*HEADER    DE NOVO PROTEIN                         18-JUL-08   2K6R              
*TITLE     PROTEIN FOLDING ON A HIGHLY RUGGED LANDSCAPE: EXPERIMENTAL            
*TITLE    2 OBSERVATION OF GLASSY DYNAMICS AND STRUCTURAL FRUSTRATION            
*COMPND    MOL_ID: 1;                                                            
*COMPND   2 MOLECULE: FULL SEQUENCE DESIGN 1 SYNTHETIC SUPERSTABLE;              
*COMPND   3 CHAIN: A;                                                            
*COMPND   4 ENGINEERED: YES                                                      
*SOURCE    MOL_ID: 1;                                                            
*SOURCE   2 SYNTHETIC: YES;                                                      
*SOURCE   3 OTHER_DETAILS: SYNTHETIC PROTEIN                                     
*KEYWDS    SYNTHETIC PROTEIN, NON-NATURAL AMINO ACIDS, DE NOVO PROTEIN           
*KEYWDS   2 DESIGN, RUGGED FOLDING ENERGY LANDSCAPE, STRUCTURAL                  
*KEYWDS   3 FRUSTRATION                                                          
*EXPDTA    SOLUTION NMR                                                          
*NUMMDL    20                                                                    
*AUTHOR    M.SADQI, E.DE ALBA, R.PEREZ-JIMENEZ, J.M.SANCHEZ-RUIZ,                
*AUTHOR   2 V.MUNOZ                                                              
*REVDAT   1   16-JUN-09 2K6R    0                                                


!noe_s_new.tbl

assign (residue 4 and name HA) (residue 4 and name HN) 2.0 0.3 0.6
assign (residue 4 and name HE#) (residue 4 and name HD#) 2.0 0.3 0.6
assign (residue 5 and name HA) (residue 5 and name HG2#) 2.0 0.3 0.6
assign (residue 6 and name HA) (residue 6 and name HB#) 2.0 0.3 0.6
assign (residue 6 and name HB#) (residue 6 and name HN) 2.0 0.3 0.6
assign (residue 7 and name HB#) (residue 7 and name Hx) 2.0 0.3 0.6
assign (residue 8 and name HA) (residue 8 and name HB) 2.0 0.3 0.6
assign (residue 8 and name HA) (residue 8 and name HG2#) 2.0 0.3 0.6
assign (residue 8 and name HB) (residue 8 and name HG2#) 2.0 0.3 0.6
assign (residue 9 and name HA) (residue 9 and name HN) 2.0 0.3 0.6
assign (residue 10 and (name HA2 or name HA1)) (residue 10 and name HN) 2.0 0.3 0.6
assign (residue 11 and name HA) (residue 11 and name HB#) 2.0 0.3 0.6
assign (residue 12 and name HA) (residue 12 and name HG2#) 2.0 0.3 0.6
assign (residue 12 and name HA) (residue 12 and name HN) 2.0 0.3 0.6
assign (residue 12 and name HB) (residue 12 and name HG2#) 2.0 0.3 0.6
assign (residue 13 and (name HB1 or name HB2)) (residue 13 and name HD#) 2.0 0.3 0.6
assign (residue 13 and (name HB2 or name HB1)) (residue 13 and name HD#) 2.0 0.3 0.6
assign (residue 13 and name HE#) (residue 13 and name HZ) 2.0 0.3 0.6
assign (residue 15 and name HN) (residue 14 and name HN) 2.0 0.3 0.6
assign (residue 15 and name HA) (residue 15 and (name HB2 or name HB1)) 2.0 0.3 0.6
assign (residue 15 and (name HB2 or name HB1)) (residue 15 and (name HD21 or name HD22)) 2.0 0.3 0.6
assign (residue 15 and (name HB2 or name HB1)) (residue 15 and (name HD22 or name HD21)) 2.0 0.3 0.6
assign (residue 16 and name HB#) (residue 16 and name HN) 2.0 0.3 0.6
assign (residue 16 and name HA) (residue 16 and name HB#) 2.0 0.3 0.6
assign (residue 16 and name HA) (residue 16 and name HG#) 2.0 0.3 0.6
assign (residue 17 and name HA) (residue 17 and name HB#) 2.0 0.3 0.6
assign (residue 17 and name HA) (residue 17 and name HN) 2.0 0.3 0.6
assign (residue 17 and name HB#) (residue 17 and name HG#) 2.0 0.3 0.6
assign (residue 17 and name HB#) (residue 17 and name HN) 2.0 0.3 0.6
assign (residue 17 and name HB#) (residue 18 and name HN) 2.0 0.3 0.6
assign (residue 18 and name HA) (residue 18 and name HN) 2.0 0.3 0.6
assign (residue 19 and name HA) (residue 19 and (name HD2# or name HD1#)) 2.0 0.3 0.6
assign (residue 19 and (name HB1 or name HB2)) (residue 19 and name HG) 2.0 0.3 0.6
assign (residue 19 and (name HB1 or name HB2)) (residue 19 and name HN) 2.0 0.3 0.6
assign (residue 19 and (name HB2 or name HB1)) (residue 19 and (name HD2# or name HD1#)) 2.0 0.3 0.6
assign (residue 19 and (name HB2 or name HB1)) (residue 19 and (name HD1# or name HD2#)) 2.0 0.3 0.6
assign (residue 19 and (name HB1 or name HB2)) (residue 19 and (name HD2# or name HD1#)) 2.0 0.3 0.6
assign (residue 19 and (name HB1 or name HB2)) (residue 19 and (name HD1# or name HD2#)) 2.0 0.3 0.6
assign (residue 19 and (name HD2# or name HD1#)) (residue 13 and name HD#) 2.0 0.3 0.6
assign (residue 19 and name HN) (residue 18 and name HN) 2.0 0.3 0.6
assign (residue 19 and name HN) (residue 20 and name HN) 2.0 0.3 0.6
assign (residue 19 and name HG) (residue 19 and (name HD1# or name HD2#)) 2.0 0.3 0.6
assign (residue 19 and name HG) (residue 19 and (name HD2# or name HD1#)) 2.0 0.3 0.6
assign (residue 20 and name HB#) (residue 20 and name HN) 2.0 0.3 0.6
assign (residue 20 and name HB#) (residue 21 and name HN) 2.0 0.3 0.6
assign (residue 20 and name HN) (residue 21 and name HN) 2.0 0.3 0.6
assign (residue 21 and name HA) (residue 21 and (name HB2 or name HB1)) 2.0 0.3 0.6
assign (residue 21 and name HA) (residue 21 and name HN) 2.0 0.3 0.6
assign (residue 21 and (name HB1 or name HB2)) (residue 21 and name HN) 2.0 0.3 0.6
assign (residue 21 and (name HB2 or name HB1)) (residue 21 and name HN) 2.0 0.3 0.6
assign (residue 22 and name HA) (residue 22 and name HD#) 2.0 0.3 0.6
assign (residue 22 and name HA) (residue 22 and name HN) 2.0 0.3 0.6
assign (residue 22 and (name HB1 or name HB2)) (residue 22 and name HD#) 2.0 0.3 0.6
assign (residue 22 and (name HB1 or name HB2)) (residue 22 and name HN) 2.0 0.3 0.6
assign (residue 22 and (name HB2 or name HB1)) (residue 22 and name HD#) 2.0 0.3 0.6
assign (residue 22 and (name HB2 or name HB1)) (residue 22 and name HN) 2.0 0.3 0.6
assign (residue 22 and name HE#) (residue 22 and name HD#) 2.0 0.3 0.6
assign (residue 22 and name HN) (residue 21 and name HN) 2.0 0.3 0.6
assign (residue 23 and name HA) (residue 23 and (name HG11 or name HG12)) 2.0 0.3 0.6
assign (residue 23 and name HA) (residue 23 and (name HG12 or name HG11)) 2.0 0.3 0.6
assign (residue 23 and name HB) (residue 23 and name HD1#) 2.0 0.3 0.6
assign (residue 23 and name HB) (residue 23 and name HN) 2.0 0.3 0.6
assign (residue 23 and name HB) (residue 24 and name HN) 2.0 0.3 0.6
assign (residue 23 and (name HG11 or name HG12)) (residue 19 and name HG) 2.0 0.3 0.6
assign (residue 23 and (name HG12 or name HG11)) (residue 23 and name HD1#) 2.0 0.3 0.6
assign (residue 23 and (name HG11 or name HG12)) (residue 23 and name HD1#) 2.0 0.3 0.6
assign (residue 23 and (name HG11 or name HG12)) (residue 23 and name HG2#) 2.0 0.3 0.6
assign (residue 24 and name HA) (residue 24 and name HN) 2.0 0.3 0.6
assign (residue 24 and (name HB1 or name HB2)) (residue 24 and name HN) 2.0 0.3 0.6
assign (residue 24 and (name HB2 or name HB1)) (residue 24 and name HN) 2.0 0.3 0.6
assign (residue 25 and name HA) (residue 25 and (name HB2 or name HB1)) 2.0 0.3 0.6
assign (residue 25 and name HN) (residue 24 and name HN) 2.0 0.3 0.6
assign (residue 26 and name HA) (residue 26 and name HD#) 2.0 0.3 0.6
assign (residue 26 and (name HB1 or name HB2)) (residue 26 and name HD#) 2.0 0.3 0.6
assign (residue 26 and (name HB2 or name HB1)) (residue 26 and name HD#) 2.0 0.3 0.6
assign (residue 29 and name HN) (residue 28 and name HN) 2.0 0.3 0.6
assign (residue 29 and name HN) (residue 28 and name HA#) 2.0 0.3 0.6

!noe_m_new.tbl

assign (residue 4 and (name HB1 or name HB2)) (residue 4 and name HA) 3.0 0.9 0.9
assign (residue 4 and (name HB2 or name HB1)) (residue 4 and name HA) 3.0 0.9 0.9
assign (residue 4 and (name HB1 or name HB2)) (residue 4 and name HD#) 3.0 0.9 0.9
assign (residue 4 and (name HB2 or name HB1)) (residue 4 and name HD#) 3.0 0.9 0.9
assign (residue 5 and name HB) (residue 5 and name HG2#) 3.0 0.9 0.9
assign (residue 5 and name HB) (residue 6 and name HN) 3.0 0.9 0.9
assign (residue 6 and name HA) (residue 6 and name HN) 3.0 0.9 0.9
assign (residue 6 and name HN) (residue 7 and name HN) 3.0 0.9 0.9
assign (residue 7 and name HA) (residue 8 and name HN) 3.0 0.9 0.9
assign (residue 7 and name HB#) (residue 7 and name H3) 3.0 0.9 0.9
assign (residue 7 and name HB#) (residue 7 and name Hx) 3.0 0.9 0.9
assign (residue 7 and name HB#) (residue 7 and name HN) 3.0 0.9 0.9
assign (residue 7 and name H3) (residue 8 and name HD1#) 3.0 0.9 0.9
assign (residue 8 and name HB) (residue 8 and name HD1#) 3.0 0.9 0.9
assign (residue 8 and name HB) (residue 8 and name HN) 3.0 0.9 0.9
assign (residue 8 and name HG2#) (residue 13 and name HD#) 3.0 0.9 0.9
assign (residue 8 and name HD1#) (residue 13 and name HD#) 3.0 0.9 0.9
assign (residue 8 and name HG2#) (residue 13 and name HE#) 3.0 0.9 0.9
assign (residue 9 and name HA) (residue 10 and name HN) 3.0 0.9 0.9
assign (residue 10 and (name HA2 or name HA1)) (residue 11 and name HN) 3.0 0.9 0.9
assign (residue 11 and name HB#) (residue 11 and name HN) 3.0 0.9 0.9
assign (residue 11 and name HB#) (residue 12 and name HN) 3.0 0.9 0.9
assign (residue 12 and name HG2#) (residue 13 and name HD#) 3.0 0.9 0.9
assign (residue 12 and name HA) (residue 13 and name HN) 3.0 0.9 0.9
assign (residue 13 and name HA) (residue 13 and (name HB1 or name HB2)) 3.0 0.9 0.9
assign (residue 13 and name HA) (residue 13 and (name HB2 or name HB1)) 3.0 0.9 0.9
assign (residue 13 and name HA) (residue 14 and name HN) 3.0 0.9 0.9
assign (residue 13 and name HA) (residue 13 and name HD#) 3.0 0.9 0.9
assign (residue 13 and name HD#) (residue 13 and name HN) 3.0 0.9 0.9
assign (residue 13 and name HD#) (residue 13 and (name HB1 or name HB2)) 3.0 0.9 0.9
assign (residue 13 and name HZ) (residue 22 and (name HB1 or name HB2)) 3.0 0.9 0.9
assign (residue 13 and name HA) (residue 15 and name HN) 3.0 0.9 0.9
assign (residue 13 and name HE#) (residue 19 and (name HB1 or name HB2)) 3.0 0.9 0.9
assign (residue 13 and name HZ) (residue 13 and name HD#) 3.0 0.9 0.9
assign (residue 14 and name HA) (residue 14 and (name HB1 or name HB2)) 3.0 0.9 0.9
assign (residue 14 and name HA) (residue 14 and (name HB2 or name HB1)) 3.0 0.9 0.9
assign (residue 14 and name HA) (residue 15 and name HN) 3.0 0.9 0.9
assign (residue 15 and name HA) (residue 15 and (name HB1 or name HB2)) 3.0 0.9 0.9
assign (residue 15 and name HA) (residue 15 and name HN) 3.0 0.9 0.9
assign (residue 15 and name HA) (residue 16 and name HN) 3.0 0.9 0.9
assign (residue 15 and (name HB1 or name HB2)) (residue 15 and (name HD21 or name HD22)) 3.0 0.9 0.9
assign (residue 15 and (name HB1 or name HB2)) (residue 15 and (name HD22 or name HD21)) 3.0 0.9 0.9
assign (residue 15 and name HA) (residue 17 and name HN) 3.0 0.9 0.9
assign (residue 16 and name HA) (residue 19 and (name HB1 or name HB2)) 3.0 0.9 0.9
assign (residue 16 and name HB#) (residue 17 and name HN) 3.0 0.9 0.9
assign (residue 16 and name HA) (residue 19 and (name HD1# or name HD2#)) 3.0 0.9 0.9
assign (residue 16 and name HA) (residue 19 and (name HD2# or name HD1#)) 3.0 0.9 0.9
assign (residue 17 and name HA) (residue 17 and name HG#) 3.0 0.9 0.9
assign (residue 17 and name HA) (residue 18 and name HN) 3.0 0.9 0.9
assign (residue 17 and name HE#) (residue 17 and name HG#) 3.0 0.9 0.9
assign (residue 18 and name HA) (residue 18 and (name HB1 or name HB2)) 3.0 0.9 0.9
assign (residue 18 and name HA) (residue 18 and (name HB2 or name HB1)) 3.0 0.9 0.9
assign (residue 18 and name HA) (residue 18 and (name HG1 or name HG2)) 3.0 0.9 0.9
assign (residue 18 and name HA) (residue 18 and (name HG2 or name HG1)) 3.0 0.9 0.9
assign (residue 18 and name HA) (residue 21 and (name HB1 or name HB2)) 3.0 0.9 0.9
assign (residue 18 and name HA) (residue 21 and (name HB2 or name HB1)) 3.0 0.9 0.9
assign (residue 18 and name HA) (residue 21 and name HN) 3.0 0.9 0.9
assign (residue 18 and name HA) (residue 22 and name HN) 3.0 0.9 0.9
assign (residue 18 and (name HB1 or name HB2)) (residue 18 and name HN) 3.0 0.9 0.9
assign (residue 18 and (name HB2 or name HB1)) (residue 18 and name HN) 3.0 0.9 0.9
assign (residue 18 and (name HG1 or name HG2)) (residue 18 and name HN) 3.0 0.9 0.9
assign (residue 18 and (name HG2 or name HG1)) (residue 18 and name HN) 3.0 0.9 0.9
assign (residue 19 and name HA) (residue 13 and name HD#) 3.0 0.9 0.9
assign (residue 19 and name HA) (residue 19 and name HN) 3.0 0.9 0.9
assign (residue 19 and (name HB1 or name HB2)) (residue 19 and name HA) 3.0 0.9 0.9
assign (residue 19 and (name HB2 or name HB1)) (residue 19 and name HN) 3.0 0.9 0.9
assign (residue 19 and (name HB1 or name HB2)) (residue 20 and name HN) 3.0 0.9 0.9
assign (residue 19 and (name HD2# or name HD1#)) (residue 13 and name HE#) 3.0 0.9 0.9
assign (residue 19 and (name HD1# or name HD2#)) (residue 27 and (name H1# or name H2#)) 3.0 0.9 0.9
assign (residue 20 and name HA) (residue 20 and name HB#) 3.0 0.9 0.9
assign (residue 20 and name HA) (residue 20 and (name HG1 or name HG2)) 3.0 0.9 0.9
assign (residue 20 and name HA) (residue 20 and name HN) 3.0 0.9 0.9
assign (residue 20 and name HA) (residue 23 and name HD1#) 3.0 0.9 0.9
assign (residue 20 and name HA) (residue 23 and name HB) 3.0 0.9 0.9
assign (residue 21 and name HA) (residue 21 and (name HB2 or name HB1)) 3.0 0.9 0.9
assign (residue 21 and name HA) (residue 23 and name HN) 3.0 0.9 0.9
assign (residue 21 and name HA) (residue 24 and (name HB2 or name HB1)) 3.0 0.9 0.9
assign (residue 21 and name HA) (residue 22 and name HN) 3.0 0.9 0.9
assign (residue 21 and name HA) (residue 24 and name HN) 3.0 0.9 0.9
assign (residue 21 and (name HB1 or name HB2)) (residue 22 and name HN) 3.0 0.9 0.9
assign (residue 22 and name HA) (residue 24 and name HN) 3.0 0.9 0.9
assign (residue 22 and name HA) (residue 22 and (name HB1 or name HB2)) 3.0 0.9 0.9
assign (residue 22 and name HA) (residue 22 and (name HB2 or name HB1)) 3.0 0.9 0.9
assign (residue 22 and (name HB1 or name HB2)) (residue 22 and name HE#) 3.0 0.9 0.9
assign (residue 22 and (name HB1 or name HB2)) (residue 23 and name HN) 3.0 0.9 0.9
assign (residue 22 and (name HB2 or name HB1)) (residue 22 and name HE#) 3.0 0.9 0.9
assign (residue 22 and (name HB2 or name HB1)) (residue 23 and name HN) 3.0 0.9 0.9
assign (residue 22 and name HD#) (residue 22 and name HN) 3.0 0.9 0.9
assign (residue 22 and name HN) (residue 23 and name HN) 3.0 0.9 0.9
assign (residue 23 and name HA) (residue 23 and name HG2#) 3.0 0.9 0.9
assign (residue 23 and name HA) (residue 23 and name HN) 3.0 0.9 0.9
assign (residue 23 and name HA) (residue 26 and name HD#) 3.0 0.9 0.9
assign (residue 23 and name HB) (residue 23 and name HG2#) 3.0 0.9 0.9
assign (residue 23 and name HD1#) (residue 23 and name HA) 3.0 0.9 0.9
assign (residue 23 and name HD1#) (residue 23 and name HN) 3.0 0.9 0.9
assign (residue 23 and (name HG11 or name HG11)) (residue 23 and name HN) 3.0 0.9 0.9
assign (residue 23 and (name HG12 or name HG11)) (residue 23 and name HN) 3.0 0.9 0.9
assign (residue 23 and (name HG12 or name HG11)) (residue 23 and name HG2#) 3.0 0.9 0.9
assign (residue 23 and (name HG12 or name HG11)) (residue 26 and name HD#) 3.0 0.9 0.9
assign (residue 23 and (name HG11 or name HG12)) (residue 26 and name HD#) 3.0 0.9 0.9
assign (residue 23 and name HG2#) (residue 26 and name HD#) 3.0 0.9 0.9
assign (residue 23 and name HG2#) (residue 27 and (name H1# or name H2#)) 3.0 0.9 0.9
assign (residue 23 and name HD1#) (residue 27 and (name H1# or name H2#)) 3.0 0.9 0.9
assign (residue 24 and name HA) (residue 24 and (name HB1 or name HB2)) 3.0 0.9 0.9
assign (residue 24 and name HA) (residue 24 and (name HB2 or name HB1)) 3.0 0.9 0.9
assign (residue 24 and name HA) (residue 24 and (name HG2 or name HG1)) 3.0 0.9 0.9
assign (residue 24 and name HA) (residue 24 and (name HG1 or name HG2)) 3.0 0.9 0.9
assign (residue 24 and (name HG1 or name HG2)) (residue 24 and name HN) 3.0 0.9 0.9
assign (residue 25 and name HA) (residue 26 and name HN) 3.0 0.9 0.9
assign (residue 25 and name HA) (residue 25 and (name HB1 or name HB2)) 3.0 0.9 0.9
assign (residue 25 and name HA) (residue 25 and name HN) 3.0 0.9 0.9
assign (residue 25 and (name HB1 or name HB2)) (residue 25 and name HN) 3.0 0.9 0.9
assign (residue 25 and (name HB2 or name HB1)) (residue 25 and name HN) 3.0 0.9 0.9
assign (residue 25 and name HN) (residue 26 and name HN) 3.0 0.9 0.9
assign (residue 26 and name HA) (residue 26 and (name HB1 or name HB2)) 3.0 0.9 0.9
assign (residue 26 and name HA) (residue 26 and (name HB2 or name HB1)) 3.0 0.9 0.9
assign (residue 26 and name HA) (residue 26 and name HN) 3.0 0.9 0.9
assign (residue 26 and (name HB1 or name HB2)) (residue 26 and name HN) 3.0 0.9 0.9
assign (residue 26 and (name HB2 or name HB1)) (residue 26 and name HN) 3.0 0.9 0.9
assign (residue 26 and name HD#) (residue 26 and name HN) 3.0 0.9 0.9
assign (residue 26 and name HN) (residue 26 and name HD#) 3.0 0.9 0.9
assign (residue 27 and name HA) (residue 27 and name HN) 3.0 0.9 0.9
assign (residue 27 and (name HB1 or name HB2)) (residue 27 and name HN) 3.0 0.9 0.9
assign (residue 28 and name HN) (residue 27 and name HA) 3.0 0.9 0.9
assign (residue 29 and name HA) (residue 29 and name HN) 3.0 0.9 0.9
assign (residue 29 and name HA) (residue 29 and name HG#) 3.0 0.9 0.9
assign (residue 29 and name HA) (residue 29 and (name HB1 or name HB2)) 3.0 0.9 0.9
assign (residue 29 and name HA) (residue 29 and (name HB2 or name HB1)) 3.0 0.9 0.9
assign (residue 29 and (name HB2 or name HB1)) (residue 29 and name HN) 3.0 0.9 0.9
assign (residue 29 and name HG#) (residue 29 and name HN) 3.0 0.9 0.9

