.530   0.293
  269   3HD1  LEU  33          3HD1      LEU  33   3.430  -4.033  -0.759
  270   1HD2  LEU  33          1HD2      LEU  33   6.103  -5.009  -1.819
  271   2HD2  LEU  33          2HD2      LEU  33   6.345  -3.719  -2.995
  272   3HD2  LEU  33          3HD2      LEU  33   4.749  -4.443  -2.799
  273    H    ARG  34           H        ARG  34   4.586   1.200  -1.626
  274    HA   ARG  34           HA       ARG  34   3.399   1.899  -4.097
  275   1HB   ARG  34          2HB       ARG  34   2.653   2.648  -1.804
  276   2HB   ARG  34          1HB       ARG  34   4.006   3.778  -1.808
  277   1HG   ARG  34          2HG       ARG  34   3.094   4.640  -4.040
  278   2HG   ARG  34          1HG       ARG  34   1.633   3.718  -3.682
  279   1HD   ARG  34          2HD       ARG  34   1.246   4.966  -1.662
  280   2HD   ARG  34          1HD       ARG  34   2.824   5.741  -1.772
  281    HE   ARG  34           HE       ARG  34   1.075   6.229  -4.040
  282   1HH1  ARG  34          1HH2      ARG  34   2.140   7.232  -0.893
  283   2HH1  ARG  34          2HH2      ARG  34   1.665   8.883  -1.110
  284   1HH2  ARG  34          1HH1      ARG  34   0.450   8.392  -4.322
  285   2HH2  ARG  34          2HH1      ARG  34   0.708   9.538  -3.048
  286    H    GLN  35           H        GLN  35   6.399   2.927  -2.518
  287    HA   GLN  35           HA       GLN  35   7.083   5.033  -4.247
  288   1HB   GLN  35          2HB       GLN  35   8.615   3.202  -2.438
  289   2HB   GLN  35          1HB       GLN  35   9.505   4.221  -3.564
  290   1HG   GLN  35          2HG       GLN  35   7.334   5.479  -1.930
  291   2HG   GLN  35          1HG       GLN  35   8.866   5.104  -1.141
  292   1HE2  GLN  35          1HE2      GLN  35   7.273   7.416  -3.107
  293   2HE2  GLN  35          2HE2      GLN  35   8.645   8.308  -3.560
  294    H    GLU  36           H        GLU  36   8.108   1.620  -4.320
  295    HA   GLU  36           HA       GLU  36   9.489   1.793  -6.789
  296   1HB   GLU  36          2HB       GLU  36   9.538  -0.040  -4.919
  297   2HB   GLU  36          1HB       GLU  36   8.212  -0.749  -5.839
  298   1HG   GLU  36          2HG       GLU  36   9.629  -0.715  -7.878
  299   2HG   GLU  36          1HG       GLU  36  10.958  -0.054  -6.926
  300    H    TYR  37           H        TYR  37   6.162   0.900  -5.942
  301    HA   TYR  37           HA       TYR  37   5.301  -0.052  -8.413
  302   1HB   TYR  37          2HB       TYR  37   3.981  -0.082  -6.267
  303   2HB   TYR  37          1HB       TYR  37   3.622   1.624  -6.535
  304    HD1  TYR  37           HD1      TYR  37   3.353  -1.757  -8.101
  305    HD2  TYR  37           HD2      TYR  37   1.897   2.284  -8.015
  306    HE1  TYR  37           HE1      TYR  37   1.525  -2.383  -9.654
  307    HE2  TYR  37           HE2      TYR  37   0.068   1.657  -9.567
  308    HH   TYR  37           HH       TYR  37  -0.559   0.020 -11.103
  309    H    LEU  38           H        LEU  38   5.103   3.297  -7.176
  310    HA   LEU  38           HA       LEU  38   4.047   4.462  -9.501
  311   1HB   LEU  38          2HB       LEU  38   5.351   5.403  -7.034
  312   2HB   LEU  38          1HB       LEU  38   5.576   6.470  -8.419
  313    HG   LEU  38           HG       LEU  38   3.506   6.927  -7.008
  314   1HD1  LEU  38          1HD1      LEU  38   2.002   6.871  -9.190
  315   2HD1  LEU  38          2HD1      LEU  38   3.525   6.440  -9.964
  316   3HD1  LEU  38          3HD1      LEU  38   3.385   7.958  -9.080
  317   1HD2  LEU  38          1HD2      LEU  38   3.105   4.287  -6.981
  318   2HD2  LEU  38          2HD2      LEU  38   2.190   4.653  -8.444
  319   3HD2  LEU  38          3HD2      LEU  38   1.754   5.418  -6.916
  320    H    LYS  39           H        LYS  39   7.312   3.530  -8.683
  321    HA   LYS  39           HA       LYS  39   8.678   5.082 -10.620
  322   1HB   LYS  39          2HB       LYS  39   9.647   3.776  -8.618
  323   2HB   LYS  39          1HB       LYS  39   9.599   2.370  -9.681
  324   1HG   LYS  39          2HG       LYS  39  11.059   3.415 -11.276
  325   2HG   LYS  39          1HG       LYS  39  10.932   4.973 -10.461
  326   1HD   LYS  39          2HD       LYS  39  13.036   4.043  -9.791
  327   2HD   LYS  39          1HD       LYS  39  11.951   3.851  -8.414
  328   1HE   LYS  39          2HE       LYS  39  11.691   1.543  -8.777
  329   2HE   LYS  39          1HE       LYS  39  12.208   1.652 -10.459
  330   1HZ   LYS  39          1HZ       LYS  39  13.893   1.924  -8.035
  331   2HZ   LYS  39          2HZ       LYS  39  14.435   2.312  -9.597
  332   3HZ   LYS  39          3HZ       LYS  39  13.982   0.718  -9.222
  333    H    GLY  40           H        GLY  40   8.008   1.571 -10.687
  334   1HA   GLY  40          2HA       GLY  40   8.427   1.462 -13.551
  335   2HA   GLY  40          1HA       GLY  40   8.004   0.116 -12.500
  336    H    PHE  41           H        PHE  41   5.837   2.316 -11.613
  337    HA   PHE  41           HA       PHE  41   3.497   2.002 -11.835
  338   1HB   PHE  41          2HB       PHE  41   4.358   4.199 -12.808
  339   2HB   PHE  41          1HB       PHE  41   4.174   3.454 -14.394
  340    HD1  PHE  41           HD1      PHE  41   2.211   3.796 -11.198
  341    HD2  PHE  41           HD2      PHE  41   2.153   3.813 -15.495
  342    HE1  PHE  41           HE1      PHE  41  -0.215   4.314 -11.166
  343    HE2  PHE  41           HE2      PHE  41  -0.270   4.331 -15.460
  344    HZ   PHE  41           HZ       PHE  41  -1.455   4.582 -13.297
  345    H    ARG  42           H        ARG  42   3.901  -0.415 -12.298
  346    HA   ARG  42           HA       ARG  42   3.176  -2.290 -13.399
  347   1HB   ARG  42          2HB       ARG  42   1.200  -0.575 -13.880
  348   2HB   ARG  42          1HB       ARG  42   1.814  -0.696 -15.530
  349   1HG   ARG  42          2HG       ARG  42   1.744  -3.253 -15.172
  350   2HG   ARG  42          1HG       ARG  42   0.736  -2.900 -13.769
  351   1HD   ARG  42          2HD       ARG  42   0.165  -2.347 -16.677
  352   2HD   ARG  42          1HD       ARG  42  -0.818  -3.236 -15.516
  353    HE   ARG  42           HE       ARG  42  -0.455  -0.476 -14.773
  354   1HH1  ARG  42          1HH2      ARG  42  -2.254  -2.691 -16.740
  355   2HH1  ARG  42          2HH2      ARG  42  -3.645  -1.665 -16.859
  356   1HH2  ARG  42          1HH1      ARG  42  -2.273   0.866 -14.926
  357   2HH2  ARG  42          2HH1      ARG  42  -3.658   0.343 -15.826
  Start of MODEL   13
    1   1H    MET   1          1HT       MET   1  -1.665  -6.748 -18.315
    2   2H    MET   1          2HT       MET   1  -1.538  -8.006 -17.182
    3   3H    MET   1          3HT       MET   1  -0.787  -8.146 -18.699
    4    HA   MET   1           HA       MET   1   1.054  -7.433 -17.701
    5   1HB   MET   1          2HB       MET   1  -0.345  -4.782 -17.326
    6   2HB   MET   1          1HB       MET   1   1.337  -5.082 -17.758
    7   1HG   MET   1          2HG       MET   1  -1.122  -5.444 -19.481
    8   2HG   MET   1          1HG       MET   1   0.276  -4.412 -19.785
    9   1HE   MET   1          1HE       MET   1   0.327  -6.798 -22.622
   10   2HE   MET   1          2HE       MET   1  -0.799  -5.721 -21.801
   11   3HE   MET   1          3HE       MET   1  -1.021  -7.464 -21.689
   12    H    ILE   2           H        ILE   2  -1.172  -5.354 -15.852
   13    HA   ILE   2           HA       ILE   2  -0.001  -6.412 -13.369
   14    HB   ILE   2           HB       ILE   2  -1.826  -4.012 -13.591
   15   1HG1  ILE   2          2HG1      ILE   2   1.205  -3.990 -13.743
   16   2HG1  ILE   2          1HG1      ILE   2   0.162  -3.826 -15.156
   17   1HG2  ILE   2          1HG2      ILE   2  -1.016  -3.458 -11.462
   18   2HG2  ILE   2          2HG2      ILE   2   0.456  -4.409 -11.666
   19   3HG2  ILE   2          3HG2      ILE   2  -1.082  -5.218 -11.369
   20   1HD1  ILE   2          1HD1      ILE   2   0.298  -1.969 -12.765
   21   2HD1  ILE   2          2HD1      ILE   2  -0.935  -1.859 -14.021
   22   3HD1  ILE   2          3HD1      ILE   2   0.761  -1.603 -14.424
   23    H    SER   3           H        SER   3  -2.694  -5.087 -12.271
   24    HA   SER   3           HA       SER   3  -4.683  -5.884 -11.446
   25   1HB   SER   3          2HB       SER   3  -4.965  -7.828 -13.693
   26   2HB   SER   3          1HB       SER   3  -6.160  -6.745 -12.984
   27    HG   SER   3           HG       SER   3  -4.914  -6.344 -15.182
   28    H    ASN   4           H        ASN   4  -1.965  -7.634 -11.561
   29    HA   ASN   4           HA       ASN   4  -2.930 -10.247 -10.848
   30   1HB   ASN   4          2HB       ASN   4  -0.414 -10.428 -10.088
   31   2HB   ASN   4          1HB       ASN   4  -0.823 -10.380 -11.798
   32   1HD2  ASN   4          1HD2      ASN   4  -1.050  -7.475  -9.777
   33   2HD2  ASN   4          2HD2      ASN   4   0.263  -6.672 -10.493
   34    H    ALA   5           H        ALA   5  -1.362 -10.957  -8.698
   35    HA   ALA   5           HA       ALA   5  -2.939 -10.322  -6.495
   36   1HB   ALA   5          1HB       ALA   5  -0.110 -11.358  -6.688
   37   2HB   ALA   5          2HB       ALA   5  -1.588 -12.276  -6.392
   38   3HB   ALA   5          3HB       ALA   5  -0.960 -11.189  -5.152
   39    H    LYS   6           H        LYS   6  -0.635  -8.355  -8.035
   40    HA   LYS   6           HA       LYS   6   0.379  -6.908  -5.806
   41   1HB   LYS   6          2HB       LYS   6   0.027  -6.039  -8.690
   42   2HB   LYS   6          1HB       LYS   6   0.980  -5.184  -7.479
   43   1HG   LYS   6          2HG       LYS   6   1.478  -8.078  -8.224
   44   2HG   LYS   6          1HG       LYS   6   2.314  -6.727  -8.991
   45   1HD   LYS   6          2HD       LYS   6   2.775  -6.023  -6.469
   46   2HD   LYS   6          1HD       LYS   6   2.533  -7.746  -6.182
   47   1HE   LYS   6          2HE       LYS   6   4.557  -6.475  -8.047
   48   2HE   LYS   6          1HE       LYS   6   4.891  -7.383  -6.573
   49   1HZ   LYS   6          1HZ       LYS   6   5.215  -8.812  -8.438
   50   2HZ   LYS   6          2HZ       LYS   6   3.689  -8.428  -9.078
   51   3HZ   LYS   6          3HZ       LYS   6   3.810  -9.319  -7.636
   52    H    ILE   7           H        ILE   7  -2.181  -6.071  -8.168
   53    HA   ILE   7           HA       ILE   7  -3.067  -3.741  -6.889
   54    HB   ILE   7           HB       ILE   7  -4.619  -5.720  -8.580
   55   1HG1  ILE   7          2HG1      ILE   7  -2.726  -4.716  -9.762
   56   2HG1  ILE   7          1HG1      ILE   7  -4.225  -4.006 -10.358
   57   1HG2  ILE   7          1HG2      ILE   7  -6.253  -4.450  -7.399
   58   2HG2  ILE   7          2HG2      ILE   7  -6.086  -3.644  -8.959
   59   3HG2  ILE   7          3HG2      ILE   7  -5.305  -2.967  -7.528
   60   1HD1  ILE   7          1HD1      ILE   7  -3.792  -2.182  -8.526
   61   2HD1  ILE   7          2HD1      ILE   7  -2.875  -2.118 -10.030
   62   3HD1  ILE   7          3HD1      ILE   7  -2.133  -2.781  -8.574
   63    H    ALA   8           H        ALA   8  -4.266  -7.081  -6.598
   64    HA   ALA   8           HA       ALA   8  -6.319  -6.641  -4.764
   65   1HB   ALA   8          1HB       ALA   8  -5.606  -8.806  -6.018
   66   2HB   ALA   8          2HB       ALA   8  -6.331  -8.954  -4.417
   67   3HB   ALA   8          3HB       ALA   8  -4.584  -9.091  -4.611
   68    H    ARG   9           H        ARG   9  -2.856  -7.097  -4.227
   69    HA   ARG   9           HA       ARG   9  -2.898  -7.353  -1.426
   70   1HB   ARG   9          2HB       ARG   9  -0.938  -7.815  -2.916
   71   2HB   ARG   9          1HB       ARG   9  -0.725  -6.075  -3.101
   72   1HG   ARG   9          2HG       ARG   9  -0.601  -5.934  -0.568
   73   2HG   ARG   9          1HG       ARG   9  -0.524  -7.696  -0.553
   74   1HD   ARG   9          2HD       ARG   9   1.402  -7.294  -2.332
   75   2HD   ARG   9          1HD       ARG   9   1.488  -5.717  -1.555
   76    HE   ARG   9           HE       ARG   9   2.353  -8.222  -0.441
   77   1HH1  ARG   9          1HH2      ARG   9   1.061  -5.083   0.262
   78   2HH1  ARG   9          2HH2      ARG   9   1.690  -5.038   1.876
   79   1HH2  ARG   9          1HH1      ARG   9   3.177  -8.165   1.671
   80   2HH2  ARG   9          2HH1      ARG   9   2.887  -6.782   2.672
   81    H    ILE  10           H        ILE  10  -1.634  -4.476  -3.081
   82    HA   ILE  10           HA       ILE  10  -1.847  -2.712  -0.960
   83    HB   ILE  10           HB       ILE  10  -2.048  -2.143  -3.927
   84   1HG1  ILE  10          2HG1      ILE  10   0.353  -1.787  -2.130
   85   2HG1  ILE  10          1HG1      ILE  10   0.008  -3.349  -2.868
   86   1HG2  ILE  10          1HG2      ILE  10  -2.866  -0.210  -2.724
   87   2HG2  ILE  10          2HG2      ILE  10  -1.206   0.134  -3.211
   88   3HG2  ILE  10          3HG2      ILE  10  -1.556  -0.329  -1.546
   89   1HD1  ILE  10          1HD1      ILE  10   1.572  -1.881  -4.208
   90   2HD1  ILE  10          2HD1      ILE  10   0.219  -0.777  -4.451
   91   3HD1  ILE  10          3HD1      ILE  10   0.140  -2.420  -5.085
   92    H    ASN  11           H        ASN  11  -4.294  -3.579  -3.360
   93    HA   ASN  11           HA       ASN  11  -6.190  -1.587  -2.810
   94   1HB   ASN  11          2HB       ASN  11  -6.518  -2.975  -4.724
   95   2HB   ASN  11          1HB       ASN  11  -6.483  -4.444  -3.751
   96   1HD2  ASN  11          1HD2      ASN  11  -8.527  -5.290  -3.437
   97   2HD2  ASN  11          2HD2      ASN  11  -9.953  -4.382  -3.328
   98    H    GLU  12           H        GLU  12  -6.280  -4.956  -1.629
   99    HA   GLU  12           HA       GLU  12  -8.261  -4.522   0.311
  100   1HB   GLU  12          2HB       GLU  12  -6.256  -6.647  -0.246
  101   2HB   GLU  12          1HB       GLU  12  -6.980  -6.626   1.362
  102   1HG   GLU  12          2HG       GLU  12  -9.195  -6.810   0.476
  103   2HG   GLU  12          1HG       GLU  12  -8.641  -6.472  -1.162
  104    H    LEU  13           H        LEU  13  -4.783  -4.038   0.413
  105    HA   LEU  13           HA       LEU  13  -4.430  -3.921   3.204
  106   1HB   LEU  13          2HB       LEU  13  -2.691  -3.824   1.219
  107   2HB   LEU  13          1HB       LEU  13  -2.890  -2.082   1.403
  108    HG   LEU  13           HG       LEU  13  -2.189  -3.978   3.668
  109   1HD1  LEU  13          1HD1      LEU  13   0.068  -3.260   3.465
  110   2HD1  LEU  13          2HD1      LEU  13  -0.362  -1.960   2.354
  111   3HD1  LEU  13          3HD1      LEU  13  -0.437  -3.639   1.818
  112   1HD2  LEU  13          1HD2      LEU  13  -3.146  -2.128   4.715
  113   2HD2  LEU  13          2HD2      LEU  13  -2.656  -1.021   3.432
  114   3HD2  LEU  13          3HD2      LEU  13  -1.468  -1.602   4.596
  115    H    ALA  14           H        ALA  14  -4.749  -1.180   0.931
  116    HA   ALA  14           HA       ALA  14  -5.016   0.846   2.811
  117   1HB   ALA  14          1HB       ALA  14  -4.701   1.302   0.433
  118   2HB   ALA  14          2HB       ALA  14  -6.148   2.126   1.015
  119   3HB   ALA  14          3HB       ALA  14  -6.296   0.640   0.074
  120    H    ALA  15           H        ALA  15  -7.581  -1.047   1.234
  121    HA   ALA  15           HA       ALA  15  -9.769   0.179   2.507
  122   1HB   ALA  15          1HB       ALA  15 -11.064  -1.684   1.731
  123   2HB   ALA  15          2HB       ALA  15  -9.630  -2.703   1.602
  124   3HB   ALA  15          3HB       ALA  15  -9.850  -1.343   0.498
  125    H    LYS  16           H        LYS  16  -7.843  -2.648   3.433
  126    HA   LYS  16           HA       LYS  16  -9.388  -3.419   5.668
  127   1HB   LYS  16          2HB       LYS  16  -7.562  -4.770   4.510
  128   2HB   LYS  16          1HB       LYS  16  -6.400  -3.796   5.409
  129   1HG   LYS  16          2HG       LYS  16  -6.644  -5.416   6.996
  130   2HG   LYS  16          1HG       LYS  16  -8.109  -4.526   7.411
  131   1HD   LYS  16          2HD       LYS  16  -8.992  -6.654   7.125
  132   2HD   LYS  16          1HD       LYS  16  -9.166  -6.022   5.488
  133   1HE   LYS  16          2HE       LYS  16  -7.015  -7.067   4.857
  134   2HE   LYS  16          1HE       LYS  16  -6.851  -7.707   6.492
  135   1HZ   LYS  16          1HZ       LYS  16  -8.257  -9.352   6.047
  136   2HZ   LYS  16          2HZ       LYS  16  -8.096  -8.939   4.407
  137   3HZ   LYS  16          3HZ       LYS  16  -9.388  -8.319   5.318
  138    H    ALA  17           H        ALA  17  -6.283  -1.673   5.570
  139    HA   ALA  17           HA       ALA  17  -6.220  -0.936   8.268
  140   1HB   ALA  17          1HB       ALA  17  -5.110   0.837   6.106
  141   2HB   ALA  17          2HB       ALA  17  -4.390  -0.741   6.426
  142   3HB   ALA  17          3HB       ALA  17  -4.442   0.479   7.698
  143    H    LYS  18           H        LYS  18  -8.079   0.288   5.612
  144    HA   LYS  18           HA       LYS  18  -8.670   2.836   6.880
  145   1HB   LYS  18          2HB       LYS  18  -9.536   1.454   4.367
  146   2HB   LYS  18          1HB       LYS  18 -10.509   2.783   4.990
  147   1HG   LYS  18          2HG       LYS  18  -7.540   3.154   4.807
  148   2HG   LYS  18          1HG       LYS  18  -8.495   3.251   3.328
  149   1HD   LYS  18          2HD       LYS  18  -9.969   4.938   4.448
  150   2HD   LYS  18          1HD       LYS  18  -8.885   4.907   5.839
  151   1HE   LYS  18          2HE       LYS  18  -7.004   5.447   4.158
  152   2HE   LYS  18          1HE       LYS  18  -8.298   5.858   3.033
  153   1HZ   LYS  18          1HZ       LYS  18  -7.626   7.127   5.611
  154   2HZ   LYS  18          2HZ       LYS  18  -9.170   7.297   4.929
  155   3HZ   LYS  18          3HZ       LYS  18  -7.804   7.853   4.086
  156    H    ALA  19           H        ALA  19 -10.401  -0.212   6.293
  157    HA   ALA  19           HA       ALA  19 -12.790   0.650   7.631
  158   1HB   ALA  19          1HB       ALA  19 -12.006  -2.212   7.100
  159   2HB   ALA  19          2HB       ALA  19 -12.574  -1.144   5.814
  160   3HB   ALA  19          3HB       ALA  19 -13.625  -1.514   7.183
  161    H    GLY  20           H        GLY  20  -9.773  -0.536   8.743
  162   1HA   GLY  20          2HA       GLY  20 -10.956  -1.510  11.262
  163   2HA   GLY  20          1HA       GLY  20  -9.302  -1.787  10.728
  164    H    VAL  21           H        VAL  21  -7.868   0.109  10.644
  165    HA   VAL  21           HA       VAL  21  -8.456   2.583  11.883
  166    HB   VAL  21           HB       VAL  21  -6.814   2.025  13.898
  167   1HG1  VAL  21          1HG1      VAL  21  -9.499   0.947  14.485
  168   2HG1  VAL  21          2HG1      VAL  21  -9.498   2.518  13.685
  169   3HG1  VAL  21          3HG1      VAL  21  -8.645   2.305  15.213
  170   1HG2  VAL  21          1HG2      VAL  21  -6.594  -0.376  13.049
  171   2HG2  VAL  21          2HG2      VAL  21  -8.255  -0.620  13.586
  172   3HG2  VAL  21          3HG2      VAL  21  -7.004  -0.198  14.754
  173    H    ILE  22           H        ILE  22  -7.279   3.247  10.049
  174    HA   ILE  22           HA       ILE  22  -4.660   2.312   9.451
  175    HB   ILE  22           HB       ILE  22  -6.270   3.437   7.854
  176   1HG1  ILE  22          2HG1      ILE  22  -3.650   4.906   7.824
  177   2HG1  ILE  22          1HG1      ILE  22  -3.648   3.149   7.671
  178   1HG2  ILE  22          1HG2      ILE  22  -6.414   5.826   7.819
  179   2HG2  ILE  22          2HG2      ILE  22  -5.168   5.986   9.059
  180   3HG2  ILE  22          3HG2      ILE  22  -6.753   5.335   9.480
  181   1HD1  ILE  22          1HD1      ILE  22  -3.736   4.293   5.459
  182   2HD1  ILE  22          2HD1      ILE  22  -5.271   5.025   5.926
  183   3HD1  ILE  22          3HD1      ILE  22  -5.146   3.274   5.747
  184    H    THR  23           H        THR  23  -2.696   3.620   9.492
  185    HA   THR  23           HA       THR  23  -2.567   5.709  11.547
  186    HB   THR  23           HB       THR  23  -0.496   3.568  11.725
  187    HG1  THR  23           HG1      THR  23  -2.943   3.318  13.097
  188   1HG2  THR  23          1HG2      THR  23  -0.339   4.290  13.966
  189   2HG2  THR  23          2HG2      THR  23  -1.957   4.993  13.944
  190   3HG2  THR  23          3HG2      THR  23  -0.643   5.775  13.064
  191    H    GLU  24           H        GLU  24  -0.655   6.989  11.417
  192    HA   GLU  24           HA       GLU  24   0.265   7.627   8.884
  193   1HB   GLU  24          2HB       GLU  24   1.751   7.964  11.505
  194   2HB   GLU  24          1HB       GLU  24   2.093   8.832  10.007
  195   1HG   GLU  24          2HG       GLU  24  -0.430   9.511  10.118
  196   2HG   GLU  24          1HG       GLU  24  -0.300   9.066  11.819
  197    H    GLU  25           H        GLU  25   1.428   5.219  11.144
  198    HA   GLU  25           HA       GLU  25   3.919   4.618   9.983
  199   1HB   GLU  25          2HB       GLU  25   1.957   2.965  11.578
  200   2HB   GLU  25          1HB       GLU  25   3.510   2.326  11.044
  201   1HG   GLU  25          2HG       GLU  25   4.702   4.066  12.248
  202   2HG   GLU  25          1HG       GLU  25   3.188   4.861  12.674
  203    H    GLU  26           H        GLU  26   0.772   2.987   9.549
  204    HA   GLU  26           HA       GLU  26   1.618   1.253   7.491
  205   1HB   GLU  26          2HB       GLU  26  -1.052   2.236   8.446
  206   2HB   GLU  26          1HB       GLU  26  -0.948   1.287   6.964
  207   1HG   GLU  26          2HG       GLU  26  -1.282  -0.332   8.653
  208   2HG   GLU  26          1HG       GLU  26   0.454  -0.381   8.355
  209    H    LYS  27           H        LYS  27   0.172   4.486   7.420
  210    HA   LYS  27           HA       LYS  27  -0.335   4.745   4.700
  211   1HB   LYS  27          2HB       LYS  27   0.364   6.658   6.891
  212   2HB   LYS  27          1HB       LYS  27   0.375   7.245   5.229
  213   1HG   LYS  27          2HG       LYS  27  -1.912   6.680   4.901
  214   2HG   LYS  27          1HG       LYS  27  -1.957   5.693   6.361
  215   1HD   LYS  27          2HD       LYS  27  -1.762   7.642   7.773
  216   2HD   LYS  27          1HD       LYS  27  -1.460   8.683   6.381
  217   1HE   LYS  27          2HE       LYS  27  -4.021   7.127   6.859
  218   2HE   LYS  27          1HE       LYS  27  -3.812   8.849   7.176
  219   1HZ   LYS  27          1HZ       LYS  27  -4.793   8.611   5.042
  220   2HZ   LYS  27          2HZ       LYS  27  -3.637   7.466   4.556
  221   3HZ   LYS  27          3HZ       LYS  27  -3.183   9.086   4.795
  222    H    ALA  28           H        ALA  28   2.675   5.327   6.483
  223    HA   ALA  28           HA       ALA  28   4.225   6.224   4.303
  224   1HB   ALA  28          1HB       ALA  28   6.170   5.503   5.733
  225   2HB   ALA  28          2HB       ALA  28   5.004   4.837   6.876
  226   3HB   ALA  28          3HB       ALA  28   5.024   6.570   6.544
  227    H    GLU  29           H        GLU  29   3.637   2.982   5.623
  228    HA   GLU  29           HA       GLU  29   5.464   1.541   4.071
  229   1HB   GLU  29          2HB       GLU  29   4.282   0.520   5.941
  230   2HB   GLU  29          1HB       GLU  29   2.745   0.685   5.095
  231   1HG   GLU  29          2HG       GLU  29   3.373  -0.898   3.427
  232   2HG   GLU  29          1HG       GLU  29   5.068  -0.845   3.909
  233    H    GLN  30           H        GLN  30   1.980   2.079   3.399
  234    HA   GLN  30           HA       GLN  30   1.843   0.845   0.923
  235   1HB   GLN  30          2HB       GLN  30   0.391   3.435   1.390
  236   2HB   GLN  30          1HB       GLN  30  -0.162   1.983   0.554
  237   1HG   GLN  30          2HG       GLN  30   0.114   0.841   2.897
  238   2HG   GLN  30          1HG       GLN  30   0.061   2.491   3.509
  239   1HE2  GLN  30          1HE2      GLN  30  -2.034   1.150   4.423
  240   2HE2  GLN  30          2HE2      GLN  30  -3.450   1.440   3.535
  241    H    GLN  31           H        GLN  31   2.825   4.179   1.663
  242    HA   GLN  31           HA       GLN  31   3.149   5.084  -0.975
  243   1HB   GLN  31          2HB       GLN  31   3.195   6.481   1.141
  244   2HB   GLN  31          1HB       GLN  31   4.857   5.934   1.372
  245   1HG   GLN  31          2HG       GLN  31   5.616   7.009  -0.582
  246   2HG   GLN  31          1HG       GLN  31   3.992   7.141  -1.251
  247   1HE2  GLN  31          1HE2      GLN  31   5.515   9.470  -1.160
  248   2HE2  GLN  31          2HE2      GLN  31   4.922  10.506   0.048
  249    H    LYS  32           H        LYS  32   5.377   3.391   1.199
  250    HA   LYS  32           HA       LYS  32   7.688   3.531  -0.409
  251   1HB   LYS  32          2HB       LYS  32   7.437   2.745   2.038
  252   2HB   LYS  32          1HB       LYS  32   7.028   1.174   1.348
  253   1HG   LYS  32          2HG       LYS  32   9.153   1.146   0.110
  254   2HG   LYS  32          1HG       LYS  32   9.564   2.732   0.764
  255   1HD   LYS  32          2HD       LYS  32   9.245   1.643   3.088
  256   2HD   LYS  32          1HD       LYS  32   9.332   0.104   2.229
  257   1HE   LYS  32          2HE       LYS  32  11.564   0.649   2.975
  258   2HE   LYS  32          1HE       LYS  32  11.516   0.876   1.227
  259   1HZ   LYS  32          1HZ       LYS  32  11.253   3.218   1.524
  260   2HZ   LYS  32          2HZ       LYS  32  12.594   2.719   2.440
  261   3HZ   LYS  32          3HZ       LYS  32  11.113   3.053   3.205
  262    H    LEU  33           H        LEU  33   5.301   0.894  -0.091
  263    HA   LEU  33           HA       LEU  33   6.330  -0.823  -2.027
  264   1HB   LEU  33          2HB       LEU  33   3.506  -0.327  -1.080
  265   2HB   LEU  33          1HB       LEU  33   3.901  -1.595  -2.241
  266    HG   LEU  33           HG       LEU  33   5.496  -1.422   0.292
  267   1HD1  LEU  33          1HD1      LEU  33   2.709  -2.596   0.043
  268   2HD1  LEU  33          2HD1      LEU  33   3.212  -1.288   1.116
  269   3HD1  LEU  33          3HD1      LEU  33   3.811  -2.925   1.381
  270   1HD2  LEU  33          1HD2      LEU  33   4.446  -3.786  -1.295
  271   2HD2  LEU  33          2HD2      LEU  33   5.707  -3.805  -0.063
  272   3HD2  LEU  33          3HD2      LEU  33   5.999  -3.012  -1.610
  273    H    ARG  34           H        ARG  34   3.882   1.731  -2.392
  274    HA   ARG  34           HA       ARG  34   3.454   1.414  -5.161
  275   1HB   ARG  34          2HB       ARG  34   1.946   2.680  -3.669
  276   2HB   ARG  34          1HB       ARG  34   3.190   3.915  -3.471
  277   1HG   ARG  34          2HG       ARG  34   3.013   4.633  -5.705
  278   2HG   ARG  34          1HG       ARG  34   2.244   3.132  -6.224
  279   1HD   ARG  34          2HD       ARG  34   0.752   5.246  -5.943