!noe_w_new.tbl

assign (residue 3 and name HA) (residue 3 and name HN) 3.5 1.1 1.1
assign (residue 3 and (name HB2 or name HB1)) (residue 4 and name HE#) 3.5 1.1 1.1
assign (residue 3 and (name HB1 or name HB2)) (residue 4 and name HE#) 4.0 1.2 1.2
assign (residue 4 and (name HB1 or name HB2)) (residue 4 and name HE#) 3.5 1.1 1.1
assign (residue 4 and (name HB2 or name HB1)) (residue 4 and name HE#) 3.5 1.1 1.1
assign (residue 4 and (name HB1 or name HB2)) (residue 4 and name HN) 3.5 1.1 1.1
assign (residue 4 and (name HB2 or name HB1)) (residue 4 and name HN) 3.5 1.1 1.1
assign (residue 4 and (name HB1 or name HB2)) (residue 5 and name HN) 3.5 1.1 1.1
assign (residue 4 and (name HB2 or name HB1)) (residue 5 and name HN) 3.5 1.1 1.1
assign (residue 4 and name HN) (residue 5 and name HN) 3.5 1.1 1.1
assign (residue 4 and name HD#) (residue 4 and name HN) 3.5 1.1 1.1
assign (residue 4 and name HE#) (residue 16 and name HA) 3.5 1.1 1.1
assign (residue 5 and name HA) (residue 12 and name HG2#) 3.5 1.1 1.1
assign (residue 5 and name HA) (residue 5 and name HN) 3.5 1.1 1.1
assign (residue 5 and name HA) (residue 6 and name HN) 3.5 1.1 1.1
assign (residue 5 and name HB) (residue 5 and name HN) 3.5 1.1 1.1
assign (residue 5 and name HG2#) (residue 5 and name HN) 3.5 1.1 1.1
assign (residue 5 and name HG2#) (residue 6 and name HN) 3.5 1.1 1.1
assign (residue 6 and name HN) (residue 8 and name HN) 3.0 0.9 0.9
assign (residue 6 and name HB#) (residue 7 and name HA) 3.5 1.1 1.1
assign (residue 7 and name HA) (residue 7 and name HN) 3.5 1.1 1.1
assign (residue 7 and name HB#) (residue 12 and name HG2#) 3.5 1.1 1.1
assign (residue 7 and name Hx) (residue 7 and name HA) 3.5 1.1 1.1
assign (residue 7 and name Hx) (residue 8 and name HG2#) 3.5 1.1 1.1
assign (residue 7 and name Hx) (residue 8 and (name HG12 or name HG11)) 3.5 1.1 1.1
assign (residue 7 and name Hx) (residue 6 and name HB#) 3.5 1.1 1.1
assign (residue 7 and name H3) (residue 5 and name HG2#) 3.5 1.1 1.1
assign (residue 7 and name H3) (residue 6 and name HB#) 3.5 1.1 1.1
assign (residue 7 and name H3) (residue 7 and name HB#) 3.5 1.1 1.1
assign (residue 7 and name H3) (residue 7 and name HA) 3.5 1.1 1.1
assign (residue 7 and name HB#) (residue 7 and name H8) 3.5 1.1 1.1
assign (residue 7 and name HB#) (residue 8 and name HG2#) 3.5 1.1 1.1
assign (residue 8 and name HA) (residue 8 and name HD1#) 3.5 1.1 1.1
assign (residue 8 and name HA) (residue 8 and name HN) 3.5 1.1 1.1
assign (residue 8 and name HN) (residue 8 and name HG12) 3.5 1.1 1.1
assign (residue 8 and name HD1#) (residue 13 and name HE#) 3.5 1.1 1.1
assign (residue 8 and name HG2#) (residue 8 and name HN) 3.5 1.1 1.1
assign (residue 8 and name HG2#) (residue 9 and name HN) 3.5 1.1 1.1
assign (residue 8 and name HG2#) (residue 13 and name HZ) 3.5 1.1 1.1
assign (residue 8 and (name HG12 or name HG11)) (residue 13 and name HZ) 3.5 1.1 1.1
assign (residue 8 and (name HG12 or name HG11)) (residue 13 and name HE#) 3.0 0.9 0.9
assign (residue 8 and name HD1#) (residue 9 and name HN) 4.0 1.2 1.2
assign (residue 8 and name HN) (residue 9 and name HN) 3.0 0.9 0.9
assign (residue 8 and (name HG11 or name HG12)) (residue 26 and name HE#) 3.5 1.1 1.1
assign (residue 8 and name HD1#) (residue 27 and (name H1# or name H2#)) 3.5 1.1 1.1
assign (residue 9 and (name HG1 or name HG2)) (residue 9 and name HN) 3.5 1.1 1.1
assign (residue 9 and (name HG2 or name HG1)) (residue 9 and name HN) 4.0 1.2 1.2
assign (residue 9 and (name HB1 or name HB2)) (residue 9 and name HN) 3.5 1.1 1.1
assign (residue 9 and (name HB2 or name HB1)) (residue 9 and name HN) 3.5 1.1 1.1
assign (residue 9 and name HD#) (residue 9 and name HN) 3.5 1.1 1.1
assign (residue 9 and (name HG1 or name HG2)) (residue 9 and name HN) 3.5 1.1 1.1
assign (residue 9 and (name HG2 or name HG1)) (residue 9 and name HN) 3.5 1.1 1.1
assign (residue 11 and name HA) (residue 11 and name HN) 3.5 1.1 1.1
assign (residue 11 and name HG#) (residue 11 and name HN) 3.5 1.1 1.1
assign (residue 11 and name HB#) (residue 22 and name HD#) 3.5 1.1 1.1
assign (residue 12 and name HA) (residue 12 and name HB) 3.5 1.1 1.1
assign (residue 12 and name HB) (residue 12 and name HN) 3.5 1.1 1.1
assign (residue 12 and name HB) (residue 13 and name HD#) 3.5 1.1 1.1
assign (residue 12 and name HG2#) (residue 12 and name HN) 3.5 1.1 1.1
assign (residue 12 and name HG2#) (residue 13 and name HN) 3.5 1.1 1.1
assign (residue 12 and name HG2#) (residue 13 and name HD#) 3.5 1.1 1.1
assign (residue 12 and name HG2#) (residue 13 and name HA) 4.0 1.2 1.2
assign (residue 13 and (name HB1 or name HB2)) (residue 14 and name HN) 3.5 1.1 1.1
assign (residue 13 and name HA) (residue 13 and name HN) 3.5 1.1 1.1
assign (residue 13 and (name HB1 or name HB2)) (residue 13 and name HN) 3.5 1.1 1.1
assign (residue 13 and (name HB2 or name HB1)) (residue 13 and name HN) 3.5 1.1 1.1
assign (residue 13 and (name HB2 or name HB1)) (residue 14 and name HN) 3.5 1.1 1.1
assign (residue 13 and (name HB2 or name HB1)) (residue 18 and (name HB2 or name HB1)) 3.5 1.1 1.1
assign (residue 13 and (name HB2 or name HB1)) (residue 18 and (name HB1 or name HB2)) 3.5 1.1 1.1
assign (residue 13 and (name HB1 or name HB2)) (residue 18 and (name HB2 or name HB1)) 3.5 1.1 1.1
assign (residue 13 and (name HB1 or name HB2)) (residue 18 and (name HB1 or name HB2)) 3.5 1.1 1.1
assign (residue 13 and name HD#) (residue 18 and name HA) 3.5 1.1 1.1
assign (residue 13 and name HD#) (residue 16 and name HA) 3.5 1.1 1.1
assign (residue 13 and name HD#) (residue 13 and name HZ) 3.5 1.1 1.1
assign (residue 13 and name HZ) (residue 11 and name HB#) 3.5 1.1 1.1
assign (residue 13 and name HZ) (residue 19 and (name HB2 or name HB1)) 3.5 1.1 1.1
assign (residue 13 and name HZ) (residue 19 and (name HD1# or name HD2#)) 3.5 1.1 1.1
assign (residue 13 and name HZ) (residue 19 and (name HD2# or name HD1#)) 3.5 1.1 1.1
assign (residue 13 and name HZ) (residue 19 and (name HB1 or name HB2)) 4.0 1.2 1.2
assign (residue 13 and name HD#) (residue 18 and (name HG1 or name HG2)) 3.5 1.1 1.1
assign (residue 13 and name HD#) (residue 18 and (name HG2 or name HG1)) 3.5 1.1 1.1
assign (residue 13 and (name HB1 or name HB2)) (residue 19 and name HN) 4.0 1.2 1.2
assign (residue 13 and (name HB2 or name HB1)) (residue 15 and name HN) 3.5 1.1 1.1
assign (residue 13 and (name HB1 or name HB2)) (residue 15 and name HN) 3.5 1.1 1.1
assign (residue 13 and name HZ) (residue 22 and (name HB2 or name HB1)) 3.5 1.1 1.1
assign (residue 13 and name HZ) (residue 22 and (name HB1 or name HB2)) 3.5 1.1 1.1
assign (residue 14 and name HA) (residue 14 and (name HG1 or name HG2)) 3.5 1.1 1.1
assign (residue 14 and name HA) (residue 14 and (name HG2 or name HG1)) 3.5 1.1 1.1
assign (residue 14 and name HA) (residue 14 and name HN) 3.5 1.1 1.1
assign (residue 14 and name HN) (residue 13 and name HD#) 3.5 1.1 1.1
assign (residue 14 and name HN) (residue 18 and (name HB1 or name HB2)) 3.5 1.1 1.1
assign (residue 14 and name HN) (residue 18 and (name HB2 or name HB1)) 3.5 1.1 1.1
assign (residue 14 and (name HB1 or name HB2)) (residue 14 and name HN) 3.5 1.1 1.1
assign (residue 14 and (name HB2 or name HB1)) (residue 14 and name HN) 3.5 1.1 1.1
assign (residue 14 and (name HG1 or name HG2)) (residue 14 and name HN) 3.5 1.1 1.1
assign (residue 15 and (name HB1 or name HB2)) (residue 15 and name HN) 3.5 1.1 1.1
assign (residue 15 and (name HB1 or name HB2)) (residue 16 and name HN) 3.5 1.1 1.1
assign (residue 15 and (name HB1 or name HB2)) (residue 17 and name HN) 3.5 1.1 1.1
assign (residue 15 and (name HB2 or name HB1)) (residue 15 and name HN) 3.5 1.1 1.1
assign (residue 15 and (name HB2 or name HB1)) (residue 16 and name HN) 3.5 1.1 1.1
assign (residue 15 and (name HD21 or name HD22)) (residue 17 and name HB#) 3.5 1.1 1.1
assign (residue 15 and (name HD22 or name HD21)) (residue 17 and name HB2#) 3.5 1.0 1.0
assign (residue 15 and name HA) (residue 18 and name HN) 3.5 1.1 1.1
assign (residue 15 and (name HB1 or name HB2)) (residue 16 and name HA) 3.5 1.1 1.1
assign (residue 15 and (name HB2 or name HB2)) (residue 16 and name HA) 3.5 1.1 1.1
assign (residue 15 and (name HD22 or name HD21)) (residue 18 and (name HG1 or name HG2)) 3.5 1.1 1.1
assign (residue 16 and name HA) (residue 16 and name HN) 3.5 1.1 1.1
assign (residue 16 and name HA) (residue 19 and name HG) 3.5 1.1 1.1
assign (residue 16 and name HA) (residue 19 and name HN) 3.5 1.1 1.1
assign (residue 16 and name HG#) (residue 16 and name HN) 3.5 1.1 1.1
assign (residue 16 and name HG#) (residue 17 and name HN) 3.5 1.1 1.1
assign (residue 16 and name HB#) (residue 19 and (name HD1# or name HD2#)) 3.5 1.1 1.1
assign (residue 16 and name HG#) (residue 19 and (name HD1# or name HD2#)) 3.0 0.9 0.9
assign (residue 17 and name HA) (residue 17 and name HE#) 3.5 1.1 1.1
assign (residue 17 and name HA) (residue 20 and name HN) 3.5 1.1 1.1
assign (residue 17 and name HA) (residue 21 and name HN) 3.5 1.1 1.1
assign (residue 17 and name HE#) (residue 17 and name HB#) 3.5 1.1 1.1
assign (residue 17 and name HE#) (residue 17 and name HN) 3.5 1.1 1.1
assign (residue 17 and name HG#) (residue 17 and name HN) 3.5 1.1 1.1
assign (residue 17 and name HG#) (residue 21 and name HN) 4.0 1.2 1.2
assign (residue 17 and name HG#) (residue 18 and name HN) 3.5 1.1 1.1
assign (residue 17 and name HN) (residue 16 and name HN) 3.5 1.1 1.1
assign (residue 17 and name HN) (residue 19 and name HN) 3.5 1.1 1.1
assign (residue 17 and name HB#) (residue 19 and name HN) 3.5 1.1 1.1
assign (residue 18 and name HA) (residue 19 and name HN) 3.5 1.1 1.1
assign (residue 18 and (name HB1 or name HB2)) (residue 13 and name HD#) 3.5 1.1 1.1
assign (residue 18 and (name HB1 or name HB2)) (residue 15 and name HN) 3.5 1.1 1.1
assign (residue 18 and (name HB1 or name HB2)) (residue 19 and name HN) 3.5 1.1 1.1
assign (residue 18 and (name HB2 or name HB1)) (residue 13 and name HD#) 3.5 1.1 1.1
assign (residue 18 and (name HB2 or name HB1)) (residue 15 and name HN) 3.5 1.1 1.1
assign (residue 18 and (name HB2 or name HB1)) (residue 19 and name HN) 3.5 1.1 1.1
assign (residue 18 and name HA) (residue 20 and name HN) 4.0 1.2 1.2
assign (residue 19 and name HA) (residue 13 and name HE#) 3.5 1.1 1.1
assign (residue 19 and name HA) (residue 19 and name HD1#) 3.5 1.1 1.1
assign (residue 19 and name HA) (residue 19 and name HG) 3.5 1.1 1.1
assign (residue 19 and name HA) (residue 20 and name HN) 3.5 1.1 1.1
assign (residue 19 and name HG) (residue 19 and name HN) 3.5 1.1 1.1
assign (residue 19 and name HA) (residue 21 and name HN) 3.5 1.1 1.1
assign (residue 19 and name HN) (residue 20 and name HB#) 4.0 1.2 1.2
assign (residue 19 and name HA) (residue 22 and (name HB1 or name HB2)) 3.5 1.1 1.1
assign (residue 19 and name HA) (residue 22 and (name HB2 or name HB1)) 3.5 1.1 1.1
assign (residue 19 and name HA) (residue 22 and name HN) 3.5 1.1 1.1
assign (residue 19 and name HB2) (residue 22 and name HB2) 3.5 1.1 1.1
assign (residue 19 and (name HB1 or name HB2)) (residue 13 and name HD#) 3.5 1.1 1.1
assign (residue 19 and (name HB1 or name HB2)) (residue 21 and name HN) 3.5 1.1 1.1
assign (residue 19 and (name HB2 or name HB1)) (residue 4 and name HD#) 3.5 1.1 1.1
assign (residue 19 and (name HB2 or name HB1)) (residue 4 and name HE#) 3.5 1.1 1.1
assign (residue 19 and (name HB2 or name HB1)) (residue 13 and name HD#) 3.5 1.1 1.1
assign (residue 19 and (name HB2 or name HB1)) (residue 13 and name HE#) 3.5 1.1 1.1
assign (residue 19 and (name HB2 or name HB1)) (residue 20 and name HN) 3.5 1.1 1.1
assign (residue 19 and (name HB2 or name HB1)) (residue 26 and name HE#) 4.0 1.2 1.2
assign (residue 19 and (name HD2# or name HD1#)) (residue 20 and name HA) 3.5 1.1 1.1
assign (residue 19 and (name HD1# or name HD2#)) (residue 4 and name HE#) 3.5 1.1 1.1
assign (residue 19 and (name HD1# or name HD2#)) (residue 13 and name HD#) 3.5 1.1 1.1
assign (residue 19 and (name HD1# or name HD2#)) (residue 13 and name HE#) 3.5 1.1 1.1
assign (residue 19 and (name HD1# or name HD2#)) (residue 19 and name HN) 3.5 1.1 1.1
assign (residue 19 and (name HD1# or name HD2#)) (residue 20 and name HN) 3.5 1.1 1.1
assign (residue 19 and (name HD2# or name HD1#)) (residue 4 and name HD#) 3.5 1.1 1.1
assign (residue 19 and (name HD1# or name HD2#)) (residue 27 and (name H2# or name H1#)) 3.5 1.1 1.1
assign (residue 19 and (name HD2# or name HD1#)) (residue 27 and (name H2# or name H1#)) 3.5 1.1 1.1
assign (residue 19 and (name HD1# or name HD2#)) (residue 27 and (name H1# or name H2#)) 3.5 1.1 1.1
assign (residue 19 and (name HD2# or name HD1#)) (residue 27 and (name H1# or name H2#)) 3.5 1.1 1.1
assign (residue 19 and (name HD2# or name HD1#)) (residue 19 and name HN) 3.5 1.1 1.1
assign (residue 19 and (name HD2# or name HD1#)) (residue 20 and name HN) 3.5 1.1 1.1
assign (residue 19 and (name HD1# or name HD2#)) (residue 20 and name HA) 3.5 1.1 1.1
assign (residue 19 and (name HD2# or name HD1#)) (residue 20 and name HA) 3.5 1.1 1.1
assign (residue 19 and name HG) (residue 13 and name HD#) 3.5 1.1 1.1
assign (residue 19 and name HG) (residue 20 and name HN) 3.5 1.1 1.1
assign (residue 19 and name HG) (residue 23 and name HG2#) 3.5 1.1 1.1
assign (residue 19 and name HN) (residue 21 and name HN) 3.5 1.1 1.1
assign (residue 20 and name HN) (residue 20 and name HD# ) 4.0 1.2 1.2
assign (residue 20 and name HA) (residue 20 and (name HG2 or name HG1)) 3.5 1.1 1.1
assign (residue 20 and name HA) (residue 21 and name HN) 3.5 1.1 1.1
assign (residue 20 and name HA) (residue 23 and name HN) 3.5 1.1 1.1
assign (residue 20 and name HA) (residue 23 and name HD1#) 3.5 1.1 1.1
assign (residue 20 and name HA) (residue 23 and name HG2#) 3.5 1.1 1.1
assign (residue 20 and name HN) (residue 22 and name HN) 3.5 1.1 1.1
assign (residue 20 and name HD#) (residue 21 and name HN) 3.5 1.1 1.1
assign (residue 20 and name HA) (residue 23 and (name HG12 or name HG11)) 3.5 1.1 1.1
assign (residue 20 and (name HG2 or name HG1)) (residue 20 and name HN) 3.5 1.1 1.1
assign (residue 20 and (name HG2 or name HG1)) (residue 21 and name HN) 3.5 1.1 1.1
assign (residue 21 and name HN) (residue 22 and (name HB1 or name HB2)) 3.5 1.1 1.1
assign (residue 21 and name HN) (residue 22 and (name HB2 or name HB1)) 3.5 1.1 1.1
assign (residue 21 and name HA) (residue 24 and (name HB1 or name HB2)) 3.5 1.1 1.1
assign (residue 21 and name HA) (residue 24 and (name HG2 or name HG1)) 3.5 1.1 1.1
assign (residue 21 and name HN) (residue 23 and name HD1#) 4.0 1.2 1.2
assign (residue 21 and name HN) (residue 23 and name HG2#) 4.0 1.2 1.2
assign (residue 21 and name HA) (residue 25 and name HN) 4.0 1.2 1.2
assign (residue 21 and (name HB2 or name HB1)) (residue 22 and name HN) 3.5 1.1 1.1
assign (residue 22 and name HA) (residue 23 and name HN) 3.5 1.1 1.1
assign (residue 22 and (name HB2 or name HB1)) (residue 24 and name HN) 3.5 1.1 1.1
assign (residue 22 and name HA) (residue 25 and name HN) 3.5 1.1 1.1
assign (residue 22 and name HN) (residue 24 and name HN) 3.5 1.1 1.1
assign (residue 22 and name HE#) (residue 22 and name HN) 3.5 1.1 1.1
assign (residue 22 and name HD#) (residue 23 and name HN) 3.5 1.1 1.1
assign (residue 23 and name HA) (residue 26 and name HN) 3.5 1.1 1.1
assign (residue 23 and name HA) (residue 23 and name HB) 3.5 1.1 1.1
assign (residue 23 and name HA) (residue 23 and name HD1#) 3.5 1.1 1.1
assign (residue 23 and name HG2#) (residue 24 and name HN) 3.5 1.1 1.1
assign (residue 23 and name HD1#) (residue 24 and name HN) 3.5 1.1 1.1
assign (residue 23 and name HN) (residue 24 and (name HG2 or name HG1 )) 3.5 1.1 1.1
assign (residue 23 and name HA) (residue 24 and name HN) 3.5 1.1 1.1
assign (residue 23 and name HA) (residue 25 and name HN) 3.5 1.1 1.1
assign (residue 23 and name HA) (residue 27 and name HN) 3.5 1.1 1.1
assign (residue 23 and (name HG11 or name HG12)) (residue 24 and name HN) 3.5 1.1 1.1
assign (residue 23 and name HG2#) (residue 27 and (name H1# or name H2#)) 3.5 1.1 1.1
assign (residue 23 and name HG2#) (residue 27 and (name H2# or name H1#)) 3.5 1.1 1.1
assign (residue 23 and name HD1#) (residue 27 and (name H1# or name H2#)) 3.5 1.1 1.1
assign (residue 23 and name HD1#) (residue 27 and (name H2# or name H1#)) 3.5 1.1 1.1
assign (residue 23 and name HN) (residue 21 and name HN) 3.5 1.1 1.1
assign (residue 23 and name HD1#) (residue 27 and name HE#) 3.5 1.1 1.1
assign (residue 23 and name HA) (residue 26 and (name HB1 or name HB2)) 3.5 1.1 1.1
assign (residue 23 and name HA) (residue 26 and (name HB2 or name HB1)) 4.0 1.2 1.2
assign (residue 23 and name HD1#) (residue 27 and name HD#) 3.5 1.1 1.1
assign (residue 24 and name HA) (residue 27 and name HN) 3.5 1.1 1.1
assign (residue 24 and name HN) (residue 26 and name HN) 3.5 1.1 1.1
assign (residue 24 and name HA) (residue 25 and name HN) 3.5 1.1 1.1
assign (residue 24 and name HA) (residue 27 and (name HB2 or name HB1)) 3.5 1.1 1.1
assign (residue 24 and (name HB1 or name HB2)) (residue 25 and name HN) 3.5 1.1 1.1
assign (residue 24 and (name HB2 or name HB1)) (residue 25 and name HN) 3.5 1.1 1.1
assign (residue 24 and (name HG2 or name HG1)) (residue 24 and name HN) 3.5 1.1 1.1
assign (residue 24 and name HA) (residue 25 and name HA) 4.0 1.2 1.2
assign (residue 25 and name HA) (residue 25 and (name HG1 or name HG2)) 3.5 1.1 1.1
assign (residue 25 and name HA) (residue 25 and (name HG2 or name HG1)) 3.5 1.1 1.1
assign (residue 25 and (name HG2 or name HG1)) (residue 25 and name HN) 3.5 1.1 1.1
assign (residue 25 and (name HG2 or name HG1)) (residue 25 and name HN) 3.5 1.1 1.1
assign (residue 26 and (name HB1 or name HB2)) (residue 23 and name HA) 3.5 1.1 1.1
assign (residue 26 and (name HB1 or name HB2)) (residue 27 and name HN) 3.5 1.1 1.1
assign (residue 26 and (name HB2 or name HB1)) (residue 23 and name HA) 3.5 1.1 1.1
assign (residue 26 and (name HB2 or name HB1)) (residue 27 and name HN) 3.5 1.1 1.1
assign (residue 26 and name HD#) (residue 27 and (name HG2 or name HG1)) 3.5 1.1 1.1
assign (residue 26 and (name HB2 or name HB1)) (residue 27 and name HA) 3.5 1.1 1.1
assign (residue 27 and (name HG1 or name HG2)) (residue 27 and name HN) 3.5 1.1 1.1
assign (residue 27 and (name HG2 or name HG1)) (residue 27 and name HN) 3.5 1.1 1.1
assign (residue 27 and name HA) (residue 29 and name HN) 3.5 1.1 1.1
assign (residue 29 and (name HB1 or name HB2)) (residue 29 and name HN) 3.5 1.1 1.1
assign (residue 29 and name HD#) (residue 29 and name HN) 3.5 1.1 1.1

!h_bonds.tbl

assign ( resid 16  and name O ) ( resid 20 and name HN ) 1.9 0.0 0.6
assign ( resid 16  and name O ) ( resid 20 and name  N ) 2.8 0.0 0.6

assign ( resid 17  and name O ) ( resid 21 and name HN ) 1.9 0.0 0.6
assign ( resid 17  and name O ) ( resid 21 and name  N ) 2.8 0.0 0.6

assign ( resid 18  and name O ) ( resid 22 and name HN ) 1.9 0.0 0.6
assign ( resid 18  and name O ) ( resid 22 and name  N ) 2.8 0.0 0.6

assign ( resid 19  and name O ) ( resid 23 and name HN ) 1.9 0.0 0.6
assign ( resid 19  and name O ) ( resid 23 and name  N ) 2.8 0.0 0.6

assign ( resid 20  and name O ) ( resid 24 and name HN ) 1.9 0.0 0.6
assign ( resid 20  and name O ) ( resid 24 and name  N ) 2.8 0.0 0.6

assign ( resid 21  and name O ) ( resid 25 and name HN ) 1.9 0.0 0.6
assign ( resid 21  and name O ) ( resid 25 and name  N ) 2.8 0.0 0.6

assign ( resid 22  and name O ) ( resid 26 and name HN ) 1.9 0.0 0.6
assign ( resid 22  and name O ) ( resid 26 and name  N ) 2.8 0.0 0.6

assign ( resid 23  and name O ) ( resid 27 and name HN ) 1.9 0.0 0.6
assign ( resid 23  and name O ) ( resid 27 and name  N ) 2.8 0.0 0.6

!dihedrals.tbl

 !phi_new.tbl

assign  ( resid 1   and name C )
        ( resid 2   and name N )
        ( resid 2   and name CA )
        ( resid 2   and name C ) 5.00 -95.700 28.930  2

assign  ( resid 2   and name C )
        ( resid 3   and name N )
        ( resid 3   and name CA )
        ( resid 3   and name C ) 5.00 -80.06 10.00  2

assign  ( resid 3   and name C )
        ( resid 4   and name N )
        ( resid 4   and name CA )
        ( resid 4   and name C ) 5.00 -98.30 33.500  2

assign  ( resid 4   and name C )
        ( resid 5   and name N )
        ( resid 5   and name CA )
        ( resid 5   and name C ) 5.00 -93.49 23.49  2

assign  ( resid 5   and name C )
        ( resid 6   and name N )
        ( resid 6   and name CA )
        ( resid 6   and name C ) 5.00 -97.91 21.870 2 

assign  ( resid 7   and name C )
        ( resid 8   and name N )
        ( resid 8   and name CA )
        ( resid 8   and name C ) 5.00 -104.39 41.05  2

assign  ( resid 8   and name C )
        ( resid 9   and name N )
        ( resid 9   and name CA )
        ( resid 9   and name C ) 5.00 -101.57 46.680  2

assign  ( resid 9   and name C )
        ( resid 10   and name N )
        ( resid 10   and name CA )
        ( resid 10   and name C ) 5.00 87.20 18.580  2

assign  ( resid 10   and name C )
        ( resid 11   and name N )
        ( resid 11   and name CA )
        ( resid 11   and name C ) 5.00 -103.65 28.310  2

assign  ( resid 11   and name C )
        ( resid 12   and name N )
        ( resid 12   and name CA )
        ( resid 12   and name C ) 5.00 -116.25 22.84  2

assign  ( resid 12   and name C )
        ( resid 13   and name N )
        ( resid 13   and name CA )
        ( resid 13   and name C ) 5.00 -119.360 25.600  2

assign ( resid 13   and name C )
 ( resid 14   and name N ) 
 ( resid 14   and name CA )
 ( resid 14   and name C ) 5.00 -85.07 26.600  2

assign ( resid 14  and name C )
 ( resid 15  and name N ) 
 ( resid 15  and name CA )
 ( resid 15  and name C ) 5.00 -86.41 19.68  2

assign  ( resid 15  and name C )
        ( resid 16  and name N )
        ( resid 16  and name CA )
        ( resid 16  and name C ) 5.00 -63.83 10.00  2

assign ( resid 16  and name C )
 ( resid 17  and name N ) 
 ( resid 17  and name CA )
 ( resid 17  and name C ) 5.00 -64.04 10.00  2

assign ( resid 17  and name C )
 ( resid 18  and name N ) 
 ( resid 18  and name CA )
 ( resid 18  and name C ) 5.00 -66.36 10.00  2

assign ( resid 18  and name C )
 ( resid 19  and name N ) 
 ( resid 19  and name CA )
 ( resid 19  and name C ) 5.00 -63.92 10.00  2

assign ( resid 19  and name C )
 ( resid 20  and name N ) 
 ( resid 20  and name CA )
 ( resid 20  and name C ) 5.00 -62.50 10.00  2

assign ( resid 20  and name C )
 ( resid 21  and name N ) 
 ( resid 21  and name CA )
 ( resid 21  and name C ) 5.00 -61.99 10.00  2

assign ( resid 21  and name C )
 ( resid 22  and name N ) 
 ( resid 22  and name CA )
 ( resid 22  and name C ) 5.00 -63.82 10.00  2

assign ( resid 22  and name C )
 ( resid 23  and name N ) 
 ( resid 23  and name CA )
 ( resid 23  and name C ) 5.00 -65.05 10.00  2

assign ( resid 23  and name C )
 ( resid 24  and name N ) 
 ( resid 24  and name CA )
 ( resid 24  and name C ) 5.00 -62.49 10.00  2

assign ( resid 24  and name C )
 ( resid 25  and name N ) 
 ( resid 25  and name CA )
 ( resid 25  and name C ) 5.00 -66.35 10.00  2

assign ( resid 25  and name C )
 ( resid 26  and name N ) 
 ( resid 26  and name CA )
 ( resid 26  and name C ) 5.00 -79.00 20.93  2