  280   2HD   ARG  34          1HD       ARG  34   0.171   3.718  -5.286
  281    HE   ARG  34           HE       ARG  34   1.637   5.026  -3.275
  282   1HH1  ARG  34          1HH2      ARG  34  -1.258   5.416  -5.140
  283   2HH1  ARG  34          2HH2      ARG  34  -2.100   6.284  -3.901
  284   1HH2  ARG  34          1HH1      ARG  34   0.542   6.164  -1.654
  285   2HH2  ARG  34          2HH1      ARG  34  -1.082   6.706  -1.925
  286    H    GLN  35           H        GLN  35   5.652   3.527  -3.344
  287    HA   GLN  35           HA       GLN  35   6.729   4.937  -5.526
  288   1HB   GLN  35          2HB       GLN  35   7.028   5.626  -3.186
  289   2HB   GLN  35          1HB       GLN  35   8.031   4.206  -2.891
  290   1HG   GLN  35          2HG       GLN  35   9.699   4.986  -4.474
  291   2HG   GLN  35          1HG       GLN  35   8.664   6.328  -4.959
  292   1HE2  GLN  35          1HE2      GLN  35   8.244   5.924  -1.645
  293   2HE2  GLN  35          2HE2      GLN  35   9.387   7.054  -1.100
  294    H    GLU  36           H        GLU  36   7.673   1.877  -4.015
  295    HA   GLU  36           HA       GLU  36  10.050   1.476  -5.511
  296   1HB   GLU  36          2HB       GLU  36   8.201  -0.370  -4.008
  297   2HB   GLU  36          1HB       GLU  36   9.591  -0.989  -4.902
  298   1HG   GLU  36          2HG       GLU  36  11.110   0.397  -3.608
  299   2HG   GLU  36          1HG       GLU  36   9.761   1.189  -2.799
  300    H    TYR  37           H        TYR  37   6.683   0.483  -6.018
  301    HA   TYR  37           HA       TYR  37   6.999  -1.168  -8.231
  302   1HB   TYR  37          2HB       TYR  37   4.862  -0.548  -6.875
  303   2HB   TYR  37          1HB       TYR  37   4.691   0.750  -8.057
  304    HD1  TYR  37           HD1      TYR  37   5.265  -2.950  -7.823
  305    HD2  TYR  37           HD2      TYR  37   3.689   0.311 -10.140
  306    HE1  TYR  37           HE1      TYR  37   4.328  -4.560  -9.458
  307    HE2  TYR  37           HE2      TYR  37   2.753  -1.301 -11.771
  308    HH   TYR  37           HH       TYR  37   2.658  -4.703 -11.149
  309    H    LEU  38           H        LEU  38   6.599   2.376  -8.146
  310    HA   LEU  38           HA       LEU  38   6.551   2.802 -10.922
  311   1HB   LEU  38          2HB       LEU  38   7.711   4.656  -8.824
  312   2HB   LEU  38          1HB       LEU  38   7.145   5.110 -10.429
  313    HG   LEU  38           HG       LEU  38   5.454   3.991  -8.176
  314   1HD1  LEU  38          1HD1      LEU  38   6.220   6.458  -8.184
  315   2HD1  LEU  38          2HD1      LEU  38   4.491   6.148  -8.030
  316   3HD1  LEU  38          3HD1      LEU  38   5.163   6.643  -9.584
  317   1HD2  LEU  38          1HD2      LEU  38   4.909   4.480 -11.095
  318   2HD2  LEU  38          2HD2      LEU  38   3.608   4.659  -9.919
  319   3HD2  LEU  38          3HD2      LEU  38   4.431   3.109 -10.094
  320    H    LYS  39           H        LYS  39   9.294   2.780  -8.649
  321    HA   LYS  39           HA       LYS  39  11.294   3.340 -10.581
  322   1HB   LYS  39          2HB       LYS  39  11.475   3.464  -8.021
  323   2HB   LYS  39          1HB       LYS  39  11.730   1.719  -8.071
  324   1HG   LYS  39          2HG       LYS  39  13.903   2.774  -8.092
  325   2HG   LYS  39          1HG       LYS  39  13.614   2.121  -9.702
  326   1HD   LYS  39          2HD       LYS  39  13.398   4.205 -10.663
  327   2HD   LYS  39          1HD       LYS  39  12.726   4.925  -9.201
  328   1HE   LYS  39          2HE       LYS  39  14.846   5.189  -8.206
  329   2HE   LYS  39          1HE       LYS  39  15.596   4.005  -9.277
  330   1HZ   LYS  39          1HZ       LYS  39  15.088   6.816  -9.702
  331   2HZ   LYS  39          2HZ       LYS  39  14.666   5.826 -11.017
  332   3HZ   LYS  39          3HZ       LYS  39  16.252   5.803 -10.409
  333    H    GLY  40           H        GLY  40   9.677   0.413  -9.565
  334   1HA   GLY  40          2HA       GLY  40  11.520  -1.334 -10.999
  335   2HA   GLY  40          1HA       GLY  40  10.093  -1.831 -10.094
  336    H    PHE  41           H        PHE  41   9.066   0.681 -11.898
  337    HA   PHE  41           HA       PHE  41   8.768  -0.502 -14.503
  338   1HB   PHE  41          2HB       PHE  41   6.387  -0.476 -12.622
  339   2HB   PHE  41          1HB       PHE  41   6.263  -0.677 -14.366
  340    HD1  PHE  41           HD1      PHE  41   7.711  -2.607 -15.414
  341    HD2  PHE  41           HD2      PHE  41   6.650  -2.342 -11.258
  342    HE1  PHE  41           HE1      PHE  41   8.130  -5.038 -15.154
  343    HE2  PHE  41           HE2      PHE  41   7.071  -4.773 -10.998
  344    HZ   PHE  41           HZ       PHE  41   7.809  -6.120 -12.945
  345    H    ARG  42           H        ARG  42   9.731   1.710 -14.666
  346    HA   ARG  42           HA       ARG  42   7.963   3.958 -14.175
  347   1HB   ARG  42          2HB       ARG  42  10.557   3.914 -14.009
  348   2HB   ARG  42          1HB       ARG  42  10.519   4.086 -15.763
  349   1HG   ARG  42          2HG       ARG  42   9.054   6.100 -15.484
  350   2HG   ARG  42          1HG       ARG  42   9.253   5.955 -13.738
  351   1HD   ARG  42          2HD       ARG  42  11.808   5.970 -14.277
  352   2HD   ARG  42          1HD       ARG  42  11.308   6.660 -15.819
  353    HE   ARG  42           HE       ARG  42  10.008   8.226 -14.032
  354   1HH1  ARG  42          1HH2      ARG  42  13.291   7.147 -14.314
  355   2HH1  ARG  42          2HH2      ARG  42  13.958   8.547 -13.546
  356   1HH2  ARG  42          1HH1      ARG  42  10.882  10.060 -13.029
  357   2HH2  ARG  42          2HH1      ARG  42  12.595  10.194 -12.818
  Start of MODEL   14
    1   1H    MET   1          1HT       MET   1   5.375 -12.916 -14.521
    2   2H    MET   1          2HT       MET   1   4.438 -12.135 -13.339
    3   3H    MET   1          3HT       MET   1   5.970 -12.754 -12.941
    4    HA   MET   1           HA       MET   1   7.100 -11.113 -14.106
    5   1HB   MET   1          2HB       MET   1   5.439 -11.398 -16.081
    6   2HB   MET   1          1HB       MET   1   4.510 -10.119 -15.299
    7   1HG   MET   1          2HG       MET   1   5.930  -8.984 -16.827
    8   2HG   MET   1          1HG       MET   1   6.709  -8.779 -15.259
    9   1HE   MET   1          1HE       MET   1   9.911  -9.050 -17.118
   10   2HE   MET   1          2HE       MET   1   8.736  -8.090 -16.225
   11   3HE   MET   1          3HE       MET   1   8.504  -8.372 -17.948
   12    H    ILE   2           H        ILE   2   3.732 -10.342 -13.203
   13    HA   ILE   2           HA       ILE   2   4.729  -8.148 -11.500
   14    HB   ILE   2           HB       ILE   2   2.992  -7.636 -13.238
   15   1HG1  ILE   2          2HG1      ILE   2   1.757  -7.290 -10.511
   16   2HG1  ILE   2          1HG1      ILE   2   3.283  -6.492 -10.893
   17   1HG2  ILE   2          1HG2      ILE   2   1.079  -9.157 -11.461
   18   2HG2  ILE   2          2HG2      ILE   2   1.841  -9.916 -12.858
   19   3HG2  ILE   2          3HG2      ILE   2   0.794  -8.516 -13.078
   20   1HD1  ILE   2          1HD1      ILE   2   0.803  -6.257 -12.618
   21   2HD1  ILE   2          2HD1      ILE   2   2.290  -5.315 -12.747
   22   3HD1  ILE   2          3HD1      ILE   2   1.225  -5.097 -11.358
   23    H    SER   3           H        SER   3   3.577 -11.324 -11.384
   24    HA   SER   3           HA       SER   3   3.237 -12.742  -9.605
   25   1HB   SER   3          2HB       SER   3   3.397 -10.451  -7.667
   26   2HB   SER   3          1HB       SER   3   3.846 -12.137  -7.434
   27    HG   SER   3           HG       SER   3   5.675 -10.804  -7.732
   28    H    ASN   4           H        ASN   4   1.570  -9.647  -9.631
   29    HA   ASN   4           HA       ASN   4  -0.667  -9.150  -9.506
   30   1HB   ASN   4          2HB       ASN   4  -0.780 -11.605 -10.533
   31   2HB   ASN   4          1HB       ASN   4  -1.462 -11.971  -8.948
   32   1HD2  ASN   4          1HD2      ASN   4  -1.806  -9.201 -11.254
   33   2HD2  ASN   4          2HD2      ASN   4  -3.504  -9.205 -11.215
   34    H    ALA   5           H        ALA   5   0.834 -11.221  -7.135
   35    HA   ALA   5           HA       ALA   5  -1.054 -11.032  -5.057
   36   1HB   ALA   5          1HB       ALA   5   0.757 -11.657  -3.578
   37   2HB   ALA   5          2HB       ALA   5   1.957 -11.162  -4.771
   38   3HB   ALA   5          3HB       ALA   5   0.930 -12.560  -5.083
   39    H    LYS   6           H        LYS   6   1.047  -8.705  -6.442
   40    HA   LYS   6           HA       LYS   6   1.347  -6.956  -4.207
   41   1HB   LYS   6          2HB       LYS   6   1.517  -6.496  -7.194
   42   2HB   LYS   6          1HB       LYS   6   1.878  -5.254  -5.996
   43   1HG   LYS   6          2HG       LYS   6   3.681  -6.564  -5.070
   44   2HG   LYS   6          1HG       LYS   6   3.240  -7.960  -6.054
   45   1HD   LYS   6          2HD       LYS   6   3.791  -6.729  -8.100
   46   2HD   LYS   6          1HD       LYS   6   4.165  -5.290  -7.153
   47   1HE   LYS   6          2HE       LYS   6   6.278  -6.261  -7.528
   48   2HE   LYS   6          1HE       LYS   6   5.859  -6.806  -5.904
   49   1HZ   LYS   6          1HZ       LYS   6   4.947  -8.847  -6.956
   50   2HZ   LYS   6          2HZ       LYS   6   6.628  -8.670  -7.126
   51   3HZ   LYS   6          3HZ       LYS   6   5.599  -8.330  -8.435
   52    H    ILE   7           H        ILE   7  -0.914  -7.097  -6.942
   53    HA   ILE   7           HA       ILE   7  -2.391  -4.785  -6.407
   54    HB   ILE   7           HB       ILE   7  -3.502  -7.385  -7.493
   55   1HG1  ILE   7          2HG1      ILE   7  -1.506  -6.891  -8.760
   56   2HG1  ILE   7          1HG1      ILE   7  -2.881  -6.373  -9.732
   57   1HG2  ILE   7          1HG2      ILE   7  -4.269  -4.532  -8.160
   58   2HG2  ILE   7          2HG2      ILE   7  -5.074  -5.464  -6.897
   59   3HG2  ILE   7          3HG2      ILE   7  -5.136  -6.010  -8.573
   60   1HD1  ILE   7          1HD1      ILE   7  -2.496  -4.058  -8.542
   61   2HD1  ILE   7          2HD1      ILE   7  -1.468  -4.522  -9.897
   62   3HD1  ILE   7          3HD1      ILE   7  -0.879  -4.697  -8.245
   63    H    ALA   8           H        ALA   8  -3.157  -8.140  -5.463
   64    HA   ALA   8           HA       ALA   8  -5.378  -7.599  -3.869
   65   1HB   ALA   8          1HB       ALA   8  -4.953  -9.779  -2.829
   66   2HB   ALA   8          2HB       ALA   8  -3.319  -9.787  -3.493
   67   3HB   ALA   8          3HB       ALA   8  -4.711  -9.866  -4.574
   68    H    ARG   9           H        ARG   9  -1.940  -7.489  -3.085
   69    HA   ARG   9           HA       ARG   9  -2.148  -7.289  -0.286
   70   1HB   ARG   9          2HB       ARG   9  -0.034  -7.696  -1.544
   71   2HB   ARG   9          1HB       ARG   9  -0.055  -6.013  -2.065
   72   1HG   ARG   9          2HG       ARG   9   0.180  -5.214   0.178
   73   2HG   ARG   9          1HG       ARG   9  -0.148  -6.811   0.852
   74   1HD   ARG   9          2HD       ARG   9   2.269  -6.042  -0.808
   75   2HD   ARG   9          1HD       ARG   9   2.258  -6.341   0.928
   76    HE   ARG   9           HE       ARG   9   1.215  -8.624  -0.290
   77   1HH1  ARG   9          1HH2      ARG   9   4.155  -6.792  -0.256
   78   2HH1  ARG   9          2HH2      ARG   9   5.171  -8.161  -0.558
   79   1HH2  ARG   9          1HH1      ARG   9   2.542 -10.418  -0.687
   80   2HH2  ARG   9          2HH1      ARG   9   4.258 -10.214  -0.803
   81    H    ILE  10           H        ILE  10  -1.160  -4.557  -2.328
   82    HA   ILE  10           HA       ILE  10  -1.811  -2.543  -0.538
   83    HB   ILE  10           HB       ILE  10  -1.763  -2.481  -3.564
   84   1HG1  ILE  10          2HG1      ILE  10   0.283  -1.539  -1.528
   85   2HG1  ILE  10          1HG1      ILE  10   0.337  -3.129  -2.290
   86   1HG2  ILE  10          1HG2      ILE  10  -1.367   0.010  -3.145
   87   2HG2  ILE  10          2HG2      ILE  10  -1.946  -0.268  -1.503
   88   3HG2  ILE  10          3HG2      ILE  10  -3.014  -0.557  -2.876
   89   1HD1  ILE  10          1HD1      ILE  10   0.286  -0.527  -3.842
   90   2HD1  ILE  10          2HD1      ILE  10   0.563  -2.145  -4.487
   91   3HD1  ILE  10          3HD1      ILE  10   1.764  -1.398  -3.435
   92    H    ASN  11           H        ASN  11  -3.868  -4.194  -2.872
   93    HA   ASN  11           HA       ASN  11  -6.072  -2.459  -2.859
   94   1HB   ASN  11          2HB       ASN  11  -5.963  -4.241  -4.467
   95   2HB   ASN  11          1HB       ASN  11  -5.908  -5.460  -3.195
   96   1HD2  ASN  11          1HD2      ASN  11  -7.883  -6.535  -3.716
   97   2HD2  ASN  11          2HD2      ASN  11  -9.397  -5.774  -3.627
   98    H    GLU  12           H        GLU  12  -5.643  -5.446  -0.941
   99    HA   GLU  12           HA       GLU  12  -7.896  -5.098   0.695
  100   1HB   GLU  12          2HB       GLU  12  -6.504  -7.196   0.431
  101   2HB   GLU  12          1HB       GLU  12  -5.330  -6.461   1.523
  102   1HG   GLU  12          2HG       GLU  12  -7.106  -6.210   3.240
  103   2HG   GLU  12          1HG       GLU  12  -8.247  -7.002   2.154
  104    H    LEU  13           H        LEU  13  -4.498  -4.187   1.248
  105    HA   LEU  13           HA       LEU  13  -4.821  -3.126   3.831
  106   1HB   LEU  13          2HB       LEU  13  -2.758  -3.195   1.804
  107   2HB   LEU  13          1HB       LEU  13  -2.813  -1.610   2.574
  108    HG   LEU  13           HG       LEU  13  -2.839  -4.172   4.180
  109   1HD1  LEU  13          1HD1      LEU  13  -0.395  -3.785   4.513
  110   2HD1  LEU  13          2HD1      LEU  13  -0.456  -2.519   3.287
  111   3HD1  LEU  13          3HD1      LEU  13  -0.794  -4.192   2.843
  112   1HD2  LEU  13          1HD2      LEU  13  -3.537  -1.879   5.136
  113   2HD2  LEU  13          2HD2      LEU  13  -1.843  -1.422   4.956
  114   3HD2  LEU  13          3HD2      LEU  13  -2.287  -2.760   6.016
  115    H    ALA  14           H        ALA  14  -4.800  -1.454   0.678
  116    HA   ALA  14           HA       ALA  14  -5.293   1.135   1.599
  117   1HB   ALA  14          1HB       ALA  14  -6.140  -0.196  -0.984
  118   2HB   ALA  14          2HB       ALA  14  -4.671   0.738  -0.706
  119   3HB   ALA  14          3HB       ALA  14  -6.242   1.538  -0.681
  120    H    ALA  15           H        ALA  15  -7.510  -1.531   0.967
  121    HA   ALA  15           HA       ALA  15  -9.937  -0.109   1.130
  122   1HB   ALA  15          1HB       ALA  15 -10.993  -2.226   1.384
  123   2HB   ALA  15          2HB       ALA  15  -9.535  -2.954   2.058
  124   3HB   ALA  15          3HB       ALA  15  -9.591  -2.509   0.352
  125    H    LYS  16           H        LYS  16  -7.921  -1.607   3.612
  126    HA   LYS  16           HA       LYS  16  -9.681  -1.266   5.799
  127   1HB   LYS  16          2HB       LYS  16  -7.402  -2.603   5.556
  128   2HB   LYS  16          1HB       LYS  16  -6.720  -1.106   6.190
  129   1HG   LYS  16          2HG       LYS  16  -7.189  -2.163   8.186
  130   2HG   LYS  16          1HG       LYS  16  -8.738  -1.361   7.927
  131   1HD   LYS  16          2HD       LYS  16  -9.519  -3.457   6.741
  132   2HD   LYS  16          1HD       LYS  16  -8.032  -4.237   7.280
  133   1HE   LYS  16          2HE       LYS  16 -10.258  -3.115   9.000
  134   2HE   LYS  16          1HE       LYS  16  -9.710  -4.788   8.903
  135   1HZ   LYS  16          1HZ       LYS  16  -8.332  -2.469  10.106
  136   2HZ   LYS  16          2HZ       LYS  16  -7.482  -3.873   9.670
  137   3HZ   LYS  16          3HZ       LYS  16  -8.725  -3.954  10.825
  138    H    ALA  17           H        ALA  17  -6.866   0.633   4.760
  139    HA   ALA  17           HA       ALA  17  -7.125   2.751   6.571
  140   1HB   ALA  17          1HB       ALA  17  -5.177   2.260   4.993
  141   2HB   ALA  17          2HB       ALA  17  -5.633   3.956   5.156
  142   3HB   ALA  17          3HB       ALA  17  -6.131   3.042   3.732
  143    H    LYS  18           H        LYS  18  -8.823   1.949   3.653
  144    HA   LYS  18           HA       LYS  18 -10.086   4.572   3.412
  145   1HB   LYS  18          2HB       LYS  18 -10.219   1.985   1.893
  146   2HB   LYS  18          1HB       LYS  18 -11.507   3.174   1.698
  147   1HG   LYS  18          2HG       LYS  18  -9.888   4.881   1.044
  148   2HG   LYS  18          1HG       LYS  18  -8.553   3.766   1.336
  149   1HD   LYS  18          2HD       LYS  18  -9.284   2.314  -0.455
  150   2HD   LYS  18          1HD       LYS  18 -10.767   3.246  -0.668
  151   1HE   LYS  18          2HE       LYS  18  -9.265   3.969  -2.393
  152   2HE   LYS  18          1HE       LYS  18  -9.290   5.254  -1.187
  153   1HZ   LYS  18          1HZ       LYS  18  -7.320   3.208  -0.697
  154   2HZ   LYS  18          2HZ       LYS  18  -7.167   4.900  -0.648
  155   3HZ   LYS  18          3HZ       LYS  18  -7.063   4.075  -2.130
  156    H    ALA  19           H        ALA  19 -10.690   1.426   4.750
  157    HA   ALA  19           HA       ALA  19 -13.499   1.779   5.205
  158   1HB   ALA  19          1HB       ALA  19 -13.324  -0.266   6.531
  159   2HB   ALA  19          2HB       ALA  19 -11.564  -0.162   6.494
  160   3HB   ALA  19          3HB       ALA  19 -12.460  -0.460   5.006
  161    H    GLY  20           H        GLY  20 -10.987   1.215   7.687
  162   1HA   GLY  20          2HA       GLY  20 -12.454   3.077   9.446
  163   2HA   GLY  20          1HA       GLY  20 -11.337   1.826   9.977
  164    H    VAL  21           H        VAL  21  -9.049   2.119   9.423
  165    HA   VAL  21           HA       VAL  21  -7.728   4.247   8.397
  166    HB   VAL  21           HB       VAL  21  -8.847   5.877   9.727
  167   1HG1  VAL  21          1HG1      VAL  21  -8.829   3.740  11.726
  168   2HG1  VAL  21          2HG1      VAL  21  -9.912   5.120  11.573
  169   3HG1  VAL  21          3HG1      VAL  21  -8.371   5.299  12.409
  170   1HG2  VAL  21          1HG2      VAL  21  -6.420   5.458  11.439
  171   2HG2  VAL  21          2HG2      VAL  21  -7.034   6.942  10.712
  172   3HG2  VAL  21          3HG2      VAL  21  -6.200   5.753   9.714
  173    H    ILE  22           H        ILE  22  -6.139   2.737   8.121
  174    HA   ILE  22           HA       ILE  22  -5.129   0.980  10.064
  175    HB   ILE  22           HB       ILE  22  -3.160   0.764   8.599
  176   1HG1  ILE  22          2HG1      ILE  22  -4.392   3.006   6.966
  177   2HG1  ILE  22          1HG1      ILE  22  -3.046   3.247   8.076
  178   1HG2  ILE  22          1HG2      ILE  22  -4.325  -0.073   6.679
  179   2HG2  ILE  22          2HG2      ILE  22  -5.667   1.044   6.926
  180   3HG2  ILE  22          3HG2      ILE  22  -5.409  -0.286   8.054
  181   1HD1  ILE  22          1HD1      ILE  22  -3.045   1.318   5.736
  182   2HD1  ILE  22          2HD1      ILE  22  -1.695   1.620   6.829
  183   3HD1  ILE  22          3HD1      ILE  22  -2.260   2.897   5.752
  184    H    THR  23           H        THR  23  -2.443   1.269  10.300
  185    HA   THR  23           HA       THR  23  -2.239   3.550  12.135
  186    HB   THR  23           HB       THR  23  -0.309   1.249  11.753
  187    HG1  THR  23           HG1      THR  23  -1.389   0.303  13.454
  188   1HG2  THR  23          1HG2      THR  23  -0.621   3.488  13.738
  189   2HG2  THR  23          2HG2      THR  23   0.838   2.919  12.927
  190   3HG2  THR  23          3HG2      THR  23   0.127   1.968  14.231
  191    H    GLU  24           H        GLU  24  -0.590   5.066  12.036
  192    HA   GLU  24           HA       GLU  24   0.194   6.038   9.563
  193   1HB   GLU  24          2HB       GLU  24   0.289   7.190  11.857
  194   2HB   GLU  24          1HB       GLU  24   1.856   6.408  12.055
  195   1HG   GLU  24          2HG       GLU  24   2.150   8.663  11.134
  196   2HG   GLU  24          1HG       GLU  24   2.634   7.455   9.946
  197    H    GLU  25           H        GLU  25   1.937   3.862  11.751
  198    HA   GLU  25           HA       GLU  25   4.371   3.716  10.365
  199   1HB   GLU  25          2HB       GLU  25   3.768   2.762  12.672
  200   2HB   GLU  25          1HB       GLU  25   3.114   1.377  11.797
  201   1HG   GLU  25          2HG       GLU  25   5.353   1.190  10.623
  202   2HG   GLU  25          1HG       GLU  25   5.964   2.399  11.751
  203    H    GLU  26           H        GLU  26   1.488   1.624  10.130
  204    HA   GLU  26           HA       GLU  26   2.460  -0.018   8.048
  205   1HB   GLU  26          2HB       GLU  26   0.426  -0.435   9.530
  206   2HB   GLU  26          1HB       GLU  26  -0.442   0.700   8.499
  207   1HG   GLU  26          2HG       GLU  26  -0.916  -1.373   7.502
  208   2HG   GLU  26          1HG       GLU  26   0.420  -0.766   6.530
  209    H    LYS  27           H        LYS  27   0.603   2.995   8.050
  210    HA   LYS  27           HA       LYS  27   0.074   3.207   5.309
  211   1HB   LYS  27          2HB       LYS  27  -0.747   4.707   7.229
  212   2HB   LYS  27          1HB       LYS  27   0.783   5.563   7.057
  213   1HG   LYS  27          2HG       LYS  27   0.290   6.244   4.842
  214   2HG   LYS  27          1HG       LYS  27  -1.008   5.063   4.679
  215   1HD   LYS  27          2HD       LYS  27  -1.205   7.156   6.822
  216   2HD   LYS  27          1HD       LYS  27  -1.583   7.594   5.156
  217   1HE   LYS  27          2HE       LYS  27  -3.150   5.601   5.091
  218   2HE   LYS  27          1HE       LYS  27  -2.897   5.438   6.828
  219   1HZ   LYS  27          1HZ       LYS  27  -3.918   7.449   7.254
  220   2HZ   LYS  27          2HZ       LYS  27  -4.867   6.827   5.989
  221   3HZ   LYS  27          3HZ       LYS  27  -3.704   8.025   5.673
  222    H    ALA  28           H        ALA  28   2.926   4.065   7.207
  223    HA   ALA  28           HA       ALA  28   4.391   5.400   5.211
  224   1HB   ALA  28          1HB       ALA  28   4.841   4.929   7.814
  225   2HB   ALA  28          2HB       ALA  28   6.139   5.344   6.696
  226   3HB   ALA  28          3HB       ALA  28   5.857   3.659   7.133
  227    H    GLU  29           H        GLU  29   4.146   1.971   6.068
  228    HA   GLU  29           HA       GLU  29   6.092   0.949   4.328
  229   1HB   GLU  29          2HB       GLU  29   4.518  -0.188   6.156
  230   2HB   GLU  29          1HB       GLU  29   3.562  -0.585   4.730
  231   1HG   GLU  29          2HG       GLU  29   6.506  -1.213   5.105
  232   2HG   GLU  29          1HG       GLU  29   5.188  -2.374   5.234
  233    H    GLN  30           H        GLN  30   2.595   1.415   3.809
  234    HA   GLN  30           HA       GLN  30   2.365   0.490   1.211
  235   1HB   GLN  30          2HB       GLN  30   0.960   2.862   2.465
  236   2HB   GLN  30          1HB       GLN  30   0.449   2.039   0.991
  237   1HG   GLN  30          2HG       GLN  30   0.853   0.035   2.975
  238   2HG   GLN  30          1HG       GLN  30  -0.100   1.319   3.716
  239   1HE2  GLN  30          1HE2      GLN  30  -2.268   1.642   2.958
  240   2HE2  GLN  30          2HE2      GLN  30  -2.997   0.626   1.811
  241    H    GLN  31           H        GLN  31   3.508   3.642   2.346
  242    HA   GLN  31           HA       GLN  31   3.622   5.001  -0.096
  243   1HB   GLN  31          2HB       GLN  31   4.018   6.031   2.142
  244   2HB   GLN  31          1HB       GLN  31   5.592   5.237   2.193
  245   1HG   GLN  31          2HG       GLN  31   6.451   6.531   0.437
  246   2HG   GLN  31          1HG       GLN  31   4.848   6.950  -0.166
  247   1HE2  GLN  31          1HE2      GLN  31   6.143   7.188   3.188
  248   2HE2  GLN  31          2HE2      GLN  31   5.881   8.859   3.325
  249    H    LYS  32           H        LYS  32   5.953   2.799   1.410
  250    HA   LYS  32           HA       LYS  32   8.062   3.113  -0.421
  251   1HB   LYS  32          2HB       LYS  32   8.233   1.916   1.756
  252   2HB   LYS  32          1HB       LYS  32   7.278   0.599   1.077
  253   1HG   LYS  32          2HG       LYS  32   8.965  -0.011  -0.445
  254   2HG   LYS  32          1HG       LYS  32   9.776   1.551  -0.312
  255   1HD   LYS  32          2HD       LYS  32  10.614   1.049   1.863
  256   2HD   LYS  32          1HD       LYS  32   9.542  -0.341   2.036
  257   1HE   LYS  32          2HE       LYS  32  10.882  -1.704   0.775
  258   2HE   LYS  32          1HE       LYS  32  11.374  -0.396  -0.301
  259   1HZ   LYS  32          1HZ       LYS  32  13.285  -0.758   0.872
  260   2HZ   LYS  32          2HZ       LYS  32  12.476  -1.173   2.307
  261   3HZ   LYS  32          3HZ       LYS  32  12.576   0.452   1.824
  262    H    LEU  33           H        LEU  33   5.534   0.596  -0.324
  263    HA   LEU  33           HA       LEU  33   6.179  -0.689  -2.721
  264   1HB   LEU  33          2HB       LEU  33   3.407  -0.335  -1.555
  265   2HB   LEU  33          1HB       LEU  33   3.933  -1.607  -2.658
  266    HG   LEU  33           HG       LEU  33   5.145  -1.159   0.086
  267   1HD1  LEU  33          1HD1      LEU  33   3.835  -3.333   0.572
  268   2HD1  LEU  33          2HD1      LEU  33   2.868  -2.911  -0.841
  269   3HD1  LEU  33          3HD1      LEU  33   2.924  -1.823   0.547
  270   1HD2  LEU  33          1HD2      LEU  33   6.696  -2.367  -1.215
  271   2HD2  LEU  33          2HD2      LEU  33   5.431  -3.234  -2.086
  272   3HD2  LEU  33          3HD2      LEU  33   5.783  -3.640  -0.406
  273    H    ARG  34           H        ARG  34   3.743   1.850  -2.153
  274    HA   ARG  34           HA       ARG  34   2.806   2.189  -4.734
  275   1HB   ARG  34          2HB       ARG  34   2.030   3.314  -2.568
  276   2HB   ARG  34          1HB       ARG  34   3.301   4.499  -2.858
  277   1HG   ARG  34          2HG       ARG  34   2.274   4.732  -5.224
  278   2HG   ARG  34          1HG       ARG  34   0.871   3.907  -4.547
  279   1HD   ARG  34          2HD       ARG  34   1.994   6.604  -3.856
  280   2HD   ARG  34          1HD       ARG  34   0.323   6.144  -4.172
  281    HE   ARG  34           HE       ARG  34   0.950   4.776  -1.887
  282   1HH1  ARG  34          1HH2      ARG  34   1.153   8.082  -2.909
  283   2HH1  ARG  34          2HH2      ARG  34   0.926   8.728  -1.319
  284   1HH2  ARG  34          1HH1      ARG  34   0.658   5.622   0.196
  285   2HH2  ARG  34          2HH1      ARG  34   0.647   7.337   0.437
  286    H    GLN  35           H        GLN  35   5.554   3.852  -3.189
  287    HA   GLN  35           HA       GLN  35   6.302   5.414  -5.412
  288   1HB   GLN  35          2HB       GLN  35   7.078   5.758  -3.058
  289   2HB   GLN  35          1HB       GLN  35   8.115   4.343  -3.237
  290   1HG   GLN  35          2HG       GLN  35   9.377   5.392  -4.998
  291   2HG   GLN  35          1HG       GLN  35   8.232   6.727  -5.101
  292   1HE2  GLN  35          1HE2      GLN  35  10.017   8.250  -4.626
  293   2HE2  GLN  35          2HE2      GLN  35  10.606   8.408  -3.042
  294    H    GLU  36           H        GLU  36   7.173   2.138  -4.430
  295    HA   GLU  36           HA       GLU  36   9.255   1.730  -6.304
  296   1HB   GLU  36          2HB       GLU  36   8.738   0.305  -4.273
  297   2HB   GLU  36          1HB       GLU  36   7.406  -0.390  -5.195
  298   1HG   GLU  36          2HG       GLU  36   9.215  -1.881  -5.549
  299   2HG   GLU  36          1HG       GLU  36   9.142  -0.909  -7.014
  300    H    TYR  37           H        TYR  37   5.764   1.132  -6.441
  301    HA   TYR  37           HA       TYR  37   5.589  -0.247  -8.841
  302   1HB   TYR  37          2HB       TYR  37   3.636   0.038  -7.469
  303   2HB   TYR  37          1HB       TYR  37   3.712   1.791  -7.630
  304    HD1  TYR  37           HD1      TYR  37   2.257   2.760  -9.155
  305    HD2  TYR  37           HD2      TYR  37   3.686  -1.227  -9.876
  306    HE1  TYR  37           HE1      TYR  37   0.881   2.638 -11.214
  307    HE2  TYR  37           HE2      TYR  37   2.306  -1.350 -11.932
  308    HH   TYR  37           HH       TYR  37   0.710   1.443 -13.242
  309    H    LEU  38           H        LEU  38   5.717   3.271  -8.313
  310    HA   LEU  38           HA       LEU  38   5.375   4.079 -10.983
  311   1HB   LEU  38          2HB       LEU  38   6.531   5.293  -8.520
  312   2HB   LEU  38          1HB       LEU  38   6.977   6.033 -10.057
  313    HG   LEU  38           HG       LEU  38   4.926   7.045  -9.040
  314   1HD1  LEU  38          1HD1      LEU  38   3.935   5.663 -11.488
  315   2HD1  LEU  38          2HD1      LEU  38   5.432   6.582 -11.639
  316   3HD1  LEU  38          3HD1      LEU  38   3.957   7.383 -11.096
  317   1HD2  LEU  38          1HD2      LEU  38   4.195   4.708  -8.149
  318   2HD2  LEU  38          2HD2      LEU  38   3.491   4.492  -9.752
  319   3HD2  LEU  38          3HD2      LEU  38   2.946   5.814  -8.721
  320    H    LYS  39           H        LYS  39   8.259   3.106  -9.189
  321    HA   LYS  39           HA       LYS  39  10.170   3.764 -11.174
  322   1HB   LYS  39          2HB       LYS  39  10.518   3.133  -8.680
  323   2HB   LYS  39          1HB       LYS  39  10.486   1.466  -9.253
  324   1HG   LYS  39          2HG       LYS  39  12.754   1.907  -9.434
  325   2HG   LYS  39          1HG       LYS  39  12.218   2.400 -11.039
  326   1HD   LYS  39          2HD       LYS  39  12.033   4.740 -10.249
  327   2HD   LYS  39          1HD       LYS  39  12.604   4.239  -8.658
  328   1HE   LYS  39          2HE       LYS  39  14.649   3.269  -9.931
  329   2HE   LYS  39          1HE       LYS  39  14.117   4.290 -11.266
  330   1HZ   LYS  39          1HZ       LYS  39  14.034   5.836  -8.960
  331   2HZ   LYS  39          2HZ       LYS  39  15.096   5.989 -10.276
  332   3HZ   LYS  39          3HZ       LYS  39  15.524   5.026  -8.944
  333    H    GLY  40           H        GLY  40   7.980   1.105 -10.755
  334   1HA   GLY  40          2HA       GLY  40   9.300  -0.658 -12.634
  335   2HA   GLY  40          1HA       GLY  40   7.734  -0.916 -11.875
  336    H    PHE  41           H        PHE  41   7.818   2.172 -13.169
  337    HA   PHE  41           HA       PHE  41   7.238   1.603 -15.924
  338   1HB   PHE  41          2HB       PHE  41   4.977   1.945 -13.966
  339   2HB   PHE  41          1HB       PHE  41   4.803   2.512 -15.624
  340    HD1  PHE  41           HD1      PHE  41   5.746   0.714 -17.437
  341    HD2  PHE  41           HD2      PHE  41   4.227  -0.206 -13.525
  342    HE1  PHE  41           HE1      PHE  41   5.251  -1.601 -18.173
  343    HE2  PHE  41           HE2      PHE  41   3.734  -2.522 -14.262
  344    HZ   PHE  41           HZ       PHE  41   4.246  -3.219 -16.586
  345    H    ARG  42           H        ARG  42   8.683   3.295 -16.280
  346    HA   ARG  42           HA       ARG  42   9.414   5.460 -16.522
  347   1HB   ARG  42          2HB       ARG  42   6.424   5.671 -16.769
  348   2HB   ARG  42          1HB       ARG  42   7.429   7.115 -16.859
  349   1HG   ARG  42          2HG       ARG  42   7.127   6.316 -19.112
  350   2HG   ARG  42          1HG       ARG  42   8.789   5.955 -18.647
  351   1HD   ARG  42          2HD       ARG  42   7.529   4.063 -19.804
  352   2HD   ARG  42          1HD       ARG  42   8.291   3.652 -18.273
  353    HE   ARG  42           HE       ARG  42   6.171   3.374 -17.336
  354   1HH1  ARG  42          1HH2      ARG  42   5.986   4.912 -20.441
  355   2HH1  ARG  42          2HH2      ARG  42   4.264   4.770 -20.556
  356   1HH2  ARG  42          1HH1      ARG  42   3.914   3.192 -17.491
  357   2HH2  ARG  42          2HH1      ARG  42   3.094   3.799 -18.891
  Start of MODEL   15
    1   1H    MET   1          1HT       MET   1   7.254  -3.004 -10.563
    2   2H    MET   1          2HT       MET   1   8.479  -2.488 -11.620
    3   3H    MET   1          3HT       MET   1   8.687  -3.900 -10.700
    4    HA   MET   1           HA       MET   1   6.745  -3.491 -12.903
    5   1HB   MET   1          2HB       MET   1   9.127  -5.352 -12.633
    6   2HB   MET   1          1HB       MET   1   8.067  -5.220 -14.034
    7   1HG   MET   1          2HG       MET   1   9.865  -3.854 -14.650
    8   2HG   MET   1          1HG       MET   1   8.731  -2.685 -13.972
    9   1HE   MET   1          1HE       MET   1  12.195  -1.328 -12.901
   10   2HE   MET   1          2HE       MET   1  10.835  -1.216 -14.014
   11   3HE   MET   1          3HE       MET   1  12.080  -2.434 -14.275
   12    H    ILE   2           H        ILE   2   6.819  -4.534  -9.872
   13    HA   ILE   2           HA       ILE   2   6.034  -7.260 -10.019
   14    HB   ILE   2           HB       ILE   2   6.876  -6.089  -7.960
   15   1HG1  ILE   2          2HG1      ILE   2   4.962  -7.101  -6.469
   16   2HG1  ILE   2          1HG1      ILE   2   4.319  -7.679  -8.005
   17   1HG2  ILE   2          1HG2      ILE   2   4.052  -5.017  -7.747
   18   2HG2  ILE   2          2HG2      ILE   2   5.397  -4.051  -8.353
   19   3HG2  ILE   2          3HG2      ILE   2   5.428  -4.662  -6.700
   20   1HD1  ILE   2          1HD1      ILE   2   7.030  -8.285  -6.801
   21   2HD1  ILE   2          2HD1      ILE   2   6.613  -8.666  -8.472
   22   3HD1  ILE   2          3HD1      ILE   2   5.731  -9.426  -7.147
   23    H    SER   3           H        SER   3   4.071  -8.198 -10.300
   24    HA   SER   3           HA       SER   3   1.614  -6.681 -10.151
   25   1HB   SER   3          2HB       SER   3   0.955  -6.957 -12.467
   26   2HB   SER   3          1HB       SER   3   2.488  -6.093 -12.412
   27    HG   SER   3           HG       SER   3   3.401  -8.339 -12.608
   28    H    ASN   4           H        ASN   4   1.580  -8.453  -8.504
   29    HA   ASN   4           HA       ASN   4   0.124 -10.729  -9.602
   30   1HB   ASN   4          2HB       ASN   4   1.481 -12.418  -8.557
   31   2HB   ASN   4          1HB       ASN   4   2.544 -11.417  -9.544
   32   1HD2  ASN   4          1HD2      ASN   4   2.922  -9.184  -7.861
   33   2HD2  ASN   4          2HD2      ASN   4   3.709  -9.684  -6.442
   34    H    ALA   5           H        ALA   5   0.521 -12.139  -6.987
   35    HA   ALA   5           HA       ALA   5  -1.766 -11.323  -5.643
   36   1HB   ALA   5          1HB       ALA   5  -0.799 -12.596  -3.687
   37   2HB   ALA   5          2HB       ALA   5   0.674 -12.795  -4.637
   38   3HB   ALA   5          3HB       ALA   5  -0.844 -13.491  -5.205
   39    H    LYS   6           H        LYS   6   1.353  -9.873  -5.628
   40    HA   LYS   6           HA       LYS   6   1.284  -8.642  -3.064
   41   1HB   LYS   6          2HB       LYS   6   2.706  -7.781  -5.597
   42   2HB   LYS   6          1HB       LYS   6   3.028  -7.150  -3.980
   43   1HG   LYS   6          2HG       LYS   6   3.129 -10.118  -4.442
   44   2HG   LYS   6          1HG       LYS   6   4.498  -9.120  -4.933
   45   1HD   LYS   6          2HD       LYS   6   4.683  -8.215  -2.658
   46   2HD   LYS   6          1HD       LYS   6   3.287  -9.168  -2.151
   47   1HE   LYS   6          2HE       LYS   6   5.560 -10.610  -3.453
   48   2HE   LYS   6          1HE       LYS   6   5.776 -10.062  -1.791
   49   1HZ   LYS   6          1HZ       LYS   6   4.818 -12.081  -1.441
   50   2HZ   LYS   6          2HZ       LYS   6   3.905 -12.039  -2.873
   51   3HZ   LYS   6          3HZ       LYS   6   3.418 -11.129  -1.524
   52    H    ILE   7           H        ILE   7   0.242  -7.605  -6.289
   53    HA   ILE   7           HA       ILE   7  -0.463  -4.960  -5.730
   54    HB   ILE   7           HB       ILE   7  -1.890  -6.879  -7.592
   55   1HG1  ILE   7          2HG1      ILE   7   0.495  -6.874  -8.082
   56   2HG1  ILE   7          1HG1      ILE   7  -0.328  -5.914  -9.309
   57   1HG2  ILE   7          1HG2      ILE   7  -2.331  -4.722  -8.850
   58   2HG2  ILE   7          2HG2      ILE   7  -1.737  -3.857  -7.433
   59   3HG2  ILE   7          3HG2      ILE   7  -3.177  -4.866  -7.310
   60   1HD1  ILE   7          1HD1      ILE   7   1.479  -4.538  -8.731
   61   2HD1  ILE   7          2HD1      ILE   7   1.401  -4.983  -7.026
   62   3HD1  ILE   7          3HD1      ILE   7   0.190  -3.900  -7.712
   63    H    ALA   8           H        ALA   8  -2.486  -7.889  -5.570
   64    HA   ALA   8           HA       ALA   8  -4.829  -6.650  -4.653
   65   1HB   ALA   8          1HB       ALA   8  -3.946  -9.448  -3.920
   66   2HB   ALA   8          2HB       ALA   8  -4.567  -9.026  -5.516
   67   3HB   ALA   8          3HB       ALA   8  -5.593  -8.843  -4.095
   68    H    ARG   9           H        ARG   9  -2.006  -7.854  -2.895
   69    HA   ARG   9           HA       ARG   9  -3.079  -7.691  -0.292
   70   1HB   ARG   9          2HB       ARG   9  -0.911  -8.803  -0.942
   71   2HB   ARG   9          1HB       ARG   9  -0.195  -7.197  -1.061
   72   1HG   ARG   9          2HG       ARG   9  -1.685  -7.766   1.451
   73   2HG   ARG   9          1HG       ARG   9  -0.180  -8.660   1.227
   74   1HD   ARG   9          2HD       ARG   9  -0.507  -5.648   1.117
   75   2HD   ARG   9          1HD       ARG   9   0.280  -6.563   2.398
   76    HE   ARG   9           HE       ARG   9   1.355  -6.018  -0.271
   77   1HH1  ARG   9          1HH2      ARG   9   1.582  -7.710   2.746
   78   2HH1  ARG   9          2HH2      ARG   9   3.266  -8.067   2.568
   79   1HH2  ARG   9          1HH1      ARG   9   3.555  -6.491  -0.504
   80   2HH2  ARG   9          2HH1      ARG   9   4.379  -7.393   0.724
   81    H    ILE  10           H        ILE  10  -1.064  -5.358  -2.073
   82    HA   ILE  10           HA       ILE  10  -1.035  -3.317  -0.185
   83    HB   ILE  10           HB       ILE  10  -1.006  -3.109  -3.202
   84   1HG1  ILE  10          2HG1      ILE  10   1.367  -2.936  -1.351
   85   2HG1  ILE  10          1HG1      ILE  10   0.760  -4.511  -1.863
   86   1HG2  ILE  10          1HG2      ILE  10  -0.383  -1.132  -0.997
   87   2HG2  ILE  10          2HG2      ILE  10  -1.475  -0.924  -2.366
   88   3HG2  ILE  10          3HG2      ILE  10   0.268  -0.954  -2.627
   89   1HD1  ILE  10          1HD1      ILE  10   2.527  -3.742  -3.389
   90   2HD1  ILE  10          2HD1      ILE  10   1.622  -2.262  -3.705
   91   3HD1  ILE  10          3HD1      ILE  10   0.979  -3.817  -4.231
   92    H    ASN  11           H        ASN  11  -3.180  -3.444  -3.055
   93    HA   ASN  11           HA       ASN  11  -4.764  -1.257  -2.344
   94   1HB   ASN  11          2HB       ASN  11  -5.945  -1.728  -4.225
   95   2HB   ASN  11          1HB       ASN  11  -4.608  -2.828  -4.528
   96   1HD2  ASN  11          1HD2      ASN  11  -5.014  -5.092  -3.310
   97   2HD2  ASN  11          2HD2      ASN  11  -6.575  -5.727  -3.520
   98    H    GLU  12           H        GLU  12  -4.966  -4.597  -1.280
   99    HA   GLU  12           HA       GLU  12  -7.609  -4.593  -0.314
  100   1HB   GLU  12          2HB       GLU  12  -5.161  -6.197   0.215
  101   2HB   GLU  12          1HB       GLU  12  -6.437  -6.265   1.430
  102   1HG   GLU  12          2HG       GLU  12  -8.014  -7.127  -0.087
  103   2HG   GLU  12          1HG       GLU  12  -7.096  -6.590  -1.490
  104    H    LEU  13           H        LEU  13  -4.660  -4.314   1.680
  105    HA   LEU  13           HA       LEU  13  -5.990  -3.363   3.970
  106   1HB   LEU  13          2HB       LEU  13  -3.864  -3.027   4.909
  107   2HB   LEU  13          1HB       LEU  13  -3.622  -4.343   3.765
  108    HG   LEU  13           HG       LEU  13  -3.138  -2.201   2.148
  109   1HD1  LEU  13          1HD1      LEU  13  -3.387  -0.858   4.433
  110   2HD1  LEU  13          2HD1      LEU  13  -2.159  -0.411   3.251
  111   3HD1  LEU  13          3HD1      LEU  13  -1.720  -1.381   4.655
  112   1HD2  LEU  13          1HD2      LEU  13  -1.701  -4.211   2.509
  113   2HD2  LEU  13          2HD2      LEU  13  -1.102  -3.480   4.000
  114   3HD2  LEU  13          3HD2      LEU  13  -0.766  -2.717   2.446
  115    H    ALA  14           H        ALA  14  -4.882  -1.719   1.110
  116    HA   ALA  14           HA       ALA  14  -4.613   0.898   2.035
  117   1HB   ALA  14          1HB       ALA  14  -5.124   1.594  -0.273
  118   2HB   ALA  14          2HB       ALA  14  -5.695  -0.033  -0.632
  119   3HB   ALA  14          3HB       ALA  14  -3.998   0.237  -0.239
  120    H    ALA  15           H        ALA  15  -7.494  -0.224   0.238
  121    HA   ALA  15           HA       ALA  15  -9.134   1.906   1.083
  122   1HB   ALA  15          1HB       ALA  15  -9.906   0.832  -0.828
  123   2HB   ALA  15          2HB       ALA  15 -11.007   0.215   0.404
  124   3HB   ALA  15          3HB       ALA  15  -9.659  -0.777  -0.149
  125    H    LYS  16           H        LYS  16  -8.623  -1.308   2.446
  126    HA   LYS  16           HA       LYS  16 -10.755  -1.313   4.292
  127   1HB   LYS  16          2HB       LYS  16  -8.128  -2.751   4.101
  128   2HB   LYS  16          1HB       LYS  16  -9.086  -2.881   5.579
  129   1HG   LYS  16          2HG       LYS  16 -10.931  -3.835   4.437
  130   2HG   LYS  16          1HG       LYS  16 -10.307  -3.351   2.857
  131   1HD   LYS  16          2HD       LYS  16  -8.555  -4.971   2.939
  132   2HD   LYS  16          1HD       LYS  16  -8.821  -5.276   4.656
  133   1HE   LYS  16          2HE       LYS  16  -9.785  -6.939   2.832
  134   2HE   LYS  16          1HE       LYS  16 -10.715  -6.561   4.278
  135   1HZ   LYS  16          1HZ       LYS  16 -12.187  -6.282   2.504
  136   2HZ   LYS  16          2HZ       LYS  16 -11.040  -5.469   1.548
  137   3HZ   LYS  16          3HZ       LYS  16 -11.715  -4.703   2.905
  138    H    ALA  17           H        ALA  17  -7.298  -0.692   4.914
  139    HA   ALA  17           HA       ALA  17  -7.620   0.307   7.515
  140   1HB   ALA  17          1HB       ALA  17  -5.459   1.187   5.596
  141   2HB   ALA  17          2HB       ALA  17  -5.453  -0.398   6.372
  142   3HB   ALA  17          3HB       ALA  17  -5.368   1.064   7.353
  143    H    LYS  18           H        LYS  18  -8.370   1.691   4.466
  144    HA   LYS  18           HA       LYS  18  -8.090   4.449   5.187
  145   1HB   LYS  18          2HB       LYS  18  -8.382   3.349   2.821
  146   2HB   LYS  18          1HB       LYS  18 -10.102   3.515   3.166
  147   1HG   LYS  18          2HG       LYS  18  -9.672   5.564   2.157
  148   2HG   LYS  18          1HG       LYS  18  -9.410   5.973   3.852
  149   1HD   LYS  18          2HD       LYS  18  -7.447   6.805   2.961
  150   2HD   LYS  18          1HD       LYS  18  -6.934   5.152   3.296
  151   1HE   LYS  18          2HE       LYS  18  -6.265   5.344   1.084
  152   2HE   LYS  18          1HE       LYS  18  -7.897   4.715   0.858
  153   1HZ   LYS  18          1HZ       LYS  18  -7.534   7.614   1.062
  154   2HZ   LYS  18          2HZ       LYS  18  -8.684   6.727   0.184
  155   3HZ   LYS  18          3HZ       LYS  18  -7.089   6.852  -0.386
  156    H    ALA  19           H        ALA  19 -11.083   2.603   4.589
  157    HA   ALA  19           HA       ALA  19 -12.650   4.430   6.171
  158   1HB   ALA  19          1HB       ALA  19 -13.217   1.869   4.694
  159   2HB   ALA  19          2HB       ALA  19 -13.842   3.489   4.382
  160   3HB   ALA  19          3HB       ALA  19 -14.422   2.573   5.773
  161    H    GLY  20           H        GLY  20 -10.574   1.959   6.973
  162   1HA   GLY  20          2HA       GLY  20 -12.117   1.085   9.325
  163   2HA   GLY  20          1HA       GLY  20 -10.667   0.310   8.694
  164    H    VAL  21           H        VAL  21  -8.634   1.567   8.844
  165    HA   VAL  21           HA       VAL  21  -8.376   3.806  10.564
  166    HB   VAL  21           HB       VAL  21  -8.922   2.400  12.402
  167   1HG1  VAL  21          1HG1      VAL  21  -8.604   0.260  11.020
  168   2HG1  VAL  21          2HG1      VAL  21  -8.143   0.173  12.720
  169   3HG1  VAL  21          3HG1      VAL  21  -6.903   0.344  11.480
  170   1HG2  VAL  21          1HG2      VAL  21  -6.638   3.717  12.399
  171   2HG2  VAL  21          2HG2      VAL  21  -5.930   2.102  12.418
  172   3HG2  VAL  21          3HG2      VAL  21  -7.006   2.608  13.720
  173    H    ILE  22           H        ILE  22  -6.910   4.623   9.151
  174    HA   ILE  22           HA       ILE  22  -4.684   3.001   8.219
  175    HB   ILE  22           HB       ILE  22  -5.738   4.577   6.662
  176   1HG1  ILE  22          2HG1      ILE  22  -3.644   5.830   5.995
  177   2HG1  ILE  22          1HG1      ILE  22  -2.898   5.258   7.486
  178   1HG2  ILE  22          1HG2      ILE  22  -5.855   6.892   7.009
  179   2HG2  ILE  22          2HG2      ILE  22  -4.607   6.869   8.253
  180   3HG2  ILE  22          3HG2      ILE  22  -6.220   6.253   8.610
  181   1HD1  ILE  22          1HD1      ILE  22  -4.189   3.127   5.921
  182   2HD1  ILE  22          2HD1      ILE  22  -2.588   3.167   6.659
  183   3HD1  ILE  22          3HD1      ILE  22  -2.852   3.911   5.082
  184    H    THR  23           H        THR  23  -2.911   2.741   9.362
  185    HA   THR  23           HA       THR  23  -2.157   4.778  11.367
  186    HB   THR  23           HB       THR  23  -1.147   1.933  11.199
  187    HG1  THR  23           HG1      THR  23  -3.310   2.983  12.699
  188   1HG2  THR  23          1HG2      THR  23   0.271   3.168  12.610
  189   2HG2  THR  23          2HG2      THR  23  -0.898   2.473  13.733
  190   3HG2  THR  23          3HG2      THR  23  -1.054   4.155  13.229
  191    H    GLU  24           H        GLU  24  -0.086   5.600  11.416
  192    HA   GLU  24           HA       GLU  24   1.267   6.101   9.067
  193   1HB   GLU  24          2HB       GLU  24   2.622   5.878  11.762
  194   2HB   GLU  24          1HB       GLU  24   3.099   6.892  10.401
  195   1HG   GLU  24          2HG       GLU  24   0.608   7.176  12.105
  196   2HG   GLU  24          1HG       GLU  24   1.962   8.298  12.005
  197    H    GLU  25           H        GLU  25   1.507   3.327  11.176
  198    HA   GLU  25           HA       GLU  25   3.925   2.222  10.265
  199   1HB   GLU  25          2HB       GLU  25   2.519   1.493  12.262
  200   2HB   GLU  25          1HB       GLU  25   1.492   0.641  11.110
  201   1HG   GLU  25          2HG       GLU  25   3.001  -1.032  11.712
  202   2HG   GLU  25          1HG       GLU  25   3.757  -0.381  10.259
  203    H    GLU  26           H        GLU  26   0.631   1.145   9.362
  204    HA   GLU  26           HA       GLU  26   1.511  -0.307   7.082
  205   1HB   GLU  26          2HB       GLU  26  -1.271   0.799   7.501
  206   2HB   GLU  26          1HB       GLU  26  -0.798  -0.618   6.567
  207   1HG   GLU  26          2HG       GLU  26   0.253  -1.211   9.035
  208   2HG   GLU  26          1HG       GLU  26  -1.214  -0.338   9.473
  209    H    LYS  27           H        LYS  27   0.219   2.963   7.532
  210    HA   LYS  27           HA       LYS  27  -0.134   3.709   4.869
  211   1HB   LYS  27          2HB       LYS  27  -0.568   5.023   7.107
  212   2HB   LYS  27          1HB       LYS  27   1.056   5.650   6.824
  213   1HG   LYS  27          2HG       LYS  27   0.306   6.272   4.485
  214   2HG   LYS  27          1HG       LYS  27  -1.335   5.850   4.974
  215   1HD   LYS  27          2HD       LYS  27  -1.019   7.475   6.928
  216   2HD   LYS  27          1HD       LYS  27   0.427   8.040   6.088
  217   1HE   LYS  27          2HE       LYS  27  -1.227   9.505   5.297
  218   2HE   LYS  27          1HE       LYS  27  -1.159   8.284   4.028
  219   1HZ   LYS  27          1HZ       LYS  27  -3.199   7.557   4.514
  220   2HZ   LYS  27          2HZ       LYS  27  -3.393   9.035   5.329
  221   3HZ   LYS  27          3HZ       LYS  27  -2.952   7.640   6.191
  222    H    ALA  28           H        ALA  28   2.789   3.734   6.871
  223    HA   ALA  28           HA       ALA  28   4.522   4.901   4.955
  224   1HB   ALA  28          1HB       ALA  28   5.156   4.793   7.299
  225   2HB   ALA  28          2HB       ALA  28   6.332   3.881   6.351
  226   3HB   ALA  28          3HB       ALA  28   5.090   3.032   7.272
  227    H    GLU  29           H        GLU  29   3.567   1.574   5.663
  228    HA   GLU  29           HA       GLU  29   5.373   0.205   4.018
  229   1HB   GLU  29          2HB       GLU  29   3.762  -0.793   5.707
  230   2HB   GLU  29          1HB       GLU  29   2.499  -0.608   4.491
  231   1HG   GLU  29          2HG       GLU  29   3.181  -2.746   3.971
  232   2HG   GLU  29          1HG       GLU  29   4.306  -1.845   2.959
  233    H    GLN  30           H        GLN  30   1.935   0.737   3.217
  234    HA   GLN  30           HA       GLN  30   2.067   0.144   0.523
  235   1HB   GLN  30          2HB       GLN  30   0.166   2.046   0.446
  236   2HB   GLN  30          1HB       GLN  30  -0.121   0.442   1.115
  237   1HG   GLN  30          2HG       GLN  30  -0.085   1.192   3.301
  238   2HG   GLN  30          1HG       GLN  30   0.996   2.533   2.933
  239   1HE2  GLN  30          1HE2      GLN  30  -2.398   1.449   2.564
  240   2HE2  GLN  30          2HE2      GLN  30  -3.041   3.014   2.417
  241    H    GLN  31           H        GLN  31   2.755   3.235   2.122
  242    HA   GLN  31           HA       GLN  31   3.051   4.847  -0.149
  243   1HB   GLN  31          2HB       GLN  31   3.011   5.854   2.037
  244   2HB   GLN  31          1HB       GLN  31   4.432   4.945   2.542
  245   1HG   GLN  31          2HG       GLN  31   5.005   7.283   1.959
  246   2HG   GLN  31          1HG       GLN  31   5.810   6.134   0.894
  247   1HE2  GLN  31          1HE2      GLN  31   3.063   8.421   1.059
  248   2HE2  GLN  31          2HE2      GLN  31   2.905   8.596  -0.622
  249    H    LYS  32           H        LYS  32   5.396   2.768   1.518
  250    HA   LYS  32           HA       LYS  32   7.659   3.420  -0.022
  251   1HB   LYS  32          2HB       LYS  32   7.689   2.119   2.116
  252   2HB   LYS  32          1HB       LYS  32   7.022   0.742   1.240
  253   1HG   LYS  32          2HG       LYS  32   8.997   0.902  -0.334
  254   2HG   LYS  32          1HG       LYS  32   9.690   2.098   0.762
  255   1HD   LYS  32          2HD       LYS  32  10.658   0.164   1.603
  256   2HD   LYS  32          1HD       LYS  32   9.193   0.232   2.583
  257   1HE   LYS  32          2HE       LYS  32   8.060  -1.271   0.959
  258   2HE   LYS  32          1HE       LYS  32   9.560  -1.377   0.036
  259   1HZ   LYS  32          1HZ       LYS  32   8.799  -2.792   2.367
  260   2HZ   LYS  32          2HZ       LYS  32  10.230  -1.925   2.656
  261   3HZ   LYS  32          3HZ       LYS  32  10.147  -3.029   1.367
  262    H    LEU  33           H        LEU  33   5.634   0.482  -0.290
  263    HA   LEU  33           HA       LEU  33   6.655  -0.432  -2.719
  264   1HB   LEU  33          2HB       LEU  33   3.812  -0.745  -1.721
  265   2HB   LEU  33          1HB       LEU  33   4.625  -1.769  -2.904
  266    HG   LEU  33           HG       LEU  33   5.470  -1.412  -0.010
  267   1HD1  LEU  33          1HD1      LEU  33   4.193  -3.751  -1.461
  268   2HD1  LEU  33          2HD1      LEU  33   3.414  -2.738  -0.246
  269   3HD1  LEU  33          3HD1      LEU  33   4.765  -3.778   0.206
  270   1HD2  LEU  33          1HD2      LEU  33   7.457  -1.876  -1.190
  271   2HD2  LEU  33          2HD2      LEU  33   6.631  -2.908  -2.358
  272   3HD2  LEU  33          3HD2      LEU  33   6.902  -3.479  -0.712
  273    H    ARG  34           H        ARG  34   4.031   1.841  -2.070
  274    HA   ARG  34           HA       ARG  34   2.985   2.108  -4.650
  275   1HB   ARG  34          2HB       ARG  34   1.831   3.061  -2.766
  276   2HB   ARG  34          1HB       ARG  34   3.201   4.100  -2.383
  277   1HG   ARG  34          2HG       ARG  34   2.754   5.565  -4.118
  278   2HG   ARG  34          1HG       ARG  34   2.000   4.321  -5.115
  279   1HD   ARG  34          2HD       ARG  34  -0.055   4.540  -4.082
  280   2HD   ARG  34          1HD       ARG  34   0.650   5.028  -2.545
  281    HE   ARG  34           HE       ARG  34   0.496   7.229  -3.246
  282   1HH1  ARG  34          1HH2      ARG  34   0.292   5.078  -5.956
  283   2HH1  ARG  34          2HH2      ARG  34  -0.070   6.331  -7.095
  284   1HH2  ARG  34          1HH1      ARG  34   0.023   8.870  -4.740
  285   2HH2  ARG  34          2HH1      ARG  34  -0.211   8.475  -6.410
  286    H    GLN  35           H        GLN  35   5.553   3.999  -3.054
  287    HA   GLN  35           HA       GLN  35   6.124   5.696  -5.221
  288   1HB   GLN  35          2HB       GLN  35   6.946   6.185  -2.991
  289   2HB   GLN  35          1HB       GLN  35   7.917   4.714  -2.989
  290   1HG   GLN  35          2HG       GLN  35   9.325   5.551  -4.759
  291   2HG   GLN  35          1HG       GLN  35   8.259   6.927  -5.029
  292   1HE2  GLN  35          1HE2      GLN  35   8.822   8.817  -3.945
  293   2HE2  GLN  35          2HE2      GLN  35   9.865   8.893  -2.608
  294    H    GLU  36           H        GLU  36   7.524   2.556  -4.301
  295    HA   GLU  36           HA       GLU  36   9.458   2.476  -6.374
  296   1HB   GLU  36          2HB       GLU  36   9.659   1.043  -4.427
  297   2HB   GLU  36          1HB       GLU  36   8.144   0.231  -4.829
  298   1HG   GLU  36          2HG       GLU  36   9.058  -0.884  -6.652
  299   2HG   GLU  36          1HG       GLU  36  10.321   0.320  -6.892
  300    H    TYR  37           H        TYR  37   6.209   1.021  -6.115
  301    HA   TYR  37           HA       TYR  37   6.098  -0.334  -8.522