 !psi_new.tbl

assign  ( resid 2  and name N )
        ( resid 2  and name CA )
        ( resid 2  and name C )
        ( resid 3  and name N ) 5.00 127.09 28.620  2

assign  ( resid 3  and name N )
        ( resid 3  and name CA )
        ( resid 3  and name C )
        ( resid 4  and name N ) 5.00 137.120 10.00  2

assign  ( resid 4  and name N )
        ( resid 4  and name CA )
        ( resid 4  and name C )
        ( resid 5  and name N ) 5.00 138.29 18.43  2

assign  ( resid 5  and name N )
        ( resid 5  and name CA )
        ( resid 5  and name C )
        ( resid 6  and name N ) 5.00 -8.09 17.00  2

assign  ( resid 6  and name N )
        ( resid 6  and name CA )
        ( resid 6  and name C )
        ( resid 7  and name N ) 5.00 -48.670 43.210  2

assign  ( resid 8  and name N )
        ( resid 8  and name CA )
        ( resid 8  and name C )
        ( resid 9  and name N ) 5.00 120.82 17.64  2

assign  ( resid 9  and name N )
        ( resid 9  and name CA )
        ( resid 9  and name C )
        ( resid 10  and name N ) 5.00 129.09 23.95  2

assign  ( resid 10  and name N )
        ( resid 10  and name CA )
        ( resid 10  and name C )
        ( resid 11  and name N ) 5.00 2.69 21.44  2

assign  ( resid 11  and name N )
        ( resid 11  and name CA )
        ( resid 11  and name C )
        ( resid 12  and name N ) 5.00 133.16 33.10  2

assign  ( resid 12  and name N )
        ( resid 12  and name CA )
        ( resid 12  and name C )
        ( resid 13  and name N ) 5.00 139.62 20.66  2

assign  ( resid 13  and name N )
        ( resid 13  and name CA )
        ( resid 13  and name C )
        ( resid 14  and name N ) 5.00 162.62 28.71  2

assign  ( resid 14  and name N )
        ( resid 14  and name CA )
        ( resid 14  and name C )
        ( resid 15  and name N ) 5.00 -42.07 12.30  2

assign  ( resid 15  and name N )
        ( resid 15  and name CA )
        ( resid 15  and name C )
        ( resid 16  and name N ) 5.00 102.53 22.77  2

assign ( resid 16  and name N )
 ( resid 16  and name CA ) 
 ( resid 16  and name C )
 ( resid 17  and name N ) 5.00 -41.71 20.00  2

assign ( resid 17  and name N )
 ( resid 17  and name CA ) 
 ( resid 17  and name C )
 ( resid 18  and name N ) 5.00 -39.75 10.00  2

assign ( resid 18  and name N )
 ( resid 18  and name CA ) 
 ( resid 18  and name C )
 ( resid 19  and name N ) 5.00 -40.14 10.00  2

assign ( resid 19  and name N )
 ( resid 19  and name CA ) 
 ( resid 19  and name C )
 ( resid 20  and name N ) 5.00 -42.47 20.00  2

assign ( resid 20  and name N )
 ( resid 20  and name CA ) 
 ( resid 20  and name C )
 ( resid 21  and name N ) 5.00 -45.93 10.00  2

assign ( resid 21  and name N )
 ( resid 21  and name CA ) 
 ( resid 21  and name C )
 ( resid 22  and name N ) 5.00 -42.00 10.00  2

assign ( resid 22  and name N )
 ( resid 22  and name CA ) 
 ( resid 22  and name C )
 ( resid 23  and name N ) 5.00 -45.72 20.00  2

assign ( resid 23  and name N )
 ( resid 23  and name CA ) 
 ( resid 23  and name C )
 ( resid 24  and name N ) 5.00 -41.38 10.00  2

assign ( resid 24  and name N )
 ( resid 24  and name CA ) 
 ( resid 24  and name C )
 ( resid 25  and name N ) 5.00 -37.27 10.00  2

assign ( resid 25  and name N )
 ( resid 25  and name CA ) 
 ( resid 25  and name C )
 ( resid 26  and name N ) 5.00 -35.30 11.42  2

assign  ( resid 26  and name N )
        ( resid 26  and name CA )
        ( resid 26  and name C )
        ( resid 27  and name N ) 5.00 -22.76 28.78  2