  302   1HB   TYR  37          2HB       TYR  37   4.312  -0.546  -6.921
  303   2HB   TYR  37          1HB       TYR  37   3.924   1.169  -7.050
  304    HD1  TYR  37           HD1      TYR  37   4.223  -1.910  -9.178
  305    HD2  TYR  37           HD2      TYR  37   2.256   1.856  -8.538
  306    HE1  TYR  37           HE1      TYR  37   2.675  -2.403 -11.051
  307    HE2  TYR  37           HE2      TYR  37   0.709   1.366 -10.414
  308    HH   TYR  37           HH       TYR  37   1.110  -1.543 -12.410
  309    H    LEU  38           H        LEU  38   5.484   3.105  -7.906
  310    HA   LEU  38           HA       LEU  38   4.567   3.827 -10.456
  311   1HB   LEU  38          2HB       LEU  38   5.702   5.225  -8.112
  312   2HB   LEU  38          1HB       LEU  38   5.926   6.060  -9.647
  313    HG   LEU  38           HG       LEU  38   3.789   6.655  -8.443
  314   1HD1  LEU  38          1HD1      LEU  38   4.248   6.546 -11.064
  315   2HD1  LEU  38          2HD1      LEU  38   2.647   6.932 -10.438
  316   3HD1  LEU  38          3HD1      LEU  38   3.006   5.297 -10.992
  317   1HD2  LEU  38          1HD2      LEU  38   2.578   4.095  -9.368
  318   2HD2  LEU  38          2HD2      LEU  38   2.172   5.092  -7.970
  319   3HD2  LEU  38          3HD2      LEU  38   3.567   4.018  -7.911
  320    H    LYS  39           H        LYS  39   7.854   3.563  -9.169
  321    HA   LYS  39           HA       LYS  39   9.198   4.592 -11.448
  322   1HB   LYS  39          2HB       LYS  39  10.114   2.673  -9.290
  323   2HB   LYS  39          1HB       LYS  39  11.180   3.387 -10.499
  324   1HG   LYS  39          2HG       LYS  39   9.426   5.240  -8.946
  325   2HG   LYS  39          1HG       LYS  39  10.809   4.531  -8.110
  326   1HD   LYS  39          2HD       LYS  39  12.363   5.537  -9.537
  327   2HD   LYS  39          1HD       LYS  39  11.187   5.738 -10.838
  328   1HE   LYS  39          2HE       LYS  39  11.689   7.901  -9.767
  329   2HE   LYS  39          1HE       LYS  39  10.005   7.449  -9.511
  330   1HZ   LYS  39          1HZ       LYS  39  12.104   6.758  -7.551
  331   2HZ   LYS  39          2HZ       LYS  39  10.422   6.831  -7.322
  332   3HZ   LYS  39          3HZ       LYS  39  11.321   8.262  -7.510
  333    H    GLY  40           H        GLY  40   7.981   1.425 -10.573
  334   1HA   GLY  40          2HA       GLY  40   9.155   0.188 -12.962
  335   2HA   GLY  40          1HA       GLY  40   8.330  -0.652 -11.653
  336    H    PHE  41           H        PHE  41   6.559   2.056 -12.435
  337    HA   PHE  41           HA       PHE  41   5.167   1.258 -14.774
  338   1HB   PHE  41          2HB       PHE  41   4.509  -0.531 -13.002
  339   2HB   PHE  41          1HB       PHE  41   3.545   0.754 -12.288
  340    HD1  PHE  41           HD1      PHE  41   4.172  -1.027 -15.517
  341    HD2  PHE  41           HD2      PHE  41   1.431   1.303 -13.166
  342    HE1  PHE  41           HE1      PHE  41   2.394  -1.409 -17.205
  343    HE2  PHE  41           HE2      PHE  41  -0.342   0.922 -14.856
  344    HZ   PHE  41           HZ       PHE  41   0.137  -0.433 -16.875
  345    H    ARG  42           H        ARG  42   5.659   3.565 -14.928
  346    HA   ARG  42           HA       ARG  42   4.371   5.445 -13.180
  347   1HB   ARG  42          2HB       ARG  42   6.434   6.000 -14.432
  348   2HB   ARG  42          1HB       ARG  42   5.540   5.858 -15.944
  349   1HG   ARG  42          2HG       ARG  42   5.604   8.198 -15.373
  350   2HG   ARG  42          1HG       ARG  42   3.959   7.632 -15.081
  351   1HD   ARG  42          2HD       ARG  42   4.098   8.135 -12.890
  352   2HD   ARG  42          1HD       ARG  42   5.610   7.247 -12.723
  353    HE   ARG  42           HE       ARG  42   5.313  10.104 -13.123
  354   1HH1  ARG  42          1HH2      ARG  42   7.366   7.325 -13.394
  355   2HH1  ARG  42          2HH2      ARG  42   8.836   8.237 -13.353
  356   1HH2  ARG  42          1HH1      ARG  42   7.244  11.300 -13.074
  357   2HH2  ARG  42          2HH1      ARG  42   8.768  10.481 -13.173
  Start of MODEL   16
    1   1H    MET   1          1HT       MET   1   5.919 -13.740 -14.345
    2   2H    MET   1          2HT       MET   1   5.251 -14.994 -15.276
    3   3H    MET   1          3HT       MET   1   4.839 -14.840 -13.635
    4    HA   MET   1           HA       MET   1   4.284 -12.639 -15.511
    5   1HB   MET   1          2HB       MET   1   1.984 -13.649 -15.769
    6   2HB   MET   1          1HB       MET   1   3.260 -14.548 -16.589
    7   1HG   MET   1          2HG       MET   1   3.254 -16.267 -14.991
    8   2HG   MET   1          1HG       MET   1   2.471 -15.262 -13.770
    9   1HE   MET   1          1HE       MET   1   1.787 -18.270 -14.821
   10   2HE   MET   1          2HE       MET   1   0.030 -18.247 -14.685
   11   3HE   MET   1          3HE       MET   1   1.016 -17.516 -13.420
   12    H    ILE   2           H        ILE   2   2.095 -11.682 -14.697
   13    HA   ILE   2           HA       ILE   2   2.367 -11.333 -11.794
   14    HB   ILE   2           HB       ILE   2   0.803  -9.733 -13.835
   15   1HG1  ILE   2          2HG1      ILE   2   3.301  -8.916 -12.334
   16   2HG1  ILE   2          1HG1      ILE   2   3.380  -9.703 -13.910
   17   1HG2  ILE   2          1HG2      ILE   2   0.994  -8.081 -11.764
   18   2HG2  ILE   2          2HG2      ILE   2   1.115  -9.588 -10.857
   19   3HG2  ILE   2          3HG2      ILE   2  -0.306  -9.267 -11.850
   20   1HD1  ILE   2          1HD1      ILE   2   3.368  -7.110 -13.854
   21   2HD1  ILE   2          2HD1      ILE   2   1.651  -7.268 -13.482
   22   3HD1  ILE   2          3HD1      ILE   2   2.290  -7.914 -14.994
   23    H    SER   3           H        SER   3   1.160 -12.641 -10.597
   24    HA   SER   3           HA       SER   3  -1.359 -13.717 -11.582
   25   1HB   SER   3          2HB       SER   3   0.135 -15.193 -10.336
   26   2HB   SER   3          1HB       SER   3   0.117 -14.094  -8.961
   27    HG   SER   3           HG       SER   3  -2.380 -14.795  -9.836
   28    H    ASN   4           H        ASN   4  -0.898 -10.797 -10.930
   29    HA   ASN   4           HA       ASN   4  -2.064  -9.047 -10.020
   30   1HB   ASN   4          2HB       ASN   4  -4.195 -11.184  -9.768
   31   2HB   ASN   4          1HB       ASN   4  -4.472  -9.465  -9.497
   32   1HD2  ASN   4          1HD2      ASN   4  -2.146 -10.163 -11.984
   33   2HD2  ASN   4          2HD2      ASN   4  -3.173  -9.877 -13.305
   34    H    ALA   5           H        ALA   5  -0.472 -10.959  -8.322
   35    HA   ALA   5           HA       ALA   5  -1.764 -10.987  -5.745
   36   1HB   ALA   5          1HB       ALA   5   0.774 -11.537  -5.125
   37   2HB   ALA   5          2HB       ALA   5   0.859 -11.852  -6.859
   38   3HB   ALA   5          3HB       ALA   5  -0.290 -12.739  -5.856
   39    H    LYS   6           H        LYS   6   0.473  -8.899  -7.457
   40    HA   LYS   6           HA       LYS   6   1.369  -7.415  -5.192
   41   1HB   LYS   6          2HB       LYS   6   2.370  -7.544  -7.590
   42   2HB   LYS   6          1HB       LYS   6   1.211  -6.269  -7.966
   43   1HG   LYS   6          2HG       LYS   6   2.135  -4.826  -6.263
   44   2HG   LYS   6          1HG       LYS   6   3.164  -6.122  -5.655
   45   1HD   LYS   6          2HD       LYS   6   4.314  -6.191  -7.876
   46   2HD   LYS   6          1HD       LYS   6   3.353  -4.801  -8.378
   47   1HE   LYS   6          2HE       LYS   6   5.612  -4.147  -7.542
   48   2HE   LYS   6          1HE       LYS   6   4.310  -3.444  -6.584
   49   1HZ   LYS   6          1HZ       LYS   6   4.999  -4.523  -4.790
   50   2HZ   LYS   6          2HZ       LYS   6   6.394  -4.966  -5.651
   51   3HZ   LYS   6          3HZ       LYS   6   5.054  -6.009  -5.603
   52    H    ILE   7           H        ILE   7  -0.964  -6.573  -7.771
   53    HA   ILE   7           HA       ILE   7  -1.899  -4.187  -6.671
   54    HB   ILE   7           HB       ILE   7  -3.268  -6.256  -8.403
   55   1HG1  ILE   7          2HG1      ILE   7  -2.271  -3.461  -9.047
   56   2HG1  ILE   7          1HG1      ILE   7  -1.297  -4.913  -9.278
   57   1HG2  ILE   7          1HG2      ILE   7  -4.874  -4.294  -8.863
   58   2HG2  ILE   7          2HG2      ILE   7  -4.257  -3.590  -7.369
   59   3HG2  ILE   7          3HG2      ILE   7  -5.082  -5.148  -7.334
   60   1HD1  ILE   7          1HD1      ILE   7  -2.435  -4.284 -11.374
   61   2HD1  ILE   7          2HD1      ILE   7  -3.996  -4.379 -10.559
   62   3HD1  ILE   7          3HD1      ILE   7  -3.028  -5.837 -10.783
   63    H    ALA   8           H        ALA   8  -3.100  -7.504  -6.218
   64    HA   ALA   8           HA       ALA   8  -5.283  -6.964  -4.575
   65   1HB   ALA   8          1HB       ALA   8  -4.876  -9.281  -3.662
   66   2HB   ALA   8          2HB       ALA   8  -3.384  -9.319  -4.601
   67   3HB   ALA   8          3HB       ALA   8  -4.938  -9.190  -5.422
   68    H    ARG   9           H        ARG   9  -1.868  -7.436  -3.711
   69    HA   ARG   9           HA       ARG   9  -2.181  -7.254  -0.910
   70   1HB   ARG   9          2HB       ARG   9  -0.112  -7.955  -2.348
   71   2HB   ARG   9          1HB       ARG   9   0.268  -6.234  -2.327
   72   1HG   ARG   9          2HG       ARG   9  -0.116  -6.434   0.253
   73   2HG   ARG   9          1HG       ARG   9   0.116  -8.161  -0.020
   74   1HD   ARG   9          2HD       ARG   9   2.249  -7.455  -1.316
   75   2HD   ARG   9          1HD       ARG   9   2.057  -5.906  -0.502
   76    HE   ARG   9           HE       ARG   9   2.820  -6.908   1.439
   77   1HH1  ARG   9          1HH2      ARG   9   1.694  -9.314  -0.790
   78   2HH1  ARG   9          2HH2      ARG   9   2.235 -10.650   0.169
   79   1HH2  ARG   9          1HH1      ARG   9   3.530  -8.655   2.696
   80   2HH2  ARG   9          2HH1      ARG   9   3.260 -10.276   2.151
   81    H    ILE  10           H        ILE  10  -1.402  -4.802  -3.356
   82    HA   ILE  10           HA       ILE  10  -1.078  -2.598  -1.683
   83    HB   ILE  10           HB       ILE  10  -2.035  -2.809  -4.536
   84   1HG1  ILE  10          2HG1      ILE  10   0.577  -1.806  -3.357
   85   2HG1  ILE  10          1HG1      ILE  10   0.333  -3.464  -3.903
   86   1HG2  ILE  10          1HG2      ILE  10  -1.294  -0.283  -4.468
   87   2HG2  ILE  10          2HG2      ILE  10  -1.660  -0.419  -2.748
   88   3HG2  ILE  10          3HG2      ILE  10  -2.919  -0.723  -3.944
   89   1HD1  ILE  10          1HD1      ILE  10  -0.526  -2.199  -6.105
   90   2HD1  ILE  10          2HD1      ILE  10   1.179  -2.570  -5.851
   91   3HD1  ILE  10          3HD1      ILE  10   0.568  -0.954  -5.502
   92    H    ASN  11           H        ASN  11  -4.046  -3.315  -3.576
   93    HA   ASN  11           HA       ASN  11  -5.618  -1.366  -2.322
   94   1HB   ASN  11          2HB       ASN  11  -7.577  -2.727  -3.155
   95   2HB   ASN  11          1HB       ASN  11  -6.402  -2.261  -4.379
   96   1HD2  ASN  11          1HD2      ASN  11  -6.850  -5.014  -2.070
   97   2HD2  ASN  11          2HD2      ASN  11  -6.454  -6.208  -3.208
   98    H    GLU  12           H        GLU  12  -4.808  -4.614  -1.288
   99    HA   GLU  12           HA       GLU  12  -6.875  -5.012   0.586
  100   1HB   GLU  12          2HB       GLU  12  -5.312  -6.795  -0.105
  101   2HB   GLU  12          1HB       GLU  12  -3.999  -5.966   0.730
  102   1HG   GLU  12          2HG       GLU  12  -5.150  -6.219   2.871
  103   2HG   GLU  12          1HG       GLU  12  -6.543  -6.937   2.069
  104    H    LEU  13           H        LEU  13  -3.639  -3.594   0.963
  105    HA   LEU  13           HA       LEU  13  -3.843  -2.932   3.692
  106   1HB   LEU  13          2HB       LEU  13  -2.124  -2.129   1.408
  107   2HB   LEU  13          1HB       LEU  13  -2.181  -1.014   2.774
  108    HG   LEU  13           HG       LEU  13  -1.815  -3.944   3.312
  109   1HD1  LEU  13          1HD1      LEU  13  -0.131  -3.622   1.646
  110   2HD1  LEU  13          2HD1      LEU  13   0.695  -3.467   3.196
  111   3HD1  LEU  13          3HD1      LEU  13   0.282  -2.023   2.270
  112   1HD2  LEU  13          1HD2      LEU  13  -0.512  -3.016   5.211
  113   2HD2  LEU  13          2HD2      LEU  13  -2.151  -2.365   5.172
  114   3HD2  LEU  13          3HD2      LEU  13  -0.799  -1.387   4.600
  115    H    ALA  14           H        ALA  14  -4.377  -0.927   0.795
  116    HA   ALA  14           HA       ALA  14  -5.184   1.413   2.094
  117   1HB   ALA  14          1HB       ALA  14  -4.645   1.363  -0.285
  118   2HB   ALA  14          2HB       ALA  14  -6.276   1.994  -0.051
  119   3HB   ALA  14          3HB       ALA  14  -6.040   0.333  -0.600
  120    H    ALA  15           H        ALA  15  -7.016  -1.473   1.203
  121    HA   ALA  15           HA       ALA  15  -9.614  -0.493   1.632
  122   1HB   ALA  15          1HB       ALA  15  -8.609  -3.297   2.164
  123   2HB   ALA  15          2HB       ALA  15  -9.086  -2.685   0.581
  124   3HB   ALA  15          3HB       ALA  15 -10.280  -2.818   1.872
  125    H    LYS  16           H        LYS  16  -7.260  -1.913   3.859
  126    HA   LYS  16           HA       LYS  16  -8.904  -1.999   6.153
  127   1HB   LYS  16          2HB       LYS  16  -5.989  -2.103   5.598
  128   2HB   LYS  16          1HB       LYS  16  -6.451  -1.606   7.226
  129   1HG   LYS  16          2HG       LYS  16  -7.950  -3.634   7.334
  130   2HG   LYS  16          1HG       LYS  16  -7.252  -4.161   5.803
  131   1HD   LYS  16          2HD       LYS  16  -5.720  -3.646   8.371
  132   2HD   LYS  16          1HD       LYS  16  -6.088  -5.231   7.689
  133   1HE   LYS  16          2HE       LYS  16  -4.252  -3.102   6.579
  134   2HE   LYS  16          1HE       LYS  16  -3.860  -4.768   6.997
  135   1HZ   LYS  16          1HZ       LYS  16  -4.062  -4.663   4.658
  136   2HZ   LYS  16          2HZ       LYS  16  -5.534  -3.821   4.743
  137   3HZ   LYS  16          3HZ       LYS  16  -5.454  -5.448   5.223
  138    H    ALA  17           H        ALA  17  -6.541   0.411   5.035
  139    HA   ALA  17           HA       ALA  17  -6.993   2.336   7.034
  140   1HB   ALA  17          1HB       ALA  17  -5.979   2.473   4.202
  141   2HB   ALA  17          2HB       ALA  17  -5.096   2.727   5.708
  142   3HB   ALA  17          3HB       ALA  17  -6.232   3.949   5.134
  143    H    LYS  18           H        LYS  18  -8.949   1.254   4.449
  144    HA   LYS  18           HA       LYS  18 -10.545   3.704   4.302
  145   1HB   LYS  18          2HB       LYS  18  -9.969   1.855   2.425
  146   2HB   LYS  18          1HB       LYS  18 -11.488   1.190   3.022
  147   1HG   LYS  18          2HG       LYS  18 -11.118   4.067   2.134
  148   2HG   LYS  18          1HG       LYS  18 -11.790   2.791   1.119
  149   1HD   LYS  18          2HD       LYS  18 -13.506   2.400   2.972
  150   2HD   LYS  18          1HD       LYS  18 -12.937   3.909   3.685
  151   1HE   LYS  18          2HE       LYS  18 -13.515   5.134   1.656
  152   2HE   LYS  18          1HE       LYS  18 -13.987   3.636   0.855
  153   1HZ   LYS  18          1HZ       LYS  18 -15.802   5.064   1.919
  154   2HZ   LYS  18          2HZ       LYS  18 -15.237   4.455   3.400
  155   3HZ   LYS  18          3HZ       LYS  18 -15.833   3.395   2.215
  156    H    ALA  19           H        ALA  19 -10.967   0.309   5.281
  157    HA   ALA  19           HA       ALA  19 -13.616   0.678   6.282
  158   1HB   ALA  19          1HB       ALA  19 -12.699  -1.515   5.541
  159   2HB   ALA  19          2HB       ALA  19 -13.383  -1.570   7.165
  160   3HB   ALA  19          3HB       ALA  19 -11.633  -1.509   6.944
  161    H    GLY  20           H        GLY  20 -10.436   0.345   7.875
  162   1HA   GLY  20          2HA       GLY  20 -11.581   0.932  10.476
  163   2HA   GLY  20          1HA       GLY  20  -9.884   0.632  10.122
  164    H    VAL  21           H        VAL  21  -8.687   2.393   9.021
  165    HA   VAL  21           HA       VAL  21  -9.608   5.008   8.721
  166    HB   VAL  21           HB       VAL  21 -10.073   5.232  11.027
  167   1HG1  VAL  21          1HG1      VAL  21  -7.456   3.776  11.488
  168   2HG1  VAL  21          2HG1      VAL  21  -9.077   3.218  11.897
  169   3HG1  VAL  21          3HG1      VAL  21  -8.363   4.571  12.772
  170   1HG2  VAL  21          1HG2      VAL  21  -7.223   6.203  11.005
  171   2HG2  VAL  21          2HG2      VAL  21  -8.655   6.984  11.674
  172   3HG2  VAL  21          3HG2      VAL  21  -8.413   6.934   9.928
  173    H    ILE  22           H        ILE  22  -6.908   3.102   9.952
  174    HA   ILE  22           HA       ILE  22  -4.937   2.803   8.536
  175    HB   ILE  22           HB       ILE  22  -5.592   4.819   7.096
  176   1HG1  ILE  22          2HG1      ILE  22  -2.692   4.902   7.897
  177   2HG1  ILE  22          1HG1      ILE  22  -3.364   3.451   7.154
  178   1HG2  ILE  22          1HG2      ILE  22  -5.213   6.957   7.824
  179   2HG2  ILE  22          2HG2      ILE  22  -3.766   6.498   8.721
  180   3HG2  ILE  22          3HG2      ILE  22  -5.360   6.238   9.427
  181   1HD1  ILE  22          1HD1      ILE  22  -3.545   6.236   5.975
  182   2HD1  ILE  22          2HD1      ILE  22  -4.116   4.747   5.224
  183   3HD1  ILE  22          3HD1      ILE  22  -2.389   5.001   5.472
  184    H    THR  23           H        THR  23  -2.687   3.419   9.157
  185    HA   THR  23           HA       THR  23  -2.468   4.637  11.824
  186    HB   THR  23           HB       THR  23  -1.051   2.745  12.585
  187    HG1  THR  23           HG1      THR  23  -2.008   1.542  10.201
  188   1HG2  THR  23          1HG2      THR  23  -2.859   1.281  13.131
  189   2HG2  THR  23          2HG2      THR  23  -3.758   1.739  11.686
  190   3HG2  THR  23          3HG2      THR  23  -3.563   2.893  13.004
  191    H    GLU  24           H        GLU  24  -0.341   5.351  12.332
  192    HA   GLU  24           HA       GLU  24   1.090   6.591  10.324
  193   1HB   GLU  24          2HB       GLU  24   1.297   6.891  12.864
  194   2HB   GLU  24          1HB       GLU  24   2.414   5.528  12.820
  195   1HG   GLU  24          2HG       GLU  24   3.844   7.382  12.600
  196   2HG   GLU  24          1HG       GLU  24   3.619   6.852  10.936
  197    H    GLU  25           H        GLU  25   1.593   3.374  11.711
  198    HA   GLU  25           HA       GLU  25   3.966   2.706  10.350
  199   1HB   GLU  25          2HB       GLU  25   1.754   0.809  11.178
  200   2HB   GLU  25          1HB       GLU  25   3.452   0.409  10.921
  201   1HG   GLU  25          2HG       GLU  25   2.479   2.391  13.003
  202   2HG   GLU  25          1HG       GLU  25   2.825   0.697  13.345
  203    H    GLU  26           H        GLU  26   0.561   2.034   9.521
  204    HA   GLU  26           HA       GLU  26   1.071   0.709   7.079
  205   1HB   GLU  26          2HB       GLU  26  -1.320   2.154   8.204
  206   2HB   GLU  26          1HB       GLU  26  -1.339   1.503   6.565
  207   1HG   GLU  26          2HG       GLU  26  -0.734  -0.732   7.461
  208   2HG   GLU  26          1HG       GLU  26  -0.776  -0.073   9.095
  209    H    LYS  27           H        LYS  27   0.547   4.112   7.872
  210    HA   LYS  27           HA       LYS  27   0.268   5.211   5.346
  211   1HB   LYS  27          2HB       LYS  27   0.177   6.376   7.630
  212   2HB   LYS  27          1HB       LYS  27   1.932   6.501   7.511
  213   1HG   LYS  27          2HG       LYS  27   1.326   8.508   6.521
  214   2HG   LYS  27          1HG       LYS  27   1.361   7.464   5.099
  215   1HD   LYS  27          2HD       LYS  27  -0.720   8.508   4.877
  216   2HD   LYS  27          1HD       LYS  27  -1.152   7.008   5.697
  217   1HE   LYS  27          2HE       LYS  27  -0.736   8.412   7.883
  218   2HE   LYS  27          1HE       LYS  27  -0.986   9.791   6.813
  219   1HZ   LYS  27          1HZ       LYS  27  -2.862   7.582   7.413
  220   2HZ   LYS  27          2HZ       LYS  27  -3.071   8.607   6.074
  221   3HZ   LYS  27          3HZ       LYS  27  -3.091   9.246   7.648
  222    H    ALA  28           H        ALA  28   3.296   4.620   7.134
  223    HA   ALA  28           HA       ALA  28   5.046   5.512   5.107
  224   1HB   ALA  28          1HB       ALA  28   6.768   4.210   6.338
  225   2HB   ALA  28          2HB       ALA  28   5.490   3.495   7.322
  226   3HB   ALA  28          3HB       ALA  28   5.801   5.230   7.404
  227    H    GLU  29           H        GLU  29   3.831   2.270   5.911
  228    HA   GLU  29           HA       GLU  29   5.269   0.808   4.016
  229   1HB   GLU  29          2HB       GLU  29   3.984  -0.249   5.817
  230   2HB   GLU  29          1HB       GLU  29   2.478   0.282   5.069
  231   1HG   GLU  29          2HG       GLU  29   2.941  -2.055   4.473
  232   2HG   GLU  29          1HG       GLU  29   3.035  -1.034   3.040
  233    H    GLN  30           H        GLN  30   1.952   2.102   3.732
  234    HA   GLN  30           HA       GLN  30   1.346   1.345   1.161
  235   1HB   GLN  30          2HB       GLN  30   0.696   4.018   2.425
  236   2HB   GLN  30          1HB       GLN  30  -0.152   3.282   1.067
  237   1HG   GLN  30          2HG       GLN  30   0.000   1.386   3.236
  238   2HG   GLN  30          1HG       GLN  30  -0.665   2.904   3.832
  239   1HE2  GLN  30          1HE2      GLN  30  -1.024   0.911   0.827
  240   2HE2  GLN  30          2HE2      GLN  30  -2.718   1.028   0.792
  241    H    GLN  31           H        GLN  31   3.029   4.335   2.131
  242    HA   GLN  31           HA       GLN  31   3.466   5.355  -0.448
  243   1HB   GLN  31          2HB       GLN  31   3.803   6.558   1.757
  244   2HB   GLN  31          1HB       GLN  31   5.332   5.696   1.906
  245   1HG   GLN  31          2HG       GLN  31   5.851   7.810   0.906
  246   2HG   GLN  31          1HG       GLN  31   5.946   6.618  -0.387
  247   1HE2  GLN  31          1HE2      GLN  31   3.030   8.152   1.066
  248   2HE2  GLN  31          2HE2      GLN  31   2.482   8.830  -0.391
  249    H    LYS  32           H        LYS  32   5.313   3.069   1.500
  250    HA   LYS  32           HA       LYS  32   7.648   2.922  -0.048
  251   1HB   LYS  32          2HB       LYS  32   6.954   1.833   2.271
  252   2HB   LYS  32          1HB       LYS  32   6.557   0.456   1.246
  253   1HG   LYS  32          2HG       LYS  32   8.802   0.363   0.373
  254   2HG   LYS  32          1HG       LYS  32   9.227   1.886   1.154
  255   1HD   LYS  32          2HD       LYS  32   8.217  -0.368   2.858
  256   2HD   LYS  32          1HD       LYS  32   9.881  -0.429   2.274
  257   1HE   LYS  32          2HE       LYS  32  10.425   1.654   3.330
  258   2HE   LYS  32          1HE       LYS  32   8.730   1.997   3.676
  259   1HZ   LYS  32          1HZ       LYS  32  10.598   0.325   5.101
  260   2HZ   LYS  32          2HZ       LYS  32   9.082  -0.400   4.844
  261   3HZ   LYS  32          3HZ       LYS  32   9.188   1.092   5.652
  262    H    LEU  33           H        LEU  33   4.839   0.714  -0.099
  263    HA   LEU  33           HA       LEU  33   5.609  -0.798  -2.319
  264   1HB   LEU  33          2HB       LEU  33   2.748  -0.116  -1.618
  265   2HB   LEU  33          1HB       LEU  33   3.349  -1.572  -2.410
  266    HG   LEU  33           HG       LEU  33   3.796  -0.727   0.465
  267   1HD1  LEU  33          1HD1      LEU  33   2.434  -3.089  -0.853
  268   2HD1  LEU  33          2HD1      LEU  33   1.670  -1.822   0.105
  269   3HD1  LEU  33          3HD1      LEU  33   2.754  -2.979   0.878
  270   1HD2  LEU  33          1HD2      LEU  33   5.013  -3.023   0.515
  271   2HD2  LEU  33          2HD2      LEU  33   5.888  -1.642  -0.147
  272   3HD2  LEU  33          3HD2      LEU  33   5.153  -2.824  -1.233
  273    H    ARG  34           H        ARG  34   3.869   2.268  -2.125
  274    HA   ARG  34           HA       ARG  34   3.121   2.426  -4.859
  275   1HB   ARG  34          2HB       ARG  34   3.342   4.370  -2.595
  276   2HB   ARG  34          1HB       ARG  34   3.166   4.995  -4.234
  277   1HG   ARG  34          2HG       ARG  34   1.333   2.779  -3.458
  278   2HG   ARG  34          1HG       ARG  34   1.046   4.342  -2.696
  279   1HD   ARG  34          2HD       ARG  34   1.408   4.048  -5.685
  280   2HD   ARG  34          1HD       ARG  34  -0.169   3.920  -4.912
  281    HE   ARG  34           HE       ARG  34   1.117   6.305  -4.066
  282   1HH1  ARG  34          1HH2      ARG  34  -0.382   4.839  -6.833
  283   2HH1  ARG  34          2HH2      ARG  34  -0.927   6.342  -7.498
  284   1HH2  ARG  34          1HH1      ARG  34   0.413   8.268  -4.949
  285   2HH2  ARG  34          2HH1      ARG  34  -0.467   8.279  -6.440
  286    H    GLN  35           H        GLN  35   5.982   3.503  -3.071
  287    HA   GLN  35           HA       GLN  35   7.201   4.988  -5.133
  288   1HB   GLN  35          2HB       GLN  35   7.923   5.007  -2.744
  289   2HB   GLN  35          1HB       GLN  35   8.566   3.381  -2.954
  290   1HG   GLN  35          2HG       GLN  35   9.412   5.638  -4.771
  291   2HG   GLN  35          1HG       GLN  35  10.203   5.373  -3.220
  292   1HE2  GLN  35          1HE2      GLN  35  10.085   2.461  -3.236
  293   2HE2  GLN  35          2HE2      GLN  35  11.128   1.922  -4.459
  294    H    GLU  36           H        GLU  36   7.610   1.588  -4.161
  295    HA   GLU  36           HA       GLU  36   9.410   0.887  -6.237
  296   1HB   GLU  36          2HB       GLU  36   9.038  -0.418  -4.126
  297   2HB   GLU  36          1HB       GLU  36   7.481  -0.929  -4.774
  298   1HG   GLU  36          2HG       GLU  36   8.782  -1.764  -6.824
  299   2HG   GLU  36          1HG       GLU  36  10.237  -1.540  -5.856
  300    H    TYR  37           H        TYR  37   5.895   0.840  -5.957
  301    HA   TYR  37           HA       TYR  37   5.186  -0.641  -8.193
  302   1HB   TYR  37          2HB       TYR  37   3.601   0.261  -6.489
  303   2HB   TYR  37          1HB       TYR  37   3.797   1.862  -7.200
  304    HD1  TYR  37           HD1      TYR  37   3.093  -1.658  -8.326
  305    HD2  TYR  37           HD2      TYR  37   2.216   2.523  -8.773
  306    HE1  TYR  37           HE1      TYR  37   1.371  -2.200 -10.025
  307    HE2  TYR  37           HE2      TYR  37   0.494   1.980 -10.471
  308    HH   TYR  37           HH       TYR  37  -0.105   0.226 -11.986
  309    H    LEU  38           H        LEU  38   5.638   2.901  -8.024
  310    HA   LEU  38           HA       LEU  38   5.303   3.399 -10.772
  311   1HB   LEU  38          2HB       LEU  38   6.399   4.863  -8.443
  312   2HB   LEU  38          1HB       LEU  38   7.003   5.386 -10.014
  313    HG   LEU  38           HG       LEU  38   4.927   6.600  -9.263
  314   1HD1  LEU  38          1HD1      LEU  38   5.644   5.722 -11.767
  315   2HD1  LEU  38          2HD1      LEU  38   4.344   6.864 -11.438
  316   3HD1  LEU  38          3HD1      LEU  38   3.980   5.151 -11.646
  317   1HD2  LEU  38          1HD2      LEU  38   2.883   5.505  -8.987
  318   2HD2  LEU  38          2HD2      LEU  38   4.000   4.326  -8.303
  319   3HD2  LEU  38          3HD2      LEU  38   3.384   4.111  -9.943
  320    H    LYS  39           H        LYS  39   8.171   2.546  -8.883
  321    HA   LYS  39           HA       LYS  39  10.074   2.936 -10.954
  322   1HB   LYS  39          2HB       LYS  39  10.461   2.599  -8.415
  323   2HB   LYS  39          1HB       LYS  39  10.372   0.875  -8.776
  324   1HG   LYS  39          2HG       LYS  39  12.196   1.083 -10.393
  325   2HG   LYS  39          1HG       LYS  39  12.252   2.828 -10.142
  326   1HD   LYS  39          2HD       LYS  39  13.071   2.598  -7.927
  327   2HD   LYS  39          1HD       LYS  39  12.623   0.893  -7.851
  328   1HE   LYS  39          2HE       LYS  39  15.115   1.416  -8.218
  329   2HE   LYS  39          1HE       LYS  39  14.378   0.250  -9.315
  330   1HZ   LYS  39          1HZ       LYS  39  14.265   3.062 -10.086
  331   2HZ   LYS  39          2HZ       LYS  39  14.468   1.679 -11.051
  332   3HZ   LYS  39          3HZ       LYS  39  15.780   2.308 -10.171
  333    H    GLY  40           H        GLY  40   7.991   0.251 -10.051
  334   1HA   GLY  40          2HA       GLY  40   9.216  -1.613 -11.901
  335   2HA   GLY  40          1HA       GLY  40   7.763  -1.887 -10.943
  336    H    PHE  41           H        PHE  41   7.469   1.060 -12.443
  337    HA   PHE  41           HA       PHE  41   6.735   0.362 -15.091
  338   1HB   PHE  41          2HB       PHE  41   4.911  -0.753 -13.577
  339   2HB   PHE  41          1HB       PHE  41   4.303   0.891 -13.405
  340    HD1  PHE  41           HD1      PHE  41   3.145   1.981 -15.184
  341    HD2  PHE  41           HD2      PHE  41   5.167  -1.745 -15.887
  342    HE1  PHE  41           HE1      PHE  41   2.078   1.820 -17.417
  343    HE2  PHE  41           HE2      PHE  41   4.100  -1.904 -18.119
  344    HZ   PHE  41           HZ       PHE  41   2.557  -0.120 -18.886
  345    H    ARG  42           H        ARG  42   7.753   2.257 -15.634
  346    HA   ARG  42           HA       ARG  42   6.901   4.777 -14.432
  347   1HB   ARG  42          2HB       ARG  42   8.774   4.610 -16.764
  348   2HB   ARG  42          1HB       ARG  42   8.776   5.732 -15.404
  349   1HG   ARG  42          2HG       ARG  42   9.409   3.821 -13.901
  350   2HG   ARG  42          1HG       ARG  42   9.556   2.802 -15.334
  351   1HD   ARG  42          2HD       ARG  42  11.190   5.251 -14.635
  352   2HD   ARG  42          1HD       ARG  42  11.761   3.598 -14.845
  353    HE   ARG  42           HE       ARG  42  10.555   4.395 -17.252
  354   1HH1  ARG  42          1HH2      ARG  42  13.270   5.192 -15.248
  355   2HH1  ARG  42          2HH2      ARG  42  14.248   5.750 -16.565
  356   1HH2  ARG  42          1HH1      ARG  42  11.827   5.143 -18.971
  357   2HH2  ARG  42          2HH1      ARG  42  13.428   5.732 -18.668
  Start of MODEL   17
    1   1H    MET   1          1HT       MET   1   3.459 -10.290 -16.282
    2   2H    MET   1          2HT       MET   1   2.629  -8.808 -16.281
    3   3H    MET   1          3HT       MET   1   2.114 -10.074 -15.273
    4    HA   MET   1           HA       MET   1   4.291  -9.955 -14.114
    5   1HB   MET   1          2HB       MET   1   5.180  -7.433 -14.500
    6   2HB   MET   1          1HB       MET   1   5.817  -8.815 -15.386
    7   1HG   MET   1          2HG       MET   1   3.464  -7.209 -16.398
    8   2HG   MET   1          1HG       MET   1   5.129  -6.784 -16.789
    9   1HE   MET   1          1HE       MET   1   4.907  -6.936 -19.204
   10   2HE   MET   1          2HE       MET   1   5.382  -8.433 -20.004
   11   3HE   MET   1          3HE       MET   1   6.405  -7.756 -18.739
   12    H    ILE   2           H        ILE   2   1.317  -9.098 -14.332
   13    HA   ILE   2           HA       ILE   2   1.362  -7.298 -11.981
   14    HB   ILE   2           HB       ILE   2  -0.771  -7.323 -14.129
   15   1HG1  ILE   2          2HG1      ILE   2   1.506  -5.359 -13.680
   16   2HG1  ILE   2          1HG1      ILE   2   1.376  -6.482 -15.033
   17   1HG2  ILE   2          1HG2      ILE   2  -1.441  -6.598 -11.829
   18   2HG2  ILE   2          2HG2      ILE   2  -1.533  -5.287 -13.005
   19   3HG2  ILE   2          3HG2      ILE   2  -0.177  -5.370 -11.881
   20   1HD1  ILE   2          1HD1      ILE   2  -0.391  -4.113 -14.406
   21   2HD1  ILE   2          2HD1      ILE   2  -0.889  -5.382 -15.526
   22   3HD1  ILE   2          3HD1      ILE   2   0.548  -4.417 -15.868
   23    H    SER   3           H        SER   3  -0.592  -9.646 -13.809
   24    HA   SER   3           HA       SER   3  -2.186 -11.163 -13.147
   25   1HB   SER   3          2HB       SER   3  -1.456 -12.690 -11.439
   26   2HB   SER   3          1HB       SER   3  -0.034 -12.175 -12.337
   27    HG   SER   3           HG       SER   3  -0.799 -10.662 -10.122
   28    H    ASN   4           H        ASN   4  -2.375  -8.324 -12.077
   29    HA   ASN   4           HA       ASN   4  -3.698  -7.102 -10.654
   30   1HB   ASN   4          2HB       ASN   4  -5.315  -9.657 -10.490
   31   2HB   ASN   4          1HB       ASN   4  -5.886  -8.023 -10.168
   32   1HD2  ASN   4          1HD2      ASN   4  -3.797  -7.640 -12.721
   33   2HD2  ASN   4          2HD2      ASN   4  -4.890  -7.816 -14.008
   34    H    ALA   5           H        ALA   5  -1.567  -9.052  -9.581
   35    HA   ALA   5           HA       ALA   5  -2.474  -9.778  -6.948
   36   1HB   ALA   5          1HB       ALA   5  -0.052 -10.302  -6.577
   37   2HB   ALA   5          2HB       ALA   5   0.279  -9.691  -8.199
   38   3HB   ALA   5          3HB       ALA   5  -0.748 -11.108  -7.981
   39    H    LYS   6           H        LYS   6  -0.699  -7.086  -8.374
   40    HA   LYS   6           HA       LYS   6   0.187  -5.930  -5.928
   41   1HB   LYS   6          2HB       LYS   6   1.295  -5.215  -7.906
   42   2HB   LYS   6          1HB       LYS   6  -0.225  -4.820  -8.708
   43   1HG   LYS   6          2HG       LYS   6  -0.595  -2.932  -7.288
   44   2HG   LYS   6          1HG       LYS   6   0.682  -3.427  -6.178
   45   1HD   LYS   6          2HD       LYS   6   2.394  -2.877  -7.733
   46   2HD   LYS   6          1HD       LYS   6   1.250  -2.777  -9.074
   47   1HE   LYS   6          2HE       LYS   6   0.892  -0.958  -6.713
   48   2HE   LYS   6          1HE       LYS   6   2.114  -0.567  -7.922
   49   1HZ   LYS   6          1HZ       LYS   6  -0.773  -1.036  -8.432
   50   2HZ   LYS   6          2HZ       LYS   6   0.395  -0.746  -9.633
   51   3HZ   LYS   6          3HZ       LYS   6   0.028   0.458  -8.493
   52    H    ILE   7           H        ILE   7  -2.534  -5.137  -8.085
   53    HA   ILE   7           HA       ILE   7  -3.681  -3.120  -6.531
   54    HB   ILE   7           HB       ILE   7  -4.878  -5.091  -8.484
   55   1HG1  ILE   7          2HG1      ILE   7  -5.152  -2.845  -9.739
   56   2HG1  ILE   7          1HG1      ILE   7  -4.048  -2.183  -8.536
   57   1HG2  ILE   7          1HG2      ILE   7  -6.766  -4.598  -7.174
   58   2HG2  ILE   7          2HG2      ILE   7  -6.823  -3.342  -8.411
   59   3HG2  ILE   7          3HG2      ILE   7  -6.201  -2.968  -6.804
   60   1HD1  ILE   7          1HD1      ILE   7  -3.050  -3.116 -10.755
   61   2HD1  ILE   7          2HD1      ILE   7  -3.336  -4.699 -10.032
   62   3HD1  ILE   7          3HD1      ILE   7  -2.265  -3.545  -9.235
   63    H    ALA   8           H        ALA   8  -4.481  -6.597  -6.600
   64    HA   ALA   8           HA       ALA   8  -6.437  -6.619  -4.626
   65   1HB   ALA   8          1HB       ALA   8  -4.381  -8.743  -5.268
   66   2HB   ALA   8          2HB       ALA   8  -5.964  -8.562  -6.020
   67   3HB   ALA   8          3HB       ALA   8  -5.845  -9.003  -4.318
   68    H    ARG   9           H        ARG   9  -2.911  -6.963  -4.255
   69    HA   ARG   9           HA       ARG   9  -2.887  -7.432  -1.482
   70   1HB   ARG   9          2HB       ARG   9  -0.920  -7.787  -2.917
   71   2HB   ARG   9          1HB       ARG   9  -0.790  -6.048  -3.175
   72   1HG   ARG   9          2HG       ARG   9  -0.451  -5.696  -0.764
   73   2HG   ARG   9          1HG       ARG   9  -0.628  -7.427  -0.475
   74   1HD   ARG   9          2HD       ARG   9   1.313  -7.669  -2.201
   75   2HD   ARG   9          1HD       ARG   9   1.606  -5.964  -1.864
   76    HE   ARG   9           HE       ARG   9   1.389  -7.606   0.512
   77   1HH1  ARG   9          1HH2      ARG   9   3.462  -6.373  -1.980
   78   2HH1  ARG   9          2HH2      ARG   9   4.908  -6.542  -1.043
   79   1HH2  ARG   9          1HH1      ARG   9   3.283  -7.824   1.735
   80   2HH2  ARG   9          2HH1      ARG   9   4.809  -7.365   1.055
   81    H    ILE  10           H        ILE  10  -1.728  -4.401  -2.932
   82    HA   ILE  10           HA       ILE  10  -1.886  -2.817  -0.687
   83    HB   ILE  10           HB       ILE  10  -2.384  -1.945  -3.546
   84   1HG1  ILE  10          2HG1      ILE  10   0.220  -1.896  -1.996
   85   2HG1  ILE  10          1HG1      ILE  10  -0.241  -3.268  -3.002
   86   1HG2  ILE  10          1HG2      ILE  10  -1.394   0.218  -2.642
   87   2HG2  ILE  10          2HG2      ILE  10  -1.601  -0.454  -1.024
   88   3HG2  ILE  10          3HG2      ILE  10  -3.008  -0.167  -2.050
   89   1HD1  ILE  10          1HD1      ILE  10  -0.569  -1.597  -4.904
   90   2HD1  ILE  10          2HD1      ILE  10   1.098  -1.858  -4.392
   91   3HD1  ILE  10          3HD1      ILE  10   0.231  -0.411  -3.877
   92    H    ASN  11           H        ASN  11  -4.477  -3.545  -3.004
   93    HA   ASN  11           HA       ASN  11  -6.380  -1.697  -2.066
   94   1HB   ASN  11          2HB       ASN  11  -6.748  -2.872  -4.147
   95   2HB   ASN  11          1HB       ASN  11  -6.763  -4.428  -3.317
   96   1HD2  ASN  11          1HD2      ASN  11  -8.826  -5.190  -2.845
   97   2HD2  ASN  11          2HD2      ASN  11 -10.202  -4.216  -2.649
   98    H    GLU  12           H        GLU  12  -5.996  -5.150  -1.223
   99    HA   GLU  12           HA       GLU  12  -7.995  -5.249   0.736
  100   1HB   GLU  12          2HB       GLU  12  -6.673  -7.185  -0.329
  101   2HB   GLU  12          1HB       GLU  12  -5.452  -6.858   0.903
  102   1HG   GLU  12          2HG       GLU  12  -7.235  -7.085   2.654
  103   2HG   GLU  12          1HG       GLU  12  -8.365  -7.555   1.389
  104    H    LEU  13           H        LEU  13  -4.478  -4.758   1.152
  105    HA   LEU  13           HA       LEU  13  -4.530  -4.384   3.938
  106   1HB   LEU  13          2HB       LEU  13  -2.533  -4.640   2.220
  107   2HB   LEU  13          1HB       LEU  13  -2.562  -2.878   2.261
  108    HG   LEU  13           HG       LEU  13  -2.385  -4.656   4.715
  109   1HD1  LEU  13          1HD1      LEU  13  -0.269  -3.068   3.232
  110   2HD1  LEU  13          2HD1      LEU  13  -0.331  -4.820   3.420
  111   3HD1  LEU  13          3HD1      LEU  13  -0.036  -3.792   4.822
  112   1HD2  LEU  13          1HD2      LEU  13  -2.515  -1.692   4.246
  113   2HD2  LEU  13          2HD2      LEU  13  -1.565  -2.300   5.601
  114   3HD2  LEU  13          3HD2      LEU  13  -3.289  -2.657   5.502
  115    H    ALA  14           H        ALA  14  -4.439  -1.925   1.344
  116    HA   ALA  14           HA       ALA  14  -4.614   0.349   2.932
  117   1HB   ALA  14          1HB       ALA  14  -4.185   0.452   0.525
  118   2HB   ALA  14          2HB       ALA  14  -5.564   1.467   0.946
  119   3HB   ALA  14          3HB       ALA  14  -5.823  -0.107   0.193
  120    H    ALA  15           H        ALA  15  -7.332  -1.329   1.331
  121    HA   ALA  15           HA       ALA  15  -9.381   0.172   2.551
  122   1HB   ALA  15          1HB       ALA  15 -10.861  -1.682   1.850
  123   2HB   ALA  15          2HB       ALA  15  -9.440  -2.654   1.469
  124   3HB   ALA  15          3HB       ALA  15  -9.771  -1.181   0.558
  125    H    LYS  16           H        LYS  16  -7.729  -2.783   3.539
  126    HA   LYS  16           HA       LYS  16  -9.411  -3.497   5.689
  127   1HB   LYS  16          2HB       LYS  16  -7.808  -5.101   4.904
  128   2HB   LYS  16          1HB       LYS  16  -6.467  -3.994   5.196
  129   1HG   LYS  16          2HG       LYS  16  -6.666  -4.191   7.548
  130   2HG   LYS  16          1HG       LYS  16  -8.286  -4.878   7.436
  131   1HD   LYS  16          2HD       LYS  16  -6.604  -6.615   7.974
  132   2HD   LYS  16          1HD       LYS  16  -7.371  -6.920   6.417
  133   1HE   LYS  16          2HE       LYS  16  -4.835  -7.176   6.462
  134   2HE   LYS  16          1HE       LYS  16  -5.467  -6.103   5.215
  135   1HZ   LYS  16          1HZ       LYS  16  -3.540  -5.440   6.954
  136   2HZ   LYS  16          2HZ       LYS  16  -4.909  -4.828   7.748
  137   3HZ   LYS  16          3HZ       LYS  16  -4.541  -4.318   6.170
  138    H    ALA  17           H        ALA  17  -6.221  -1.909   5.816
  139    HA   ALA  17           HA       ALA  17  -6.364  -1.099   8.497
  140   1HB   ALA  17          1HB       ALA  17  -4.931   0.438   6.325
  141   2HB   ALA  17          2HB       ALA  17  -4.325  -1.094   6.960
  142   3HB   ALA  17          3HB       ALA  17  -4.496   0.297   8.032
  143    H    LYS  18           H        LYS  18  -7.999   0.094   5.704
  144    HA   LYS  18           HA       LYS  18  -8.437   2.762   6.715
  145   1HB   LYS  18          2HB       LYS  18  -8.533   2.097   4.270
  146   2HB   LYS  18          1HB       LYS  18 -10.087   1.341   4.620
  147   1HG   LYS  18          2HG       LYS  18 -10.984   3.475   5.413
  148   2HG   LYS  18          1HG       LYS  18  -9.417   4.247   5.173
  149   1HD   LYS  18          2HD       LYS  18  -9.542   3.880   2.774
  150   2HD   LYS  18          1HD       LYS  18 -11.027   2.946   2.959
  151   1HE   LYS  18          2HE       LYS  18 -12.303   4.835   3.512
  152   2HE   LYS  18          1HE       LYS  18 -10.887   5.772   3.987
  153   1HZ   LYS  18          1HZ       LYS  18 -10.362   6.248   1.835
  154   2HZ   LYS  18          2HZ       LYS  18 -12.053   6.158   1.696
  155   3HZ   LYS  18          3HZ       LYS  18 -11.086   4.847   1.214
  156    H    ALA  19           H        ALA  19 -10.722   0.065   6.144
  157    HA   ALA  19           HA       ALA  19 -12.695   1.198   7.900
  158   1HB   ALA  19          1HB       ALA  19 -13.837  -1.027   7.553
  159   2HB   ALA  19          2HB       ALA  19 -12.454  -1.509   6.570
  160   3HB   ALA  19          3HB       ALA  19 -13.464  -0.153   6.067
  161    H    GLY  20           H        GLY  20  -9.835  -0.412   8.464
  162   1HA   GLY  20          2HA       GLY  20 -10.758  -1.711  10.943
  163   2HA   GLY  20          1HA       GLY  20  -9.200  -1.969  10.159
  164    H    VAL  21           H        VAL  21  -7.783   0.021  10.033
  165    HA   VAL  21           HA       VAL  21  -8.116   2.194  11.807
  166    HB   VAL  21           HB       VAL  21  -7.853   0.720  13.645
  167   1HG1  VAL  21          1HG1      VAL  21  -5.395  -0.483  12.352
  168   2HG1  VAL  21          2HG1      VAL  21  -7.001  -1.186  12.178
  169   3HG1  VAL  21          3HG1      VAL  21  -6.263  -1.058  13.773
  170   1HG2  VAL  21          1HG2      VAL  21  -4.997   1.567  13.194
  171   2HG2  VAL  21          2HG2      VAL  21  -5.929   1.576  14.691
  172   3HG2  VAL  21          3HG2      VAL  21  -6.261   2.774  13.439
  173    H    ILE  22           H        ILE  22  -7.261   3.486  10.254
  174    HA   ILE  22           HA       ILE  22  -4.699   2.795   9.022
  175    HB   ILE  22           HB       ILE  22  -6.636   3.688   7.676
  176   1HG1  ILE  22          2HG1      ILE  22  -5.065   5.602   6.658
  177   2HG1  ILE  22          1HG1      ILE  22  -3.881   4.854   7.730
  178   1HG2  ILE  22          1HG2      ILE  22  -5.904   6.359   8.886
  179   2HG2  ILE  22          2HG2      ILE  22  -7.249   5.392   9.491
  180   3HG2  ILE  22          3HG2      ILE  22  -7.261   5.978   7.828
  181   1HD1  ILE  22          1HD1      ILE  22  -5.529   3.398   5.641
  182   2HD1  ILE  22          2HD1      ILE  22  -4.339   2.656   6.710
  183   3HD1  ILE  22          3HD1      ILE  22  -3.822   3.818   5.490
  184    H    THR  23           H        THR  23  -2.813   3.783   9.421
  185    HA   THR  23           HA       THR  23  -2.770   6.189  11.114
  186    HB   THR  23           HB       THR  23  -1.213   5.285  12.655
  187    HG1  THR  23           HG1      THR  23  -1.082   2.783  11.479
  188   1HG2  THR  23          1HG2      THR  23  -2.423   3.516  13.688
  189   2HG2  THR  23          2HG2      THR  23  -3.055   2.945  12.145
  190   3HG2  THR  23          3HG2      THR  23  -3.634   4.465  12.827
  191    H    GLU  24           H        GLU  24  -0.656   7.271  11.066
  192    HA   GLU  24           HA       GLU  24   0.300   7.754   8.513
  193   1HB   GLU  24          2HB       GLU  24   1.617   8.093  11.210
  194   2HB   GLU  24          1HB       GLU  24   2.359   8.657   9.711
  195   1HG   GLU  24          2HG       GLU  24   0.565  10.164   9.272
  196   2HG   GLU  24          1HG       GLU  24  -0.459   9.418  10.497
  197    H    GLU  25           H        GLU  25   1.340   5.352  10.861
  198    HA   GLU  25           HA       GLU  25   3.732   4.514   9.650
  199   1HB   GLU  25          2HB       GLU  25   2.680   3.874  11.948
  200   2HB   GLU  25          1HB       GLU  25   1.874   2.598  11.039
  201   1HG   GLU  25          2HG       GLU  25   4.869   3.061  11.001
  202   2HG   GLU  25          1HG       GLU  25   4.070   1.899  12.057
  203    H    GLU  26           H        GLU  26   0.402   3.323   9.248
  204    HA   GLU  26           HA       GLU  26   0.980   1.276   7.402
  205   1HB   GLU  26          2HB       GLU  26  -1.571   2.901   7.565
  206   2HB   GLU  26          1HB       GLU  26  -1.388   1.278   6.899
  207   1HG   GLU  26          2HG       GLU  26  -0.882   2.048   9.790
  208   2HG   GLU  26          1HG       GLU  26  -2.323   1.225   9.196
  209    H    LYS  27           H        LYS  27  -0.229   4.583   6.837
  210    HA   LYS  27           HA       LYS  27  -0.270   4.569   4.067
  211   1HB   LYS  27          2HB       LYS  27   0.214   6.739   6.093
  212   2HB   LYS  27          1HB       LYS  27   0.232   7.086   4.365
  213   1HG   LYS  27          2HG       LYS  27  -2.030   6.027   4.178
  214   2HG   LYS  27          1HG       LYS  27  -2.053   5.859   5.934
  215   1HD   LYS  27          2HD       LYS  27  -1.405   8.563   4.879
  216   2HD   LYS  27          1HD       LYS  27  -3.067   8.018   4.663
  217   1HE   LYS  27          2HE       LYS  27  -3.456   7.854   6.961
  218   2HE   LYS  27          1HE       LYS  27  -1.741   7.693   7.339
  219   1HZ   LYS  27          1HZ       LYS  27  -1.515   9.882   7.484
  220   2HZ   LYS  27          2HZ       LYS  27  -3.209   9.987   7.467
  221   3HZ   LYS  27          3HZ       LYS  27  -2.332  10.155   6.023
  222    H    ALA  28           H        ALA  28   2.449   5.109   6.259
  223    HA   ALA  28           HA       ALA  28   4.344   5.991   4.374
  224   1HB   ALA  28          1HB       ALA  28   5.075   4.235   6.707
  225   2HB   ALA  28          2HB       ALA  28   4.491   5.877   6.967
  226   3HB   ALA  28          3HB       ALA  28   5.958   5.603   6.030
  227    H    GLU  29           H        GLU  29   3.640   2.719   5.584
  228    HA   GLU  29           HA       GLU  29   5.519   1.310   4.067
  229   1HB   GLU  29          2HB       GLU  29   4.122   0.412   5.965
  230   2HB   GLU  29          1HB       GLU  29   2.771   0.309   4.838
  231   1HG   GLU  29          2HG       GLU  29   4.250  -1.104   3.343
  232   2HG   GLU  29          1HG       GLU  29   5.425  -1.142   4.656
  233    H    GLN  30           H        GLN  30   2.043   1.765   3.360
  234    HA   GLN  30           HA       GLN  30   1.939   0.573   0.869
  235   1HB   GLN  30          2HB       GLN  30   0.429   3.115   1.447
  236   2HB   GLN  30          1HB       GLN  30  -0.086   1.718   0.503
  237   1HG   GLN  30          2HG       GLN  30   0.368   0.521   2.897
  238   2HG   GLN  30          1HG       GLN  30  -0.107   2.130   3.440
  239   1HE2  GLN  30          1HE2      GLN  30  -1.226  -0.687   1.554
  240   2HE2  GLN  30          2HE2      GLN  30  -2.872  -0.284   1.635
  241    H    GLN  31           H        GLN  31   2.788   3.940   1.629
  242    HA   GLN  31           HA       GLN  31   3.078   4.896  -0.987
  243   1HB   GLN  31          2HB       GLN  31   3.081   6.299   1.074
  244   2HB   GLN  31          1HB       GLN  31   4.704   5.708   1.434
  245   1HG   GLN  31          2HG       GLN  31   5.481   6.591  -0.762
  246   2HG   GLN  31          1HG       GLN  31   3.870   7.247  -1.044
  247   1HE2  GLN  31          1HE2      GLN  31   3.802   7.792   2.051
  248   2HE2  GLN  31          2HE2      GLN  31   4.671   9.243   2.194
  249    H    LYS  32           H        LYS  32   5.330   3.134   1.088
  250    HA   LYS  32           HA       LYS  32   7.654   3.426  -0.469
  251   1HB   LYS  32          2HB       LYS  32   7.508   2.473   1.869
  252   2HB   LYS  32          1HB       LYS  32   6.912   0.978   1.147
  253   1HG   LYS  32          2HG       LYS  32   8.953   0.706  -0.131
  254   2HG   LYS  32          1HG       LYS  32   9.534   2.293   0.378
  255   1HD   LYS  32          2HD       LYS  32   9.775   1.577   2.652
  256   2HD   LYS  32          1HD       LYS  32   8.899   0.077   2.340
  257   1HE   LYS  32          2HE       LYS  32  10.717  -0.607   0.764
  258   2HE   LYS  32          1HE       LYS  32  11.609   0.849   1.211
  259   1HZ   LYS  32          1HZ       LYS  32  10.784  -0.485   3.543
  260   2HZ   LYS  32          2HZ       LYS  32  12.364  -0.177   2.999
  261   3HZ   LYS  32          3HZ       LYS  32  11.563  -1.601   2.532
  262    H    LEU  33           H        LEU  33   5.211   0.827  -0.461
  263    HA   LEU  33           HA       LEU  33   6.289  -0.746  -2.498
  264   1HB   LEU  33          2HB       LEU  33   3.404  -0.288  -1.714
  265   2HB   LEU  33          1HB       LEU  33   3.931  -1.540  -2.838
  266    HG   LEU  33           HG       LEU  33   4.931  -1.261   0.013
  267   1HD1  LEU  33          1HD1      LEU  33   3.058  -3.365  -1.092
  268   2HD1  LEU  33          2HD1      LEU  33   2.474  -1.898  -0.307
  269   3HD1  LEU  33          3HD1      LEU  33   3.460  -3.048   0.596
  270   1HD2  LEU  33          1HD2      LEU  33   5.479  -3.147  -2.268
  271   2HD2  LEU  33          2HD2      LEU  33   5.551  -3.757  -0.613
  272   3HD2  LEU  33          3HD2      LEU  33   6.609  -2.437  -1.113
  273    H    ARG  34           H        ARG  34   3.586   1.564  -2.856
  274    HA   ARG  34           HA       ARG  34   3.297   1.541  -5.580
  275   1HB   ARG  34          2HB       ARG  34   3.056   3.835  -3.631
  276   2HB   ARG  34          1HB       ARG  34   2.585   3.970  -5.326
  277   1HG   ARG  34          2HG       ARG  34   1.041   2.054  -5.044
  278   2HG   ARG  34          1HG       ARG  34   1.493   1.949  -3.343
  279   1HD   ARG  34          2HD       ARG  34   0.388   3.910  -2.787
  280   2HD   ARG  34          1HD       ARG  34   0.536   4.579  -4.407
  281    HE   ARG  34           HE       ARG  34  -1.257   3.084  -5.105
  282   1HH1  ARG  34          1HH2      ARG  34  -0.704   3.375  -1.683
  283   2HH1  ARG  34          2HH2      ARG  34  -2.294   2.843  -1.256
  284   1HH2  ARG  34          1HH1      ARG  34  -3.325   2.387  -4.528
  285   2HH2  ARG  34          2HH1      ARG  34  -3.770   2.281  -2.858
  286    H    GLN  35           H        GLN  35   5.476   3.708  -3.762
  287    HA   GLN  35           HA       GLN  35   6.635   4.959  -6.011
  288   1HB   GLN  35          2HB       GLN  35   7.356   4.654  -3.130
  289   2HB   GLN  35          1HB       GLN  35   8.618   5.186  -4.240
  290   1HG   GLN  35          2HG       GLN  35   7.261   7.054  -4.985
  291   2HG   GLN  35          1HG       GLN  35   5.883   6.480  -4.048
  292   1HE2  GLN  35          1HE2      GLN  35   5.844   8.467  -2.762
  293   2HE2  GLN  35          2HE2      GLN  35   7.027   8.768  -1.583
  294    H    GLU  36           H        GLU  36   7.679   2.160  -4.088
  295    HA   GLU  36           HA       GLU  36  10.079   1.657  -5.493
  296   1HB   GLU  36          2HB       GLU  36   9.412   0.751  -3.225
  297   2HB   GLU  36          1HB       GLU  36   8.387  -0.408  -4.073
  298   1HG   GLU  36          2HG       GLU  36  10.278  -1.374  -5.203
  299   2HG   GLU  36          1HG       GLU  36  11.342  -0.082  -4.655
  300    H    TYR  37           H        TYR  37   6.770   0.467  -5.945
  301    HA   TYR  37           HA       TYR  37   7.244  -1.514  -7.852
  302   1HB   TYR  37          2HB       TYR  37   5.049  -0.898  -6.671
  303   2HB   TYR  37          1HB       TYR  37   4.844   0.314  -7.933
  304    HD1  TYR  37           HD1      TYR  37   5.740  -3.319  -7.574
  305    HD2  TYR  37           HD2      TYR  37   3.713  -0.314  -9.880
  306    HE1  TYR  37           HE1      TYR  37   4.891  -5.070  -9.110
  307    HE2  TYR  37           HE2      TYR  37   2.863  -2.066 -11.414
  308    HH   TYR  37           HH       TYR  37   2.467  -4.407 -11.498
  309    H    LEU  38           H        LEU  38   6.217   1.846  -8.501
  310    HA   LEU  38           HA       LEU  38   6.576   1.771 -11.280
  311   1HB   LEU  38          2HB       LEU  38   6.339   3.900  -9.215
  312   2HB   LEU  38          1HB       LEU  38   7.010   4.376 -10.772
  313    HG   LEU  38           HG       LEU  38   4.505   4.608 -10.619
  314   1HD1  LEU  38          1HD1      LEU  38   6.010   3.952 -12.734
  315   2HD1  LEU  38          2HD1      LEU  38   4.255   4.083 -12.847
  316   3HD1  LEU  38          3HD1      LEU  38   5.011   2.500 -12.670
  317   1HD2  LEU  38          1HD2      LEU  38   4.337   1.619 -10.883
  318   2HD2  LEU  38          2HD2      LEU  38   3.103   2.762 -10.355
  319   3HD2  LEU  38          3HD2      LEU  38   4.428   2.337  -9.274
  320    H    LYS  39           H        LYS  39   8.819   2.653  -8.685
  321    HA   LYS  39           HA       LYS  39  10.953   3.524 -10.335
  322   1HB   LYS  39          2HB       LYS  39  10.679   2.622  -7.500
  323   2HB   LYS  39          1HB       LYS  39  12.295   2.730  -8.196
  324   1HG   LYS  39          2HG       LYS  39  11.704   5.086  -8.940