  Entry H atom name         Submitted Coord H atom name
  Start of MODEL    1
    1    H1   GLY   1           HT1      GLY   1   9.631  -1.463 -11.583
    2    H2   GLY   1           HT2      GLY   1  11.253  -1.389 -11.083
    3    H3   GLY   1           HT3      GLY   1  10.723  -0.449 -12.395
    4    HA2  GLY   1           HA2      GLY   1  10.421   1.293 -11.038
    5    HA3  GLY   1           HA1      GLY   1   9.169   0.277 -10.262
    6    H    GLN   2           HN       GLN   2  10.537   2.074  -8.763
    7    HA   GLN   2           HA       GLN   2  11.566   0.380  -6.678
    8    HB2  GLN   2           HB2      GLN   2  10.310   3.133  -6.437
    9    HB3  GLN   2           HB1      GLN   2  11.354   2.357  -5.245
   10    HG2  GLN   2           HG2      GLN   2  13.203   2.319  -6.861
   11    HG3  GLN   2           HG1      GLN   2  12.165   3.052  -8.084
   12   HE21  GLN   2          HE21      GLN   2  10.816   4.922  -6.281
   13   HE22  GLN   2          HE22      GLN   2  11.960   6.092  -5.829
   14    H    GLN   3           HN       GLN   3  10.214  -1.257  -5.987
   15    HA   GLN   3           HA       GLN   3   7.351  -0.949  -5.747
   16    HB2  GLN   3           HB2      GLN   3   7.447  -3.121  -4.542
   17    HB3  GLN   3           HB1      GLN   3   8.317  -3.161  -6.075
   18    HG2  GLN   3           HG2      GLN   3  10.441  -2.698  -4.827
   19    HG3  GLN   3           HG1      GLN   3   9.537  -2.829  -3.319
   20   HE21  GLN   3          HE21      GLN   3  11.721  -4.627  -4.396
   21   HE22  GLN   3          HE22      GLN   3  11.034  -6.179  -4.432
   22    H    TYR   4           HN       TYR   4   6.122  -0.731  -3.860
   23    HA   TYR   4           HA       TYR   4   7.082   1.071  -1.911
   24    HB2  TYR   4           HB2      TYR   4   4.673  -0.658  -1.373
   25    HB3  TYR   4           HB1      TYR   4   4.863   1.068  -1.124
   26    HD1  TYR   4           HD2      TYR   4   4.843   2.631  -3.092
   27    HD2  TYR   4           HD1      TYR   4   3.881  -1.540  -3.470
   28    HE1  TYR   4           HE2      TYR   4   3.817   3.063  -5.308
   29    HE2  TYR   4           HE1      TYR   4   2.875  -1.110  -5.687
   30    HH   TYR   4           HH       TYR   4   2.919   0.504  -7.447
   31    H    THR   5           HN       THR   5   8.408   0.614  -0.150
   32    HA   THR   5           HA       THR   5   8.410  -2.197   0.969
   33    HB   THR   5           HB       THR   5  10.730  -1.963   1.399
   34    HG1  THR   5           HG1      THR   5  11.704   0.162   0.967
   35   HG21  THR   5          HG21      THR   5  10.418  -0.415  -1.171
   36   HG22  THR   5          HG22      THR   5  10.038  -2.135  -1.075
   37   HG23  THR   5          HG23      THR   5  11.678  -1.572  -0.755
   38    H    ALA   6           HN       ALA   6   8.305   1.219   1.754
   39    HA   ALA   6           HA       ALA   6   8.412   0.682   4.691
   40    HB1  ALA   6           HB1      ALA   6   8.103   3.321   3.196
   41    HB2  ALA   6           HB2      ALA   6   9.660   2.630   3.674
   42    HB3  ALA   6           HB3      ALA   6   8.493   3.108   4.907
   43    H1   NAL   7           H1       NAL   7   3.348   4.790   1.763
   44    H3   NAL   7           H3       NAL   7   6.292   2.229  -0.014
   45    H4   NAL   7           H4       NAL   7   7.375   4.173  -1.110
   46    H5   NAL   7           H5       NAL   7   7.454   6.717  -1.550
   47    H6   NAL   7           H6       NAL   7   6.496   8.973  -1.191
   48    H7   NAL   7           H7       NAL   7   4.483   9.272   0.230
   49    H8   NAL   7           H8       NAL   7   3.405   7.314   1.305
   50    H91  NAL   7           H91      NAL   7   3.013   2.429   1.471
   51    H92  NAL   7           H92      NAL   7   4.414   1.396   1.174
   52    H10  NAL   7           H10      NAL   7   4.246   3.378   3.473
   53    HN1  NAL   7           HN1      NAL   7   6.496   2.507   2.426
   54    H    ILE   8           HN       ILE   8   4.731  -0.110   3.062
   55    HA   ILE   8           HA       ILE   8   2.728  -0.617   5.174
   56    HB   ILE   8           HB       ILE   8   1.807  -2.427   3.389
   57   HG12  ILE   8          HG12      ILE   8   1.651  -1.445   1.136
   58   HG13  ILE   8          HG11      ILE   8   2.618  -0.067   1.635
   59   HG21  ILE   8          HG21      ILE   8  -0.008  -0.889   2.830
   60   HG22  ILE   8          HG22      ILE   8   0.981   0.497   3.299
   61   HG23  ILE   8          HG23      ILE   8   0.446  -0.667   4.520
   62   HD11  ILE   8          HD11      ILE   8   4.589  -1.373   1.774
   63   HD12  ILE   8          HD12      ILE   8   3.780  -1.973   0.338
   64   HD13  ILE   8          HD13      ILE   8   3.684  -2.888   1.830
   65    H    LYS   9           HN       LYS   9   3.510  -2.116   6.461
   66    HA   LYS   9           HA       LYS   9   5.788  -3.786   5.628
   67    HB2  LYS   9           HB2      LYS   9   5.986  -2.357   7.673
   68    HB3  LYS   9           HB1      LYS   9   4.703  -3.317   8.411
   69    HG2  LYS   9           HG2      LYS   9   6.047  -5.336   8.253
   70    HG3  LYS   9           HG1      LYS   9   7.298  -4.478   7.354
   71    HD2  LYS   9           HD2      LYS   9   7.654  -2.989   9.312
   72    HD3  LYS   9           HD1      LYS   9   6.455  -3.919  10.212
   73    HE2  LYS   9           HE2      LYS   9   8.767  -4.663  10.723
   74    HE3  LYS   9           HE1      LYS   9   7.816  -5.947   9.976
   75    HZ1  LYS   9           HZ1      LYS   9   9.113  -5.959   8.179
   76    HZ2  LYS   9           HZ2      LYS   9  10.236  -5.104   9.124
   77    HZ3  LYS   9           HZ3      LYS   9   9.185  -4.267   8.084
   78    H    GLY  10           HN       GLY  10   5.536  -5.939   5.305
   79    HA2  GLY  10           HA2      GLY  10   4.728  -8.134   5.711
   80    HA3  GLY  10           HA1      GLY  10   3.488  -7.475   6.772
   81    H    ARG  11           HN       ARG  11   2.840  -5.510   4.437
   82    HA   ARG  11           HA       ARG  11   1.407  -7.440   2.620
   83    HB2  ARG  11           HB2      ARG  11   0.242  -4.938   3.893
   84    HB3  ARG  11           HB1      ARG  11  -0.571  -5.934   2.693
   85    HG2  ARG  11           HG2      ARG  11   0.400  -7.134   5.307
   86    HG3  ARG  11           HG1      ARG  11  -1.151  -6.314   5.216
   87    HD2  ARG  11           HD2      ARG  11  -0.310  -8.724   3.572
   88    HD3  ARG  11           HD1      ARG  11  -1.478  -8.707   4.886
   89    HE   ARG  11           HE       ARG  11  -2.479  -6.839   3.099
   90   HH11  ARG  11          HH21      ARG  11  -1.462 -10.137   2.951
   91   HH12  ARG  11          HH22      ARG  11  -2.574 -10.559   1.692
   92   HH21  ARG  11          HH11      ARG  11  -3.934  -7.379   1.459
   93   HH22  ARG  11          HH12      ARG  11  -3.972  -8.999   0.848
   94    H    THR  12           HN       THR  12   2.732  -7.012   0.837
   95    HA   THR  12           HA       THR  12   3.079  -4.213  -0.006
   96    HB   THR  12           HB       THR  12   4.475  -5.953  -1.792
   97    HG1  THR  12           HG1      THR  12   5.642  -6.653   0.483
   98   HG21  THR  12          HG21      THR  12   6.469  -4.901  -0.864
   99   HG22  THR  12          HG22      THR  12   5.577  -4.394   0.572
  100   HG23  THR  12          HG23      THR  12   5.195  -3.686  -0.997
  101    H    PHE  13           HN       PHE  13   2.758  -3.708  -2.287
  102    HA   PHE  13           HA       PHE  13   0.428  -5.216  -3.459
  103    HB2  PHE  13           HB2      PHE  13   1.105  -2.260  -3.431
  104    HB3  PHE  13           HB1      PHE  13  -0.203  -2.959  -4.385
  105    HD1  PHE  13           HD1      PHE  13   1.112  -2.782  -0.865
  106    HD2  PHE  13           HD2      PHE  13  -2.338  -3.223  -3.385
  107    HE1  PHE  13           HE1      PHE  13  -0.354  -2.745   1.124
  108    HE2  PHE  13           HE2      PHE  13  -3.791  -3.196  -1.391
  109    HZ   PHE  13           HZ       PHE  13  -2.799  -2.932   0.850
  110    H    ARG  14           HN       ARG  14   0.655  -5.887  -5.527
  111    HA   ARG  14           HA       ARG  14   3.179  -5.276  -6.982
  112    HB2  ARG  14           HB2      ARG  14   2.280  -7.632  -6.876
  113    HB3  ARG  14           HB1      ARG  14   0.871  -7.092  -7.790
  114    HG2  ARG  14           HG2      ARG  14   2.329  -6.403  -9.654
  115    HG3  ARG  14           HG1      ARG  14   3.749  -6.918  -8.741
  116    HD2  ARG  14           HD2      ARG  14   2.920  -9.222  -8.702
  117    HD3  ARG  14           HD1      ARG  14   1.458  -8.727  -9.556
  118    HE   ARG  14           HE       ARG  14   3.518  -7.893 -11.221
  119   HH11  ARG  14          HH21      ARG  14   2.574 -10.846  -9.699
  120   HH12  ARG  14          HH22      ARG  14   3.219 -11.851 -10.954
  121   HH21  ARG  14          HH11      ARG  14   4.363  -9.192 -12.862
  122   HH22  ARG  14          HH12      ARG  14   4.231 -10.914 -12.743
  123    H    ASN  15           HN       ASN  15  -0.319  -4.887  -7.230
  124    HA   ASN  15           HA       ASN  15   0.000  -3.020  -9.559
  125    HB2  ASN  15           HB2      ASN  15  -2.687  -3.318  -9.371
  126    HB3  ASN  15           HB1      ASN  15  -1.689  -4.428 -10.313
  127   HD21  ASN  15          HD21      ASN  15  -4.203  -4.563  -8.273
  128   HD22  ASN  15          HD22      ASN  15  -3.868  -6.005  -7.443
  129    H    GLU  16           HN       GLU  16  -0.199  -0.899  -9.138
  130    HA   GLU  16           HA       GLU  16  -0.715   0.034  -6.479
  131    HB2  GLU  16           HB2      GLU  16   0.642   1.289  -8.182
  132    HB3  GLU  16           HB1      GLU  16  -0.853   1.629  -9.055
  133    HG2  GLU  16           HG2      GLU  16  -1.754   2.833  -7.142
  134    HG3  GLU  16           HG1      GLU  16  -0.350   2.400  -6.166
  135    H    LYS  17           HN       LYS  17  -2.761  -0.782  -9.128
  136    HA   LYS  17           HA       LYS  17  -5.007   0.815  -8.618
  137    HB2  LYS  17           HB2      LYS  17  -4.788  -0.629 -10.591
  138    HB3  LYS  17           HB1      LYS  17  -4.886  -2.050  -9.551
  139    HG2  LYS  17           HG2      LYS  17  -7.159  -1.544  -8.930
  140    HG3  LYS  17           HG1      LYS  17  -7.072   0.051  -9.677
  141    HD2  LYS  17           HD2      LYS  17  -8.313  -1.612 -11.072
  142    HD3  LYS  17           HD1      LYS  17  -6.907  -0.939 -11.893
  143    HE2  LYS  17           HE2      LYS  17  -6.633  -3.513 -10.336
  144    HE3  LYS  17           HE1      LYS  17  -7.286  -3.537 -11.975
  145    HZ1  LYS  17           HZ1      LYS  17  -5.125  -1.936 -12.211
  146    HZ2  LYS  17           HZ2      LYS  17  -5.165  -3.589 -12.599
  147    HZ3  LYS  17           HZ3      LYS  17  -4.592  -3.084 -11.082
  148    H    GLU  18           HN       GLU  18  -4.095  -2.347  -7.232
  149    HA   GLU  18           HA       GLU  18  -6.391  -2.517  -5.536
  150    HB2  GLU  18           HB2      GLU  18  -5.044  -4.479  -6.228
  151    HB3  GLU  18           HB1      GLU  18  -3.707  -3.882  -5.247
  152    HG2  GLU  18           HG2      GLU  18  -5.048  -4.068  -3.230
  153    HG3  GLU  18           HG1      GLU  18  -6.469  -4.508  -4.174
  154    H    LEU  19           HN       LEU  19  -3.154  -1.172  -5.133
  155    HA   LEU  19           HA       LEU  19  -3.392  -0.755  -2.293
  156    HB2  LEU  19           HB2      LEU  19  -1.210  -0.758  -3.312
  157    HB3  LEU  19           HB1      LEU  19  -1.665   0.534  -4.399
  158    HG   LEU  19           HG       LEU  19  -1.919   1.999  -2.350
  159   HD11  LEU  19          HD11      LEU  19  -2.128   0.327  -0.599
  160   HD12  LEU  19          HD12      LEU  19  -0.661   1.254  -0.321
  161   HD13  LEU  19          HD13      LEU  19  -0.562  -0.350  -1.034
  162   HD21  LEU  19          HD21      LEU  19   0.057   2.118  -3.794
  163   HD22  LEU  19          HD22      LEU  19   0.799   0.802  -2.884
  164   HD23  LEU  19          HD23      LEU  19   0.509   2.358  -2.106
  165    H    ARG  20           HN       ARG  20  -4.283   1.132  -5.144
  166    HA   ARG  20           HA       ARG  20  -4.889   3.590  -3.822
  167    HB2  ARG  20           HB2      ARG  20  -4.794   3.278  -6.310
  168    HB3  ARG  20           HB1      ARG  20  -6.311   2.386  -6.214
  169    HG2  ARG  20           HG2      ARG  20  -7.440   4.357  -5.281
  170    HG3  ARG  20           HG1      ARG  20  -5.922   5.254  -5.300
  171    HD2  ARG  20           HD2      ARG  20  -5.809   4.949  -7.768
  172    HD3  ARG  20           HD1      ARG  20  -7.378   4.145  -7.716
  173    HE   ARG  20           HE       ARG  20  -7.833   6.576  -6.454
  174   HH11  ARG  20          HH21      ARG  20  -6.515   5.538  -9.474
  175   HH12  ARG  20          HH22      ARG  20  -7.032   6.950 -10.333
  176   HH21  ARG  20          HH11      ARG  20  -8.511   8.420  -7.563
  177   HH22  ARG  20          HH12      ARG  20  -8.161   8.581  -9.252
  178    H    ASP  21           HN       ASP  21  -6.698   0.652  -4.313
  179    HA   ASP  21           HA       ASP  21  -9.148   1.611  -3.166
  180    HB2  ASP  21           HB2      ASP  21  -9.140  -0.247  -4.781
  181    HB3  ASP  21           HB1      ASP  21  -8.210  -1.228  -3.650
  182    H    PHE  22           HN       PHE  22  -6.623  -0.638  -2.002
  183    HA   PHE  22           HA       PHE  22  -7.714  -0.922   0.586
  184    HB2  PHE  22           HB2      PHE  22  -4.995  -1.316  -0.609
  185    HB3  PHE  22           HB1      PHE  22  -5.124  -1.343   1.141
  186    HD1  PHE  22           HD2      PHE  22  -7.508  -2.597  -1.476
  187    HD2  PHE  22           HD1      PHE  22  -4.885  -3.622   1.776
  188    HE1  PHE  22           HE2      PHE  22  -8.285  -4.936  -1.580
  189    HE2  PHE  22           HE1      PHE  22  -5.669  -5.956   1.663
  190    HZ   PHE  22           HZ       PHE  22  -7.370  -6.624  -0.012
  191    H    ILE  23           HN       ILE  23  -5.911   1.608  -0.902
  192    HA   ILE  23           HA       ILE  23  -5.011   2.933   1.487
  193    HB   ILE  23           HB       ILE  23  -5.340   3.606  -1.409
  194   HG12  ILE  23          HG12      ILE  23  -3.121   4.181   0.593
  195   HG13  ILE  23          HG11      ILE  23  -3.218   2.728  -0.393
  196   HG21  ILE  23          HG21      ILE  23  -6.407   5.571  -0.592
  197   HG22  ILE  23          HG22      ILE  23  -4.749   6.042  -0.926
  198   HG23  ILE  23          HG23      ILE  23  -5.254   5.730   0.733
  199   HD11  ILE  23          HD11      ILE  23  -1.681   4.392  -1.379
  200   HD12  ILE  23          HD12      ILE  23  -2.999   5.559  -1.460
  201   HD13  ILE  23          HD13      ILE  23  -3.057   4.094  -2.429
  202    H    GLU  24           HN       GLU  24  -7.921   3.009  -0.437
  203    HA   GLU  24           HA       GLU  24  -9.210   5.129   0.958
  204    HB2  GLU  24           HB2      GLU  24 -10.422   2.763  -0.495
  205    HB3  GLU  24           HB1      GLU  24 -11.373   4.083   0.166
  206    HG2  GLU  24           HG2      GLU  24 -10.090   5.688  -1.225
  207    HG3  GLU  24           HG1      GLU  24  -9.197   4.343  -1.932
  208    H    LYS  25           HN       LYS  25  -8.665   1.785   1.738
  209    HA   LYS  25           HA       LYS  25 -10.632   1.663   3.894
  210    HB2  LYS  25           HB2      LYS  25  -9.733  -0.351   2.654
  211    HB3  LYS  25           HB1      LYS  25  -8.199  -0.106   3.485
  212    HG2  LYS  25           HG2      LYS  25  -9.369  -0.315   5.670
  213    HG3  LYS  25           HG1      LYS  25 -10.878  -0.634   4.812
  214    HD2  LYS  25           HD2      LYS  25  -9.938  -2.638   3.804
  215    HD3  LYS  25           HD1      LYS  25  -8.360  -2.295   4.515
  216    HE2  LYS  25           HE2      LYS  25  -9.744  -4.005   5.777
  217    HE3  LYS  25           HE1      LYS  25  -9.201  -2.633   6.743
  218    HZ1  LYS  25           HZ1      LYS  25 -11.342  -1.590   6.438
  219    HZ2  LYS  25           HZ2      LYS  25 -11.548  -3.140   7.103
  220    HZ3  LYS  25           HZ3      LYS  25 -11.867  -2.870   5.456
  221    H    PHE  26           HN       PHE  26  -7.052   2.062   3.778
  222    HA   PHE  26           HA       PHE  26  -6.711   2.291   6.607
  223    HB2  PHE  26           HB2      PHE  26  -5.035   3.862   4.626
  224    HB3  PHE  26           HB1      PHE  26  -4.541   3.180   6.169
  225    HD1  PHE  26           HD1      PHE  26  -5.820   0.361   5.767
  226    HD2  PHE  26           HD2      PHE  26  -3.383   2.841   3.222
  227    HE1  PHE  26           HE1      PHE  26  -4.983  -1.646   4.604
  228    HE2  PHE  26           HE2      PHE  26  -2.556   0.813   2.053
  229    HZ   PHE  26           HZ       PHE  26  -3.352  -1.426   2.754
  230   H11A  DNS  27          H22       DNS  27  -1.036   2.233   6.831
  231    H12  DNS  27           H23      DNS  27  -1.218   2.245   5.074
  232    H13  DNS  27           H24      DNS  27  -2.359   3.153   6.090
  233    H21  DNS  27           H21      DNS  27   1.103   3.217   4.688
  234    H22  DNS  27           H19      DNS  27   1.218   2.830   6.415
  235    H23  DNS  27           H20      DNS  27   1.628   4.453   5.851
  236    H4   DNS  27           H14      DNS  27  -0.577   3.423   3.243
  237    H5   DNS  27           H15      DNS  27  -1.322   5.039   1.478
  238    H6   DNS  27           H16      DNS  27  -2.011   7.363   2.107
  239    HZ   DNS  27           HZ1      DNS  27  -4.141   8.149   3.925
  240    HE3  DNS  27           HE1      DNS  27  -5.053  10.235   2.863
  241    HE2  DNS  27           HE2      DNS  27  -4.650   9.435   1.352
  242    HD3  DNS  27           HD1      DNS  27  -7.050   9.132   2.272
  243    HD2  DNS  27           HD2      DNS  27  -6.203   7.686   1.724
  244    HG3  DNS  27           HG1      DNS  27  -5.688   7.007   3.960
  245    HG2  DNS  27           HG2      DNS  27  -6.139   8.579   4.624
  246    HB3  DNS  27           HB1      DNS  27  -8.470   8.208   4.138
  247    HB2  DNS  27           HB2      DNS  27  -8.107   6.751   3.212
  248    HA   DNS  27           HA       DNS  27  -7.351   6.960   6.140
  249    H    DNS  27           HN       DNS  27  -7.184   4.856   4.152
  250    H9   DNS  27           H9       DNS  27  -2.296   9.793   6.258
  251    H10  DNS  27           H10      DNS  27  -1.552   8.175   8.009
  252    H11  DNS  27           H11      DNS  27  -0.865   5.855   7.375
  253    H    GLY  28           HN       GLY  28  -8.907   6.438   7.696
  254    HA2  GLY  28           HA2      GLY  28 -11.612   7.107   7.199
  255    HA3  GLY  28           HA1      GLY  28 -11.488   5.348   7.129
  256    H    ARG  29           HN       ARG  29 -10.316   8.014   9.218
  257    HA   ARG  29           HA       ARG  29 -11.579   6.907  11.570
  258    HB2  ARG  29           HB2      ARG  29  -9.435   6.352  12.772
  259    HB3  ARG  29           HB1      ARG  29  -9.819   5.245  11.455
  260    HG2  ARG  29           HG2      ARG  29  -8.294   6.490   9.960
  261    HG3  ARG  29           HG1      ARG  29  -7.902   7.592  11.281
  262    HD2  ARG  29           HD2      ARG  29  -7.427   4.597  11.300
  263    HD3  ARG  29           HD1      ARG  29  -6.187   5.824  11.042
  264    HE   ARG  29           HE       ARG  29  -7.351   6.542  13.460
  265   HH11  ARG  29          HH21      ARG  29  -5.908   3.704  12.120
  266   HH12  ARG  29          HH22      ARG  29  -5.318   3.128  13.643
  267   HH21  ARG  29          HH11      ARG  29  -6.585   5.801  15.450
  268   HH22  ARG  29          HH12      ARG  29  -5.701   4.314  15.526
  Start of MODEL    2
    1    H1   GLY   1           HT1      GLY   1   7.888   1.247 -12.264
    2    H2   GLY   1           HT2      GLY   1   9.278   0.549 -11.581
    3    H3   GLY   1           HT3      GLY   1   9.352   2.108 -12.253
    4    HA2  GLY   1           HA2      GLY   1   8.076   3.147 -10.559
    5    HA3  GLY   1           HA1      GLY   1   7.703   1.518  -9.920
    6    H    GLN   2           HN       GLN   2   8.813   3.423  -8.293
    7    HA   GLN   2           HA       GLN   2  11.071   1.943  -7.276
    8    HB2  GLN   2           HB2      GLN   2  10.727   3.308  -5.217
    9    HB3  GLN   2           HB1      GLN   2  10.754   4.291  -6.681
   10    HG2  GLN   2           HG2      GLN   2   8.241   4.207  -6.708
   11    HG3  GLN   2           HG1      GLN   2   8.297   3.382  -5.150
   12   HE21  GLN   2          HE21      GLN   2  10.384   4.812  -3.873
   13   HE22  GLN   2          HE22      GLN   2   9.903   6.427  -3.668
   14    H    GLN   3           HN       GLN   3  11.134   0.300  -5.756
   15    HA   GLN   3           HA       GLN   3   8.709  -1.258  -5.356
   16    HB2  GLN   3           HB2      GLN   3  11.427  -1.536  -4.029
   17    HB3  GLN   3           HB1      GLN   3  10.155  -2.757  -4.058
   18    HG2  GLN   3           HG2      GLN   3  11.475  -1.615  -6.540
   19    HG3  GLN   3           HG1      GLN   3  11.937  -3.138  -5.784
   20   HE21  GLN   3          HE21      GLN   3   9.574  -4.382  -5.187
   21   HE22  GLN   3          HE22      GLN   3   8.620  -4.591  -6.576
   22    H    TYR   4           HN       TYR   4   7.269  -0.995  -3.724
   23    HA   TYR   4           HA       TYR   4   7.559   1.070  -1.798
   24    HB2  TYR   4           HB2      TYR   4   5.496  -0.593  -0.819
   25    HB3  TYR   4           HB1      TYR   4   5.284   0.782  -1.890
   26    HD1  TYR   4           HD1      TYR   4   6.585  -2.741  -2.263
   27    HD2  TYR   4           HD2      TYR   4   3.906   0.283  -3.756
   28    HE1  TYR   4           HE1      TYR   4   5.857  -4.268  -4.067
   29    HE2  TYR   4           HE2      TYR   4   3.185  -1.257  -5.554
   30    HH   TYR   4           HH       TYR   4   4.602  -4.513  -5.869
   31    H    THR   5           HN       THR   5   8.664   1.037   0.101
   32    HA   THR   5           HA       THR   5   9.311  -1.621   1.383
   33    HB   THR   5           HB       THR   5  11.408  -0.718   2.047
   34    HG1  THR   5           HG1      THR   5  10.073   1.654   1.644
   35   HG21  THR   5          HG21      THR   5  10.975   0.491  -0.685
   36   HG22  THR   5          HG22      THR   5  11.131  -1.250  -0.439
   37   HG23  THR   5          HG23      THR   5  12.470  -0.176  -0.031
   38    H    ALA   6           HN       ALA   6   8.124   1.622   1.857
   39    HA   ALA   6           HA       ALA   6   7.865   1.189   4.828
   40    HB1  ALA   6           HB1      ALA   6   7.768   3.609   5.003
   41    HB2  ALA   6           HB2      ALA   6   7.728   3.783   3.245
   42    HB3  ALA   6           HB3      ALA   6   9.187   3.184   4.046
   43    H1   NAL   7           H1       NAL   7   3.237   4.834   0.918
   44    H3   NAL   7           H3       NAL   7   6.259   2.143  -0.504
   45    H4   NAL   7           H4       NAL   7   7.426   3.999  -1.661
   46    H5   NAL   7           H5       NAL   7   7.553   6.508  -2.264
   47    H6   NAL   7           H6       NAL   7   6.593   8.786  -2.113
   48    H7   NAL   7           H7       NAL   7   4.502   9.189  -0.835
   49    H8   NAL   7           H8       NAL   7   3.349   7.312   0.303
   50    H91  NAL   7           H91      NAL   7   2.903   2.424   0.691
   51    H92  NAL   7           H92      NAL   7   4.327   1.386   0.613
   52    H10  NAL   7           H10      NAL   7   3.847   3.500   2.747
   53    HN1  NAL   7           HN1      NAL   7   6.274   2.672   2.060
   54    H    ILE   8           HN       ILE   8   4.406   0.010   2.361
   55    HA   ILE   8           HA       ILE   8   2.345  -0.505   4.443
   56    HB   ILE   8           HB       ILE   8   1.416  -2.261   2.622
   57   HG12  ILE   8          HG12      ILE   8   1.323  -1.254   0.378
   58   HG13  ILE   8          HG11      ILE   8   2.331   0.085   0.903
   59   HG21  ILE   8          HG21      ILE   8   0.082  -0.475   3.741
   60   HG22  ILE   8          HG22      ILE   8  -0.345  -0.672   2.041
   61   HG23  ILE   8          HG23      ILE   8   0.674   0.682   2.539
   62   HD11  ILE   8          HD11      ILE   8   4.237  -1.349   1.139
   63   HD12  ILE   8          HD12      ILE   8   3.488  -1.750  -0.404
   64   HD13  ILE   8          HD13      ILE   8   3.239  -2.795   0.982
   65    H    LYS   9           HN       LYS   9   3.568  -1.639   5.814
   66    HA   LYS   9           HA       LYS   9   5.561  -3.544   4.862
   67    HB2  LYS   9           HB2      LYS   9   6.523  -3.426   6.973
   68    HB3  LYS   9           HB1      LYS   9   5.686  -1.879   6.934
   69    HG2  LYS   9           HG2      LYS   9   3.718  -3.092   8.091
   70    HG3  LYS   9           HG1      LYS   9   4.834  -4.430   8.345
   71    HD2  LYS   9           HD2      LYS   9   6.393  -2.866   9.504
   72    HD3  LYS   9           HD1      LYS   9   5.191  -1.588   9.335
   73    HE2  LYS   9           HE2      LYS   9   5.053  -2.666  11.558
   74    HE3  LYS   9           HE1      LYS   9   3.575  -2.914  10.629
   75    HZ1  LYS   9           HZ1      LYS   9   3.955  -5.105  10.444
   76    HZ2  LYS   9           HZ2      LYS   9   4.938  -4.878  11.811
   77    HZ3  LYS   9           HZ3      LYS   9   5.631  -4.922  10.261
   78    H    GLY  10           HN       GLY  10   5.440  -5.750   4.995
   79    HA2  GLY  10           HA2      GLY  10   4.593  -7.884   5.497
   80    HA3  GLY  10           HA1      GLY  10   3.437  -7.133   6.589
   81    H    ARG  11           HN       ARG  11   2.587  -5.366   4.160
   82    HA   ARG  11           HA       ARG  11   1.049  -7.458   2.627
   83    HB2  ARG  11           HB2      ARG  11  -0.103  -4.887   3.755
   84    HB3  ARG  11           HB1      ARG  11  -0.972  -6.105   2.821
   85    HG2  ARG  11           HG2      ARG  11  -0.558  -7.772   4.583
   86    HG3  ARG  11           HG1      ARG  11   0.339  -6.573   5.516