  325   2HG   LYS  39          1HG       LYS  39  10.246   4.949  -7.956
  326   1HD   LYS  39          2HD       LYS  39  13.111   4.725  -6.981
  327   2HD   LYS  39          1HD       LYS  39  11.985   6.040  -6.643
  328   1HE   LYS  39          2HE       LYS  39  10.456   4.241  -5.617
  329   2HE   LYS  39          1HE       LYS  39  11.866   3.184  -5.664
  330   1HZ   LYS  39          1HZ       LYS  39  12.326   4.092  -3.693
  331   2HZ   LYS  39          2HZ       LYS  39  11.292   5.419  -3.935
  332   3HZ   LYS  39          3HZ       LYS  39  12.865   5.433  -4.580
  333    H    GLY  40           H        GLY  40  10.344   0.416  -8.722
  334   1HA   GLY  40          2HA       GLY  40  12.534  -1.051  -9.421
  335   2HA   GLY  40          1HA       GLY  40  10.914  -1.736  -9.341
  336    H    PHE  41           H        PHE  41   9.537  -1.304 -11.311
  337    HA   PHE  41           HA       PHE  41   9.401  -2.271 -13.482
  338   1HB   PHE  41          2HB       PHE  41   8.925   0.209 -13.419
  339   2HB   PHE  41          1HB       PHE  41  10.575   0.471 -13.982
  340    HD1  PHE  41           HD1      PHE  41   7.480  -1.481 -14.827
  341    HD2  PHE  41           HD2      PHE  41  11.023   0.472 -16.275
  342    HE1  PHE  41           HE1      PHE  41   6.757  -1.899 -17.162
  343    HE2  PHE  41           HE2      PHE  41  10.300   0.055 -18.607
  344    HZ   PHE  41           HZ       PHE  41   8.167  -1.130 -19.053
  345    H    ARG  42           H        ARG  42  11.429  -3.680 -12.801
  346    HA   ARG  42           HA       ARG  42  13.317  -3.462 -15.029
  347   1HB   ARG  42          2HB       ARG  42  14.382  -2.265 -13.134
  348   2HB   ARG  42          1HB       ARG  42  14.227  -3.721 -12.150
  349   1HG   ARG  42          2HG       ARG  42  15.725  -4.946 -13.553
  350   2HG   ARG  42          1HG       ARG  42  15.669  -3.710 -14.811
  351   1HD   ARG  42          2HD       ARG  42  16.856  -2.137 -13.419
  352   2HD   ARG  42          1HD       ARG  42  16.738  -3.207 -12.024
  353    HE   ARG  42           HE       ARG  42  18.119  -4.337 -14.318
  354   1HH1  ARG  42          1HH2      ARG  42  18.344  -2.555 -11.349
  355   2HH1  ARG  42          2HH2      ARG  42  20.018  -2.925 -11.102
  356   1HH2  ARG  42          1HH1      ARG  42  20.302  -4.820 -13.990
  357   2HH2  ARG  42          2HH1      ARG  42  21.124  -4.210 -12.593
  Start of MODEL   18
    1   1H    MET   1          1HT       MET   1   6.862  -9.675  -4.968
    2   2H    MET   1          2HT       MET   1   7.042  -8.366  -6.039
    3   3H    MET   1          3HT       MET   1   8.291  -8.760  -4.957
    4    HA   MET   1           HA       MET   1   8.974  -9.575  -7.043
    5   1HB   MET   1          2HB       MET   1   7.788 -11.766  -5.312
    6   2HB   MET   1          1HB       MET   1   8.902 -12.067  -6.648
    7   1HG   MET   1          2HG       MET   1  10.282 -11.971  -4.712
    8   2HG   MET   1          1HG       MET   1  10.486 -10.407  -5.498
    9   1HE   MET   1          1HE       MET   1  10.863  -8.688  -2.669
   10   2HE   MET   1          2HE       MET   1  11.596 -10.046  -3.519
   11   3HE   MET   1          3HE       MET   1  10.993 -10.267  -1.880
   12    H    ILE   2           H        ILE   2   6.148 -11.651  -6.407
   13    HA   ILE   2           HA       ILE   2   5.526 -11.814  -9.205
   14    HB   ILE   2           HB       ILE   2   5.102 -13.615  -7.432
   15   1HG1  ILE   2          2HG1      ILE   2   2.831 -12.773  -9.264
   16   2HG1  ILE   2          1HG1      ILE   2   4.226 -13.739  -9.738
   17   1HG2  ILE   2          1HG2      ILE   2   3.941 -11.967  -5.873
   18   2HG2  ILE   2          2HG2      ILE   2   3.081 -13.483  -6.144
   19   3HG2  ILE   2          3HG2      ILE   2   2.569 -12.017  -6.980
   20   1HD1  ILE   2          1HD1      ILE   2   3.566 -15.467  -8.082
   21   2HD1  ILE   2          2HD1      ILE   2   2.308 -15.199  -9.290
   22   3HD1  ILE   2          3HD1      ILE   2   2.141 -14.512  -7.675
   23    H    SER   3           H        SER   3   3.541 -11.147 -10.192
   24    HA   SER   3           HA       SER   3   2.482  -8.645  -9.029
   25   1HB   SER   3          2HB       SER   3   1.782  -8.231 -11.461
   26   2HB   SER   3          1HB       SER   3   3.505  -8.160 -11.108
   27    HG   SER   3           HG       SER   3   3.563 -10.411 -11.762
   28    H    ASN   4           H        ASN   4   1.289 -10.601  -7.823
   29    HA   ASN   4           HA       ASN   4  -1.390 -10.678  -9.006
   30   1HB   ASN   4          2HB       ASN   4   0.272 -13.101  -8.340
   31   2HB   ASN   4          1HB       ASN   4  -1.489 -13.166  -8.287
   32   1HD2  ASN   4          1HD2      ASN   4   1.284 -13.051 -10.408
   33   2HD2  ASN   4          2HD2      ASN   4   0.418 -13.118 -11.863
   34    H    ALA   5           H        ALA   5  -0.407 -12.808  -6.411
   35    HA   ALA   5           HA       ALA   5  -2.339 -12.033  -4.597
   36   1HB   ALA   5          1HB       ALA   5  -0.907 -13.047  -2.850
   37   2HB   ALA   5          2HB       ALA   5   0.439 -13.083  -3.990
   38   3HB   ALA   5          3HB       ALA   5  -1.000 -14.058  -4.290
   39    H    LYS   6           H        LYS   6   0.654 -10.502  -5.397
   40    HA   LYS   6           HA       LYS   6   0.925  -8.859  -3.084
   41   1HB   LYS   6          2HB       LYS   6   2.719  -9.426  -4.795
   42   2HB   LYS   6          1HB       LYS   6   1.946  -8.253  -5.863
   43   1HG   LYS   6          2HG       LYS   6   2.290  -6.473  -4.250
   44   2HG   LYS   6          1HG       LYS   6   2.909  -7.621  -3.060
   45   1HD   LYS   6          2HD       LYS   6   4.806  -8.151  -4.521
   46   2HD   LYS   6          1HD       LYS   6   4.179  -7.057  -5.756
   47   1HE   LYS   6          2HE       LYS   6   4.228  -5.317  -3.744
   48   2HE   LYS   6          1HE       LYS   6   5.462  -6.416  -3.130
   49   1HZ   LYS   6          1HZ       LYS   6   6.131  -4.485  -4.689
   50   2HZ   LYS   6          2HZ       LYS   6   5.573  -5.507  -5.926
   51   3HZ   LYS   6          3HZ       LYS   6   6.836  -6.012  -4.908
   52    H    ILE   7           H        ILE   7  -0.361  -8.271  -6.358
   53    HA   ILE   7           HA       ILE   7  -1.108  -5.604  -6.062
   54    HB   ILE   7           HB       ILE   7  -2.560  -7.761  -7.620
   55   1HG1  ILE   7          2HG1      ILE   7  -0.485  -5.803  -8.634
   56   2HG1  ILE   7          1HG1      ILE   7  -0.047  -7.411  -8.055
   57   1HG2  ILE   7          1HG2      ILE   7  -2.524  -4.735  -7.873
   58   2HG2  ILE   7          2HG2      ILE   7  -3.900  -5.722  -7.381
   59   3HG2  ILE   7          3HG2      ILE   7  -3.281  -5.832  -9.029
   60   1HD1  ILE   7          1HD1      ILE   7  -1.644  -8.400  -9.693
   61   2HD1  ILE   7          2HD1      ILE   7  -0.358  -7.482 -10.474
   62   3HD1  ILE   7          3HD1      ILE   7  -1.969  -6.781 -10.314
   63    H    ALA   8           H        ALA   8  -2.999  -8.544  -5.405
   64    HA   ALA   8           HA       ALA   8  -5.367  -7.328  -4.544
   65   1HB   ALA   8          1HB       ALA   8  -5.796  -9.443  -3.342
   66   2HB   ALA   8          2HB       ALA   8  -4.116  -9.918  -3.599
   67   3HB   ALA   8          3HB       ALA   8  -5.201  -9.730  -4.977
   68    H    ARG   9           H        ARG   9  -2.391  -8.076  -2.783
   69    HA   ARG   9           HA       ARG   9  -3.332  -7.434  -0.197
   70   1HB   ARG   9          2HB       ARG   9  -1.169  -8.630  -0.774
   71   2HB   ARG   9          1HB       ARG   9  -0.492  -7.046  -1.155
   72   1HG   ARG   9          2HG       ARG   9  -1.474  -6.409   1.224
   73   2HG   ARG   9          1HG       ARG   9  -1.362  -8.148   1.497
   74   1HD   ARG   9          2HD       ARG   9   0.927  -6.413   0.530
   75   2HD   ARG   9          1HD       ARG   9   0.696  -6.919   2.202
   76    HE   ARG   9           HE       ARG   9   0.816  -9.049   0.201
   77   1HH1  ARG   9          1HH2      ARG   9   2.408  -7.147   2.623
   78   2HH1  ARG   9          2HH2      ARG   9   3.687  -8.287   2.867
   79   1HH2  ARG   9          1HH1      ARG   9   2.483 -10.541   0.525
   80   2HH2  ARG   9          2HH1      ARG   9   3.723 -10.215   1.690
   81    H    ILE  10           H        ILE  10  -0.963  -5.429  -1.974
   82    HA   ILE  10           HA       ILE  10  -1.309  -3.087  -0.583
   83    HB   ILE  10           HB       ILE  10  -0.804  -3.357  -3.559
   84   1HG1  ILE  10          2HG1      ILE  10   1.208  -2.950  -1.328
   85   2HG1  ILE  10          1HG1      ILE  10   0.761  -4.554  -1.907
   86   1HG2  ILE  10          1HG2      ILE  10  -0.346  -1.070  -1.616
   87   2HG2  ILE  10          2HG2      ILE  10  -1.449  -1.075  -2.991
   88   3HG2  ILE  10          3HG2      ILE  10   0.294  -1.119  -3.259
   89   1HD1  ILE  10          1HD1      ILE  10   1.760  -2.353  -3.732
   90   2HD1  ILE  10          2HD1      ILE  10   1.530  -4.055  -4.131
   91   3HD1  ILE  10          3HD1      ILE  10   2.812  -3.576  -3.019
   92    H    ASN  11           H        ASN  11  -3.220  -4.240  -3.335
   93    HA   ASN  11           HA       ASN  11  -4.835  -1.974  -3.709
   94   1HB   ASN  11          2HB       ASN  11  -4.775  -3.752  -5.349
   95   2HB   ASN  11          1HB       ASN  11  -5.392  -4.913  -4.179
   96   1HD2  ASN  11          1HD2      ASN  11  -7.298  -5.366  -5.478
   97   2HD2  ASN  11          2HD2      ASN  11  -8.551  -4.232  -5.640
   98    H    GLU  12           H        GLU  12  -5.842  -5.014  -2.130
   99    HA   GLU  12           HA       GLU  12  -8.145  -3.959  -0.918
  100   1HB   GLU  12          2HB       GLU  12  -7.496  -6.413  -1.281
  101   2HB   GLU  12          1HB       GLU  12  -6.551  -6.266   0.199
  102   1HG   GLU  12          2HG       GLU  12  -8.618  -7.054   0.983
  103   2HG   GLU  12          1HG       GLU  12  -8.746  -5.315   1.234
  104    H    LEU  13           H        LEU  13  -4.838  -4.325   0.328
  105    HA   LEU  13           HA       LEU  13  -5.294  -3.613   2.996
  106   1HB   LEU  13          2HB       LEU  13  -3.136  -4.465   1.813
  107   2HB   LEU  13          1HB       LEU  13  -2.809  -2.758   1.528
  108    HG   LEU  13           HG       LEU  13  -3.371  -3.970   4.253
  109   1HD1  LEU  13          1HD1      LEU  13  -1.255  -4.818   3.488
  110   2HD1  LEU  13          2HD1      LEU  13  -0.898  -3.489   4.590
  111   3HD1  LEU  13          3HD1      LEU  13  -0.786  -3.244   2.848
  112   1HD2  LEU  13          1HD2      LEU  13  -2.161  -1.669   4.813
  113   2HD2  LEU  13          2HD2      LEU  13  -3.896  -1.715   4.503
  114   3HD2  LEU  13          3HD2      LEU  13  -2.785  -1.207   3.231
  115    H    ALA  14           H        ALA  14  -4.170  -1.501   0.339
  116    HA   ALA  14           HA       ALA  14  -4.174   0.914   1.695
  117   1HB   ALA  14          1HB       ALA  14  -4.203   1.982  -0.429
  118   2HB   ALA  14          2HB       ALA  14  -5.059   0.632  -1.176
  119   3HB   ALA  14          3HB       ALA  14  -3.378   0.443  -0.678
  120    H    ALA  15           H        ALA  15  -6.842  -0.472  -0.221
  121    HA   ALA  15           HA       ALA  15  -8.719   1.555   0.327
  122   1HB   ALA  15          1HB       ALA  15 -10.356   0.054  -0.570
  123   2HB   ALA  15          2HB       ALA  15  -9.347  -1.351  -0.222
  124   3HB   ALA  15          3HB       ALA  15  -8.866  -0.207  -1.476
  125    H    LYS  16           H        LYS  16  -8.009  -1.491   1.981
  126    HA   LYS  16           HA       LYS  16 -10.153  -1.415   3.817
  127   1HB   LYS  16          2HB       LYS  16  -8.720  -3.420   3.285
  128   2HB   LYS  16          1HB       LYS  16  -7.457  -2.695   4.280
  129   1HG   LYS  16          2HG       LYS  16  -8.715  -2.898   6.251
  130   2HG   LYS  16          1HG       LYS  16 -10.242  -3.027   5.377
  131   1HD   LYS  16          2HD       LYS  16  -9.556  -5.219   6.290
  132   2HD   LYS  16          1HD       LYS  16  -9.580  -5.244   4.526
  133   1HE   LYS  16          2HE       LYS  16  -7.235  -5.198   4.366
  134   2HE   LYS  16          1HE       LYS  16  -7.040  -4.564   6.001
  135   1HZ   LYS  16          1HZ       LYS  16  -6.804  -6.636   6.698
  136   2HZ   LYS  16          2HZ       LYS  16  -7.107  -7.248   5.141
  137   3HZ   LYS  16          3HZ       LYS  16  -8.393  -6.979   6.216
  138    H    ALA  17           H        ALA  17  -6.705  -0.764   4.423
  139    HA   ALA  17           HA       ALA  17  -6.994   0.353   6.970
  140   1HB   ALA  17          1HB       ALA  17  -4.917   0.856   4.823
  141   2HB   ALA  17          2HB       ALA  17  -4.812  -0.286   6.164
  142   3HB   ALA  17          3HB       ALA  17  -4.781   1.449   6.478
  143    H    LYS  18           H        LYS  18  -7.778   1.630   3.863
  144    HA   LYS  18           HA       LYS  18  -7.630   4.415   4.600
  145   1HB   LYS  18          2HB       LYS  18  -8.554   2.855   2.250
  146   2HB   LYS  18          1HB       LYS  18  -9.305   4.431   2.487
  147   1HG   LYS  18          2HG       LYS  18  -7.176   5.542   2.467
  148   2HG   LYS  18          1HG       LYS  18  -6.308   4.008   2.537
  149   1HD   LYS  18          2HD       LYS  18  -7.198   3.391   0.324
  150   2HD   LYS  18          1HD       LYS  18  -8.083   4.913   0.250
  151   1HE   LYS  18          2HE       LYS  18  -6.157   6.180  -0.049
  152   2HE   LYS  18          1HE       LYS  18  -5.125   4.988   0.739
  153   1HZ   LYS  18          1HZ       LYS  18  -5.980   5.157  -2.019
  154   2HZ   LYS  18          2HZ       LYS  18  -6.062   3.598  -1.348
  155   3HZ   LYS  18          3HZ       LYS  18  -4.590   4.446  -1.356
  156    H    ALA  19           H        ALA  19 -10.480   2.473   3.682
  157    HA   ALA  19           HA       ALA  19 -12.267   4.240   5.076
  158   1HB   ALA  19          1HB       ALA  19 -12.798   1.497   3.907
  159   2HB   ALA  19          2HB       ALA  19 -12.915   3.015   3.020
  160   3HB   ALA  19          3HB       ALA  19 -14.012   2.693   4.362
  161    H    GLY  20           H        GLY  20 -10.194   1.890   6.179
  162   1HA   GLY  20          2HA       GLY  20 -11.967   1.010   8.367
  163   2HA   GLY  20          1HA       GLY  20 -10.434   0.262   7.919
  164    H    VAL  21           H        VAL  21  -8.465   1.574   8.251
  165    HA   VAL  21           HA       VAL  21  -8.322   3.911   9.754
  166    HB   VAL  21           HB       VAL  21  -9.328   2.926  11.646
  167   1HG1  VAL  21          1HG1      VAL  21  -9.365   0.602  10.939
  168   2HG1  VAL  21          2HG1      VAL  21  -8.602   0.691  12.524
  169   3HG1  VAL  21          3HG1      VAL  21  -7.612   0.489  11.081
  170   1HG2  VAL  21          1HG2      VAL  21  -7.668   3.167  13.247
  171   2HG2  VAL  21          2HG2      VAL  21  -6.872   3.905  11.856
  172   3HG2  VAL  21          3HG2      VAL  21  -6.487   2.246  12.312
  173    H    ILE  22           H        ILE  22  -6.514   4.400   8.603
  174    HA   ILE  22           HA       ILE  22  -4.273   2.504   8.567
  175    HB   ILE  22           HB       ILE  22  -5.068   3.738   6.484
  176   1HG1  ILE  22          2HG1      ILE  22  -2.191   4.414   7.045
  177   2HG1  ILE  22          1HG1      ILE  22  -2.691   2.724   7.036
  178   1HG2  ILE  22          1HG2      ILE  22  -3.480   6.070   7.520
  179   2HG2  ILE  22          2HG2      ILE  22  -5.199   5.943   7.897
  180   3HG2  ILE  22          3HG2      ILE  22  -4.669   6.020   6.219
  181   1HD1  ILE  22          1HD1      ILE  22  -1.921   3.396   4.800
  182   2HD1  ILE  22          2HD1      ILE  22  -3.104   4.703   4.775
  183   3HD1  ILE  22          3HD1      ILE  22  -3.644   3.025   4.768
  184    H    THR  23           H        THR  23  -2.381   2.822   9.636
  185    HA   THR  23           HA       THR  23  -2.187   5.232  11.347
  186    HB   THR  23           HB       THR  23  -1.081   3.905  13.004
  187    HG1  THR  23           HG1      THR  23  -0.250   1.983  12.583
  188   1HG2  THR  23          1HG2      THR  23  -3.269   2.087  12.001
  189   2HG2  THR  23          2HG2      THR  23  -3.635   3.682  12.656
  190   3HG2  THR  23          3HG2      THR  23  -2.842   2.475  13.667
  191    H    GLU  24           H        GLU  24   0.166   5.639  12.036
  192    HA   GLU  24           HA       GLU  24   1.689   6.446   9.872
  193   1HB   GLU  24          2HB       GLU  24   2.015   7.203  12.225
  194   2HB   GLU  24          1HB       GLU  24   2.768   5.650  12.589
  195   1HG   GLU  24          2HG       GLU  24   4.583   6.071  11.089
  196   2HG   GLU  24          1HG       GLU  24   3.759   7.451  10.368
  197    H    GLU  25           H        GLU  25   1.961   3.438  11.737
  198    HA   GLU  25           HA       GLU  25   4.215   2.346  10.477
  199   1HB   GLU  25          2HB       GLU  25   2.953   1.524  12.559
  200   2HB   GLU  25          1HB       GLU  25   1.859   0.720  11.436
  201   1HG   GLU  25          2HG       GLU  25   4.864   0.339  11.402
  202   2HG   GLU  25          1HG       GLU  25   3.759  -0.726  12.269
  203    H    GLU  26           H        GLU  26   0.767   1.745   9.792
  204    HA   GLU  26           HA       GLU  26   1.170   0.142   7.507
  205   1HB   GLU  26          2HB       GLU  26  -1.153   1.782   8.504
  206   2HB   GLU  26          1HB       GLU  26  -1.243   0.881   6.990
  207   1HG   GLU  26          2HG       GLU  26  -0.872  -1.204   8.105
  208   2HG   GLU  26          1HG       GLU  26  -0.413  -0.398   9.604
  209    H    LYS  27           H        LYS  27   0.285   3.592   7.756
  210    HA   LYS  27           HA       LYS  27   0.223   4.213   5.055
  211   1HB   LYS  27          2HB       LYS  27  -0.107   5.638   7.347
  212   2HB   LYS  27          1HB       LYS  27   1.442   6.273   6.794
  213   1HG   LYS  27          2HG       LYS  27  -0.974   6.044   4.982
  214   2HG   LYS  27          1HG       LYS  27  -0.624   7.491   5.925
  215   1HD   LYS  27          2HD       LYS  27   1.642   7.577   4.839
  216   2HD   LYS  27          1HD       LYS  27   1.146   6.234   3.808
  217   1HE   LYS  27          2HE       LYS  27  -0.542   7.526   2.750
  218   2HE   LYS  27          1HE       LYS  27  -0.471   8.780   3.987
  219   1HZ   LYS  27          1HZ       LYS  27   0.916   8.715   1.609
  220   2HZ   LYS  27          2HZ       LYS  27   2.073   8.379   2.803
  221   3HZ   LYS  27          3HZ       LYS  27   1.145   9.799   2.894
  222    H    ALA  28           H        ALA  28   3.010   4.375   7.272
  223    HA   ALA  28           HA       ALA  28   4.903   5.314   5.431
  224   1HB   ALA  28          1HB       ALA  28   5.404   5.297   7.790
  225   2HB   ALA  28          2HB       ALA  28   6.581   4.266   6.974
  226   3HB   ALA  28          3HB       ALA  28   5.239   3.542   7.859
  227    H    GLU  29           H        GLU  29   3.849   2.022   6.184
  228    HA   GLU  29           HA       GLU  29   5.760   0.615   4.680
  229   1HB   GLU  29          2HB       GLU  29   4.240  -0.481   6.271
  230   2HB   GLU  29          1HB       GLU  29   2.868  -0.110   5.227
  231   1HG   GLU  29          2HG       GLU  29   5.155  -1.530   3.956
  232   2HG   GLU  29          1HG       GLU  29   4.194  -2.456   5.106
  233    H    GLN  30           H        GLN  30   2.381   1.286   3.733
  234    HA   GLN  30           HA       GLN  30   2.511   0.521   1.087
  235   1HB   GLN  30          2HB       GLN  30   0.955   2.960   1.922
  236   2HB   GLN  30          1HB       GLN  30   0.521   1.728   0.736
  237   1HG   GLN  30          2HG       GLN  30   0.718   0.140   2.884
  238   2HG   GLN  30          1HG       GLN  30   0.340   1.645   3.715
  239   1HE2  GLN  30          1HE2      GLN  30  -0.840   0.282   0.585
  240   2HE2  GLN  30          2HE2      GLN  30  -2.482   0.398   0.998
  241    H    GLN  31           H        GLN  31   3.814   3.384   2.569
  242    HA   GLN  31           HA       GLN  31   4.063   5.101   0.394
  243   1HB   GLN  31          2HB       GLN  31   4.689   5.413   2.908
  244   2HB   GLN  31          1HB       GLN  31   6.273   4.822   2.404
  245   1HG   GLN  31          2HG       GLN  31   6.309   6.588   0.626
  246   2HG   GLN  31          1HG       GLN  31   4.803   7.224   1.281
  247   1HE2  GLN  31          1HE2      GLN  31   6.420   6.074   3.944
  248   2HE2  GLN  31          2HE2      GLN  31   7.242   7.488   4.401
  249    H    LYS  32           H        LYS  32   6.480   2.731   1.565
  250    HA   LYS  32           HA       LYS  32   8.343   3.136  -0.493
  251   1HB   LYS  32          2HB       LYS  32   8.721   1.885   1.668
  252   2HB   LYS  32          1HB       LYS  32   7.872   0.521   0.942
  253   1HG   LYS  32          2HG       LYS  32   9.499   0.469  -0.904
  254   2HG   LYS  32          1HG       LYS  32  10.344   1.853  -0.210
  255   1HD   LYS  32          2HD       LYS  32  10.570   0.412   1.922
  256   2HD   LYS  32          1HD       LYS  32  10.114  -0.948   0.894
  257   1HE   LYS  32          2HE       LYS  32  12.583  -0.682   1.048
  258   2HE   LYS  32          1HE       LYS  32  11.994  -0.490  -0.602
  259   1HZ   LYS  32          1HZ       LYS  32  13.594   1.257   0.644
  260   2HZ   LYS  32          2HZ       LYS  32  12.070   1.945   0.953
  261   3HZ   LYS  32          3HZ       LYS  32  12.568   1.659  -0.646
  262    H    LEU  33           H        LEU  33   6.065   0.382  -0.186
  263    HA   LEU  33           HA       LEU  33   6.530  -0.731  -2.687
  264   1HB   LEU  33          2HB       LEU  33   3.875  -0.681  -1.233
  265   2HB   LEU  33          1HB       LEU  33   4.383  -1.847  -2.455
  266    HG   LEU  33           HG       LEU  33   5.553  -1.458   0.315
  267   1HD1  LEU  33          1HD1      LEU  33   4.315  -3.865  -1.062
  268   2HD1  LEU  33          2HD1      LEU  33   3.503  -2.853   0.134
  269   3HD1  LEU  33          3HD1      LEU  33   4.908  -3.811   0.598
  270   1HD2  LEU  33          1HD2      LEU  33   7.012  -3.464  -0.470
  271   2HD2  LEU  33          2HD2      LEU  33   7.475  -1.849  -1.008
  272   3HD2  LEU  33          3HD2      LEU  33   6.609  -2.930  -2.102
  273    H    ARG  34           H        ARG  34   3.685   1.295  -1.897
  274    HA   ARG  34           HA       ARG  34   2.698   1.673  -4.434
  275   1HB   ARG  34          2HB       ARG  34   1.614   2.479  -2.359
  276   2HB   ARG  34          1HB       ARG  34   2.812   3.768  -2.253
  277   1HG   ARG  34          2HG       ARG  34   2.059   4.736  -4.334
  278   2HG   ARG  34          1HG       ARG  34   0.998   3.362  -4.648
  279   1HD   ARG  34          2HD       ARG  34  -0.101   5.482  -3.689
  280   2HD   ARG  34          1HD       ARG  34  -0.479   3.958  -2.895
  281    HE   ARG  34           HE       ARG  34   0.722   4.675  -1.019
  282   1HH1  ARG  34          1HH2      ARG  34   1.166   6.806  -3.718
  283   2HH1  ARG  34          2HH2      ARG  34   1.950   8.036  -2.786
  284   1HH2  ARG  34          1HH1      ARG  34   1.762   6.288   0.195
  285   2HH2  ARG  34          2HH1      ARG  34   2.288   7.744  -0.580
  286    H    GLN  35           H        GLN  35   5.306   3.510  -2.860
  287    HA   GLN  35           HA       GLN  35   5.663   5.440  -4.885
  288   1HB   GLN  35          2HB       GLN  35   6.703   5.859  -2.792
  289   2HB   GLN  35          1HB       GLN  35   7.533   4.304  -2.806
  290   1HG   GLN  35          2HG       GLN  35   9.066   4.993  -4.453
  291   2HG   GLN  35          1HG       GLN  35   8.039   6.324  -4.983
  292   1HE2  GLN  35          1HE2      GLN  35   8.714   5.634  -1.555
  293   2HE2  GLN  35          2HE2      GLN  35   9.619   7.044  -1.281
  294    H    GLU  36           H        GLU  36   7.608   2.516  -4.245
  295    HA   GLU  36           HA       GLU  36   9.084   2.623  -6.647
  296   1HB   GLU  36          2HB       GLU  36   8.392   0.219  -4.938
  297   2HB   GLU  36          1HB       GLU  36   9.664   0.278  -6.158
  298   1HG   GLU  36          2HG       GLU  36   9.603   2.289  -3.913
  299   2HG   GLU  36          1HG       GLU  36  10.310   0.695  -3.664
  300    H    TYR  37           H        TYR  37   6.023   1.081  -5.812
  301    HA   TYR  37           HA       TYR  37   5.673  -0.509  -8.081
  302   1HB   TYR  37          2HB       TYR  37   4.230  -0.372  -5.940
  303   2HB   TYR  37          1HB       TYR  37   3.372   0.925  -6.771
  304    HD1  TYR  37           HD1      TYR  37   4.665  -2.542  -7.435
  305    HD2  TYR  37           HD2      TYR  37   1.557   0.343  -8.127
  306    HE1  TYR  37           HE1      TYR  37   3.399  -4.222  -8.751
  307    HE2  TYR  37           HE2      TYR  37   0.286  -1.337  -9.434
  308    HH   TYR  37           HH       TYR  37   0.212  -3.432 -10.163
  309    H    LEU  38           H        LEU  38   4.104   2.665  -7.556
  310    HA   LEU  38           HA       LEU  38   3.301   3.013 -10.230
  311   1HB   LEU  38          2HB       LEU  38   3.545   4.728  -7.824
  312   2HB   LEU  38          1HB       LEU  38   3.535   5.574  -9.370
  313    HG   LEU  38           HG       LEU  38   1.247   5.244  -8.361
  314   1HD1  LEU  38          1HD1      LEU  38   1.925   5.297 -10.934
  315   2HD1  LEU  38          2HD1      LEU  38   0.261   4.998 -10.432
  316   3HD1  LEU  38          3HD1      LEU  38   1.300   3.649 -10.889
  317   1HD2  LEU  38          1HD2      LEU  38   1.493   2.357  -9.190
  318   2HD2  LEU  38          2HD2      LEU  38   0.300   3.106  -8.129
  319   3HD2  LEU  38          3HD2      LEU  38   1.949   2.859  -7.561
  320    H    LYS  39           H        LYS  39   6.208   4.096  -8.518
  321    HA   LYS  39           HA       LYS  39   7.327   5.579 -10.658
  322   1HB   LYS  39          2HB       LYS  39   8.005   5.814  -8.288
  323   2HB   LYS  39          1HB       LYS  39   8.747   4.218  -8.359
  324   1HG   LYS  39          2HG       LYS  39  10.233   5.008 -10.182
  325   2HG   LYS  39          1HG       LYS  39   9.514   6.616 -10.052
  326   1HD   LYS  39          2HD       LYS  39  10.201   6.643  -7.627
  327   2HD   LYS  39          1HD       LYS  39  11.074   5.136  -7.915
  328   1HE   LYS  39          2HE       LYS  39  11.562   7.599  -9.596
  329   2HE   LYS  39          1HE       LYS  39  12.430   7.317  -8.086
  330   1HZ   LYS  39          1HZ       LYS  39  12.319   5.100  -9.974
  331   2HZ   LYS  39          2HZ       LYS  39  13.581   5.600  -8.953
  332   3HZ   LYS  39          3HZ       LYS  39  13.290   6.421 -10.411
  333    H    GLY  40           H        GLY  40   7.274   2.167  -9.945
  334   1HA   GLY  40          2HA       GLY  40   9.347   1.635 -11.973
  335   2HA   GLY  40          1HA       GLY  40   8.730   0.471 -10.805