   87    HD2  ARG  11           HD2      ARG  11  -1.982  -6.766   6.333
   88    HD3  ARG  11           HD1      ARG  11  -1.678  -5.164   5.661
   89    HE   ARG  11           HE       ARG  11  -2.684  -6.617   3.516
   90   HH11  ARG  11          HH21      ARG  11  -3.677  -5.902   6.746
   91   HH12  ARG  11          HH22      ARG  11  -5.368  -5.965   6.378
   92   HH21  ARG  11          HH11      ARG  11  -4.886  -6.701   3.025
   93   HH22  ARG  11          HH12      ARG  11  -6.052  -6.417   4.275
   94    H    THR  12           HN       THR  12   2.192  -7.131   0.695
   95    HA   THR  12           HA       THR  12   2.273  -4.392  -0.422
   96    HB   THR  12           HB       THR  12   3.804  -5.932  -2.140
   97    HG1  THR  12           HG1      THR  12   4.875  -6.847   0.159
   98   HG21  THR  12          HG21      THR  12   5.761  -4.989  -0.971
   99   HG22  THR  12          HG22      THR  12   4.745  -4.581   0.412
  100   HG23  THR  12          HG23      THR  12   4.483  -3.786  -1.139
  101    H    PHE  13           HN       PHE  13   1.780  -4.156  -2.694
  102    HA   PHE  13           HA       PHE  13  -0.346  -6.063  -3.638
  103    HB2  PHE  13           HB2      PHE  13  -0.141  -3.071  -4.092
  104    HB3  PHE  13           HB1      PHE  13  -1.474  -4.120  -4.583
  105    HD1  PHE  13           HD1      PHE  13   0.375  -2.774  -1.625
  106    HD2  PHE  13           HD2      PHE  13  -3.187  -4.735  -3.020
  107    HE1  PHE  13           HE1      PHE  13  -0.631  -2.592   0.635
  108    HE2  PHE  13           HE2      PHE  13  -4.196  -4.502  -0.775
  109    HZ   PHE  13           HZ       PHE  13  -2.910  -3.417   1.043
  110    H    ARG  14           HN       ARG  14  -0.034  -6.889  -5.658
  111    HA   ARG  14           HA       ARG  14   2.437  -6.424  -7.064
  112    HB2  ARG  14           HB2      ARG  14  -0.175  -7.717  -7.934
  113    HB3  ARG  14           HB1      ARG  14   1.260  -7.666  -8.958
  114    HG2  ARG  14           HG2      ARG  14   2.542  -8.927  -7.320
  115    HG3  ARG  14           HG1      ARG  14   1.207  -8.867  -6.171
  116    HD2  ARG  14           HD2      ARG  14  -0.197 -10.173  -7.710
  117    HD3  ARG  14           HD1      ARG  14   1.117 -10.211  -8.888
  118    HE   ARG  14           HE       ARG  14   2.250 -11.267  -6.582
  119   HH11  ARG  14          HH21      ARG  14  -0.532 -11.913  -8.525
  120   HH12  ARG  14          HH22      ARG  14  -0.546 -13.607  -8.169
  121   HH21  ARG  14          HH11      ARG  14   2.242 -13.471  -6.112
  122   HH22  ARG  14          HH12      ARG  14   1.023 -14.489  -6.805
  123    H    ASN  15           HN       ASN  15  -0.874  -5.277  -7.467
  124    HA   ASN  15           HA       ASN  15   0.045  -3.239  -9.475
  125    HB2  ASN  15           HB2      ASN  15  -2.562  -2.937  -9.661
  126    HB3  ASN  15           HB1      ASN  15  -1.792  -4.294 -10.488
  127   HD21  ASN  15          HD21      ASN  15  -4.133  -5.149 -10.233
  128   HD22  ASN  15          HD22      ASN  15  -4.479  -6.018  -8.815
  129    H    GLU  16           HN       GLU  16   0.206  -1.192  -8.768
  130    HA   GLU  16           HA       GLU  16  -0.342  -0.512  -6.057
  131    HB2  GLU  16           HB2      GLU  16   1.289   0.764  -7.371
  132    HB3  GLU  16           HB1      GLU  16   0.028   1.268  -8.494
  133    HG2  GLU  16           HG2      GLU  16  -1.067   2.591  -6.801
  134    HG3  GLU  16           HG1      GLU  16  -0.035   1.928  -5.536
  135    H    LYS  17           HN       LYS  17  -2.314  -0.687  -8.867
  136    HA   LYS  17           HA       LYS  17  -4.364   1.128  -8.311
  137    HB2  LYS  17           HB2      LYS  17  -4.119  -0.380 -10.355
  138    HB3  LYS  17           HB1      LYS  17  -4.805  -1.675  -9.383
  139    HG2  LYS  17           HG2      LYS  17  -6.807  -0.262  -8.946
  140    HG3  LYS  17           HG1      LYS  17  -6.143   0.984  -9.996
  141    HD2  LYS  17           HD2      LYS  17  -6.527  -1.843 -11.036
  142    HD3  LYS  17           HD1      LYS  17  -7.882  -0.722 -10.997
  143    HE2  LYS  17           HE2      LYS  17  -5.254  -0.276 -12.454
  144    HE3  LYS  17           HE1      LYS  17  -6.808  -0.643 -13.190
  145    HZ1  LYS  17           HZ1      LYS  17  -7.431   1.473 -11.691
  146    HZ2  LYS  17           HZ2      LYS  17  -6.968   1.571 -13.322
  147    HZ3  LYS  17           HZ3      LYS  17  -5.828   1.849 -12.094
  148    H    GLU  18           HN       GLU  18  -3.952  -2.215  -7.166
  149    HA   GLU  18           HA       GLU  18  -6.319  -2.244  -5.569
  150    HB2  GLU  18           HB2      GLU  18  -3.802  -3.910  -5.465
  151    HB3  GLU  18           HB1      GLU  18  -5.237  -4.236  -4.488
  152    HG2  GLU  18           HG2      GLU  18  -6.588  -4.556  -6.475
  153    HG3  GLU  18           HG1      GLU  18  -5.251  -4.061  -7.512
  154    H    LEU  19           HN       LEU  19  -3.007  -1.216  -4.951
  155    HA   LEU  19           HA       LEU  19  -3.357  -0.990  -2.093
  156    HB2  LEU  19           HB2      LEU  19  -1.109  -1.083  -2.870
  157    HB3  LEU  19           HB1      LEU  19  -1.384   0.174  -4.054
  158    HG   LEU  19           HG       LEU  19  -1.584   1.829  -2.209
  159   HD11  LEU  19          HD11      LEU  19  -0.759  -0.457  -0.434
  160   HD12  LEU  19          HD12      LEU  19  -2.346   0.286  -0.412
  161   HD13  LEU  19          HD13      LEU  19  -0.932   1.215   0.063
  162   HD21  LEU  19          HD21      LEU  19   0.920   0.146  -2.156
  163   HD22  LEU  19          HD22      LEU  19   0.797   1.803  -1.564
  164   HD23  LEU  19          HD23      LEU  19   0.581   1.461  -3.279
  165    H    ARG  20           HN       ARG  20  -3.927   1.112  -4.864
  166    HA   ARG  20           HA       ARG  20  -4.400   3.549  -3.453
  167    HB2  ARG  20           HB2      ARG  20  -4.182   3.339  -5.948
  168    HB3  ARG  20           HB1      ARG  20  -5.777   2.590  -5.978
  169    HG2  ARG  20           HG2      ARG  20  -6.761   4.622  -4.985
  170    HG3  ARG  20           HG1      ARG  20  -5.166   5.371  -4.925
  171    HD2  ARG  20           HD2      ARG  20  -4.991   5.186  -7.383
  172    HD3  ARG  20           HD1      ARG  20  -6.598   4.459  -7.437
  173    HE   ARG  20           HE       ARG  20  -6.998   6.854  -6.094
  174   HH11  ARG  20          HH21      ARG  20  -5.584   5.882  -9.091
  175   HH12  ARG  20          HH22      ARG  20  -5.992   7.352  -9.910
  176   HH21  ARG  20          HH11      ARG  20  -7.534   8.774  -7.150
  177   HH22  ARG  20          HH12      ARG  20  -7.094   8.989  -8.811
  178    H    ASP  21           HN       ASP  21  -6.392   0.791  -4.177
  179    HA   ASP  21           HA       ASP  21  -8.832   1.888  -3.136
  180    HB2  ASP  21           HB2      ASP  21  -8.012  -0.959  -3.764
  181    HB3  ASP  21           HB1      ASP  21  -9.638  -0.489  -3.269
  182    H    PHE  22           HN       PHE  22  -6.541  -0.575  -1.922
  183    HA   PHE  22           HA       PHE  22  -7.793  -0.844   0.599
  184    HB2  PHE  22           HB2      PHE  22  -5.079  -1.467  -0.500
  185    HB3  PHE  22           HB1      PHE  22  -5.252  -1.484   1.247
  186    HD1  PHE  22           HD2      PHE  22  -7.655  -2.501  -1.451
  187    HD2  PHE  22           HD1      PHE  22  -5.257  -3.773   1.885
  188    HE1  PHE  22           HE2      PHE  22  -8.647  -4.759  -1.592
  189    HE2  PHE  22           HE1      PHE  22  -6.254  -6.024   1.736
  190    HZ   PHE  22           HZ       PHE  22  -7.951  -6.527   0.001
  191    H    ILE  23           HN       ILE  23  -5.730   1.586  -0.710
  192    HA   ILE  23           HA       ILE  23  -4.852   2.750   1.773
  193    HB   ILE  23           HB       ILE  23  -4.955   3.532  -1.108
  194   HG12  ILE  23          HG12      ILE  23  -2.854   3.893   1.067
  195   HG13  ILE  23          HG11      ILE  23  -2.952   2.521  -0.023
  196   HG21  ILE  23          HG21      ILE  23  -5.964   5.536  -0.300
  197   HG22  ILE  23          HG22      ILE  23  -4.269   5.919  -0.538
  198   HG23  ILE  23          HG23      ILE  23  -4.876   5.606   1.087
  199   HD11  ILE  23          HD11      ILE  23  -2.332   5.388  -0.725
  200   HD12  ILE  23          HD12      ILE  23  -2.722   4.175  -1.934
  201   HD13  ILE  23          HD13      ILE  23  -1.293   3.978  -0.929
  202    H    GLU  24           HN       GLU  24  -7.635   3.115  -0.287
  203    HA   GLU  24           HA       GLU  24  -8.836   5.277   1.126
  204    HB2  GLU  24           HB2      GLU  24 -10.124   3.088  -0.523
  205    HB3  GLU  24           HB1      GLU  24 -11.018   4.446   0.142
  206    HG2  GLU  24           HG2      GLU  24  -8.598   4.782  -1.657
  207    HG3  GLU  24           HG1      GLU  24 -10.253   4.750  -2.258
  208    H    LYS  25           HN       LYS  25  -8.626   1.862   1.778
  209    HA   LYS  25           HA       LYS  25 -10.750   1.837   3.792
  210    HB2  LYS  25           HB2      LYS  25  -8.499  -0.122   3.236
  211    HB3  LYS  25           HB1      LYS  25  -9.785  -0.392   4.405
  212    HG2  LYS  25           HG2      LYS  25 -11.467  -0.199   2.596
  213    HG3  LYS  25           HG1      LYS  25 -10.170   0.039   1.424
  214    HD2  LYS  25           HD2      LYS  25  -9.246  -2.171   1.972
  215    HD3  LYS  25           HD1      LYS  25 -10.506  -2.410   3.182
  216    HE2  LYS  25           HE2      LYS  25 -11.042  -3.538   1.026
  217    HE3  LYS  25           HE1      LYS  25 -12.233  -2.309   1.455
  218    HZ1  LYS  25           HZ1      LYS  25 -11.366  -0.824  -0.097
  219    HZ2  LYS  25           HZ2      LYS  25 -11.360  -2.313  -0.914
  220    HZ3  LYS  25           HZ3      LYS  25  -9.917  -1.686  -0.272
  221    H    PHE  26           HN       PHE  26  -7.150   1.914   3.941
  222    HA   PHE  26           HA       PHE  26  -6.981   1.972   6.788
  223    HB2  PHE  26           HB2      PHE  26  -5.089   3.544   5.011
  224    HB3  PHE  26           HB1      PHE  26  -4.737   2.752   6.540
  225    HD1  PHE  26           HD1      PHE  26  -6.137   0.042   5.912
  226    HD2  PHE  26           HD2      PHE  26  -3.422   2.503   3.645
  227    HE1  PHE  26           HE1      PHE  26  -5.340  -1.950   4.695
  228    HE2  PHE  26           HE2      PHE  26  -2.637   0.491   2.420
  229    HZ   PHE  26           HZ       PHE  26  -3.592  -1.732   2.955
  230   H11A  DNS  27          H22       DNS  27  -0.217   0.897   7.230
  231    H12  DNS  27           H23      DNS  27  -1.596   1.743   7.940
  232    H13  DNS  27           H24      DNS  27  -0.188   1.343   8.946
  233    H21  DNS  27           H21      DNS  27   1.911   2.496   8.597
  234    H22  DNS  27           H19      DNS  27   2.027   3.806   7.408
  235    H23  DNS  27           H20      DNS  27   1.895   2.131   6.859
  236    H4   DNS  27           H14      DNS  27   0.436   1.702   5.213
  237    H5   DNS  27           H15      DNS  27  -0.429   2.595   3.036
  238    H6   DNS  27           H16      DNS  27  -1.686   4.762   2.973
  239    HZ   DNS  27           HZ1      DNS  27  -2.707   8.857   4.543
  240    HE3  DNS  27           HE1      DNS  27  -4.475  10.009   3.662
  241    HE2  DNS  27           HE2      DNS  27  -3.860   9.066   2.314
  242    HD3  DNS  27           HD1      DNS  27  -6.444   9.017   2.892
  243    HD2  DNS  27           HD2      DNS  27  -5.631   7.527   2.406
  244    HG3  DNS  27           HG1      DNS  27  -5.445   6.762   4.663
  245    HG2  DNS  27           HG2      DNS  27  -5.878   8.342   5.319
  246    HB3  DNS  27           HB1      DNS  27  -8.151   8.135   4.582
  247    HB2  DNS  27           HB2      DNS  27  -7.778   6.718   3.598
  248    HA   DNS  27           HA       DNS  27  -7.333   6.682   6.595
  249    H    DNS  27           HN       DNS  27  -7.144   4.697   4.474
  250    H9   DNS  27           H9       DNS  27  -3.013   7.991   6.285
  251    H10  DNS  27           H10      DNS  27  -2.149   7.098   8.448
  252    H11  DNS  27           H11      DNS  27  -0.893   4.935   8.511
  253    H    GLY  28           HN       GLY  28  -9.066   6.229   7.949
  254    HA2  GLY  28           HA2      GLY  28 -11.642   7.137   7.312
  255    HA3  GLY  28           HA1      GLY  28 -11.662   5.397   7.019
  256    H    ARG  29           HN       ARG  29 -10.545   7.696   9.525
  257    HA   ARG  29           HA       ARG  29 -11.998   6.216  11.601
  258    HB2  ARG  29           HB2      ARG  29  -9.923   5.781  12.947
  259    HB3  ARG  29           HB1      ARG  29 -10.011   4.818  11.473
  260    HG2  ARG  29           HG2      ARG  29  -8.550   6.460  10.323
  261    HG3  ARG  29           HG1      ARG  29  -8.433   7.388  11.818
  262    HD2  ARG  29           HD2      ARG  29  -7.488   5.369  12.946
  263    HD3  ARG  29           HD1      ARG  29  -7.498   4.536  11.390
  264    HE   ARG  29           HE       ARG  29  -6.088   6.879  10.893
  265   HH11  ARG  29          HH21      ARG  29  -5.895   4.271  13.148
  266   HH12  ARG  29          HH22      ARG  29  -4.174   4.375  13.319
  267   HH21  ARG  29          HH11      ARG  29  -3.846   7.022  11.106
  268   HH22  ARG  29          HH12      ARG  29  -3.016   5.931  12.164
  Start of MODEL    3
    1    H1   GLY   1           HT1      GLY   1  12.789   1.282  -9.770
    2    H2   GLY   1           HT2      GLY   1  11.234   0.618  -9.940
    3    H3   GLY   1           HT3      GLY   1  12.453   0.226 -11.056
    4    HA2  GLY   1           HA2      GLY   1  12.352  -1.716  -9.767
    5    HA3  GLY   1           HA1      GLY   1  13.614  -0.722  -8.979
    6    H    GLN   2           HN       GLN   2  12.596   1.315  -7.729
    7    HA   GLN   2           HA       GLN   2  13.049   0.037  -5.187
    8    HB2  GLN   2           HB2      GLN   2  11.800   2.743  -5.760
    9    HB3  GLN   2           HB1      GLN   2  12.483   2.218  -4.221
   10    HG2  GLN   2           HG2      GLN   2  14.695   1.991  -5.243
   11    HG3  GLN   2           HG1      GLN   2  14.033   2.428  -6.819
   12   HE21  GLN   2          HE21      GLN   2  13.543   4.674  -7.218
   13   HE22  GLN   2          HE22      GLN   2  13.984   5.904  -6.136
   14    H    GLN   3           HN       GLN   3  11.529  -1.569  -4.744
   15    HA   GLN   3           HA       GLN   3   8.699  -1.237  -5.227
   16    HB2  GLN   3           HB2      GLN   3  10.010  -3.151  -3.273
   17    HB3  GLN   3           HB1      GLN   3   8.421  -3.308  -4.025
   18    HG2  GLN   3           HG2      GLN   3   9.508  -3.429  -6.254
   19    HG3  GLN   3           HG1      GLN   3  11.087  -3.344  -5.471
   20   HE21  GLN   3          HE21      GLN   3  10.455  -5.029  -3.189
   21   HE22  GLN   3          HE22      GLN   3  10.244  -6.612  -3.765
   22    H    TYR   4           HN       TYR   4   7.067  -0.788  -3.717
   23    HA   TYR   4           HA       TYR   4   7.674   1.162  -1.746
   24    HB2  TYR   4           HB2      TYR   4   5.028   0.048  -1.275
   25    HB3  TYR   4           HB1      TYR   4   5.431   1.580  -2.020
   26    HD1  TYR   4           HD2      TYR   4   6.392   1.398  -4.498
   27    HD2  TYR   4           HD1      TYR   4   3.822  -1.504  -2.635
   28    HE1  TYR   4           HE2      TYR   4   5.698   0.571  -6.727
   29    HE2  TYR   4           HE1      TYR   4   3.137  -2.323  -4.863
   30    HH   TYR   4           HH       TYR   4   3.788  -0.624  -7.732
   31    H    THR   5           HN       THR   5   8.541   0.777   0.269
   32    HA   THR   5           HA       THR   5   8.005  -1.885   1.605
   33    HB   THR   5           HB       THR   5  10.211  -1.880   2.431
   34    HG1  THR   5           HG1      THR   5  10.160   0.278   3.169
   35   HG21  THR   5          HG21      THR   5  10.002  -2.035  -0.160
   36   HG22  THR   5          HG22      THR   5  11.605  -1.732   0.514
   37   HG23  THR   5          HG23      THR   5  10.666  -0.400  -0.154
   38    H    ALA   6           HN       ALA   6   8.169   1.582   2.017
   39    HA   ALA   6           HA       ALA   6   7.754   1.470   4.946
   40    HB1  ALA   6           HB1      ALA   6   7.777   3.904   4.812
   41    HB2  ALA   6           HB2      ALA   6   7.619   3.856   3.053
   42    HB3  ALA   6           HB3      ALA   6   9.106   3.289   3.828
   43    H1   NAL   7           H1       NAL   7   3.001   4.885   0.927
   44    H3   NAL   7           H3       NAL   7   6.315   2.379  -0.140
   45    H4   NAL   7           H4       NAL   7   7.524   4.326  -1.096
   46    H5   NAL   7           H5       NAL   7   7.593   6.847  -1.647
   47    H6   NAL   7           H6       NAL   7   6.502   9.071  -1.597
   48    H7   NAL   7           H7       NAL   7   4.243   9.342  -0.604
   49    H8   NAL   7           H8       NAL   7   3.051   7.388   0.351
   50    H91  NAL   7           H91      NAL   7   2.810   2.526   0.771
   51    H92  NAL   7           H92      NAL   7   4.258   1.518   0.686
   52    H10  NAL   7           H10      NAL   7   3.699   3.550   2.883
   53    HN1  NAL   7           HN1      NAL   7   6.119   2.594   2.084
   54    H    ILE   8           HN       ILE   8   4.421   0.088   2.493
   55    HA   ILE   8           HA       ILE   8   2.299  -0.532   4.486
   56    HB   ILE   8           HB       ILE   8   1.555  -2.350   2.650
   57   HG12  ILE   8          HG12      ILE   8   1.537  -1.395   0.383
   58   HG13  ILE   8          HG11      ILE   8   2.431   0.016   0.930
   59   HG21  ILE   8          HG21      ILE   8   0.678   0.553   2.475
   60   HG22  ILE   8          HG22      ILE   8   0.078  -0.614   3.664
   61   HG23  ILE   8          HG23      ILE   8  -0.247  -0.853   1.948
   62   HD11  ILE   8          HD11      ILE   8   4.398  -1.340   1.346
   63   HD12  ILE   8          HD12      ILE   8   3.808  -1.711  -0.264
   64   HD13  ILE   8          HD13      ILE   8   3.486  -2.825   1.050
   65    H    LYS   9           HN       LYS   9   3.621  -1.512   5.920
   66    HA   LYS   9           HA       LYS   9   5.744  -3.306   5.081
   67    HB2  LYS   9           HB2      LYS   9   5.957  -1.811   7.080
   68    HB3  LYS   9           HB1      LYS   9   4.733  -2.795   7.888
   69    HG2  LYS   9           HG2      LYS   9   6.145  -4.771   7.729
   70    HG3  LYS   9           HG1      LYS   9   7.337  -3.883   6.779
   71    HD2  LYS   9           HD2      LYS   9   7.754  -2.376   8.672
   72    HD3  LYS   9           HD1      LYS   9   6.532  -3.218   9.625
   73    HE2  LYS   9           HE2      LYS   9   7.852  -5.324   9.385
   74    HE3  LYS   9           HE1      LYS   9   9.103  -4.409   8.545
   75    HZ1  LYS   9           HZ1      LYS   9   9.842  -4.375  10.706
   76    HZ2  LYS   9           HZ2      LYS   9   8.280  -4.271  11.366
   77    HZ3  LYS   9           HZ3      LYS   9   8.986  -2.912  10.631
   78    H    GLY  10           HN       GLY  10   5.438  -5.423   4.647
   79    HA2  GLY  10           HA2      GLY  10   4.807  -7.655   5.232
   80    HA3  GLY  10           HA1      GLY  10   3.566  -7.023   6.306
   81    H    ARG  11           HN       ARG  11   2.727  -5.201   3.881
   82    HA   ARG  11           HA       ARG  11   1.357  -7.335   2.247
   83    HB2  ARG  11           HB2      ARG  11   0.054  -4.860   3.419
   84    HB3  ARG  11           HB1      ARG  11  -0.727  -6.046   2.372
   85    HG2  ARG  11           HG2      ARG  11  -0.319  -7.804   4.056
   86    HG3  ARG  11           HG1      ARG  11   0.459  -6.618   5.105
   87    HD2  ARG  11           HD2      ARG  11  -1.621  -5.331   5.238
   88    HD3  ARG  11           HD1      ARG  11  -2.409  -6.456   4.132
   89    HE   ARG  11           HE       ARG  11  -1.507  -8.072   6.203
   90   HH11  ARG  11          HH21      ARG  11  -3.436  -5.221   5.912
   91   HH12  ARG  11          HH22      ARG  11  -4.407  -5.580   7.300
   92   HH21  ARG  11          HH11      ARG  11  -2.767  -8.550   8.015
   93   HH22  ARG  11          HH12      ARG  11  -4.029  -7.462   8.489
   94    H    THR  12           HN       THR  12   2.560  -6.917   0.370
   95    HA   THR  12           HA       THR  12   2.547  -4.167  -0.714
   96    HB   THR  12           HB       THR  12   4.057  -5.754  -2.474
   97    HG1  THR  12           HG1      THR  12   4.482  -6.555   0.212
   98   HG21  THR  12          HG21      THR  12   4.671  -3.508  -1.598
   99   HG22  THR  12          HG22      THR  12   6.009  -4.654  -1.488
  100   HG23  THR  12          HG23      THR  12   5.080  -4.244  -0.047
  101    H    PHE  13           HN       PHE  13   1.984  -3.954  -3.034
  102    HA   PHE  13           HA       PHE  13  -0.084  -5.963  -3.914
  103    HB2  PHE  13           HB2      PHE  13  -0.136  -2.953  -4.264
  104    HB3  PHE  13           HB1      PHE  13  -1.401  -4.088  -4.743
  105    HD1  PHE  13           HD1      PHE  13   0.498  -2.777  -1.801
  106    HD2  PHE  13           HD2      PHE  13  -3.029  -4.829  -3.149
  107    HE1  PHE  13           HE1      PHE  13  -0.423  -2.741   0.500
  108    HE2  PHE  13           HE2      PHE  13  -3.956  -4.744  -0.856
  109    HZ   PHE  13           HZ       PHE  13  -2.645  -3.687   0.958
  110    H    ARG  14           HN       ARG  14   0.150  -6.692  -5.970
  111    HA   ARG  14           HA       ARG  14   2.488  -6.015  -7.513
  112    HB2  ARG  14           HB2      ARG  14   1.270  -8.194  -7.774
  113    HB3  ARG  14           HB1      ARG  14  -0.081  -7.322  -8.500
  114    HG2  ARG  14           HG2      ARG  14   1.332  -6.572 -10.339
  115    HG3  ARG  14           HG1      ARG  14   2.751  -7.306  -9.589
  116    HD2  ARG  14           HD2      ARG  14   0.287  -8.804 -10.523
  117    HD3  ARG  14           HD1      ARG  14   1.834  -8.753 -11.367
  118    HE   ARG  14           HE       ARG  14   2.487  -9.658  -8.825
  119   HH11  ARG  14          HH21      ARG  14   0.273 -10.575 -11.312
  120   HH12  ARG  14          HH22      ARG  14   0.314 -12.259 -10.908
  121   HH21  ARG  14          HH11      ARG  14   2.550 -11.851  -8.290
  122   HH22  ARG  14          HH12      ARG  14   1.602 -12.980  -9.199
  123    H    ASN  15           HN       ASN  15  -0.909  -5.080  -7.661
  124    HA   ASN  15           HA       ASN  15  -0.287  -2.948  -9.679
  125    HB2  ASN  15           HB2      ASN  15  -2.997  -2.803  -9.374
  126    HB3  ASN  15           HB1      ASN  15  -2.229  -3.862 -10.560
  127   HD21  ASN  15          HD21      ASN  15  -3.957  -5.441 -10.414
  128   HD22  ASN  15          HD22      ASN  15  -4.136  -6.438  -9.052
  129    H    GLU  16           HN       GLU  16  -0.099  -0.912  -8.933
  130    HA   GLU  16           HA       GLU  16  -0.367  -0.340  -6.137
  131    HB2  GLU  16           HB2      GLU  16  -0.122   1.471  -8.566
  132    HB3  GLU  16           HB1      GLU  16  -0.166   2.093  -6.916
  133    HG2  GLU  16           HG2      GLU  16   1.812   0.718  -6.349
  134    HG3  GLU  16           HG1      GLU  16   1.866   0.120  -8.006
  135    H    LYS  17           HN       LYS  17  -2.643  -0.405  -8.743
  136    HA   LYS  17           HA       LYS  17  -4.541   1.428  -7.723
  137    HB2  LYS  17           HB2      LYS  17  -4.515  -0.769  -9.720
  138    HB3  LYS  17           HB1      LYS  17  -6.093  -0.543  -8.974
  139    HG2  LYS  17           HG2      LYS  17  -6.004   0.836 -10.949
  140    HG3  LYS  17           HG1      LYS  17  -5.942   1.905  -9.548
  141    HD2  LYS  17           HD2      LYS  17  -3.511   2.100  -9.766
  142    HD3  LYS  17           HD1      LYS  17  -3.512   0.939 -11.092
  143    HE2  LYS  17           HE2      LYS  17  -4.888   2.459 -12.444
  144    HE3  LYS  17           HE1      LYS  17  -4.935   3.616 -11.114
  145    HZ1  LYS  17           HZ1      LYS  17  -2.363   2.664 -12.199
  146    HZ2  LYS  17           HZ2      LYS  17  -2.694   4.085 -11.330
  147    HZ3  LYS  17           HZ3      LYS  17  -3.197   3.938 -12.946
  148    H    GLU  18           HN       GLU  18  -4.187  -2.086  -7.207
  149    HA   GLU  18           HA       GLU  18  -6.363  -2.389  -5.449
  150    HB2  GLU  18           HB2      GLU  18  -3.719  -3.855  -5.534
  151    HB3  GLU  18           HB1      GLU  18  -5.106  -4.374  -4.574
  152    HG2  GLU  18           HG2      GLU  18  -5.211  -3.949  -7.575
  153    HG3  GLU  18           HG1      GLU  18  -4.906  -5.512  -6.820
  154    H    LEU  19           HN       LEU  19  -3.137  -1.158  -4.957
  155    HA   LEU  19           HA       LEU  19  -3.323  -1.075  -2.053
  156    HB2  LEU  19           HB2      LEU  19  -1.130  -1.149  -2.959
  157    HB3  LEU  19           HB1      LEU  19  -1.469   0.130  -4.096
  158    HG   LEU  19           HG       LEU  19  -1.615   1.715  -2.129
  159   HD11  LEU  19          HD11      LEU  19  -0.451  -0.623  -0.640
  160   HD12  LEU  19          HD12      LEU  19  -2.063   0.018  -0.373
  161   HD13  LEU  19          HD13      LEU  19  -0.650   1.000  -0.003
  162   HD21  LEU  19          HD21      LEU  19   0.813   1.835  -1.802
  163   HD22  LEU  19          HD22      LEU  19   0.419   1.523  -3.493
  164   HD23  LEU  19          HD23      LEU  19   0.978   0.206  -2.461
  165    H    ARG  20           HN       ARG  20  -3.961   1.156  -4.733
  166    HA   ARG  20           HA       ARG  20  -4.420   3.517  -3.202
  167    HB2  ARG  20           HB2      ARG  20  -4.245   3.414  -5.710
  168    HB3  ARG  20           HB1      ARG  20  -5.847   2.680  -5.744
  169    HG2  ARG  20           HG2      ARG  20  -6.785   4.676  -4.623
  170    HG3  ARG  20           HG1      ARG  20  -5.181   5.411  -4.598
  171    HD2  ARG  20           HD2      ARG  20  -6.675   4.573  -7.099
  172    HD3  ARG  20           HD1      ARG  20  -6.540   6.228  -6.505
  173    HE   ARG  20           HE       ARG  20  -3.906   5.374  -6.710