  336    H    PHE  41           H        PHE  41   5.992   0.800 -11.163
  337    HA   PHE  41           HA       PHE  41   5.493  -0.814 -13.442
  338   1HB   PHE  41          2HB       PHE  41   4.143  -0.619 -11.244
  339   2HB   PHE  41          1HB       PHE  41   3.382   0.783 -11.993
  340    HD1  PHE  41           HD1      PHE  41   1.477   0.446 -13.291
  341    HD2  PHE  41           HD2      PHE  41   4.267  -2.784 -12.790
  342    HE1  PHE  41           HE1      PHE  41  -0.036  -1.059 -14.553
  343    HE2  PHE  41           HE2      PHE  41   2.751  -4.287 -14.051
  344    HZ   PHE  41           HZ       PHE  41   0.602  -3.425 -14.934
  345    H    ARG  42           H        ARG  42   6.605   0.635 -15.010
  346    HA   ARG  42           HA       ARG  42   5.506   3.154 -15.737
  347   1HB   ARG  42          2HB       ARG  42   7.231   1.210 -17.294
  348   2HB   ARG  42          1HB       ARG  42   6.863   2.857 -17.808
  349   1HG   ARG  42          2HG       ARG  42   7.776   3.594 -15.515
  350   2HG   ARG  42          1HG       ARG  42   8.442   1.965 -15.392
  351   1HD   ARG  42          2HD       ARG  42  10.228   2.957 -16.429
  352   2HD   ARG  42          1HD       ARG  42   9.289   2.576 -17.869
  353    HE   ARG  42           HE       ARG  42   8.755   5.176 -16.656
  354   1HH1  ARG  42          1HH2      ARG  42  10.485   3.318 -19.022
  355   2HH1  ARG  42          2HH2      ARG  42  10.825   4.679 -20.034
  356   1HH2  ARG  42          1HH1      ARG  42   9.215   6.957 -17.980
  357   2HH2  ARG  42          2HH1      ARG  42  10.109   6.735 -19.447
  Start of MODEL   19
    1   1H    MET   1          1HT       MET   1   1.230  -4.299 -14.569
    2   2H    MET   1          2HT       MET   1   2.192  -3.374 -15.618
    3   3H    MET   1          3HT       MET   1   2.744  -3.732 -14.053
    4    HA   MET   1           HA       MET   1   2.770  -5.359 -16.454
    5   1HB   MET   1          2HB       MET   1   4.407  -5.462 -13.899
    6   2HB   MET   1          1HB       MET   1   4.827  -6.172 -15.458
    7   1HG   MET   1          2HG       MET   1   4.614  -3.226 -14.780
    8   2HG   MET   1          1HG       MET   1   6.060  -4.111 -15.259
    9   1HE   MET   1          1HE       MET   1   6.356  -5.349 -17.086
   10   2HE   MET   1          2HE       MET   1   6.261  -4.556 -18.655
   11   3HE   MET   1          3HE       MET   1   5.069  -5.778 -18.221
   12    H    ILE   2           H        ILE   2   3.749  -7.105 -13.772
   13    HA   ILE   2           HA       ILE   2   1.744  -9.100 -14.137
   14    HB   ILE   2           HB       ILE   2   4.132  -9.486 -13.388
   15   1HG1  ILE   2          2HG1      ILE   2   2.083 -10.645 -11.478
   16   2HG1  ILE   2          1HG1      ILE   2   2.173 -11.130 -13.171
   17   1HG2  ILE   2          1HG2      ILE   2   4.694  -9.170 -11.069
   18   2HG2  ILE   2          2HG2      ILE   2   3.042  -8.705 -10.668
   19   3HG2  ILE   2          3HG2      ILE   2   4.045  -7.637 -11.651
   20   1HD1  ILE   2          1HD1      ILE   2   3.483 -12.708 -11.905
   21   2HD1  ILE   2          2HD1      ILE   2   4.339 -11.410 -11.071
   22   3HD1  ILE   2          3HD1      ILE   2   4.612 -11.684 -12.791
   23    H    SER   3           H        SER   3   0.308  -9.915 -12.456
   24    HA   SER   3           HA       SER   3  -0.390  -8.141 -10.266
   25   1HB   SER   3          2HB       SER   3  -2.774  -7.955 -11.026
   26   2HB   SER   3          1HB       SER   3  -1.636  -7.056 -12.025
   27    HG   SER   3           HG       SER   3  -1.864  -8.501 -13.610
   28    H    ASN   4           H        ASN   4  -0.414  -9.598  -8.691
   29    HA   ASN   4           HA       ASN   4  -2.323 -11.786  -8.809
   30   1HB   ASN   4          2HB       ASN   4  -0.756 -13.540  -8.312
   31   2HB   ASN   4          1HB       ASN   4  -0.175 -12.708  -9.752
   32   1HD2  ASN   4          1HD2      ASN   4   1.345 -10.689  -9.060
   33   2HD2  ASN   4          2HD2      ASN   4   2.522 -11.080  -7.902
   34    H    ALA   5           H        ALA   5  -1.097 -13.104  -6.502
   35    HA   ALA   5           HA       ALA   5  -2.416 -11.952  -4.395
   36   1HB   ALA   5          1HB       ALA   5  -0.818 -13.182  -2.921
   37   2HB   ALA   5          2HB       ALA   5   0.175 -13.516  -4.339
   38   3HB   ALA   5          3HB       ALA   5  -1.459 -14.172  -4.233
   39    H    LYS   6           H        LYS   6   0.534 -10.886  -5.843
   40    HA   LYS   6           HA       LYS   6   1.571  -9.386  -3.656
   41   1HB   LYS   6          2HB       LYS   6   1.977  -8.999  -6.633
   42   2HB   LYS   6          1HB       LYS   6   2.971  -8.298  -5.355
   43   1HG   LYS   6          2HG       LYS   6   3.409 -10.676  -4.553
   44   2HG   LYS   6          1HG       LYS   6   2.653 -11.231  -6.046
   45   1HD   LYS   6          2HD       LYS   6   4.348 -10.337  -7.395
   46   2HD   LYS   6          1HD       LYS   6   4.867  -9.196  -6.155
   47   1HE   LYS   6          2HE       LYS   6   5.883 -10.931  -4.853
   48   2HE   LYS   6          1HE       LYS   6   5.132 -12.193  -5.828
   49   1HZ   LYS   6          1HZ       LYS   6   7.356 -11.991  -6.557
   50   2HZ   LYS   6          2HZ       LYS   6   7.258 -10.297  -6.651
   51   3HZ   LYS   6          3HZ       LYS   6   6.400 -11.263  -7.754
   52    H    ILE   7           H        ILE   7   0.318  -8.029  -6.707
   53    HA   ILE   7           HA       ILE   7  -0.186  -5.472  -5.694
   54    HB   ILE   7           HB       ILE   7  -1.241  -7.002  -8.060
   55   1HG1  ILE   7          2HG1      ILE   7   0.059  -5.383  -9.307
   56   2HG1  ILE   7          1HG1      ILE   7   0.317  -4.405  -7.865
   57   1HG2  ILE   7          1HG2      ILE   7  -2.264  -4.758  -8.760
   58   2HG2  ILE   7          2HG2      ILE   7  -2.125  -4.285  -7.066
   59   3HG2  ILE   7          3HG2      ILE   7  -3.137  -5.658  -7.520
   60   1HD1  ILE   7          1HD1      ILE   7   1.287  -7.263  -8.112
   61   2HD1  ILE   7          2HD1      ILE   7   1.724  -6.084  -6.876
   62   3HD1  ILE   7          3HD1      ILE   7   2.280  -5.868  -8.535
   63    H    ALA   8           H        ALA   8  -2.274  -8.329  -5.824
   64    HA   ALA   8           HA       ALA   8  -4.703  -7.169  -5.078
   65   1HB   ALA   8          1HB       ALA   8  -3.503  -9.893  -4.812
   66   2HB   ALA   8          2HB       ALA   8  -4.950  -9.386  -5.680
   67   3HB   ALA   8          3HB       ALA   8  -4.986  -9.545  -3.923
   68    H    ARG   9           H        ARG   9  -2.072  -8.429  -3.055
   69    HA   ARG   9           HA       ARG   9  -3.276  -8.019  -0.547
   70   1HB   ARG   9          2HB       ARG   9  -1.226  -9.366  -0.909
   71   2HB   ARG   9          1HB       ARG   9  -0.332  -7.889  -1.257
   72   1HG   ARG   9          2HG       ARG   9   0.069  -8.422   1.053
   73   2HG   ARG   9          1HG       ARG   9  -1.030  -7.043   1.028
   74   1HD   ARG   9          2HD       ARG   9  -1.619  -8.973   2.628
   75   2HD   ARG   9          1HD       ARG   9  -2.906  -8.380   1.582
   76    HE   ARG   9           HE       ARG   9  -1.408 -10.596   0.465
   77   1HH1  ARG   9          1HH2      ARG   9  -4.047  -9.592   2.474
   78   2HH1  ARG   9          2HH2      ARG   9  -4.934 -11.066   2.276
   79   1HH2  ARG   9          1HH1      ARG   9  -2.570 -12.528   0.207
   80   2HH2  ARG   9          2HH1      ARG   9  -4.103 -12.723   0.989
   81    H    ILE  10           H        ILE  10  -0.635  -6.050  -1.907
   82    HA   ILE  10           HA       ILE  10  -0.897  -3.893  -0.184
   83    HB   ILE  10           HB       ILE  10   0.606  -2.756  -1.547
   84   1HG1  ILE  10          2HG1      ILE  10  -0.641  -4.220  -3.890
   85   2HG1  ILE  10          1HG1      ILE  10  -0.772  -2.501  -3.533
   86   1HG2  ILE  10          1HG2      ILE  10   2.235  -4.348  -2.068
   87   2HG2  ILE  10          2HG2      ILE  10   1.054  -5.492  -2.705
   88   3HG2  ILE  10          3HG2      ILE  10   1.195  -5.248  -0.966
   89   1HD1  ILE  10          1HD1      ILE  10   1.527  -4.036  -4.661
   90   2HD1  ILE  10          2HD1      ILE  10   1.899  -2.674  -3.606
   91   3HD1  ILE  10          3HD1      ILE  10   0.948  -2.419  -5.069
   92    H    ASN  11           H        ASN  11  -2.646  -4.541  -3.192
   93    HA   ASN  11           HA       ASN  11  -3.855  -2.006  -3.498
   94   1HB   ASN  11          2HB       ASN  11  -3.961  -3.558  -5.324
   95   2HB   ASN  11          1HB       ASN  11  -4.768  -4.767  -4.328
   96   1HD2  ASN  11          1HD2      ASN  11  -6.879  -4.903  -5.121
   97   2HD2  ASN  11          2HD2      ASN  11  -7.883  -3.569  -5.425
   98    H    GLU  12           H        GLU  12  -5.323  -4.995  -2.212
   99    HA   GLU  12           HA       GLU  12  -7.639  -3.825  -1.174
  100   1HB   GLU  12          2HB       GLU  12  -6.783  -6.362  -1.413
  101   2HB   GLU  12          1HB       GLU  12  -6.460  -6.126   0.302
  102   1HG   GLU  12          2HG       GLU  12  -9.125  -5.586  -1.044
  103   2HG   GLU  12          1HG       GLU  12  -8.739  -7.034  -0.120
  104    H    LEU  13           H        LEU  13  -4.541  -4.542   0.451
  105    HA   LEU  13           HA       LEU  13  -5.222  -3.625   3.004
  106   1HB   LEU  13          2HB       LEU  13  -3.014  -4.762   2.000
  107   2HB   LEU  13          1HB       LEU  13  -2.461  -3.088   2.010
  108    HG   LEU  13           HG       LEU  13  -3.503  -4.681   4.376
  109   1HD1  LEU  13          1HD1      LEU  13  -0.820  -3.344   3.907
  110   2HD1  LEU  13          2HD1      LEU  13  -1.127  -5.057   3.619
  111   3HD1  LEU  13          3HD1      LEU  13  -1.257  -4.399   5.250
  112   1HD2  LEU  13          1HD2      LEU  13  -4.327  -2.476   4.724
  113   2HD2  LEU  13          2HD2      LEU  13  -2.876  -1.739   4.044
  114   3HD2  LEU  13          3HD2      LEU  13  -2.809  -2.525   5.620
  115    H    ALA  14           H        ALA  14  -3.639  -1.858   0.333
  116    HA   ALA  14           HA       ALA  14  -3.414   0.627   1.568
  117   1HB   ALA  14          1HB       ALA  14  -3.394   1.569  -0.719
  118   2HB   ALA  14          2HB       ALA  14  -3.947   0.017  -1.349
  119   3HB   ALA  14          3HB       ALA  14  -2.364   0.146  -0.581
  120    H    ALA  15           H        ALA  15  -6.042  -0.466  -0.592
  121    HA   ALA  15           HA       ALA  15  -7.689   1.792  -0.234
  122   1HB   ALA  15          1HB       ALA  15  -8.174  -1.033  -1.138
  123   2HB   ALA  15          2HB       ALA  15  -8.233   0.460  -2.076
  124   3HB   ALA  15          3HB       ALA  15  -9.522   0.084  -0.932
  125    H    LYS  16           H        LYS  16  -7.536  -1.297   1.481
  126    HA   LYS  16           HA       LYS  16  -9.799  -0.914   3.134
  127   1HB   LYS  16          2HB       LYS  16  -8.897  -3.125   2.916
  128   2HB   LYS  16          1HB       LYS  16  -7.313  -2.600   3.485
  129   1HG   LYS  16          2HG       LYS  16  -8.098  -2.272   5.702
  130   2HG   LYS  16          1HG       LYS  16  -9.786  -2.308   5.195
  131   1HD   LYS  16          2HD       LYS  16  -9.520  -4.699   4.562
  132   2HD   LYS  16          1HD       LYS  16  -7.860  -4.653   5.153
  133   1HE   LYS  16          2HE       LYS  16 -10.280  -3.996   6.858
  134   2HE   LYS  16          1HE       LYS  16  -9.502  -5.576   6.820
  135   1HZ   LYS  16          1HZ       LYS  16  -7.825  -3.222   7.290
  136   2HZ   LYS  16          2HZ       LYS  16  -7.662  -4.805   7.884
  137   3HZ   LYS  16          3HZ       LYS  16  -8.815  -3.757   8.559
  138    H    ALA  17           H        ALA  17  -6.337  -0.659   3.966
  139    HA   ALA  17           HA       ALA  17  -6.684   0.520   6.480
  140   1HB   ALA  17          1HB       ALA  17  -4.328   1.301   6.198
  141   2HB   ALA  17          2HB       ALA  17  -4.395   0.779   4.515
  142   3HB   ALA  17          3HB       ALA  17  -4.540  -0.406   5.814
  143    H    LYS  18           H        LYS  18  -7.211   1.793   3.354
  144    HA   LYS  18           HA       LYS  18  -6.803   4.574   4.120
  145   1HB   LYS  18          2HB       LYS  18  -6.356   3.979   1.819
  146   2HB   LYS  18          1HB       LYS  18  -7.977   3.314   1.631
  147   1HG   LYS  18          2HG       LYS  18  -8.993   5.454   1.797
  148   2HG   LYS  18          1HG       LYS  18  -7.518   6.192   2.423
  149   1HD   LYS  18          2HD       LYS  18  -6.398   5.874   0.277
  150   2HD   LYS  18          1HD       LYS  18  -7.803   5.017  -0.358
  151   1HE   LYS  18          2HE       LYS  18  -7.922   7.297  -1.156
  152   2HE   LYS  18          1HE       LYS  18  -9.167   7.096   0.078
  153   1HZ   LYS  18          1HZ       LYS  18  -6.460   8.196   0.603
  154   2HZ   LYS  18          2HZ       LYS  18  -7.766   8.132   1.689
  155   3HZ   LYS  18          3HZ       LYS  18  -7.838   9.147   0.330
  156    H    ALA  19           H        ALA  19  -9.659   2.869   2.806
  157    HA   ALA  19           HA       ALA  19 -11.474   4.772   3.966
  158   1HB   ALA  19          1HB       ALA  19 -11.957   3.587   1.842
  159   2HB   ALA  19          2HB       ALA  19 -13.223   3.335   3.044
  160   3HB   ALA  19          3HB       ALA  19 -12.040   2.066   2.729
  161    H    GLY  20           H        GLY  20  -9.702   2.352   5.331
  162   1HA   GLY  20          2HA       GLY  20 -11.786   1.533   7.250
  163   2HA   GLY  20          1HA       GLY  20 -10.233   0.739   7.021
  164    H    VAL  21           H        VAL  21  -8.284   1.984   7.668
  165    HA   VAL  21           HA       VAL  21  -8.578   4.213   9.475
  166    HB   VAL  21           HB       VAL  21  -7.427   2.867  11.368
  167   1HG1  VAL  21          1HG1      VAL  21 -10.298   2.088  10.887
  168   2HG1  VAL  21          2HG1      VAL  21  -9.854   3.762  11.219
  169   3HG1  VAL  21          3HG1      VAL  21  -9.508   2.508  12.407
  170   1HG2  VAL  21          1HG2      VAL  21  -6.996   0.817  10.108
  171   2HG2  VAL  21          2HG2      VAL  21  -8.714   0.635   9.760
  172   3HG2  VAL  21          3HG2      VAL  21  -8.126   0.469  11.414
  173    H    ILE  22           H        ILE  22  -7.061   5.197   8.130
  174    HA   ILE  22           HA       ILE  22  -4.493   3.934   7.653
  175    HB   ILE  22           HB       ILE  22  -5.635   5.425   5.985
  176   1HG1  ILE  22          2HG1      ILE  22  -3.450   6.899   5.689
  177   2HG1  ILE  22          1HG1      ILE  22  -2.837   5.870   6.984
  178   1HG2  ILE  22          1HG2      ILE  22  -6.213   7.080   7.973
  179   2HG2  ILE  22          2HG2      ILE  22  -5.931   7.697   6.344
  180   3HG2  ILE  22          3HG2      ILE  22  -4.650   7.783   7.551
  181   1HD1  ILE  22          1HD1      ILE  22  -3.705   5.105   4.211
  182   2HD1  ILE  22          2HD1      ILE  22  -3.782   3.913   5.509
  183   3HD1  ILE  22          3HD1      ILE  22  -2.239   4.652   5.081
  184    H    THR  23           H        THR  23  -2.725   4.139   8.872
  185    HA   THR  23           HA       THR  23  -2.559   6.360  10.806
  186    HB   THR  23           HB       THR  23  -1.738   3.555  11.549
  187    HG1  THR  23           HG1      THR  23  -4.175   4.794  12.256
  188   1HG2  THR  23          1HG2      THR  23  -2.219   4.617  13.855
  189   2HG2  THR  23          2HG2      THR  23  -2.227   6.157  12.997
  190   3HG2  THR  23          3HG2      THR  23  -0.775   5.158  12.999
  191    H    GLU  24           H        GLU  24  -0.432   6.879  11.486
  192    HA   GLU  24           HA       GLU  24   1.481   7.134   9.552
  193   1HB   GLU  24          2HB       GLU  24   2.988   7.794  11.250
  194   2HB   GLU  24          1HB       GLU  24   1.394   8.186  11.891
  195   1HG   GLU  24          2HG       GLU  24   1.420   5.897  13.016
  196   2HG   GLU  24          1HG       GLU  24   3.125   5.797  12.582
  197    H    GLU  25           H        GLU  25   1.123   4.453  11.830
  198    HA   GLU  25           HA       GLU  25   3.505   3.085  11.270
  199   1HB   GLU  25          2HB       GLU  25   0.849   1.820  11.973
  200   2HB   GLU  25          1HB       GLU  25   2.462   1.181  12.300
  201   1HG   GLU  25          2HG       GLU  25   2.881   3.296  13.667
  202   2HG   GLU  25          1HG       GLU  25   1.156   3.623  13.522
  203    H    GLU  26           H        GLU  26   0.242   2.500   9.924
  204    HA   GLU  26           HA       GLU  26   1.107   0.605   7.999
  205   1HB   GLU  26          2HB       GLU  26  -1.305   2.389   7.667
  206   2HB   GLU  26          1HB       GLU  26  -1.074   0.739   7.090
  207   1HG   GLU  26          2HG       GLU  26  -0.777   0.219   9.672
  208   2HG   GLU  26          1HG       GLU  26  -1.701   1.709   9.857
  209    H    LYS  27           H        LYS  27   0.696   4.112   7.938
  210    HA   LYS  27           HA       LYS  27   0.985   4.626   5.221
  211   1HB   LYS  27          2HB       LYS  27   0.504   6.299   7.080
  212   2HB   LYS  27          1HB       LYS  27   2.237   6.308   7.403
  213   1HG   LYS  27          2HG       LYS  27   2.091   8.070   5.900
  214   2HG   LYS  27          1HG       LYS  27   2.391   6.737   4.789
  215   1HD   LYS  27          2HD       LYS  27   0.539   7.651   3.761
  216   2HD   LYS  27          1HD       LYS  27  -0.280   6.559   4.879
  217   1HE   LYS  27          2HE       LYS  27  -1.403   8.526   5.353
  218   2HE   LYS  27          1HE       LYS  27  -0.087   8.643   6.518
  219   1HZ   LYS  27          1HZ       LYS  27  -0.038   9.826   3.795
  220   2HZ   LYS  27          2HZ       LYS  27   1.138  10.021   5.007
  221   3HZ   LYS  27          3HZ       LYS  27  -0.413  10.687   5.207
  222    H    ALA  28           H        ALA  28   3.487   4.165   7.699
  223    HA   ALA  28           HA       ALA  28   5.737   4.630   6.069
  224   1HB   ALA  28          1HB       ALA  28   6.714   2.847   7.825
  225   2HB   ALA  28          2HB       ALA  28   5.214   3.255   8.658
  226   3HB   ALA  28          3HB       ALA  28   6.378   4.521   8.270
  227    H    GLU  29           H        GLU  29   4.094   1.599   6.949
  228    HA   GLU  29           HA       GLU  29   5.670  -0.156   5.434
  229   1HB   GLU  29          2HB       GLU  29   3.849  -0.671   7.187
  230   2HB   GLU  29          1HB       GLU  29   2.705  -0.525   5.856
  231   1HG   GLU  29          2HG       GLU  29   5.123  -2.331   5.708
  232   2HG   GLU  29          1HG       GLU  29   3.577  -2.881   6.351
  233    H    GLN  30           H        GLN  30   2.377   0.891   4.581
  234    HA   GLN  30           HA       GLN  30   2.306   0.038   1.966
  235   1HB   GLN  30          2HB       GLN  30   1.023   2.600   2.921
  236   2HB   GLN  30          1HB       GLN  30   0.457   1.524   1.644
  237   1HG   GLN  30          2HG       GLN  30   0.751  -0.088   3.956
  238   2HG   GLN  30          1HG       GLN  30  -0.050   1.387   4.487
  239   1HE2  GLN  30          1HE2      GLN  30  -0.269  -0.849   1.652
  240   2HE2  GLN  30          2HE2      GLN  30  -1.965  -0.879   1.631
  241    H    GLN  31           H        GLN  31   4.111   2.715   3.228
  242    HA   GLN  31           HA       GLN  31   4.285   4.400   1.011
  243   1HB   GLN  31          2HB       GLN  31   5.226   4.845   3.306
  244   2HB   GLN  31          1HB       GLN  31   6.574   3.788   2.888
  245   1HG   GLN  31          2HG       GLN  31   7.323   5.224   1.167
  246   2HG   GLN  31          1HG       GLN  31   5.788   6.083   1.097
  247   1HE2  GLN  31          1HE2      GLN  31   8.111   7.604   1.374
  248   2HE2  GLN  31          2HE2      GLN  31   8.187   8.253   2.943
  249    H    LYS  32           H        LYS  32   6.310   1.588   1.829
  250    HA   LYS  32           HA       LYS  32   8.097   1.753  -0.332
  251   1HB   LYS  32          2HB       LYS  32   7.187  -0.429   1.499
  252   2HB   LYS  32          1HB       LYS  32   8.123  -0.866   0.071
  253   1HG   LYS  32          2HG       LYS  32   9.583  -0.480   2.032
  254   2HG   LYS  32          1HG       LYS  32   9.912   0.674   0.744
  255   1HD   LYS  32          2HD       LYS  32   8.579   2.379   1.870
  256   2HD   LYS  32          1HD       LYS  32   8.104   1.228   3.120
  257   1HE   LYS  32          2HE       LYS  32  10.886   2.295   2.570
  258   2HE   LYS  32          1HE       LYS  32   9.908   2.562   4.010
  259   1HZ   LYS  32          1HZ       LYS  32  11.050   0.832   4.809
  260   2HZ   LYS  32          2HZ       LYS  32  11.527   0.286   3.273
  261   3HZ   LYS  32          3HZ       LYS  32   9.995  -0.120   3.885
  262    H    LEU  33           H        LEU  33   5.488  -0.638  -0.031
  263    HA   LEU  33           HA       LEU  33   5.436  -1.511  -2.651
  264   1HB   LEU  33          2HB       LEU  33   2.726  -1.380  -1.673
  265   2HB   LEU  33          1HB       LEU  33   3.755  -2.790  -1.892
  266    HG   LEU  33           HG       LEU  33   3.856  -0.959   0.530
  267   1HD1  LEU  33          1HD1      LEU  33   2.833  -3.052   1.632
  268   2HD1  LEU  33          2HD1      LEU  33   2.407  -3.550  -0.001
  269   3HD1  LEU  33          3HD1      LEU  33   1.761  -2.049   0.657
  270   1HD2  LEU  33          1HD2      LEU  33   5.554  -2.284   1.321
  271   2HD2  LEU  33          2HD2      LEU  33   5.816  -2.628  -0.386
  272   3HD2  LEU  33          3HD2      LEU  33   4.884  -3.749   0.605
  273    H    ARG  34           H        ARG  34   3.809   1.290  -1.231
  274    HA   ARG  34           HA       ARG  34   2.247   2.008  -3.467
  275   1HB   ARG  34          2HB       ARG  34   1.771   3.047  -1.363
  276   2HB   ARG  34          1HB       ARG  34   3.421   3.655  -1.218
  277   1HG   ARG  34          2HG       ARG  34   3.105   5.290  -2.867
  278   2HG   ARG  34          1HG       ARG  34   1.735   4.439  -3.583
  279   1HD   ARG  34          2HD       ARG  34   1.109   6.496  -2.253
  280   2HD   ARG  34          1HD       ARG  34   0.303   5.017  -1.738
  281    HE   ARG  34           HE       ARG  34   1.410   5.195   0.293
  282   1HH1  ARG  34          1HH2      ARG  34   2.966   7.149  -2.108
  283   2HH1  ARG  34          2HH2      ARG  34   4.038   7.914  -0.984
  284   1HH2  ARG  34          1HH1      ARG  34   2.816   6.181   1.765
  285   2HH2  ARG  34          2HH1      ARG  34   3.956   7.364   1.212
  286    H    GLN  35           H        GLN  35   5.513   2.981  -2.458
  287    HA   GLN  35           HA       GLN  35   6.029   4.791  -4.537
  288   1HB   GLN  35          2HB       GLN  35   7.414   4.219  -2.391
  289   2HB   GLN  35          1HB       GLN  35   8.196   3.030  -3.434
  290   1HG   GLN  35          2HG       GLN  35   9.541   4.937  -3.725
  291   2HG   GLN  35          1HG       GLN  35   8.458   5.004  -5.112
  292   1HE2  GLN  35          1HE2      GLN  35   9.686   7.382  -4.158
  293   2HE2  GLN  35          2HE2      GLN  35   8.495   8.373  -3.466
  294    H    GLU  36           H        GLU  36   6.096   1.291  -4.444
  295    HA   GLU  36           HA       GLU  36   7.611   0.840  -6.794
  296   1HB   GLU  36          2HB       GLU  36   6.599  -0.792  -4.899
  297   2HB   GLU  36          1HB       GLU  36   5.387  -1.032  -6.154
  298   1HG   GLU  36          2HG       GLU  36   8.363  -1.249  -6.677
  299   2HG   GLU  36          1HG       GLU  36   7.366  -2.630  -6.230
  300    H    TYR  37           H        TYR  37   4.068   0.745  -6.304
  301    HA   TYR  37           HA       TYR  37   3.282   0.486  -8.945
  302   1HB   TYR  37          2HB       TYR  37   1.870   0.526  -6.750
  303   2HB   TYR  37          1HB       TYR  37   1.727   2.254  -7.077
  304    HD1  TYR  37           HD1      TYR  37   0.889   2.988  -9.380
  305    HD2  TYR  37           HD2      TYR  37   0.558  -1.046  -7.941
  306    HE1  TYR  37           HE1      TYR  37  -0.849   2.521 -11.084
  307    HE2  TYR  37           HE2      TYR  37  -1.181  -1.511  -9.648
  308    HH   TYR  37           HH       TYR  37  -1.971   0.833 -12.149
  309    H    LEU  38           H        LEU  38   3.630   3.553  -7.132
  310    HA   LEU  38           HA       LEU  38   3.056   5.288  -9.255
  311   1HB   LEU  38          2HB       LEU  38   4.993   5.834  -6.995
  312   2HB   LEU  38          1HB       LEU  38   4.119   7.023  -7.957
  313    HG   LEU  38           HG       LEU  38   2.904   4.996  -6.059
  314   1HD1  LEU  38          1HD1      LEU  38   3.674   6.760  -4.737
  315   2HD1  LEU  38          2HD1      LEU  38   2.033   7.281  -5.112
  316   3HD1  LEU  38          3HD1      LEU  38   3.400   7.959  -5.999
  317   1HD2  LEU  38          1HD2      LEU  38   0.817   6.508  -6.683
  318   2HD2  LEU  38          2HD2      LEU  38   1.258   5.133  -7.696
  319   3HD2  LEU  38          3HD2      LEU  38   1.721   6.767  -8.175
  320    H    LYS  39           H        LYS  39   6.295   4.270  -8.077
  321    HA   LYS  39           HA       LYS  39   7.710   5.561 -10.164
  322   1HB   LYS  39          2HB       LYS  39   8.607   4.614  -7.928
  323   2HB   LYS  39          1HB       LYS  39   8.708   3.076  -8.785
  324   1HG   LYS  39          2HG       LYS  39  10.109   4.150 -10.526
  325   2HG   LYS  39          1HG       LYS  39  10.025   5.674  -9.643
  326   1HD   LYS  39          2HD       LYS  39  12.009   4.877  -8.788
  327   2HD   LYS  39          1HD       LYS  39  10.900   4.124  -7.642
  328   1HE   LYS  39          2HE       LYS  39  10.868   2.225  -9.545
  329   2HE   LYS  39          1HE       LYS  39  12.470   2.890  -9.856
  330   1HZ   LYS  39          1HZ       LYS  39  12.653   1.146  -8.254
  331   2HZ   LYS  39          2HZ       LYS  39  11.450   1.838  -7.276
  332   3HZ   LYS  39          3HZ       LYS  39  12.948   2.617  -7.465
  333    H    GLY  40           H        GLY  40   5.706   2.856 -10.180
  334   1HA   GLY  40          2HA       GLY  40   7.006   1.571 -12.474
  335   2HA   GLY  40          1HA       GLY  40   5.623   0.952 -11.574
  336    H    PHE  41           H        PHE  41   4.717   3.984 -11.845
  337    HA   PHE  41           HA       PHE  41   2.777   3.569 -13.832
  338   1HB   PHE  41          2HB       PHE  41   3.019   5.405 -11.931
  339   2HB   PHE  41          1HB       PHE  41   3.738   6.341 -13.240
  340    HD1  PHE  41           HD1      PHE  41   2.415   7.063 -15.154
  341    HD2  PHE  41           HD2      PHE  41   0.677   4.654 -12.048
  342    HE1  PHE  41           HE1      PHE  41   0.149   7.551 -16.041
  343    HE2  PHE  41           HE2      PHE  41  -1.588   5.143 -12.935
  344    HZ   PHE  41           HZ       PHE  41  -1.851   6.594 -14.931
  345    H    ARG  42           H        ARG  42   2.591   4.385 -15.957
  346    HA   ARG  42           HA       ARG  42   4.949   4.192 -17.519