  174   HH11  ARG  20          HH21      ARG  20  -6.657   5.517  -8.793
  175   HH12  ARG  20          HH22      ARG  20  -5.719   5.732 -10.233
  176   HH21  ARG  20          HH11      ARG  20  -2.673   5.654  -8.580
  177   HH22  ARG  20          HH12      ARG  20  -3.465   5.810 -10.112
  178    H    ASP  21           HN       ASP  21  -6.464   0.834  -4.086
  179    HA   ASP  21           HA       ASP  21  -8.862   1.883  -2.907
  180    HB2  ASP  21           HB2      ASP  21  -8.104  -0.926  -3.744
  181    HB3  ASP  21           HB1      ASP  21  -9.715  -0.457  -3.198
  182    H    PHE  22           HN       PHE  22  -6.585  -0.686  -1.909
  183    HA   PHE  22           HA       PHE  22  -7.798  -1.138   0.601
  184    HB2  PHE  22           HB2      PHE  22  -5.109  -1.691  -0.593
  185    HB3  PHE  22           HB1      PHE  22  -5.253  -1.849   1.148
  186    HD1  PHE  22           HD1      PHE  22  -7.734  -2.626  -1.557
  187    HD2  PHE  22           HD2      PHE  22  -5.232  -4.186   1.574
  188    HE1  PHE  22           HE1      PHE  22  -8.736  -4.862  -1.863
  189    HE2  PHE  22           HE2      PHE  22  -6.242  -6.415   1.262
  190    HZ   PHE  22           HZ       PHE  22  -7.995  -6.763  -0.456
  191    H    ILE  23           HN       ILE  23  -5.735   1.366  -0.554
  192    HA   ILE  23           HA       ILE  23  -4.811   2.328   2.003
  193    HB   ILE  23           HB       ILE  23  -4.940   3.336  -0.813
  194   HG12  ILE  23          HG12      ILE  23  -2.770   3.462   1.319
  195   HG13  ILE  23          HG11      ILE  23  -2.950   2.160   0.153
  196   HG21  ILE  23          HG21      ILE  23  -5.852   5.297   0.171
  197   HG22  ILE  23          HG22      ILE  23  -4.143   5.639  -0.035
  198   HG23  ILE  23          HG23      ILE  23  -4.764   5.198   1.556
  199   HD11  ILE  23          HD11      ILE  23  -2.651   3.818  -1.680
  200   HD12  ILE  23          HD12      ILE  23  -1.245   3.708  -0.631
  201   HD13  ILE  23          HD13      ILE  23  -2.363   5.061  -0.473
  202    H    GLU  24           HN       GLU  24  -7.610   2.873  -0.003
  203    HA   GLU  24           HA       GLU  24  -8.751   4.979   1.527
  204    HB2  GLU  24           HB2      GLU  24 -10.118   2.876  -0.170
  205    HB3  GLU  24           HB1      GLU  24 -10.972   4.219   0.572
  206    HG2  GLU  24           HG2      GLU  24  -8.597   4.592  -1.280
  207    HG3  GLU  24           HG1      GLU  24 -10.270   4.606  -1.835
  208    H    LYS  25           HN       LYS  25  -8.614   1.530   2.013
  209    HA   LYS  25           HA       LYS  25 -10.656   1.474   4.099
  210    HB2  LYS  25           HB2      LYS  25 -10.184  -0.570   2.870
  211    HB3  LYS  25           HB1      LYS  25  -8.487  -0.502   3.317
  212    HG2  LYS  25           HG2      LYS  25  -9.797  -2.155   4.654
  213    HG3  LYS  25           HG1      LYS  25  -9.015  -0.934   5.650
  214    HD2  LYS  25           HD2      LYS  25 -11.067   0.218   6.052
  215    HD3  LYS  25           HD1      LYS  25 -11.885  -0.598   4.720
  216    HE2  LYS  25           HE2      LYS  25 -11.729  -2.742   5.952
  217    HE3  LYS  25           HE1      LYS  25 -10.935  -1.908   7.289
  218    HZ1  LYS  25           HZ1      LYS  25 -12.931  -1.413   8.070
  219    HZ2  LYS  25           HZ2      LYS  25 -13.689  -2.111   6.718
  220    HZ3  LYS  25           HZ3      LYS  25 -13.233  -0.475   6.690
  221    H    PHE  26           HN       PHE  26  -7.057   1.457   4.095
  222    HA   PHE  26           HA       PHE  26  -6.785   1.434   6.949
  223    HB2  PHE  26           HB2      PHE  26  -4.848   2.892   5.123
  224    HB3  PHE  26           HB1      PHE  26  -4.502   2.051   6.629
  225    HD1  PHE  26           HD1      PHE  26  -6.121  -0.540   5.991
  226    HD2  PHE  26           HD2      PHE  26  -3.285   1.765   3.706
  227    HE1  PHE  26           HE1      PHE  26  -5.497  -2.559   4.719
  228    HE2  PHE  26           HE2      PHE  26  -2.675  -0.274   2.426
  229    HZ   PHE  26           HZ       PHE  26  -3.777  -2.432   2.943
  230   H11A  DNS  27          H22       DNS  27  -1.955   1.785   8.478
  231    H12  DNS  27           H23      DNS  27  -0.836   0.474   8.863
  232    H13  DNS  27           H24      DNS  27  -1.465   0.647   7.210
  233    H21  DNS  27           H21      DNS  27   2.040   1.863   7.162
  234    H22  DNS  27           H19      DNS  27   0.951   0.614   6.529
  235    H23  DNS  27           H20      DNS  27   1.441   0.572   8.226
  236    H4   DNS  27           H14      DNS  27  -0.734   1.402   5.231
  237    H5   DNS  27           H15      DNS  27  -1.290   3.085   3.459
  238    H6   DNS  27           H16      DNS  27  -1.175   5.536   3.971
  239    HZ   DNS  27           HZ1      DNS  27  -2.945   7.632   5.783
  240    HE3  DNS  27           HE1      DNS  27  -2.628   8.184   3.195
  241    HE2  DNS  27           HE2      DNS  27  -2.974   6.462   3.168
  242    HD3  DNS  27           HD1      DNS  27  -4.668   8.637   4.405
  243    HD2  DNS  27           HD2      DNS  27  -5.051   7.664   2.985
  244    HG3  DNS  27           HG1      DNS  27  -4.938   5.620   4.480
  245    HG2  DNS  27           HG2      DNS  27  -4.816   6.714   5.858
  246    HB3  DNS  27           HB1      DNS  27  -6.960   7.798   5.089
  247    HB2  DNS  27           HB2      DNS  27  -7.112   6.524   3.879
  248    HA   DNS  27           HA       DNS  27  -6.955   6.105   6.884
  249    H    DNS  27           HN       DNS  27  -6.848   4.167   4.649
  250    H9   DNS  27           H9       DNS  27  -0.074   8.122   7.880
  251    H10  DNS  27           H10      DNS  27   0.478   6.437   9.639
  252    H11  DNS  27           H11      DNS  27   0.374   3.992   9.122
  253    H    GLY  28           HN       GLY  28  -8.759   7.853   5.140
  254    HA2  GLY  28           HA2      GLY  28 -11.060   8.224   4.813
  255    HA3  GLY  28           HA1      GLY  28 -11.336   6.500   5.064
  256    H    ARG  29           HN       ARG  29  -9.947   9.064   7.128
  257    HA   ARG  29           HA       ARG  29 -10.989   8.044   9.557
  258    HB2  ARG  29           HB2      ARG  29 -10.553  10.278  10.492
  259    HB3  ARG  29           HB1      ARG  29  -9.221   9.771   9.454
  260    HG2  ARG  29           HG2      ARG  29 -10.312  11.073   7.572
  261    HG3  ARG  29           HG1      ARG  29 -11.449  11.711   8.760
  262    HD2  ARG  29           HD2      ARG  29  -8.434  12.019   8.838
  263    HD3  ARG  29           HD1      ARG  29  -9.598  13.286   8.450
  264    HE   ARG  29           HE       ARG  29 -10.394  12.386  10.955
  265   HH11  ARG  29          HH21      ARG  29  -7.475  13.561   9.530
  266   HH12  ARG  29          HH22      ARG  29  -6.886  14.262  11.000
  267   HH21  ARG  29          HH11      ARG  29  -9.636  13.294  12.876
  268   HH22  ARG  29          HH12      ARG  29  -8.109  14.110  12.893
  Start of MODEL    4
    1    H1   GLY   1           HT1      GLY   1  10.348   2.596  -9.638
    2    H2   GLY   1           HT2      GLY   1  10.370   2.060 -11.249
    3    H3   GLY   1           HT3      GLY   1  11.739   2.818 -10.585
    4    HA2  GLY   1           HA2      GLY   1  11.047   0.026 -10.668
    5    HA3  GLY   1           HA1      GLY   1  12.442   0.821  -9.878
    6    H    GLN   2           HN       GLN   2  11.700   2.453  -8.004
    7    HA   GLN   2           HA       GLN   2  12.537   0.586  -5.978
    8    HB2  GLN   2           HB2      GLN   2  11.263   3.319  -5.626
    9    HB3  GLN   2           HB1      GLN   2  12.186   2.438  -4.409
   10    HG2  GLN   2           HG2      GLN   2  13.303   3.302  -7.093
   11    HG3  GLN   2           HG1      GLN   2  13.530   4.196  -5.592
   12   HE21  GLN   2          HE21      GLN   2  14.856   1.718  -7.524
   13   HE22  GLN   2          HE22      GLN   2  15.913   1.056  -6.370
   14    H    GLN   3           HN       GLN   3  11.197  -1.025  -5.290
   15    HA   GLN   3           HA       GLN   3   8.318  -0.857  -5.490
   16    HB2  GLN   3           HB2      GLN   3   9.931  -2.778  -3.784
   17    HB3  GLN   3           HB1      GLN   3   8.276  -2.996  -4.360
   18    HG2  GLN   3           HG2      GLN   3  10.713  -2.748  -6.155
   19    HG3  GLN   3           HG1      GLN   3   9.924  -4.265  -5.729
   20   HE21  GLN   3          HE21      GLN   3   7.943  -4.800  -6.796
   21   HE22  GLN   3          HE22      GLN   3   7.266  -3.837  -8.019
   22    H    TYR   4           HN       TYR   4   6.816  -0.591  -3.827
   23    HA   TYR   4           HA       TYR   4   7.468   1.298  -1.816
   24    HB2  TYR   4           HB2      TYR   4   4.961  -0.084  -1.220
   25    HB3  TYR   4           HB1      TYR   4   5.181   1.548  -1.805
   26    HD1  TYR   4           HD2      TYR   4   5.816   1.808  -4.330
   27    HD2  TYR   4           HD1      TYR   4   3.899  -1.663  -2.672
   28    HE1  TYR   4           HE2      TYR   4   5.007   1.174  -6.583
   29    HE2  TYR   4           HE1      TYR   4   3.102  -2.293  -4.926
   30    HH   TYR   4           HH       TYR   4   4.280  -1.349  -7.634
   31    H    THR   5           HN       THR   5   8.523   0.889   0.105
   32    HA   THR   5           HA       THR   5   8.305  -1.866   1.336
   33    HB   THR   5           HB       THR   5  10.556  -1.687   2.030
   34    HG1  THR   5           HG1      THR   5  11.477   0.599   1.396
   35   HG21  THR   5          HG21      THR   5  10.179  -1.847  -0.529
   36   HG22  THR   5          HG22      THR   5  11.790  -1.378   0.019
   37   HG23  THR   5          HG23      THR   5  10.667  -0.153  -0.562
   38    H    ALA   6           HN       ALA   6   8.185   1.577   1.913
   39    HA   ALA   6           HA       ALA   6   7.934   1.242   4.863
   40    HB1  ALA   6           HB1      ALA   6   9.272   3.135   3.860
   41    HB2  ALA   6           HB2      ALA   6   7.971   3.677   4.919
   42    HB3  ALA   6           HB3      ALA   6   7.772   3.768   3.165
   43    H1   NAL   7           H1       NAL   7   3.122   4.956   1.212
   44    H3   NAL   7           H3       NAL   7   6.299   2.419  -0.154
   45    H4   NAL   7           H4       NAL   7   7.504   4.373  -1.096
   46    H5   NAL   7           H5       NAL   7   7.611   6.914  -1.541
   47    H6   NAL   7           H6       NAL   7   6.585   9.159  -1.336
   48    H7   NAL   7           H7       NAL   7   4.395   9.442  -0.201
   49    H8   NAL   7           H8       NAL   7   3.206   7.478   0.737
   50    H91  NAL   7           H91      NAL   7   2.858   2.600   0.940
   51    H92  NAL   7           H92      NAL   7   4.281   1.567   0.766
   52    H10  NAL   7           H10      NAL   7   3.852   3.540   3.045
   53    HN1  NAL   7           HN1      NAL   7   6.225   2.604   2.144
   54    H    ILE   8           HN       ILE   8   4.453   0.074   2.510
   55    HA   ILE   8           HA       ILE   8   2.419  -0.553   4.578
   56    HB   ILE   8           HB       ILE   8   1.524  -2.277   2.710
   57   HG12  ILE   8          HG12      ILE   8   1.390  -1.200   0.495
   58   HG13  ILE   8          HG11      ILE   8   2.379   0.141   1.056
   59   HG21  ILE   8          HG21      ILE   8   0.707   0.649   2.710
   60   HG22  ILE   8          HG22      ILE   8   0.150  -0.555   3.883
   61   HG23  ILE   8          HG23      ILE   8  -0.278  -0.718   2.179
   62   HD11  ILE   8          HD11      ILE   8   3.530  -1.681  -0.311
   63   HD12  ILE   8          HD12      ILE   8   3.353  -2.719   1.086
   64   HD13  ILE   8          HD13      ILE   8   4.314  -1.236   1.199
   65    H    LYS   9           HN       LYS   9   3.566  -1.792   5.903
   66    HA   LYS   9           HA       LYS   9   5.687  -3.549   4.904
   67    HB2  LYS   9           HB2      LYS   9   6.104  -2.114   6.877
   68    HB3  LYS   9           HB1      LYS   9   4.833  -2.963   7.749
   69    HG2  LYS   9           HG2      LYS   9   6.958  -4.716   6.546
   70    HG3  LYS   9           HG1      LYS   9   7.501  -3.681   7.856
   71    HD2  LYS   9           HD2      LYS   9   4.967  -5.287   8.266
   72    HD3  LYS   9           HD1      LYS   9   6.513  -6.117   8.363
   73    HE2  LYS   9           HE2      LYS   9   5.620  -5.227  10.571
   74    HE3  LYS   9           HE1      LYS   9   7.258  -4.720  10.165
   75    HZ1  LYS   9           HZ1      LYS   9   6.364  -2.641   9.316
   76    HZ2  LYS   9           HZ2      LYS   9   5.938  -2.863  10.946
   77    HZ3  LYS   9           HZ3      LYS   9   4.790  -3.129   9.722
   78    H    GLY  10           HN       GLY  10   5.605  -5.759   4.909
   79    HA2  GLY  10           HA2      GLY  10   4.820  -7.933   5.342
   80    HA3  GLY  10           HA1      GLY  10   3.644  -7.256   6.462
   81    H    ARG  11           HN       ARG  11   2.770  -5.408   4.103
   82    HA   ARG  11           HA       ARG  11   1.269  -7.462   2.487
   83    HB2  ARG  11           HB2      ARG  11   0.095  -4.972   3.764
   84    HB3  ARG  11           HB1      ARG  11  -0.764  -6.096   2.710
   85    HG2  ARG  11           HG2      ARG  11  -0.375  -7.918   4.328
   86    HG3  ARG  11           HG1      ARG  11   0.483  -6.795   5.386
   87    HD2  ARG  11           HD2      ARG  11  -1.539  -5.430   5.619
   88    HD3  ARG  11           HD1      ARG  11  -2.405  -6.494   4.511
   89    HE   ARG  11           HE       ARG  11  -1.501  -8.198   6.510
   90   HH11  ARG  11          HH21      ARG  11  -3.326  -5.270   6.352
   91   HH12  ARG  11          HH22      ARG  11  -4.267  -5.626   7.761
   92   HH21  ARG  11          HH11      ARG  11  -2.724  -8.676   8.348
   93   HH22  ARG  11          HH12      ARG  11  -3.927  -7.553   8.890
   94    H    THR  12           HN       THR  12   2.409  -7.041   0.573
   95    HA   THR  12           HA       THR  12   2.425  -4.264  -0.451
   96    HB   THR  12           HB       THR  12   3.960  -5.772  -2.230
   97    HG1  THR  12           HG1      THR  12   5.119  -6.604   0.057
   98   HG21  THR  12          HG21      THR  12   5.909  -4.739  -1.131
   99   HG22  THR  12          HG22      THR  12   4.917  -4.341   0.271
  100   HG23  THR  12          HG23      THR  12   4.587  -3.582  -1.286
  101    H    PHE  13           HN       PHE  13   1.897  -3.992  -2.735
  102    HA   PHE  13           HA       PHE  13  -0.214  -5.926  -3.670
  103    HB2  PHE  13           HB2      PHE  13  -0.044  -2.925  -4.076
  104    HB3  PHE  13           HB1      PHE  13  -1.363  -3.978  -4.596
  105    HD1  PHE  13           HD1      PHE  13   0.458  -2.673  -1.602
  106    HD2  PHE  13           HD2      PHE  13  -3.061  -4.672  -3.047
  107    HE1  PHE  13           HE1      PHE  13  -0.557  -2.555   0.658
  108    HE2  PHE  13           HE2      PHE  13  -4.079  -4.507  -0.800
  109    HZ   PHE  13           HZ       PHE  13  -2.818  -3.437   1.043
  110    H    ARG  14           HN       ARG  14   0.069  -6.743  -5.686
  111    HA   ARG  14           HA       ARG  14   2.506  -6.258  -7.140
  112    HB2  ARG  14           HB2      ARG  14   1.212  -8.371  -7.400
  113    HB3  ARG  14           HB1      ARG  14  -0.095  -7.467  -8.168
  114    HG2  ARG  14           HG2      ARG  14   1.330  -6.848 -10.023
  115    HG3  ARG  14           HG1      ARG  14   2.749  -7.524  -9.223
  116    HD2  ARG  14           HD2      ARG  14   0.314  -9.139 -10.031
  117    HD3  ARG  14           HD1      ARG  14   1.799  -9.037 -10.977
  118    HE   ARG  14           HE       ARG  14   2.658  -9.822  -8.453
  119   HH11  ARG  14          HH21      ARG  14   0.359 -10.938 -10.777
  120   HH12  ARG  14          HH22      ARG  14   0.516 -12.602 -10.325
  121   HH21  ARG  14          HH11      ARG  14   2.869 -11.987  -7.853
  122   HH22  ARG  14          HH12      ARG  14   1.935 -13.196  -8.671
  123    H    ASN  15           HN       ASN  15  -0.829  -5.154  -7.518
  124    HA   ASN  15           HA       ASN  15   0.064  -3.071  -9.492
  125    HB2  ASN  15           HB2      ASN  15  -2.575  -2.825  -9.661
  126    HB3  ASN  15           HB1      ASN  15  -1.743  -4.088 -10.570
  127   HD21  ASN  15          HD21      ASN  15  -3.987  -5.113 -10.425
  128   HD22  ASN  15          HD22      ASN  15  -4.327  -6.067  -9.062
  129    H    GLU  16           HN       GLU  16   0.175  -1.033  -8.764
  130    HA   GLU  16           HA       GLU  16  -0.379  -0.400  -6.049
  131    HB2  GLU  16           HB2      GLU  16   1.208   0.944  -7.330
  132    HB3  GLU  16           HB1      GLU  16  -0.051   1.403  -8.473
  133    HG2  GLU  16           HG2      GLU  16  -1.209   2.704  -6.807
  134    HG3  GLU  16           HG1      GLU  16  -0.186   2.071  -5.520
  135    H    LYS  17           HN       LYS  17  -2.371  -0.590  -8.840
  136    HA   LYS  17           HA       LYS  17  -4.462   1.163  -8.257
  137    HB2  LYS  17           HB2      LYS  17  -4.189  -0.341 -10.305
  138    HB3  LYS  17           HB1      LYS  17  -4.847  -1.648  -9.330
  139    HG2  LYS  17           HG2      LYS  17  -6.880  -0.297  -8.896
  140    HG3  LYS  17           HG1      LYS  17  -6.243   0.988  -9.917
  141    HD2  LYS  17           HD2      LYS  17  -6.556  -1.829 -11.008
  142    HD3  LYS  17           HD1      LYS  17  -7.931  -0.731 -10.969
  143    HE2  LYS  17           HE2      LYS  17  -6.567   0.939 -12.267
  144    HE3  LYS  17           HE1      LYS  17  -5.303  -0.280 -12.421
  145    HZ1  LYS  17           HZ1      LYS  17  -8.100  -0.755 -13.261
  146    HZ2  LYS  17           HZ2      LYS  17  -6.726  -1.685 -13.629
  147    HZ3  LYS  17           HZ3      LYS  17  -6.916  -0.141 -14.310
  148    H    GLU  18           HN       GLU  18  -3.960  -2.174  -7.127
  149    HA   GLU  18           HA       GLU  18  -6.314  -2.249  -5.506
  150    HB2  GLU  18           HB2      GLU  18  -3.771  -3.874  -5.433
  151    HB3  GLU  18           HB1      GLU  18  -5.188  -4.229  -4.442
  152    HG2  GLU  18           HG2      GLU  18  -5.269  -4.034  -7.467
  153    HG3  GLU  18           HG1      GLU  18  -5.049  -5.550  -6.594
  154    H    LEU  19           HN       LEU  19  -3.006  -1.191  -4.911
  155    HA   LEU  19           HA       LEU  19  -3.326  -0.982  -2.052
  156    HB2  LEU  19           HB2      LEU  19  -1.090  -1.032  -2.872
  157    HB3  LEU  19           HB1      LEU  19  -1.408   0.234  -4.034
  158    HG   LEU  19           HG       LEU  19  -1.611   1.857  -2.156
  159   HD11  LEU  19          HD11      LEU  19  -2.272   0.259  -0.365
  160   HD12  LEU  19          HD12      LEU  19  -0.880   1.232   0.083
  161   HD13  LEU  19          HD13      LEU  19  -0.656  -0.425  -0.444
  162   HD21  LEU  19          HD21      LEU  19   0.940   0.250  -2.212
  163   HD22  LEU  19          HD22      LEU  19   0.788   1.891  -1.586
  164   HD23  LEU  19          HD23      LEU  19   0.528   1.574  -3.298
  165    H    ARG  20           HN       ARG  20  -3.978   1.133  -4.797
  166    HA   ARG  20           HA       ARG  20  -4.480   3.552  -3.364
  167    HB2  ARG  20           HB2      ARG  20  -4.298   3.321  -5.873
  168    HB3  ARG  20           HB1      ARG  20  -5.905   2.595  -5.864
  169    HG2  ARG  20           HG2      ARG  20  -6.781   4.667  -4.757
  170    HG3  ARG  20           HG1      ARG  20  -5.179   5.389  -4.926
  171    HD2  ARG  20           HD2      ARG  20  -6.898   4.375  -7.209
  172    HD3  ARG  20           HD1      ARG  20  -6.670   6.069  -6.778
  173    HE   ARG  20           HE       ARG  20  -4.086   5.115  -7.143
  174   HH11  ARG  20          HH21      ARG  20  -7.014   5.177  -8.975
  175   HH12  ARG  20          HH22      ARG  20  -6.207   5.240 -10.506
  176   HH21  ARG  20          HH11      ARG  20  -3.024   5.198  -9.132
  177   HH22  ARG  20          HH12      ARG  20  -3.951   5.254 -10.595
  178    H    ASP  21           HN       ASP  21  -6.432   0.759  -4.078
  179    HA   ASP  21           HA       ASP  21  -8.872   1.804  -2.980
  180    HB2  ASP  21           HB2      ASP  21  -8.021  -1.020  -3.662
  181    HB3  ASP  21           HB1      ASP  21  -9.643  -0.583  -3.128
  182    H    PHE  22           HN       PHE  22  -6.528  -0.641  -1.836
  183    HA   PHE  22           HA       PHE  22  -7.731  -0.965   0.701
  184    HB2  PHE  22           HB2      PHE  22  -5.021  -1.515  -0.449
  185    HB3  PHE  22           HB1      PHE  22  -5.166  -1.561   1.300
  186    HD1  PHE  22           HD2      PHE  22  -7.598  -2.588  -1.368
  187    HD2  PHE  22           HD1      PHE  22  -5.104  -3.860   1.897
  188    HE1  PHE  22           HE2      PHE  22  -8.544  -4.863  -1.526
  189    HE2  PHE  22           HE1      PHE  22  -6.055  -6.130   1.730
  190    HZ   PHE  22           HZ       PHE  22  -7.777  -6.640   0.022
  191    H    ILE  23           HN       ILE  23  -5.729   1.514  -0.609
  192    HA   ILE  23           HA       ILE  23  -4.836   2.670   1.870
  193    HB   ILE  23           HB       ILE  23  -5.012   3.492  -1.000
  194   HG12  ILE  23          HG12      ILE  23  -2.854   3.860   1.116
  195   HG13  ILE  23          HG11      ILE  23  -2.977   2.475   0.044
  196   HG21  ILE  23          HG21      ILE  23  -4.321   5.876  -0.376
  197   HG22  ILE  23          HG22      ILE  23  -4.924   5.515   1.240
  198   HG23  ILE  23          HG23      ILE  23  -6.016   5.472  -0.147
  199   HD11  ILE  23          HD11      ILE  23  -1.326   4.084  -0.802
  200   HD12  ILE  23          HD12      ILE  23  -2.555   5.346  -0.825
  201   HD13  ILE  23          HD13      ILE  23  -2.691   3.964  -1.901
  202    H    GLU  24           HN       GLU  24  -7.663   3.012  -0.145
  203    HA   GLU  24           HA       GLU  24  -8.875   5.143   1.302
  204    HB2  GLU  24           HB2      GLU  24 -10.170   2.920  -0.299
  205    HB3  GLU  24           HB1      GLU  24 -11.067   4.264   0.391
  206    HG2  GLU  24           HG2      GLU  24  -9.665   5.854  -0.882
  207    HG3  GLU  24           HG1      GLU  24  -8.795   4.502  -1.604
  208    H    LYS  25           HN       LYS  25  -8.564   1.741   1.943
  209    HA   LYS  25           HA       LYS  25 -10.607   1.638   4.022
  210    HB2  LYS  25           HB2      LYS  25  -9.726  -0.357   2.716
  211    HB3  LYS  25           HB1      LYS  25  -8.245  -0.237   3.664
  212    HG2  LYS  25           HG2      LYS  25  -9.720  -0.383   5.752
  213    HG3  LYS  25           HG1      LYS  25 -11.048  -0.808   4.674
  214    HD2  LYS  25           HD2      LYS  25  -8.424  -2.315   4.917
  215    HD3  LYS  25           HD1      LYS  25  -9.966  -2.826   5.604
  216    HE2  LYS  25           HE2      LYS  25  -9.874  -4.047   3.585
  217    HE3  LYS  25           HE1      LYS  25 -10.840  -2.645   3.124
  218    HZ1  LYS  25           HZ1      LYS  25  -8.039  -2.150   2.876
  219    HZ2  LYS  25           HZ2      LYS  25  -9.273  -1.982   1.719
  220    HZ3  LYS  25           HZ3      LYS  25  -8.518  -3.487   1.949
  221    H    PHE  26           HN       PHE  26  -7.016   1.867   4.042
  222    HA   PHE  26           HA       PHE  26  -6.791   2.014   6.901
  223    HB2  PHE  26           HB2      PHE  26  -4.895   3.463   5.030
  224    HB3  PHE  26           HB1      PHE  26  -4.534   2.699   6.572
  225    HD1  PHE  26           HD1      PHE  26  -6.009   0.020   6.063
  226    HD2  PHE  26           HD2      PHE  26  -3.307   2.341   3.638
  227    HE1  PHE  26           HE1      PHE  26  -5.303  -2.027   4.881
  228    HE2  PHE  26           HE2      PHE  26  -2.614   0.275   2.450
  229    HZ   PHE  26           HZ       PHE  26  -3.608  -1.906   3.081
  230   H11A  DNS  27          H22       DNS  27   1.676   2.329   6.286
  231    H12  DNS  27           H23      DNS  27   0.957   3.467   7.429
  232    H13  DNS  27           H24      DNS  27   2.006   4.063   6.125
  233    H21  DNS  27           H21      DNS  27  -0.481   1.422   5.635
  234    H22  DNS  27           H19      DNS  27  -1.804   2.525   5.212
  235    H23  DNS  27           H20      DNS  27  -1.205   2.469   6.874
  236    H4   DNS  27           H14      DNS  27  -1.018   4.525   7.768
  237    H5   DNS  27           H15      DNS  27  -2.000   6.828   7.893
  238    H6   DNS  27           H16      DNS  27  -2.023   8.298   5.863
  239    HZ   DNS  27           HZ1      DNS  27  -3.746   9.184   4.478
  240    HE3  DNS  27           HE1      DNS  27  -3.724   8.874   1.890
  241    HE2  DNS  27           HE2      DNS  27  -3.623   7.191   2.388
  242    HD3  DNS  27           HD1      DNS  27  -5.754   9.184   3.190
  243    HD2  DNS  27           HD2      DNS  27  -5.947   7.811   2.099
  244    HG3  DNS  27           HG1      DNS  27  -5.306   6.296   3.996
  245    HG2  DNS  27           HG2      DNS  27  -5.311   7.699   5.063
  246    HB3  DNS  27           HB1      DNS  27  -7.682   8.131   4.438
  247    HB2  DNS  27           HB2      DNS  27  -7.671   6.666   3.457
  248    HA   DNS  27           HA       DNS  27  -7.046   6.709   6.426
  249    H    DNS  27           HN       DNS  27  -6.960   4.585   4.432
  250    H9   DNS  27           H9       DNS  27  -0.531   7.797   1.313
  251    H10  DNS  27           H10      DNS  27   0.444   5.500   1.198
  252    H11  DNS  27           H11      DNS  27   0.472   4.038   3.228
  253    H    GLY  28           HN       GLY  28  -9.153   4.414   6.263
  254    HA2  GLY  28           HA2      GLY  28 -11.664   5.795   5.706
  255    HA3  GLY  28           HA1      GLY  28 -11.495   4.201   6.445
  256    H    ARG  29           HN       ARG  29 -10.124   4.577   8.705
  257    HA   ARG  29           HA       ARG  29 -12.018   5.990  10.411
  258    HB2  ARG  29           HB2      ARG  29  -9.350   4.689  11.040
  259    HB3  ARG  29           HB1      ARG  29 -10.496   5.278  12.244
  260    HG2  ARG  29           HG2      ARG  29 -12.220   3.738  11.298
  261    HG3  ARG  29           HG1      ARG  29 -10.997   3.092  10.203
  262    HD2  ARG  29           HD2      ARG  29 -11.161   1.639  12.152
  263    HD3  ARG  29           HD1      ARG  29  -9.608   2.475  12.186
  264    HE   ARG  29           HE       ARG  29 -11.279   4.115  13.676
  265   HH11  ARG  29          HH21      ARG  29 -10.385   0.780  13.702
  266   HH12  ARG  29          HH22      ARG  29 -10.568   0.610  15.416
  267   HH21  ARG  29          HH11      ARG  29 -11.520   3.907  15.910
  268   HH22  ARG  29          HH12      ARG  29 -11.210   2.379  16.664
  Start of MODEL    5
    1    H1   GLY   1           HT1      GLY   1   9.091   3.510 -10.260
    2    H2   GLY   1           HT2      GLY   1   8.825   1.844 -10.459
    3    H3   GLY   1           HT3      GLY   1   9.676   2.718 -11.642
    4    HA2  GLY   1           HA2      GLY   1  11.323   1.451 -10.470
    5    HA3  GLY   1           HA1      GLY   1  11.365   3.123  -9.835
    6    H    GLN   2           HN       GLN   2   9.308   3.634  -8.331
    7    HA   GLN   2           HA       GLN   2  10.961   3.238  -5.928
    8    HB2  GLN   2           HB2      GLN   2   9.715   5.366  -6.401
    9    HB3  GLN   2           HB1      GLN   2   8.204   4.483  -6.183
   10    HG2  GLN   2           HG2      GLN   2   8.794   3.940  -3.885
   11    HG3  GLN   2           HG1      GLN   2  10.389   4.667  -4.086
   12   HE21  GLN   2          HE21      GLN   2  10.561   6.960  -3.895
   13   HE22  GLN   2          HE22      GLN   2   9.238   7.964  -3.547
   14    H    GLN   3           HN       GLN   3  10.874   1.056  -5.354
   15    HA   GLN   3           HA       GLN   3   8.402  -0.474  -5.352
   16    HB2  GLN   3           HB2      GLN   3  11.146  -0.949  -4.142
   17    HB3  GLN   3           HB1      GLN   3   9.822  -2.099  -3.957
   18    HG2  GLN   3           HG2      GLN   3  11.234  -2.728  -5.865
   19    HG3  GLN   3           HG1      GLN   3   9.627  -2.262  -6.420
   20   HE21  GLN   3          HE21      GLN   3  12.831  -0.706  -5.799
   21   HE22  GLN   3          HE22      GLN   3  12.747   0.329  -7.142
   22    H    TYR   4           HN       TYR   4   7.135  -1.033  -3.531
   23    HA   TYR   4           HA       TYR   4   6.878   0.973  -1.536
   24    HB2  TYR   4           HB2      TYR   4   5.577  -1.543  -0.754
   25    HB3  TYR   4           HB1      TYR   4   4.824  -0.013  -1.186
   26    HD1  TYR   4           HD1      TYR   4   6.428  -3.069  -2.636
   27    HD2  TYR   4           HD2      TYR   4   3.707   0.206  -3.302
   28    HE1  TYR   4           HE1      TYR   4   5.757  -4.056  -4.808
   29    HE2  TYR   4           HE2      TYR   4   3.047  -0.792  -5.471
   30    HH   TYR   4           HH       TYR   4   4.405  -3.903  -6.559
   31    H    THR   5           HN       THR   5   8.185   1.218   0.250
   32    HA   THR   5           HA       THR   5   9.476  -1.233   1.456
   33    HB   THR   5           HB       THR   5  11.343   0.189   2.094
   34    HG1  THR   5           HG1      THR   5  10.660   2.353   0.620
   35   HG21  THR   5          HG21      THR   5  10.694   0.758  -0.798
   36   HG22  THR   5          HG22      THR   5  11.238  -0.822  -0.233
   37   HG23  THR   5          HG23      THR   5  12.291   0.585  -0.076
   38    H    ALA   6           HN       ALA   6   7.697   1.719   2.042
   39    HA   ALA   6           HA       ALA   6   7.642   1.148   5.006
   40    HB1  ALA   6           HB1      ALA   6   8.735   3.318   4.324
   41    HB2  ALA   6           HB2      ALA   6   7.300   3.535   5.327
   42    HB3  ALA   6           HB3      ALA   6   7.204   3.804   3.582
   43    H1   NAL   7           H1       NAL   7   2.682   4.643   1.264
   44    H3   NAL   7           H3       NAL   7   5.942   2.200  -0.087
   45    H4   NAL   7           H4       NAL   7   6.977   4.144  -1.222
   46    H5   NAL   7           H5       NAL   7   6.918   6.656  -1.821
   47    H6   NAL   7           H6       NAL   7   5.779   8.851  -1.693
   48    H7   NAL   7           H7       NAL   7   3.636   9.086  -0.460
   49    H8   NAL   7           H8       NAL   7   2.609   7.121   0.651
   50    H91  NAL   7           H91      NAL   7   2.543   2.218   1.051
   51    H92  NAL   7           H92      NAL   7   4.040   1.286   0.982
   52    H10  NAL   7           H10      NAL   7   3.394   3.364   3.111
   53    HN1  NAL   7           HN1      NAL   7   5.856   2.870   2.526
   54    H    ILE   8           HN       ILE   8   4.174  -0.085   2.751
   55    HA   ILE   8           HA       ILE   8   2.151  -0.731   4.808
   56    HB   ILE   8           HB       ILE   8   1.365  -2.553   2.974
   57   HG12  ILE   8          HG12      ILE   8   1.207  -1.529   0.729
   58   HG13  ILE   8          HG11      ILE   8   2.118  -0.132   1.275
   59   HG21  ILE   8          HG21      ILE   8  -0.510  -1.095   2.395
   60   HG22  ILE   8          HG22      ILE   8   0.402   0.330   2.904
   61   HG23  ILE   8          HG23      ILE   8  -0.104  -0.875   4.098
   62   HD11  ILE   8          HD11      ILE   8   3.364  -1.960  -0.039
   63   HD12  ILE   8          HD12      ILE   8   3.268  -2.915   1.431
   64   HD13  ILE   8          HD13      ILE   8   4.123  -1.370   1.436
   65    H    LYS   9           HN       LYS   9   3.122  -2.069   6.143
   66    HA   LYS   9           HA       LYS   9   5.408  -3.712   5.265
   67    HB2  LYS   9           HB2      LYS   9   4.454  -2.837   7.999
   68    HB3  LYS   9           HB1      LYS   9   5.764  -3.992   7.765
   69    HG2  LYS   9           HG2      LYS   9   6.971  -2.291   6.388
   70    HG3  LYS   9           HG1      LYS   9   5.699  -1.128   6.763
   71    HD2  LYS   9           HD2      LYS   9   6.188  -1.285   9.141
   72    HD3  LYS   9           HD1      LYS   9   7.370  -2.562   8.846
   73    HE2  LYS   9           HE2      LYS   9   8.717  -0.992   7.489
   74    HE3  LYS   9           HE1      LYS   9   7.547   0.286   7.819
   75    HZ1  LYS   9           HZ1      LYS   9   8.349   0.592   9.864
   76    HZ2  LYS   9           HZ2      LYS   9   9.719  -0.254   9.323
   77    HZ3  LYS   9           HZ3      LYS   9   8.496  -1.069  10.175
   78    H    GLY  10           HN       GLY  10   5.252  -5.883   5.120
   79    HA2  GLY  10           HA2      GLY  10   4.532  -8.076   5.686
   80    HA3  GLY  10           HA1      GLY  10   3.264  -7.392   6.698
   81    H    ARG  11           HN       ARG  11   2.564  -5.596   4.257
   82    HA   ARG  11           HA       ARG  11   1.234  -7.673   2.532
   83    HB2  ARG  11           HB2      ARG  11  -0.118  -5.175   3.620
   84    HB3  ARG  11           HB1      ARG  11  -0.840  -6.380   2.562
   85    HG2  ARG  11           HG2      ARG  11  -1.639  -7.227   4.575
   86    HG3  ARG  11           HG1      ARG  11  -0.076  -8.035   4.591
   87    HD2  ARG  11           HD2      ARG  11   0.828  -6.080   5.917
   88    HD3  ARG  11           HD1      ARG  11  -0.814  -5.449   6.000
   89    HE   ARG  11           HE       ARG  11  -1.044  -8.055   6.937
   90   HH11  ARG  11          HH21      ARG  11   0.882  -5.288   7.684
   91   HH12  ARG  11          HH22      ARG  11   1.033  -5.685   9.364
   92   HH21  ARG  11          HH11      ARG  11  -0.856  -8.582   9.123
   93   HH22  ARG  11          HH12      ARG  11   0.049  -7.548  10.177
   94    H    THR  12           HN       THR  12   2.561  -7.230   0.738
   95    HA   THR  12           HA       THR  12   2.721  -4.448  -0.220
   96    HB   THR  12           HB       THR  12   4.259  -6.016  -1.970
   97    HG1  THR  12           HG1      THR  12   5.473  -7.288  -0.492
   98   HG21  THR  12          HG21      THR  12   4.903  -3.830  -0.948
   99   HG22  THR  12          HG22      THR  12   6.191  -5.029  -0.830
  100   HG23  THR  12          HG23      THR  12   5.203  -4.656   0.580
  101    H    PHE  13           HN       PHE  13   2.334  -4.049  -2.501
  102    HA   PHE  13           HA       PHE  13   0.057  -5.710  -3.547
  103    HB2  PHE  13           HB2      PHE  13   0.690  -2.755  -3.761
  104    HB3  PHE  13           HB1      PHE  13  -0.620  -3.542  -4.641
  105    HD1  PHE  13           HD1      PHE  13   0.734  -3.102  -1.153
  106    HD2  PHE  13           HD2      PHE  13  -2.740  -3.725  -3.597
  107    HE1  PHE  13           HE1      PHE  13  -0.714  -2.918   0.841
  108    HE2  PHE  13           HE2      PHE  13  -4.175  -3.538  -1.596
  109    HZ   PHE  13           HZ       PHE  13  -3.157  -3.117   0.607
  110    H    ARG  14           HN       ARG  14   0.074  -6.302  -5.688
  111    HA   ARG  14           HA       ARG  14   2.645  -5.997  -7.164
  112    HB2  ARG  14           HB2      ARG  14   1.485  -8.234  -7.069
  113    HB3  ARG  14           HB1      ARG  14   0.126  -7.525  -7.941
  114    HG2  ARG  14           HG2      ARG  14   1.594  -6.995  -9.840
  115    HG3  ARG  14           HG1      ARG  14   2.980  -7.653  -8.968
  116    HD2  ARG  14           HD2      ARG  14   2.093  -9.314 -10.546
  117    HD3  ARG  14           HD1      ARG  14   1.871  -9.861  -8.884
  118    HE   ARG  14           HE       ARG  14  -0.499  -8.539  -9.479
  119   HH11  ARG  14          HH21      ARG  14   1.366 -11.090 -10.874
  120   HH12  ARG  14          HH22      ARG  14  -0.008 -11.902 -11.547
  121   HH21  ARG  14          HH11      ARG  14  -2.296  -9.588 -10.351
  122   HH22  ARG  14          HH12      ARG  14  -2.079 -11.052 -11.251
  123    H    ASN  15           HN       ASN  15  -0.786  -5.223  -7.359
  124    HA   ASN  15           HA       ASN  15  -0.291  -3.338  -9.645
  125    HB2  ASN  15           HB2      ASN  15  -3.005  -3.380  -9.428
  126    HB3  ASN  15           HB1      ASN  15  -2.121  -4.520 -10.445
  127   HD21  ASN  15          HD21      ASN  15  -4.615  -4.543  -8.379
  128   HD22  ASN  15          HD22      ASN  15  -4.403  -6.054  -7.635
  129    H    GLU  16           HN       GLU  16  -0.278  -1.217  -9.146
  130    HA   GLU  16           HA       GLU  16  -0.705  -0.353  -6.436
  131    HB2  GLU  16           HB2      GLU  16  -0.418   1.187  -9.036
  132    HB3  GLU  16           HB1      GLU  16  -0.561   1.977  -7.466
  133    HG2  GLU  16           HG2      GLU  16   1.446   0.769  -6.677
  134    HG3  GLU  16           HG1      GLU  16   1.598  -0.003  -8.255
  135    H    LYS  17           HN       LYS  17  -2.788  -0.803  -9.151
  136    HA   LYS  17           HA       LYS  17  -4.852   1.005  -8.568
  137    HB2  LYS  17           HB2      LYS  17  -4.650  -0.500 -10.600
  138    HB3  LYS  17           HB1      LYS  17  -5.240  -1.821  -9.594
  139    HG2  LYS  17           HG2      LYS  17  -7.259  -0.339  -9.060
  140    HG3  LYS  17           HG1      LYS  17  -6.696   0.734 -10.340
  141    HD2  LYS  17           HD2      LYS  17  -7.466  -2.187 -10.639
  142    HD3  LYS  17           HD1      LYS  17  -8.369  -0.798 -11.242
  143    HE2  LYS  17           HE2      LYS  17  -7.191  -1.528 -13.156
  144    HE3  LYS  17           HE1      LYS  17  -6.155  -0.237 -12.548
  145    HZ1  LYS  17           HZ1      LYS  17  -4.530  -1.692 -12.261
  146    HZ2  LYS  17           HZ2      LYS  17  -5.502  -2.908 -12.943
  147    HZ3  LYS  17           HZ3      LYS  17  -5.503  -2.658 -11.263
  148    H    GLU  18           HN       GLU  18  -4.341  -2.323  -7.377
  149    HA   GLU  18           HA       GLU  18  -6.647  -2.314  -5.693
  150    HB2  GLU  18           HB2      GLU  18  -5.558  -4.378  -6.492
  151    HB3  GLU  18           HB1      GLU  18  -4.146  -4.007  -5.509
  152    HG2  GLU  18           HG2      GLU  18  -5.490  -4.133  -3.480
  153    HG3  GLU  18           HG1      GLU  18  -6.953  -4.363  -4.429
  154    H    LEU  19           HN       LEU  19  -3.341  -1.227  -5.280
  155    HA   LEU  19           HA       LEU  19  -3.480  -0.967  -2.397
  156    HB2  LEU  19           HB2      LEU  19  -1.323  -1.081  -3.495
  157    HB3  LEU  19           HB1      LEU  19  -1.715   0.310  -4.480
  158    HG   LEU  19           HG       LEU  19  -1.877   1.570  -2.205
  159   HD11  LEU  19          HD11      LEU  19  -0.653   0.729  -0.360
  160   HD12  LEU  19          HD12      LEU  19  -0.002  -0.602  -1.310
  161   HD13  LEU  19          HD13      LEU  19  -1.704  -0.590  -0.862
  162   HD21  LEU  19          HD21      LEU  19   0.553   2.029  -2.231
  163   HD22  LEU  19          HD22      LEU  19  -0.138   2.023  -3.854
  164   HD23  LEU  19          HD23      LEU  19   0.778   0.628  -3.281
  165    H    ARG  20           HN       ARG  20  -4.245   1.116  -5.153
  166    HA   ARG  20           HA       ARG  20  -4.655   3.550  -3.737
  167    HB2  ARG  20           HB2      ARG  20  -4.623   3.481  -6.185
  168    HB3  ARG  20           HB1      ARG  20  -6.037   2.439  -6.197
  169    HG2  ARG  20           HG2      ARG  20  -6.568   4.824  -6.720
  170    HG3  ARG  20           HG1      ARG  20  -7.439   4.220  -5.315
  171    HD2  ARG  20           HD2      ARG  20  -6.342   6.564  -5.128
  172    HD3  ARG  20           HD1      ARG  20  -6.067   5.441  -3.800
  173    HE   ARG  20           HE       ARG  20  -3.924   4.986  -5.508
  174   HH11  ARG  20          HH21      ARG  20  -5.345   7.725  -3.958
  175   HH12  ARG  20          HH22      ARG  20  -3.850   8.590  -3.830
  176   HH21  ARG  20          HH11      ARG  20  -1.972   6.102  -5.349
  177   HH22  ARG  20          HH12      ARG  20  -1.942   7.672  -4.618
  178    H    ASP  21           HN       ASP  21  -6.697   0.786  -4.311
  179    HA   ASP  21           HA       ASP  21  -9.046   1.867  -3.065
  180    HB2  ASP  21           HB2      ASP  21  -8.293  -0.967  -3.812
  181    HB3  ASP  21           HB1      ASP  21  -9.875  -0.496  -3.195
  182    H    PHE  22           HN       PHE  22  -6.693  -0.639  -2.067
  183    HA   PHE  22           HA       PHE  22  -7.773  -0.978   0.517
  184    HB2  PHE  22           HB2      PHE  22  -5.111  -1.523  -0.743
  185    HB3  PHE  22           HB1      PHE  22  -5.199  -1.603   1.008
  186    HD1  PHE  22           HD1      PHE  22  -7.691  -2.572  -1.622
  187    HD2  PHE  22           HD2      PHE  22  -5.167  -3.910   1.596
  188    HE1  PHE  22           HE1      PHE  22  -8.660  -4.837  -1.797
  189    HE2  PHE  22           HE2      PHE  22  -6.144  -6.166   1.413
  190    HZ   PHE  22           HZ       PHE  22  -7.892  -6.641  -0.280
  191    H    ILE  23           HN       ILE  23  -5.807   1.495  -0.852
  192    HA   ILE  23           HA       ILE  23  -4.809   2.625   1.601
  193    HB   ILE  23           HB       ILE  23  -5.093   3.472  -1.255
  194   HG12  ILE  23          HG12      ILE  23  -2.819   3.799   0.739
  195   HG13  ILE  23          HG11      ILE  23  -3.040   2.380  -0.276
  196   HG21  ILE  23          HG21      ILE  23  -4.853   5.453   1.009
  197   HG22  ILE  23          HG22      ILE  23  -5.993   5.469  -0.340
  198   HG23  ILE  23          HG23      ILE  23  -4.297   5.827  -0.622
  199   HD11  ILE  23          HD11      ILE  23  -1.399   3.962  -1.248
  200   HD12  ILE  23          HD12      ILE  23  -2.644   5.209  -1.296
  201   HD13  ILE  23          HD13      ILE  23  -2.803   3.764  -2.286
  202    H    GLU  24           HN       GLU  24  -7.710   3.005  -0.309
  203    HA   GLU  24           HA       GLU  24  -8.828   5.158   1.174
  204    HB2  GLU  24           HB2      GLU  24 -10.229   2.936  -0.335
  205    HB3  GLU  24           HB1      GLU  24 -11.076   4.295   0.383
  206    HG2  GLU  24           HG2      GLU  24  -8.818   4.624  -1.617
  207    HG3  GLU  24           HG1      GLU  24 -10.519   4.574  -2.074
  208    H    LYS  25           HN       LYS  25  -8.527   1.761   1.834
  209    HA   LYS  25           HA       LYS  25 -10.457   1.723   4.031
  210    HB2  LYS  25           HB2      LYS  25  -9.764  -0.313   2.702
  211    HB3  LYS  25           HB1      LYS  25  -8.192  -0.227   3.493
  212    HG2  LYS  25           HG2      LYS  25  -9.307  -0.426   5.703
  213    HG3  LYS  25           HG1      LYS  25 -10.866  -0.566   4.890
  214    HD2  LYS  25           HD2      LYS  25 -10.095  -2.592   3.730
  215    HD3  LYS  25           HD1      LYS  25  -8.521  -2.450   4.513
  216    HE2  LYS  25           HE2      LYS  25 -10.045  -4.074   5.662
  217    HE3  LYS  25           HE1      LYS  25  -9.525  -2.751   6.706
  218    HZ1  LYS  25           HZ1      LYS  25 -12.004  -2.467   5.155
  219    HZ2  LYS  25           HZ2      LYS  25 -11.575  -1.765   6.642
  220    HZ3  LYS  25           HZ3      LYS  25 -12.022  -3.403   6.570
  221    H    PHE  26           HN       PHE  26  -6.862   1.813   3.833
  222    HA   PHE  26           HA       PHE  26  -6.444   1.929   6.666
  223    HB2  PHE  26           HB2      PHE  26  -4.655   3.349   4.670
  224    HB3  PHE  26           HB1      PHE  26  -4.201   2.601   6.196
  225    HD1  PHE  26           HD1      PHE  26  -5.760  -0.067   5.805
  226    HD2  PHE  26           HD2      PHE  26  -3.158   2.185   3.214
  227    HE1  PHE  26           HE1      PHE  26  -5.158  -2.134   4.604
  228    HE2  PHE  26           HE2      PHE  26  -2.570   0.097   2.003
  229    HZ   PHE  26           HZ       PHE  26  -3.567  -2.058   2.713
  230   H11A  DNS  27          H22       DNS  27   0.066   3.447   6.860
  231    H12  DNS  27           H23      DNS  27  -0.488   5.054   7.344
  232    H13  DNS  27           H24      DNS  27   1.019   4.396   8.017
  233    H21  DNS  27           H21      DNS  27   2.882   4.645   4.860
  234    H22  DNS  27           H19      DNS  27   2.136   3.225   5.615
  235    H23  DNS  27           H20      DNS  27   3.052   4.365   6.607
  236    H4   DNS  27           H14      DNS  27   0.023   2.972   4.670
  237    H5   DNS  27           H15      DNS  27  -1.360   3.231   2.598
  238    H6   DNS  27           H16      DNS  27  -1.811   5.505   1.659
  239    HZ   DNS  27           HZ1      DNS  27  -2.855   7.000   2.836
  240    HE3  DNS  27           HE1      DNS  27  -3.677   9.086   3.299
  241    HE2  DNS  27           HE2      DNS  27  -4.021   9.376   1.605
  242    HD3  DNS  27           HD1      DNS  27  -6.123   9.011   2.661
  243    HD2  DNS  27           HD2      DNS  27  -5.771   7.552   1.737
  244    HG3  DNS  27           HG1      DNS  27  -5.123   6.345   3.710
  245    HG2  DNS  27           HG2      DNS  27  -5.113   7.812   4.688
  246    HB3  DNS  27           HB1      DNS  27  -7.549   8.058   4.346
  247    HB2  DNS  27           HB2      DNS  27  -7.563   6.582   3.383
  248    HA   DNS  27           HA       DNS  27  -6.570   6.650   6.248
  249    H    DNS  27           HN       DNS  27  -6.723   4.552   4.259
  250    H9   DNS  27           H9       DNS  27  -0.520   9.987   2.902
  251    H10  DNS  27           H10      DNS  27   0.859   9.712   4.963
  252    H11  DNS  27           H11      DNS  27   1.287   7.436   5.904
  253    H    GLY  28           HN       GLY  28  -8.468   4.652   7.049
  254    HA2  GLY  28           HA2      GLY  28 -11.163   5.770   6.560
  255    HA3  GLY  28           HA1      GLY  28 -10.784   4.339   7.519
  256    H    ARG  29           HN       ARG  29  -9.259   5.001   9.503
  257    HA   ARG  29           HA       ARG  29  -9.282   6.006  11.623
  258    HB2  ARG  29           HB2      ARG  29  -9.830   8.519  10.016
  259    HB3  ARG  29           HB1      ARG  29  -9.125   8.431  11.630
  260    HG2  ARG  29           HG2      ARG  29  -7.199   7.183  10.729
  261    HG3  ARG  29           HG1      ARG  29  -7.899   7.264   9.113
  262    HD2  ARG  29           HD2      ARG  29  -7.125   9.658  10.807
  263    HD3  ARG  29           HD1      ARG  29  -6.195   9.028   9.447
  264    HE   ARG  29           HE       ARG  29  -8.714   9.487   8.375
  265   HH11  ARG  29          HH21      ARG  29  -6.380  11.319  10.143
  266   HH12  ARG  29          HH22      ARG  29  -6.819  12.827   9.414
  267   HH21  ARG  29          HH11      ARG  29  -9.297  11.446   7.420
  268   HH22  ARG  29          HH12      ARG  29  -8.470  12.899   7.874
  Start of MODEL    6
    1    H1   GLY   1           HT1      GLY   1  10.466   1.076 -11.346
    2    H2   GLY   1           HT2      GLY   1  12.125   1.090 -10.982
    3    H3   GLY   1           HT3      GLY   1  11.424   2.400 -11.805
    4    HA2  GLY   1           HA2      GLY   1  11.334   3.461  -9.829
    5    HA3  GLY   1           HA1      GLY   1  10.027   2.281  -9.506
    6    H    GLN   2           HN       GLN   2  11.555   3.259  -7.450
    7    HA   GLN   2           HA       GLN   2  12.397   0.779  -6.237
    8    HB2  GLN   2           HB2      GLN   2  11.504   3.354  -4.900
    9    HB3  GLN   2           HB1      GLN   2  12.431   2.060  -4.142
   10    HG2  GLN   2           HG2      GLN   2  13.367   3.621  -6.569
   11    HG3  GLN   2           HG1      GLN   2  13.849   3.984  -4.913
   12   HE21  GLN   2          HE21      GLN   2  14.641   1.796  -3.711
   13   HE22  GLN   2          HE22      GLN   2  15.734   0.864  -4.615
   14    H    GLN   3           HN       GLN   3  11.113  -0.815  -5.444
   15    HA   GLN   3           HA       GLN   3   8.235  -0.579  -5.486
   16    HB2  GLN   3           HB2      GLN   3   8.260  -2.822  -4.411
   17    HB3  GLN   3           HB1      GLN   3   9.260  -2.745  -5.861
   18    HG2  GLN   3           HG2      GLN   3  11.261  -2.353  -4.416
   19    HG3  GLN   3           HG1      GLN   3  10.238  -2.565  -2.996
   20   HE21  GLN   3          HE21      GLN   3  10.253  -4.662  -2.194
   21   HE22  GLN   3          HE22      GLN   3  10.539  -6.059  -3.114
   22    H    TYR   4           HN       TYR   4   6.816  -0.556  -3.720
   23    HA   TYR   4           HA       TYR   4   7.504   1.176  -1.602
   24    HB2  TYR   4           HB2      TYR   4   5.126  -0.560  -1.157
   25    HB3  TYR   4           HB1      TYR   4   5.210   1.186  -1.209
   26    HD1  TYR   4           HD2      TYR   4   6.278   1.813  -3.824
   27    HD2  TYR   4           HD1      TYR   4   3.487  -1.278  -2.732
   28    HE1  TYR   4           HE2      TYR   4   5.396   1.783  -6.135
   29    HE2  TYR   4           HE1      TYR   4   2.615  -1.297  -5.047
   30    HH   TYR   4           HH       TYR   4   3.024   1.076  -7.190
   31    H    THR   5           HN       THR   5   8.723   0.681   0.208
   32    HA   THR   5           HA       THR   5   8.662  -2.146   1.284
   33    HB   THR   5           HB       THR   5  10.947  -1.933   1.873
   34    HG1  THR   5           HG1      THR   5  12.000   0.067   1.809
   35   HG21  THR   5          HG21      THR   5  10.876  -0.329  -0.676
   36   HG22  THR   5          HG22      THR   5  10.414  -2.031  -0.663
   37   HG23  THR   5          HG23      THR   5  12.048  -1.552  -0.198
   38    H    ALA   6           HN       ALA   6   8.508   1.260   2.052
   39    HA   ALA   6           HA       ALA   6   8.401   0.743   4.992
   40    HB1  ALA   6           HB1      ALA   6   9.756   2.659   4.058
   41    HB2  ALA   6           HB2      ALA   6   8.513   3.166   5.201
   42    HB3  ALA   6           HB3      ALA   6   8.250   3.375   3.466
   43    H1   NAL   7           H1       NAL   7   3.566   4.795   1.733
   44    H3   NAL   7           H3       NAL   7   6.579   2.235   0.073
   45    H4   NAL   7           H4       NAL   7   7.759   4.190  -0.896
   46    H5   NAL   7           H5       NAL   7   7.902   6.744  -1.260
   47    H6   NAL   7           H6       NAL   7   6.954   9.003  -0.900
   48    H7   NAL   7           H7       NAL   7   4.857   9.297   0.397
   49    H8   NAL   7           H8       NAL   7   3.684   7.327   1.345
   50    H91  NAL   7           H91      NAL   7   3.217   2.450   1.369
   51    H92  NAL   7           H92      NAL   7   4.610   1.395   1.109
   52    H10  NAL   7           H10      NAL   7   4.337   3.320   3.454
   53    HN1  NAL   7           HN1      NAL   7   6.638   2.364   2.454
   54    H    ILE   8           HN       ILE   8   4.810  -0.152   2.879
   55    HA   ILE   8           HA       ILE   8   2.818  -0.742   4.977
   56    HB   ILE   8           HB       ILE   8   1.835  -2.431   3.116
   57   HG12  ILE   8          HG12      ILE   8   1.680  -1.333   0.910
   58   HG13  ILE   8          HG11      ILE   8   2.707  -0.017   1.463
   59   HG21  ILE   8          HG21      ILE   8   0.535  -0.678   4.342
   60   HG22  ILE   8          HG22      ILE   8   0.051  -0.832   2.653
   61   HG23  ILE   8          HG23      ILE   8   1.080   0.515   3.151
   62   HD11  ILE   8          HD11      ILE   8   4.627  -1.369   1.473
   63   HD12  ILE   8          HD12      ILE   8   3.743  -1.954   0.066
   64   HD13  ILE   8          HD13      ILE   8   3.691  -2.867   1.559
   65    H    LYS   9           HN       LYS   9   3.601  -2.320   6.169
   66    HA   LYS   9           HA       LYS   9   5.866  -3.944   5.212
   67    HB2  LYS   9           HB2      LYS   9   6.103  -2.613   7.316
   68    HB3  LYS   9           HB1      LYS   9   4.838  -3.611   8.035
   69    HG2  LYS   9           HG2      LYS   9   6.183  -5.615   7.754
   70    HG3  LYS   9           HG1      LYS   9   7.413  -4.712   6.868
   71    HD2  LYS   9           HD2      LYS   9   7.807  -3.315   8.886
   72    HD3  LYS   9           HD1      LYS   9   6.633  -4.292   9.769
   73    HE2  LYS   9           HE2      LYS   9   9.232  -5.255   8.543
   74    HE3  LYS   9           HE1      LYS   9   8.857  -5.135  10.261
   75    HZ1  LYS   9           HZ1      LYS   9   7.054  -6.743   9.906
   76    HZ2  LYS   9           HZ2      LYS   9   8.579  -7.389   9.529
   77    HZ3  LYS   9           HZ3      LYS   9   7.527  -6.907   8.286
   78    H    GLY  10           HN       GLY  10   5.779  -6.160   5.116
   79    HA2  GLY  10           HA2      GLY  10   4.927  -8.341   5.323