  347   1HB   ARG  42          2HB       ARG  42   2.133   5.081 -18.133
  348   2HB   ARG  42          1HB       ARG  42   3.394   5.045 -19.363
  349   1HG   ARG  42          2HG       ARG  42   3.205   2.589 -17.732
  350   2HG   ARG  42          1HG       ARG  42   1.797   2.909 -18.743
  351   1HD   ARG  42          2HD       ARG  42   3.713   1.550 -19.800
  352   2HD   ARG  42          1HD       ARG  42   3.074   2.901 -20.729
  353    HE   ARG  42           HE       ARG  42   5.069   4.096 -20.312
  354   1HH1  ARG  42          1HH2      ARG  42   4.973   1.038 -18.674
  355   2HH1  ARG  42          2HH2      ARG  42   6.669   1.024 -18.324
  356   1HH2  ARG  42          1HH1      ARG  42   7.280   4.081 -19.837
  357   2HH2  ARG  42          2HH1      ARG  42   7.974   2.744 -18.986
  Start of MODEL   20
    1   1H    MET   1          1HT       MET   1  -0.642  -6.860 -17.508
    2   2H    MET   1          2HT       MET   1  -2.071  -5.941 -17.477
    3   3H    MET   1          3HT       MET   1  -2.004  -7.385 -18.371
    4    HA   MET   1           HA       MET   1  -2.746  -7.023 -15.688
    5   1HB   MET   1          2HB       MET   1  -2.390  -9.499 -17.410
    6   2HB   MET   1          1HB       MET   1  -3.300  -9.432 -15.900
    7   1HG   MET   1          2HG       MET   1  -5.048  -8.271 -16.843
    8   2HG   MET   1          1HG       MET   1  -4.011  -7.433 -17.997
    9   1HE   MET   1          1HE       MET   1  -6.359  -9.105 -20.409
   10   2HE   MET   1          2HE       MET   1  -6.040  -7.725 -19.361
   11   3HE   MET   1          3HE       MET   1  -6.992  -9.080 -18.758
   12    H    ILE   2           H        ILE   2  -2.132  -8.904 -14.099
   13    HA   ILE   2           HA       ILE   2   0.729  -9.517 -14.158
   14    HB   ILE   2           HB       ILE   2   0.426  -8.831 -11.512
   15   1HG1  ILE   2          2HG1      ILE   2  -0.434  -6.465 -11.593
   16   2HG1  ILE   2          1HG1      ILE   2  -1.052  -6.792 -13.211
   17   1HG2  ILE   2          1HG2      ILE   2   1.418  -7.007 -13.722
   18   2HG2  ILE   2          2HG2      ILE   2   2.330  -8.369 -13.074
   19   3HG2  ILE   2          3HG2      ILE   2   1.934  -6.999 -12.036
   20   1HD1  ILE   2          1HD1      ILE   2  -1.788  -8.697 -11.025
   21   2HD1  ILE   2          2HD1      ILE   2  -2.721  -8.195 -12.436
   22   3HD1  ILE   2          3HD1      ILE   2  -2.577  -7.120 -11.046
   23    H    SER   3           H        SER   3  -2.424  -9.912 -12.624
   24    HA   SER   3           HA       SER   3  -3.417 -11.694 -11.576
   25   1HB   SER   3          2HB       SER   3  -3.109 -13.014 -13.498
   26   2HB   SER   3          1HB       SER   3  -1.362 -13.062 -13.303
   27    HG   SER   3           HG       SER   3  -1.576 -14.505 -11.685
   28    H    ASN   4           H        ASN   4  -0.478 -10.547 -10.800
   29    HA   ASN   4           HA       ASN   4   0.466 -12.516  -8.942
   30   1HB   ASN   4          2HB       ASN   4   1.125  -9.576  -9.212
   31   2HB   ASN   4          1HB       ASN   4   2.000 -10.730  -8.207
   32   1HD2  ASN   4          1HD2      ASN   4   2.404  -9.182 -11.028
   33   2HD2  ASN   4          2HD2      ASN   4   3.193 -10.378 -11.935
   34    H    ALA   5           H        ALA   5   0.098 -12.716  -6.810
   35    HA   ALA   5           HA       ALA   5  -2.218 -11.580  -5.634
   36   1HB   ALA   5          1HB       ALA   5  -1.104 -13.758  -4.975
   37   2HB   ALA   5          2HB       ALA   5  -1.543 -12.711  -3.624
   38   3HB   ALA   5          3HB       ALA   5   0.133 -12.798  -4.167
   39    H    LYS   6           H        LYS   6   0.755 -10.259  -6.306
   40    HA   LYS   6           HA       LYS   6   1.302  -8.659  -4.039
   41   1HB   LYS   6          2HB       LYS   6   2.827  -9.161  -6.034
   42   2HB   LYS   6          1HB       LYS   6   1.921  -7.921  -6.906
   43   1HG   LYS   6          2HG       LYS   6   2.564  -6.225  -5.330
   44   2HG   LYS   6          1HG       LYS   6   3.228  -7.423  -4.216
   45   1HD   LYS   6          2HD       LYS   6   4.895  -8.051  -5.994
   46   2HD   LYS   6          1HD       LYS   6   4.301  -6.700  -6.958
   47   1HE   LYS   6          2HE       LYS   6   5.450  -6.460  -4.160
   48   2HE   LYS   6          1HE       LYS   6   6.323  -6.088  -5.645
   49   1HZ   LYS   6          1HZ       LYS   6   5.442  -4.072  -4.792
   50   2HZ   LYS   6          2HZ       LYS   6   3.891  -4.743  -4.605
   51   3HZ   LYS   6          3HZ       LYS   6   4.524  -4.475  -6.159
   52    H    ILE   7           H        ILE   7  -0.251  -7.827  -7.151
   53    HA   ILE   7           HA       ILE   7  -1.026  -5.223  -6.444
   54    HB   ILE   7           HB       ILE   7  -1.991  -7.218  -8.469
   55   1HG1  ILE   7          2HG1      ILE   7  -1.318  -5.296  -9.974
   56   2HG1  ILE   7          1HG1      ILE   7  -0.768  -4.441  -8.534
   57   1HG2  ILE   7          1HG2      ILE   7  -3.353  -4.635  -7.671
   58   2HG2  ILE   7          2HG2      ILE   7  -4.082  -6.226  -7.900
   59   3HG2  ILE   7          3HG2      ILE   7  -3.512  -5.309  -9.294
   60   1HD1  ILE   7          1HD1      ILE   7   0.986  -5.805  -9.855
   61   2HD1  ILE   7          2HD1      ILE   7   0.208  -7.227  -9.158
   62   3HD1  ILE   7          3HD1      ILE   7   0.940  -6.015  -8.105
   63    H    ALA   8           H        ALA   8  -2.714  -8.321  -6.087
   64    HA   ALA   8           HA       ALA   8  -5.158  -7.379  -5.106
   65   1HB   ALA   8          1HB       ALA   8  -5.601  -9.578  -4.511
   66   2HB   ALA   8          2HB       ALA   8  -3.939  -9.887  -4.006
   67   3HB   ALA   8          3HB       ALA   8  -4.338  -9.801  -5.722
   68    H    ARG   9           H        ARG   9  -2.114  -8.070  -3.432
   69    HA   ARG   9           HA       ARG   9  -3.040  -7.728  -0.790
   70   1HB   ARG   9          2HB       ARG   9  -0.821  -8.714  -1.484
   71   2HB   ARG   9          1HB       ARG   9  -0.263  -7.070  -1.793
   72   1HG   ARG   9          2HG       ARG   9  -1.158  -6.624   0.651
   73   2HG   ARG   9          1HG       ARG   9  -0.974  -8.369   0.819
   74   1HD   ARG   9          2HD       ARG   9   1.369  -8.249   0.254
   75   2HD   ARG   9          1HD       ARG   9   1.227  -6.549  -0.186
   76    HE   ARG   9           HE       ARG   9   0.442  -7.020   2.534
   77   1HH1  ARG   9          1HH2      ARG   9   3.140  -6.652   0.392
   78   2HH1  ARG   9          2HH2      ARG   9   4.210  -6.063   1.620
   79   1HH2  ARG   9          1HH1      ARG   9   1.838  -6.245   4.144
   80   2HH2  ARG   9          2HH1      ARG   9   3.472  -5.832   3.744
   81    H    ILE  10           H        ILE  10  -0.873  -5.430  -2.436
   82    HA   ILE  10           HA       ILE  10  -1.289  -3.240  -0.839
   83    HB   ILE  10           HB       ILE  10  -0.793  -3.344  -3.822
   84   1HG1  ILE  10          2HG1      ILE  10   1.156  -2.647  -1.624
   85   2HG1  ILE  10          1HG1      ILE  10   0.857  -4.327  -2.068
   86   1HG2  ILE  10          1HG2      ILE  10   0.149  -0.979  -3.327
   87   2HG2  ILE  10          2HG2      ILE  10  -0.854  -1.033  -1.877
   88   3HG2  ILE  10          3HG2      ILE  10  -1.601  -1.148  -3.472
   89   1HD1  ILE  10          1HD1      ILE  10   2.771  -3.489  -3.332
   90   2HD1  ILE  10          2HD1      ILE  10   1.820  -2.124  -3.917
   91   3HD1  ILE  10          3HD1      ILE  10   1.422  -3.762  -4.435
   92    H    ASN  11           H        ASN  11  -3.277  -4.317  -3.562
   93    HA   ASN  11           HA       ASN  11  -4.985  -2.097  -3.750
   94   1HB   ASN  11          2HB       ASN  11  -5.024  -3.773  -5.470
   95   2HB   ASN  11          1HB       ASN  11  -5.450  -5.031  -4.315
   96   1HD2  ASN  11          1HD2      ASN  11  -7.515  -5.603  -5.120
   97   2HD2  ASN  11          2HD2      ASN  11  -8.814  -4.515  -5.223
   98    H    GLU  12           H        GLU  12  -5.642  -5.201  -2.096
   99    HA   GLU  12           HA       GLU  12  -7.954  -4.321  -0.747
  100   1HB   GLU  12          2HB       GLU  12  -7.042  -6.728  -1.101
  101   2HB   GLU  12          1HB       GLU  12  -6.120  -6.428   0.371
  102   1HG   GLU  12          2HG       GLU  12  -8.030  -7.262   1.341
  103   2HG   GLU  12          1HG       GLU  12  -8.518  -5.574   1.221
  104    H    LEU  13           H        LEU  13  -4.557  -4.463   0.282
  105    HA   LEU  13           HA       LEU  13  -4.883  -3.642   2.941
  106   1HB   LEU  13          2HB       LEU  13  -2.764  -4.441   1.543
  107   2HB   LEU  13          1HB       LEU  13  -2.498  -2.706   1.400
  108    HG   LEU  13           HG       LEU  13  -2.889  -4.204   4.012
  109   1HD1  LEU  13          1HD1      LEU  13  -0.552  -4.008   4.354
  110   2HD1  LEU  13          2HD1      LEU  13  -0.369  -2.853   3.035
  111   3HD1  LEU  13          3HD1      LEU  13  -0.704  -4.549   2.684
  112   1HD2  LEU  13          1HD2      LEU  13  -1.865  -1.876   4.781
  113   2HD2  LEU  13          2HD2      LEU  13  -3.599  -2.045   4.513
  114   3HD2  LEU  13          3HD2      LEU  13  -2.584  -1.310   3.273
  115    H    ALA  14           H        ALA  14  -4.243  -1.701   0.026
  116    HA   ALA  14           HA       ALA  14  -4.074   0.814   1.185
  117   1HB   ALA  14          1HB       ALA  14  -4.841   1.678  -1.028
  118   2HB   ALA  14          2HB       ALA  14  -5.231   0.023  -1.498
  119   3HB   ALA  14          3HB       ALA  14  -3.559   0.474  -1.158
  120    H    ALA  15           H        ALA  15  -7.001  -0.549  -0.347
  121    HA   ALA  15           HA       ALA  15  -8.761   1.443   0.562
  122   1HB   ALA  15          1HB       ALA  15  -9.514  -1.429   0.007
  123   2HB   ALA  15          2HB       ALA  15  -9.182  -0.256  -1.267
  124   3HB   ALA  15          3HB       ALA  15 -10.528   0.004  -0.156
  125    H    LYS  16           H        LYS  16  -7.721  -1.583   2.046
  126    HA   LYS  16           HA       LYS  16  -9.626  -1.662   4.132
  127   1HB   LYS  16          2HB       LYS  16  -8.206  -3.595   3.517
  128   2HB   LYS  16          1HB       LYS  16  -6.795  -2.741   4.143
  129   1HG   LYS  16          2HG       LYS  16  -7.692  -2.729   6.376
  130   2HG   LYS  16          1HG       LYS  16  -9.259  -3.310   5.810
  131   1HD   LYS  16          2HD       LYS  16  -8.153  -5.419   5.047
  132   2HD   LYS  16          1HD       LYS  16  -6.644  -4.845   5.757
  133   1HE   LYS  16          2HE       LYS  16  -7.867  -4.626   7.959
  134   2HE   LYS  16          1HE       LYS  16  -9.238  -5.439   7.204
  135   1HZ   LYS  16          1HZ       LYS  16  -6.999  -6.952   6.611
  136   2HZ   LYS  16          2HZ       LYS  16  -8.260  -7.348   7.679
  137   3HZ   LYS  16          3HZ       LYS  16  -6.869  -6.562   8.257
  138    H    ALA  17           H        ALA  17  -6.174  -0.834   4.410
  139    HA   ALA  17           HA       ALA  17  -6.347   0.365   6.931
  140   1HB   ALA  17          1HB       ALA  17  -4.375   0.998   4.723
  141   2HB   ALA  17          2HB       ALA  17  -4.231  -0.350   5.851
  142   3HB   ALA  17          3HB       ALA  17  -4.155   1.309   6.444
  143    H    LYS  18           H        LYS  18  -7.288   1.545   3.821
  144    HA   LYS  18           HA       LYS  18  -7.171   4.346   4.611
  145   1HB   LYS  18          2HB       LYS  18  -6.750   3.673   2.269
  146   2HB   LYS  18          1HB       LYS  18  -8.409   3.086   2.153
  147   1HG   LYS  18          2HG       LYS  18  -9.254   5.347   2.645
  148   2HG   LYS  18          1HG       LYS  18  -7.601   5.940   2.796
  149   1HD   LYS  18          2HD       LYS  18  -8.103   6.509   0.587
  150   2HD   LYS  18          1HD       LYS  18  -7.314   4.945   0.380
  151   1HE   LYS  18          2HE       LYS  18  -9.449   3.816   0.211
  152   2HE   LYS  18          1HE       LYS  18 -10.315   5.293   0.633
  153   1HZ   LYS  18          1HZ       LYS  18  -8.832   4.674  -1.844
  154   2HZ   LYS  18          2HZ       LYS  18  -9.165   6.279  -1.395
  155   3HZ   LYS  18          3HZ       LYS  18 -10.439   5.190  -1.671
  156    H    ALA  19           H        ALA  19  -9.863   2.339   3.388
  157    HA   ALA  19           HA       ALA  19 -11.836   4.067   4.536
  158   1HB   ALA  19          1HB       ALA  19 -13.445   2.425   3.714
  159   2HB   ALA  19          2HB       ALA  19 -12.142   1.272   3.421
  160   3HB   ALA  19          3HB       ALA  19 -12.231   2.760   2.479
  161    H    GLY  20           H        GLY  20  -9.853   1.799   5.966
  162   1HA   GLY  20          2HA       GLY  20 -11.871   0.951   7.942
  163   2HA   GLY  20          1HA       GLY  20 -10.275   0.240   7.735
  164    H    VAL  21           H        VAL  21  -8.406   1.615   8.318
  165    HA   VAL  21           HA       VAL  21  -8.776   3.924   9.985
  166    HB   VAL  21           HB       VAL  21  -7.616   2.691  11.979
  167   1HG1  VAL  21          1HG1      VAL  21 -10.096   3.597  11.639
  168   2HG1  VAL  21          2HG1      VAL  21  -9.658   2.647  13.057
  169   3HG1  VAL  21          3HG1      VAL  21 -10.480   1.877  11.701
  170   1HG2  VAL  21          1HG2      VAL  21  -7.234   0.542  10.954
  171   2HG2  VAL  21          2HG2      VAL  21  -8.922   0.410  10.463
  172   3HG2  VAL  21          3HG2      VAL  21  -8.490   0.320  12.171
  173    H    ILE  22           H        ILE  22  -7.248   4.799   8.553
  174    HA   ILE  22           HA       ILE  22  -4.741   3.570   8.005
  175    HB   ILE  22           HB       ILE  22  -5.781   5.298   6.557
  176   1HG1  ILE  22          2HG1      ILE  22  -3.600   6.757   6.436
  177   2HG1  ILE  22          1HG1      ILE  22  -3.002   5.641   7.663
  178   1HG2  ILE  22          1HG2      ILE  22  -6.466   6.692   8.642
  179   2HG2  ILE  22          2HG2      ILE  22  -5.959   7.552   7.189
  180   3HG2  ILE  22          3HG2      ILE  22  -4.837   7.364   8.535
  181   1HD1  ILE  22          1HD1      ILE  22  -4.149   4.808   4.981
  182   2HD1  ILE  22          2HD1      ILE  22  -3.454   3.734   6.195
  183   3HD1  ILE  22          3HD1      ILE  22  -2.429   4.898   5.358
  184    H    THR  23           H        THR  23  -3.013   3.394   9.246
  185    HA   THR  23           HA       THR  23  -2.764   5.154  11.612
  186    HB   THR  23           HB       THR  23  -1.182   3.179  12.331
  187    HG1  THR  23           HG1      THR  23  -3.000   1.669  10.850
  188   1HG2  THR  23          1HG2      THR  23  -3.189   3.744  13.556
  189   2HG2  THR  23          2HG2      THR  23  -3.186   2.000  13.290
  190   3HG2  THR  23          3HG2      THR  23  -4.208   3.041  12.299
  191    H    GLU  24           H        GLU  24  -0.738   6.007  12.131
  192    HA   GLU  24           HA       GLU  24   0.860   6.957  10.081
  193   1HB   GLU  24          2HB       GLU  24   0.793   7.695  12.531
  194   2HB   GLU  24          1HB       GLU  24   1.914   6.373  12.851
  195   1HG   GLU  24          2HG       GLU  24   3.184   8.420  12.483
  196   2HG   GLU  24          1HG       GLU  24   3.463   7.316  11.138
  197    H    GLU  25           H        GLU  25   1.253   4.033  12.039
  198    HA   GLU  25           HA       GLU  25   3.764   3.216  11.077
  199   1HB   GLU  25          2HB       GLU  25   1.410   1.656  12.154
  200   2HB   GLU  25          1HB       GLU  25   2.949   0.901  11.743
  201   1HG   GLU  25          2HG       GLU  25   2.752   3.264  13.623
  202   2HG   GLU  25          1HG       GLU  25   2.667   1.596  14.186
  203    H    GLU  26           H        GLU  26   0.485   2.330   9.971
  204    HA   GLU  26           HA       GLU  26   1.316   0.690   7.825
  205   1HB   GLU  26          2HB       GLU  26  -1.042   0.980   8.893
  206   2HB   GLU  26          1HB       GLU  26  -1.222   2.304   7.743
  207   1HG   GLU  26          2HG       GLU  26  -2.078   0.428   6.586
  208   2HG   GLU  26          1HG       GLU  26  -0.445   0.607   5.954
  209    H    LYS  27           H        LYS  27   0.701   4.156   8.091
  210    HA   LYS  27           HA       LYS  27   0.738   4.896   5.406
  211   1HB   LYS  27          2HB       LYS  27   0.434   6.297   7.629
  212   2HB   LYS  27          1HB       LYS  27   2.161   6.590   7.430
  213   1HG   LYS  27          2HG       LYS  27   1.164   8.370   6.247
  214   2HG   LYS  27          1HG       LYS  27   1.562   7.208   4.981
  215   1HD   LYS  27          2HD       LYS  27  -0.670   6.523   4.727
  216   2HD   LYS  27          1HD       LYS  27  -1.133   7.113   6.323
  217   1HE   LYS  27          2HE       LYS  27  -1.998   8.575   4.515
  218   2HE   LYS  27          1HE       LYS  27  -0.874   9.434   5.568
  219   1HZ   LYS  27          1HZ       LYS  27  -0.156   9.976   3.452
  220   2HZ   LYS  27          2HZ       LYS  27  -0.444   8.422   2.831
  221   3HZ   LYS  27          3HZ       LYS  27   0.876   8.695   3.867
  222    H    ALA  28           H        ALA  28   3.442   4.452   7.664
  223    HA   ALA  28           HA       ALA  28   5.520   5.179   5.903
  224   1HB   ALA  28          1HB       ALA  28   6.938   3.746   7.449
  225   2HB   ALA  28          2HB       ALA  28   5.450   3.352   8.310
  226   3HB   ALA  28          3HB       ALA  28   6.010   5.022   8.237
  227    H    GLU  29           H        GLU  29   3.987   2.052   6.590
  228    HA   GLU  29           HA       GLU  29   5.642   0.416   5.021
  229   1HB   GLU  29          2HB       GLU  29   3.918  -0.399   6.633
  230   2HB   GLU  29          1HB       GLU  29   2.668   0.085   5.487
  231   1HG   GLU  29          2HG       GLU  29   3.775  -1.403   3.776
  232   2HG   GLU  29          1HG       GLU  29   4.834  -1.990   5.057
  233    H    GLN  30           H        GLN  30   2.409   1.641   4.149
  234    HA   GLN  30           HA       GLN  30   2.369   0.939   1.482
  235   1HB   GLN  30          2HB       GLN  30   1.228   3.532   2.535
  236   2HB   GLN  30          1HB       GLN  30   0.641   2.561   1.186
  237   1HG   GLN  30          2HG       GLN  30   0.675   0.771   3.325
  238   2HG   GLN  30          1HG       GLN  30   0.106   2.276   4.044
  239   1HE2  GLN  30          1HE2      GLN  30  -0.708  -0.289   1.781
  240   2HE2  GLN  30          2HE2      GLN  30  -2.286   0.245   1.461
  241    H    GLN  31           H        GLN  31   4.162   3.517   2.997
  242    HA   GLN  31           HA       GLN  31   4.592   5.247   0.861
  243   1HB   GLN  31          2HB       GLN  31   5.361   5.483   3.293
  244   2HB   GLN  31          1HB       GLN  31   6.753   4.505   2.829
  245   1HG   GLN  31          2HG       GLN  31   7.267   6.135   1.024
  246   2HG   GLN  31          1HG       GLN  31   5.923   7.135   1.573
  247   1HE2  GLN  31          1HE2      GLN  31   9.260   6.582   1.987
  248   2HE2  GLN  31          2HE2      GLN  31   9.463   7.439   3.437
  249    H    LYS  32           H        LYS  32   6.672   2.506   1.842
  250    HA   LYS  32           HA       LYS  32   8.442   2.662  -0.336
  251   1HB   LYS  32          2HB       LYS  32   8.828   1.361   1.768
  252   2HB   LYS  32          1HB       LYS  32   7.672   0.162   1.187
  253   1HG   LYS  32          2HG       LYS  32   9.045  -0.283  -0.776
  254   2HG   LYS  32          1HG       LYS  32  10.157   1.011  -0.331
  255   1HD   LYS  32          2HD       LYS  32  10.965  -0.174   1.554
  256   2HD   LYS  32          1HD       LYS  32   9.608  -1.299   1.535
  257   1HE   LYS  32          2HE       LYS  32  11.715  -2.306   0.640
  258   2HE   LYS  32          1HE       LYS  32  10.403  -2.301  -0.537
  259   1HZ   LYS  32          1HZ       LYS  32  12.581  -1.533  -1.412
  260   2HZ   LYS  32          2HZ       LYS  32  12.478  -0.189  -0.378
  261   3HZ   LYS  32          3HZ       LYS  32  11.324  -0.409  -1.606
  262    H    LEU  33           H        LEU  33   5.725   0.389   0.151
  263    HA   LEU  33           HA       LEU  33   5.820  -0.850  -2.340
  264   1HB   LEU  33          2HB       LEU  33   3.411  -0.283  -0.594
  265   2HB   LEU  33          1HB       LEU  33   3.432  -1.416  -1.946
  266    HG   LEU  33           HG       LEU  33   5.376  -1.607   0.368
  267   1HD1  LEU  33          1HD1      LEU  33   3.932  -3.235   1.392
  268   2HD1  LEU  33          2HD1      LEU  33   2.825  -3.204   0.020
  269   3HD1  LEU  33          3HD1      LEU  33   2.948  -1.804   1.086
  270   1HD2  LEU  33          1HD2      LEU  33   5.449  -4.004  -0.477
  271   2HD2  LEU  33          2HD2      LEU  33   6.113  -2.807  -1.587
  272   3HD2  LEU  33          3HD2      LEU  33   4.502  -3.468  -1.863
  273    H    ARG  34           H        ARG  34   3.903   1.999  -1.363
  274    HA   ARG  34           HA       ARG  34   2.643   2.445  -3.833
  275   1HB   ARG  34          2HB       ARG  34   1.980   3.567  -1.729
  276   2HB   ARG  34          1HB       ARG  34   3.472   4.507  -1.774
  277   1HG   ARG  34          2HG       ARG  34   2.785   5.772  -3.602
  278   2HG   ARG  34          1HG       ARG  34   1.680   4.524  -4.179
  279   1HD   ARG  34          2HD       ARG  34   0.376   6.360  -3.258
  280   2HD   ARG  34          1HD       ARG  34   0.218   4.959  -2.203
  281    HE   ARG  34           HE       ARG  34   1.305   6.158  -0.539
  282   1HH1  ARG  34          1HH2      ARG  34   1.806   7.639  -3.636
  283   2HH1  ARG  34          2HH2      ARG  34   2.574   9.048  -2.986
  284   1HH2  ARG  34          1HH1      ARG  34   2.310   8.006   0.308
  285   2HH2  ARG  34          2HH1      ARG  34   2.857   9.257  -0.758
  286    H    GLN  35           H        GLN  35   5.743   3.606  -2.560
  287    HA   GLN  35           HA       GLN  35   6.412   5.334  -4.683
  288   1HB   GLN  35          2HB       GLN  35   7.586   5.243  -2.483
  289   2HB   GLN  35          1HB       GLN  35   8.301   3.705  -2.963
  290   1HG   GLN  35          2HG       GLN  35   9.476   4.731  -4.793
  291   2HG   GLN  35          1HG       GLN  35   8.599   6.245  -4.585
  292   1HE2  GLN  35          1HE2      GLN  35   9.491   7.772  -3.155
  293   2HE2  GLN  35          2HE2      GLN  35  10.811   7.459  -2.135
  294    H    GLU  36           H        GLU  36   7.229   1.916  -4.119
  295    HA   GLU  36           HA       GLU  36   8.654   1.542  -6.544
  296   1HB   GLU  36          2HB       GLU  36   8.655   0.063  -4.442
  297   2HB   GLU  36          1HB       GLU  36   7.161  -0.627  -5.074
  298   1HG   GLU  36          2HG       GLU  36   8.776  -2.060  -5.974
  299   2HG   GLU  36          1HG       GLU  36   8.529  -0.913  -7.288
  300    H    TYR  37           H        TYR  37   5.291   0.914  -5.598
  301    HA   TYR  37           HA       TYR  37   4.356  -0.311  -7.911
  302   1HB   TYR  37          2HB       TYR  37   3.028  -0.100  -5.853
  303   2HB   TYR  37          1HB       TYR  37   2.891   1.638  -6.113
  304    HD1  TYR  37           HD1      TYR  37   1.788  -1.688  -7.222
  305    HD2  TYR  37           HD2      TYR  37   1.532   2.538  -7.962
  306    HE1  TYR  37           HE1      TYR  37  -0.173  -2.062  -8.690
  307    HE2  TYR  37           HE2      TYR  37  -0.428   2.162  -9.430
  308    HH   TYR  37           HH       TYR  37  -2.238  -0.514  -9.427
  309    H    LEU  38           H        LEU  38   4.450   3.169  -7.135
  310    HA   LEU  38           HA       LEU  38   3.320   4.137  -9.505
  311   1HB   LEU  38          2HB       LEU  38   4.776   5.221  -7.251
  312   2HB   LEU  38          1HB       LEU  38   5.315   5.982  -8.744
  313    HG   LEU  38           HG       LEU  38   3.398   7.188  -7.735
  314   1HD1  LEU  38          1HD1      LEU  38   2.324   7.580  -9.762
  315   2HD1  LEU  38          2HD1      LEU  38   2.316   5.874 -10.209
  316   3HD1  LEU  38          3HD1      LEU  38   3.810   6.806 -10.313
  317   1HD2  LEU  38          1HD2      LEU  38   1.456   6.165  -7.106
  318   2HD2  LEU  38          2HD2      LEU  38   2.454   4.711  -7.065
  319   3HD2  LEU  38          3HD2      LEU  38   1.470   5.067  -8.485
  320    H    LYS  39           H        LYS  39   6.699   3.401  -8.705
  321    HA   LYS  39           HA       LYS  39   7.795   4.224 -11.198
  322   1HB   LYS  39          2HB       LYS  39   9.084   3.873  -9.059
  323   2HB   LYS  39          1HB       LYS  39   8.910   2.136  -9.310
  324   1HG   LYS  39          2HG       LYS  39   9.978   2.435 -11.577
  325   2HG   LYS  39          1HG       LYS  39  10.302   4.112 -11.140
  326   1HD   LYS  39          2HD       LYS  39  11.160   1.945  -9.252
  327   2HD   LYS  39          1HD       LYS  39  12.121   2.234 -10.702
  328   1HE   LYS  39          2HE       LYS  39  12.273   4.645 -10.081
  329   2HE   LYS  39          1HE       LYS  39  11.405   4.288  -8.589
  330   1HZ   LYS  39          1HZ       LYS  39  14.145   3.664  -9.339
  331   2HZ   LYS  39          2HZ       LYS  39  13.316   2.461  -8.470
  332   3HZ   LYS  39          3HZ       LYS  39  13.487   4.018  -7.815
  333    H    GLY  40           H        GLY  40   6.440   1.215  -9.993
  334   1HA   GLY  40          2HA       GLY  40   7.187  -0.329 -12.328
  335   2HA   GLY  40          1HA       GLY  40   6.184  -0.870 -10.986
  336    H    PHE  41           H        PHE  41   5.077   2.097 -12.032
  337    HA   PHE  41           HA       PHE  41   2.608   1.117 -12.971
  338   1HB   PHE  41          2HB       PHE  41   2.781   3.344 -12.041
  339   2HB   PHE  41          1HB       PHE  41   3.927   3.824 -13.292
  340    HD1  PHE  41           HD1      PHE  41   0.420   2.643 -12.765
  341    HD2  PHE  41           HD2      PHE  41   3.177   4.664 -15.369
  342    HE1  PHE  41           HE1      PHE  41  -1.459   3.310 -14.239
  343    HE2  PHE  41           HE2      PHE  41   1.297   5.329 -16.841
  344    HZ   PHE  41           HZ       PHE  41  -1.022   4.652 -16.277
  345    H    ARG  42           H        ARG  42   5.606   1.191 -14.514
  346    HA   ARG  42           HA       ARG  42   4.360   0.519 -17.069
  347   1HB   ARG  42          2HB       ARG  42   5.750   2.078 -18.345
  348   2HB   ARG  42          1HB       ARG  42   4.727   2.957 -17.209
  349   1HG   ARG  42          2HG       ARG  42   6.724   2.849 -15.586
  350   2HG   ARG  42          1HG       ARG  42   7.683   2.370 -16.986
  351   1HD   ARG  42          2HD       ARG  42   6.274   4.975 -16.467
  352   2HD   ARG  42          1HD       ARG  42   7.939   4.701 -16.961
  353    HE   ARG  42           HE       ARG  42   5.613   4.829 -18.696
  354   1HH1  ARG  42          1HH2      ARG  42   8.893   3.772 -18.285
  355   2HH1  ARG  42          2HH2      ARG  42   9.227   3.725 -19.984
  356   1HH2  ARG  42          1HH1      ARG  42   6.056   4.765 -20.915
  357   2HH2  ARG  42          2HH1      ARG  42   7.625   4.285 -21.469