   80    HA3  GLY  10           HA1      GLY  10   3.711  -7.721   6.435
   81    H    ARG  11           HN       ARG  11   3.004  -5.680   4.194
   82    HA   ARG  11           HA       ARG  11   1.528  -7.545   2.345
   83    HB2  ARG  11           HB2      ARG  11   0.361  -5.075   3.672
   84    HB3  ARG  11           HB1      ARG  11  -0.476  -6.152   2.563
   85    HG2  ARG  11           HG2      ARG  11   0.676  -7.061   5.221
   86    HG3  ARG  11           HG1      ARG  11  -0.986  -6.520   5.028
   87    HD2  ARG  11           HD2      ARG  11   0.326  -8.951   3.779
   88    HD3  ARG  11           HD1      ARG  11  -1.045  -8.906   4.878
   89    HE   ARG  11           HE       ARG  11  -1.926  -7.451   2.693
   90   HH11  ARG  11          HH21      ARG  11  -0.530 -10.568   3.206
   91   HH12  ARG  11          HH22      ARG  11  -1.355 -11.300   1.870
   92   HH21  ARG  11          HH11      ARG  11  -3.007  -8.394   0.951
   93   HH22  ARG  11          HH12      ARG  11  -2.756 -10.071   0.595
   94    H    THR  12           HN       THR  12   2.787  -7.044   0.538
   95    HA   THR  12           HA       THR  12   3.047  -4.211  -0.237
   96    HB   THR  12           HB       THR  12   4.485  -5.730  -2.118
   97    HG1  THR  12           HG1      THR  12   4.067  -7.486  -0.583
   98   HG21  THR  12          HG21      THR  12   5.227  -3.618  -1.015
   99   HG22  THR  12          HG22      THR  12   6.477  -4.863  -0.986
  100   HG23  THR  12          HG23      THR  12   5.536  -4.525   0.466
  101    H    PHE  13           HN       PHE  13   2.623  -3.668  -2.488
  102    HA   PHE  13           HA       PHE  13   0.302  -5.231  -3.597
  103    HB2  PHE  13           HB2      PHE  13   0.922  -2.264  -3.608
  104    HB3  PHE  13           HB1      PHE  13  -0.420  -2.998  -4.487
  105    HD1  PHE  13           HD1      PHE  13   1.073  -2.730  -1.045
  106    HD2  PHE  13           HD2      PHE  13  -2.490  -3.341  -3.373
  107    HE1  PHE  13           HE1      PHE  13  -0.294  -2.683   1.016
  108    HE2  PHE  13           HE2      PHE  13  -3.840  -3.304  -1.308
  109    HZ   PHE  13           HZ       PHE  13  -2.746  -2.954   0.874
  110    H    ARG  14           HN       ARG  14   0.458  -5.892  -5.675
  111    HA   ARG  14           HA       ARG  14   2.913  -5.263  -7.221
  112    HB2  ARG  14           HB2      ARG  14   0.536  -7.057  -7.847
  113    HB3  ARG  14           HB1      ARG  14   2.000  -6.929  -8.822
  114    HG2  ARG  14           HG2      ARG  14   3.348  -7.701  -6.900
  115    HG3  ARG  14           HG1      ARG  14   1.880  -7.844  -5.932
  116    HD2  ARG  14           HD2      ARG  14   2.491 -10.035  -6.839
  117    HD3  ARG  14           HD1      ARG  14   0.985  -9.482  -7.572
  118    HE   ARG  14           HE       ARG  14   2.945  -8.585  -9.321
  119   HH11  ARG  14          HH21      ARG  14   2.066 -11.603  -7.890
  120   HH12  ARG  14          HH22      ARG  14   2.616 -12.548  -9.234
  121   HH21  ARG  14          HH11      ARG  14   3.665  -9.805 -11.077
  122   HH22  ARG  14          HH12      ARG  14   3.521 -11.531 -11.036
  123    H    ASN  15           HN       ASN  15  -0.583  -4.830  -7.311
  124    HA   ASN  15           HA       ASN  15  -0.344  -2.890  -9.590
  125    HB2  ASN  15           HB2      ASN  15  -3.034  -3.197  -9.278
  126    HB3  ASN  15           HB1      ASN  15  -2.080  -4.239 -10.336
  127   HD21  ASN  15          HD21      ASN  15  -4.466  -4.498  -8.135
  128   HD22  ASN  15          HD22      ASN  15  -4.082  -5.994  -7.429
  129    H    GLU  16           HN       GLU  16  -0.512  -0.781  -9.080
  130    HA   GLU  16           HA       GLU  16  -0.933   0.051  -6.364
  131    HB2  GLU  16           HB2      GLU  16  -0.983   1.631  -8.957
  132    HB3  GLU  16           HB1      GLU  16  -1.037   2.363  -7.355
  133    HG2  GLU  16           HG2      GLU  16   1.261   2.403  -8.091
  134    HG3  GLU  16           HG1      GLU  16   1.133   1.183  -6.827
  135    H    LYS  17           HN       LYS  17  -3.048  -0.645  -8.992
  136    HA   LYS  17           HA       LYS  17  -5.274   0.934  -8.355
  137    HB2  LYS  17           HB2      LYS  17  -4.982  -0.570 -10.372
  138    HB3  LYS  17           HB1      LYS  17  -5.389  -1.933  -9.331
  139    HG2  LYS  17           HG2      LYS  17  -7.539  -0.683  -8.741
  140    HG3  LYS  17           HG1      LYS  17  -7.140   0.439 -10.042
  141    HD2  LYS  17           HD2      LYS  17  -7.589  -2.550 -10.313
  142    HD3  LYS  17           HD1      LYS  17  -8.664  -1.275 -10.882
  143    HE2  LYS  17           HE2      LYS  17  -7.482  -1.870 -12.839
  144    HE3  LYS  17           HE1      LYS  17  -6.573  -0.473 -12.265
  145    HZ1  LYS  17           HZ1      LYS  17  -5.662  -3.078 -12.667
  146    HZ2  LYS  17           HZ2      LYS  17  -5.596  -2.778 -10.996
  147    HZ3  LYS  17           HZ3      LYS  17  -4.790  -1.747 -12.079
  148    H    GLU  18           HN       GLU  18  -4.373  -2.305  -7.139
  149    HA   GLU  18           HA       GLU  18  -6.605  -2.534  -5.379
  150    HB2  GLU  18           HB2      GLU  18  -5.290  -4.471  -6.158
  151    HB3  GLU  18           HB1      GLU  18  -3.901  -3.889  -5.239
  152    HG2  GLU  18           HG2      GLU  18  -5.110  -4.143  -3.153
  153    HG3  GLU  18           HG1      GLU  18  -6.594  -4.542  -4.015
  154    H    LEU  19           HN       LEU  19  -3.408  -1.125  -5.061
  155    HA   LEU  19           HA       LEU  19  -3.513  -0.809  -2.194
  156    HB2  LEU  19           HB2      LEU  19  -1.398  -0.787  -3.365
  157    HB3  LEU  19           HB1      LEU  19  -1.915   0.577  -4.334
  158    HG   LEU  19           HG       LEU  19  -2.101   1.813  -2.042
  159   HD11  LEU  19          HD11      LEU  19  -1.718  -0.334  -0.717
  160   HD12  LEU  19          HD12      LEU  19  -0.738   1.050  -0.250
  161   HD13  LEU  19          HD13      LEU  19  -0.039  -0.229  -1.238
  162   HD21  LEU  19          HD21      LEU  19  -0.454   2.398  -3.749
  163   HD22  LEU  19          HD22      LEU  19   0.585   1.081  -3.205
  164   HD23  LEU  19          HD23      LEU  19   0.282   2.459  -2.147
  165    H    ARG  20           HN       ARG  20  -4.520   1.178  -4.946
  166    HA   ARG  20           HA       ARG  20  -5.088   3.578  -3.507
  167    HB2  ARG  20           HB2      ARG  20  -5.051   3.455  -5.970
  168    HB3  ARG  20           HB1      ARG  20  -6.474   2.420  -5.946
  169    HG2  ARG  20           HG2      ARG  20  -6.799   5.014  -4.472
  170    HG3  ARG  20           HG1      ARG  20  -6.572   5.182  -6.207
  171    HD2  ARG  20           HD2      ARG  20  -8.458   3.661  -6.626
  172    HD3  ARG  20           HD1      ARG  20  -8.685   3.442  -4.893
  173    HE   ARG  20           HE       ARG  20  -8.826   6.188  -5.227
  174   HH11  ARG  20          HH21      ARG  20 -10.369   3.428  -6.618
  175   HH12  ARG  20          HH22      ARG  20 -11.862   4.253  -6.919
  176   HH21  ARG  20          HH11      ARG  20 -10.766   7.273  -5.615
  177   HH22  ARG  20          HH12      ARG  20 -12.086   6.429  -6.352
  178    H    ASP  21           HN       ASP  21  -6.920   0.660  -4.057
  179    HA   ASP  21           HA       ASP  21  -9.326   1.579  -2.787
  180    HB2  ASP  21           HB2      ASP  21  -8.375  -1.199  -3.525
  181    HB3  ASP  21           HB1      ASP  21  -9.978  -0.843  -2.881
  182    H    PHE  22           HN       PHE  22  -6.783  -0.742  -1.818
  183    HA   PHE  22           HA       PHE  22  -7.763  -1.152   0.792
  184    HB2  PHE  22           HB2      PHE  22  -5.096  -1.456  -0.538
  185    HB3  PHE  22           HB1      PHE  22  -5.141  -1.566   1.210
  186    HD1  PHE  22           HD2      PHE  22  -7.671  -2.723  -1.312
  187    HD2  PHE  22           HD1      PHE  22  -4.806  -3.874   1.686
  188    HE1  PHE  22           HE2      PHE  22  -8.421  -5.067  -1.486
  189    HE2  PHE  22           HE1      PHE  22  -5.564  -6.211   1.500
  190    HZ   PHE  22           HZ       PHE  22  -7.372  -6.819  -0.082
  191    H    ILE  23           HN       ILE  23  -6.046   1.467  -0.633
  192    HA   ILE  23           HA       ILE  23  -5.089   2.684   1.798
  193    HB   ILE  23           HB       ILE  23  -5.464   3.476  -1.062
  194   HG12  ILE  23          HG12      ILE  23  -3.191   3.954   0.905
  195   HG13  ILE  23          HG11      ILE  23  -3.334   2.524  -0.109
  196   HG21  ILE  23          HG21      ILE  23  -4.810   5.883  -0.458
  197   HG22  ILE  23          HG22      ILE  23  -5.331   5.488   1.176
  198   HG23  ILE  23          HG23      ILE  23  -6.481   5.419  -0.161
  199   HD11  ILE  23          HD11      ILE  23  -1.803   4.197  -1.097
  200   HD12  ILE  23          HD12      ILE  23  -3.116   5.372  -1.126
  201   HD13  ILE  23          HD13      ILE  23  -3.207   3.926  -2.119
  202    H    GLU  24           HN       GLU  24  -8.036   2.820  -0.065
  203    HA   GLU  24           HA       GLU  24  -9.280   4.928   1.371
  204    HB2  GLU  24           HB2      GLU  24 -10.549   2.559  -0.025
  205    HB3  GLU  24           HB1      GLU  24 -11.476   3.881   0.664
  206    HG2  GLU  24           HG2      GLU  24  -9.289   4.296  -1.397
  207    HG3  GLU  24           HG1      GLU  24 -10.989   4.106  -1.814
  208    H    LYS  25           HN       LYS  25  -8.784   1.561   2.121
  209    HA   LYS  25           HA       LYS  25 -10.631   1.528   4.398
  210    HB2  LYS  25           HB2      LYS  25  -8.525  -0.358   3.327
  211    HB3  LYS  25           HB1      LYS  25  -9.184  -0.624   4.937
  212    HG2  LYS  25           HG2      LYS  25 -10.415  -1.919   3.233
  213    HG3  LYS  25           HG1      LYS  25 -11.458  -0.726   4.006
  214    HD2  LYS  25           HD2      LYS  25 -11.298   0.761   2.118
  215    HD3  LYS  25           HD1      LYS  25 -10.028  -0.218   1.382
  216    HE2  LYS  25           HE2      LYS  25 -11.617  -2.090   1.129
  217    HE3  LYS  25           HE1      LYS  25 -12.887  -1.112   1.866
  218    HZ1  LYS  25           HZ1      LYS  25 -11.629   0.297  -0.248
  219    HZ2  LYS  25           HZ2      LYS  25 -13.267  -0.115  -0.059
  220    HZ3  LYS  25           HZ3      LYS  25 -12.194  -1.203  -0.802
  221    H    PHE  26           HN       PHE  26  -7.047   1.766   4.052
  222    HA   PHE  26           HA       PHE  26  -6.528   1.980   6.857
  223    HB2  PHE  26           HB2      PHE  26  -4.901   3.462   4.767
  224    HB3  PHE  26           HB1      PHE  26  -4.352   2.794   6.295
  225    HD1  PHE  26           HD2      PHE  26  -5.773   0.013   5.988
  226    HD2  PHE  26           HD1      PHE  26  -3.328   2.365   3.330
  227    HE1  PHE  26           HE2      PHE  26  -5.060  -2.038   4.818
  228    HE2  PHE  26           HE1      PHE  26  -2.620   0.293   2.160
  229    HZ   PHE  26           HZ       PHE  26  -3.485  -1.905   2.913
  230   H11A  DNS  27          H22       DNS  27  -1.564   0.531   7.502
  231    H12  DNS  27           H23      DNS  27  -2.092   1.116   5.922
  232    H13  DNS  27           H24      DNS  27  -2.716   1.876   7.403
  233    H21  DNS  27           H21      DNS  27   0.563   1.142   5.761
  234    H22  DNS  27           H19      DNS  27   0.686   0.913   7.514
  235    H23  DNS  27           H20      DNS  27   1.391   2.350   6.767
  236    H4   DNS  27           H14      DNS  27  -0.926   1.921   4.243
  237    H5   DNS  27           H15      DNS  27  -1.227   3.733   2.537
  238    H6   DNS  27           H16      DNS  27  -1.360   6.130   3.256
  239    HZ   DNS  27           HZ1      DNS  27  -3.291   7.337   5.037
  240    HE3  DNS  27           HE1      DNS  27  -3.733   9.578   4.139
  241    HE2  DNS  27           HE2      DNS  27  -3.260   8.931   2.577
  242    HD3  DNS  27           HD1      DNS  27  -5.767   8.964   3.092
  243    HD2  DNS  27           HD2      DNS  27  -5.107   7.437   2.513
  244    HG3  DNS  27           HG1      DNS  27  -5.084   6.493   4.716
  245    HG2  DNS  27           HG2      DNS  27  -5.398   8.058   5.466
  246    HB3  DNS  27           HB1      DNS  27  -7.635   8.130   4.572
  247    HB2  DNS  27           HB2      DNS  27  -7.342   6.715   3.560
  248    HA   DNS  27           HA       DNS  27  -7.143   6.602   6.585
  249    H    DNS  27           HN       DNS  27  -6.993   4.579   4.431
  250    H9   DNS  27           H9       DNS  27  -1.185   8.395   7.503
  251    H10  DNS  27           H10      DNS  27  -0.892   6.581   9.194
  252    H11  DNS  27           H11      DNS  27  -0.750   4.191   8.471
  253    H    GLY  28           HN       GLY  28  -9.054   7.829   7.012
  254    HA2  GLY  28           HA2      GLY  28 -11.514   6.313   6.904
  255    HA3  GLY  28           HA1      GLY  28 -11.351   7.976   7.474
  256    H    ARG  29           HN       ARG  29 -10.331   9.207   5.216
  257    HA   ARG  29           HA       ARG  29 -12.126   8.617   2.931
  258    HB2  ARG  29           HB2      ARG  29 -12.960  11.004   2.937
  259    HB3  ARG  29           HB1      ARG  29 -13.570  10.026   4.270
  260    HG2  ARG  29           HG2      ARG  29 -11.868  10.963   5.771
  261    HG3  ARG  29           HG1      ARG  29 -11.198  11.911   4.445
  262    HD2  ARG  29           HD2      ARG  29 -13.404  13.048   4.193
  263    HD3  ARG  29           HD1      ARG  29 -13.986  12.166   5.604
  264    HE   ARG  29           HE       ARG  29 -11.665  13.402   6.498
  265   HH11  ARG  29          HH21      ARG  29 -14.589  14.389   4.946
  266   HH12  ARG  29          HH22      ARG  29 -14.593  15.963   5.669
  267   HH21  ARG  29          HH11      ARG  29 -11.661  15.450   7.445
  268   HH22  ARG  29          HH12      ARG  29 -12.938  16.563   7.083
  Start of MODEL    7
    1    H1   GLY   1           HT1      GLY   1   8.557   3.781 -10.111
    2    H2   GLY   1           HT2      GLY   1   7.643   2.741 -11.094
    3    H3   GLY   1           HT3      GLY   1   8.954   3.598 -11.752
    4    HA2  GLY   1           HA2      GLY   1   9.207   1.042 -11.206
    5    HA3  GLY   1           HA1      GLY   1  10.463   2.201 -10.678
    6    H    GLN   2           HN       GLN   2   9.302   3.559  -8.613
    7    HA   GLN   2           HA       GLN   2  11.160   2.309  -6.808
    8    HB2  GLN   2           HB2      GLN   2   8.905   4.282  -6.320
    9    HB3  GLN   2           HB1      GLN   2  10.065   3.794  -5.084
   10    HG2  GLN   2           HG2      GLN   2  10.851   5.863  -6.060
   11    HG3  GLN   2           HG1      GLN   2  11.913   4.569  -6.612
   12   HE21  GLN   2          HE21      GLN   2  12.110   4.289  -8.861
   13   HE22  GLN   2          HE22      GLN   2  11.140   5.075 -10.010
   14    H    GLN   3           HN       GLN   3  10.815   0.304  -5.975
   15    HA   GLN   3           HA       GLN   3   8.189  -0.887  -5.768
   16    HB2  GLN   3           HB2      GLN   3   9.376  -2.693  -4.520
   17    HB3  GLN   3           HB1      GLN   3  10.162  -2.299  -6.049
   18    HG2  GLN   3           HG2      GLN   3  11.733  -0.798  -4.803
   19    HG3  GLN   3           HG1      GLN   3  11.000  -1.343  -3.294
   20   HE21  GLN   3          HE21      GLN   3  13.162  -2.268  -5.910
   21   HE22  GLN   3          HE22      GLN   3  13.638  -3.753  -5.240
   22    H    TYR   4           HN       TYR   4   6.955  -1.243  -3.873
   23    HA   TYR   4           HA       TYR   4   7.015   0.833  -1.947
   24    HB2  TYR   4           HB2      TYR   4   5.571  -1.669  -1.191
   25    HB3  TYR   4           HB1      TYR   4   4.975  -0.014  -1.220
   26    HD1  TYR   4           HD1      TYR   4   5.625  -3.051  -3.240
   27    HD2  TYR   4           HD2      TYR   4   3.949   0.913  -3.243
   28    HE1  TYR   4           HE1      TYR   4   4.531  -3.511  -5.413
   29    HE2  TYR   4           HE2      TYR   4   2.857   0.444  -5.417
   30    HH   TYR   4           HH       TYR   4   3.245  -2.717  -7.028
   31    H    THR   5           HN       THR   5   8.389   1.013  -0.204
   32    HA   THR   5           HA       THR   5   9.532  -1.510   1.009
   33    HB   THR   5           HB       THR   5  11.531  -0.280   1.506
   34    HG1  THR   5           HG1      THR   5  10.339   2.002   0.352
   35   HG21  THR   5          HG21      THR   5  11.144  -1.060  -0.909
   36   HG22  THR   5          HG22      THR   5  12.376   0.182  -0.680
   37   HG23  THR   5          HG23      THR   5  10.778   0.627  -1.270
   38    H    ALA   6           HN       ALA   6   7.981   1.563   1.584
   39    HA   ALA   6           HA       ALA   6   8.005   1.087   4.563
   40    HB1  ALA   6           HB1      ALA   6   7.585   3.699   3.058
   41    HB2  ALA   6           HB2      ALA   6   9.133   3.191   3.747
   42    HB3  ALA   6           HB3      ALA   6   7.754   3.492   4.805
   43    H1   NAL   7           H1       NAL   7   2.961   4.641   1.000
   44    H3   NAL   7           H3       NAL   7   6.045   2.079  -0.530
   45    H4   NAL   7           H4       NAL   7   7.059   3.973  -1.764
   46    H5   NAL   7           H5       NAL   7   7.034   6.476  -2.403
   47    H6   NAL   7           H6       NAL   7   5.972   8.708  -2.233
   48    H7   NAL   7           H7       NAL   7   3.927   9.026  -0.862
   49    H8   NAL   7           H8       NAL   7   2.920   7.111   0.352
   50    H91  NAL   7           H91      NAL   7   2.738   2.214   0.827
   51    H92  NAL   7           H92      NAL   7   4.205   1.246   0.688
   52    H10  NAL   7           H10      NAL   7   3.736   3.364   2.818
   53    HN1  NAL   7           HN1      NAL   7   6.153   2.784   2.105
   54    H    ILE   8           HN       ILE   8   4.420  -0.111   2.488
   55    HA   ILE   8           HA       ILE   8   2.467  -0.661   4.649
   56    HB   ILE   8           HB       ILE   8   1.554  -2.497   2.898
   57   HG12  ILE   8          HG12      ILE   8   1.332  -1.536   0.639
   58   HG13  ILE   8          HG11      ILE   8   2.295  -0.145   1.102
   59   HG21  ILE   8          HG21      ILE   8  -0.300  -1.006   2.353
   60   HG22  ILE   8          HG22      ILE   8   0.669   0.406   2.784
   61   HG23  ILE   8          HG23      ILE   8   0.180  -0.750   4.033
   62   HD11  ILE   8          HD11      ILE   8   3.351  -2.974   1.226
   63   HD12  ILE   8          HD12      ILE   8   4.273  -1.463   1.253
   64   HD13  ILE   8          HD13      ILE   8   3.459  -1.982  -0.219
   65    H    LYS   9           HN       LYS   9   3.561  -1.909   5.992
   66    HA   LYS   9           HA       LYS   9   5.704  -3.685   5.035
   67    HB2  LYS   9           HB2      LYS   9   4.917  -2.730   7.798
   68    HB3  LYS   9           HB1      LYS   9   6.159  -3.951   7.524
   69    HG2  LYS   9           HG2      LYS   9   7.538  -2.417   6.296
   70    HG3  LYS   9           HG1      LYS   9   6.248  -1.221   6.203
   71    HD2  LYS   9           HD2      LYS   9   7.858  -0.561   7.921
   72    HD3  LYS   9           HD1      LYS   9   6.320  -0.971   8.675
   73    HE2  LYS   9           HE2      LYS   9   7.148  -3.047   9.491
   74    HE3  LYS   9           HE1      LYS   9   8.530  -3.028   8.394
   75    HZ1  LYS   9           HZ1      LYS   9   8.075  -1.397  10.812
   76    HZ2  LYS   9           HZ2      LYS   9   9.182  -0.912   9.618
   77    HZ3  LYS   9           HZ3      LYS   9   9.399  -2.388  10.433
   78    H    GLY  10           HN       GLY  10   5.314  -5.809   4.739
   79    HA2  GLY  10           HA2      GLY  10   4.600  -7.987   5.435
   80    HA3  GLY  10           HA1      GLY  10   3.432  -7.253   6.527
   81    H    ARG  11           HN       ARG  11   2.611  -5.457   4.112
   82    HA   ARG  11           HA       ARG  11   1.090  -7.520   2.528
   83    HB2  ARG  11           HB2      ARG  11  -0.060  -4.973   3.716
   84    HB3  ARG  11           HB1      ARG  11  -0.925  -6.122   2.694
   85    HG2  ARG  11           HG2      ARG  11  -0.662  -7.875   4.369
   86    HG3  ARG  11           HG1      ARG  11   0.316  -6.805   5.375
   87    HD2  ARG  11           HD2      ARG  11  -2.555  -6.250   4.579
   88    HD3  ARG  11           HD1      ARG  11  -2.064  -6.936   6.128
   89    HE   ARG  11           HE       ARG  11  -0.564  -4.608   5.922
   90   HH11  ARG  11          HH21      ARG  11  -3.907  -5.455   5.724
   91   HH12  ARG  11          HH22      ARG  11  -4.463  -3.933   6.335
   92   HH21  ARG  11          HH11      ARG  11  -1.277  -2.622   6.721
   93   HH22  ARG  11          HH12      ARG  11  -2.975  -2.331   6.900
   94    H    THR  12           HN       THR  12   2.289  -7.156   0.630
   95    HA   THR  12           HA       THR  12   2.422  -4.398  -0.425
   96    HB   THR  12           HB       THR  12   3.897  -5.976  -2.182
   97    HG1  THR  12           HG1      THR  12   3.444  -7.530  -0.235
   98   HG21  THR  12          HG21      THR  12   4.616  -3.834  -1.205
   99   HG22  THR  12          HG22      THR  12   5.883  -5.051  -1.053
  100   HG23  THR  12          HG23      THR  12   4.896  -4.622   0.345
  101    H    PHE  13           HN       PHE  13   1.953  -4.112  -2.722
  102    HA   PHE  13           HA       PHE  13  -0.217  -5.954  -3.704
  103    HB2  PHE  13           HB2      PHE  13  -0.007  -2.940  -3.967
  104    HB3  PHE  13           HB1      PHE  13  -1.323  -3.946  -4.580
  105    HD1  PHE  13           HD2      PHE  13   0.434  -2.826  -1.478
  106    HD2  PHE  13           HD1      PHE  13  -3.069  -4.699  -3.120
  107    HE1  PHE  13           HE2      PHE  13  -0.653  -2.804   0.759
  108    HE2  PHE  13           HE1      PHE  13  -4.146  -4.645  -0.895
  109    HZ   PHE  13           HZ       PHE  13  -2.930  -3.683   1.035
  110    H    ARG  14           HN       ARG  14   0.052  -6.685  -5.756
  111    HA   ARG  14           HA       ARG  14   2.481  -6.157  -7.213
  112    HB2  ARG  14           HB2      ARG  14  -0.150  -7.454  -8.020
  113    HB3  ARG  14           HB1      ARG  14   1.207  -7.301  -9.134
  114    HG2  ARG  14           HG2      ARG  14   1.214  -9.508  -8.037
  115    HG3  ARG  14           HG1      ARG  14   2.643  -8.577  -7.594
  116    HD2  ARG  14           HD2      ARG  14   1.826  -8.145  -5.410
  117    HD3  ARG  14           HD1      ARG  14   0.161  -8.529  -5.857
  118    HE   ARG  14           HE       ARG  14   1.537 -10.905  -6.273
  119   HH11  ARG  14          HH21      ARG  14   1.131  -8.662  -3.677
  120   HH12  ARG  14          HH22      ARG  14   1.294  -9.864  -2.440
  121   HH21  ARG  14          HH11      ARG  14   1.747 -12.480  -4.669
  122   HH22  ARG  14          HH12      ARG  14   1.642 -12.023  -3.002
  123    H    ASN  15           HN       ASN  15  -0.848  -5.005  -7.451
  124    HA   ASN  15           HA       ASN  15  -0.016  -2.891  -9.418
  125    HB2  ASN  15           HB2      ASN  15  -2.721  -2.634  -9.322
  126    HB3  ASN  15           HB1      ASN  15  -1.918  -3.734 -10.446
  127   HD21  ASN  15          HD21      ASN  15  -3.785  -5.178 -10.415
  128   HD22  ASN  15          HD22      ASN  15  -4.094  -6.182  -9.083
  129    H    GLU  16           HN       GLU  16   0.181  -0.874  -8.645
  130    HA   GLU  16           HA       GLU  16  -0.218  -0.297  -5.878
  131    HB2  GLU  16           HB2      GLU  16   1.326   0.943  -7.482
  132    HB3  GLU  16           HB1      GLU  16  -0.107   1.724  -8.148
  133    HG2  GLU  16           HG2      GLU  16  -0.647   2.522  -5.803
  134    HG3  GLU  16           HG1      GLU  16   0.929   1.908  -5.308
  135    H    LYS  17           HN       LYS  17  -2.358  -0.195  -8.633
  136    HA   LYS  17           HA       LYS  17  -4.285   1.606  -7.675
  137    HB2  LYS  17           HB2      LYS  17  -4.136  -0.479  -9.738
  138    HB3  LYS  17           HB1      LYS  17  -5.729  -0.487  -8.992
  139    HG2  LYS  17           HG2      LYS  17  -5.859   1.021 -10.846
  140    HG3  LYS  17           HG1      LYS  17  -5.822   2.022  -9.394
  141    HD2  LYS  17           HD2      LYS  17  -3.260   2.152  -9.754
  142    HD3  LYS  17           HD1      LYS  17  -3.567   1.483 -11.356
  143    HE2  LYS  17           HE2      LYS  17  -5.198   3.376 -11.736
  144    HE3  LYS  17           HE1      LYS  17  -4.635   4.075 -10.219
  145    HZ1  LYS  17           HZ1      LYS  17  -2.768   3.341 -12.390
  146    HZ2  LYS  17           HZ2      LYS  17  -2.495   4.371 -11.067
  147    HZ3  LYS  17           HZ3      LYS  17  -3.517   4.862 -12.332
  148    H    GLU  18           HN       GLU  18  -4.004  -1.905  -7.133
  149    HA   GLU  18           HA       GLU  18  -6.268  -2.146  -5.469
  150    HB2  GLU  18           HB2      GLU  18  -3.692  -3.724  -5.497
  151    HB3  GLU  18           HB1      GLU  18  -5.133  -4.197  -4.592
  152    HG2  GLU  18           HG2      GLU  18  -5.123  -3.711  -7.587
  153    HG3  GLU  18           HG1      GLU  18  -4.901  -5.300  -6.857
  154    H    LEU  19           HN       LEU  19  -3.008  -1.029  -4.836
  155    HA   LEU  19           HA       LEU  19  -3.324  -1.035  -1.942
  156    HB2  LEU  19           HB2      LEU  19  -1.077  -1.107  -2.714
  157    HB3  LEU  19           HB1      LEU  19  -1.327   0.212  -3.830
  158    HG   LEU  19           HG       LEU  19  -1.545   1.759  -1.871
  159   HD11  LEU  19          HD11      LEU  19  -0.849   0.999   0.341
  160   HD12  LEU  19          HD12      LEU  19  -0.656  -0.632  -0.275
  161   HD13  LEU  19          HD13      LEU  19  -2.256   0.079  -0.178
  162   HD21  LEU  19          HD21      LEU  19   0.860   1.689  -1.251
  163   HD22  LEU  19          HD22      LEU  19   0.598   1.532  -2.985
  164   HD23  LEU  19          HD23      LEU  19   0.975   0.107  -2.022
  165    H    ARG  20           HN       ARG  20  -3.858   1.257  -4.575
  166    HA   ARG  20           HA       ARG  20  -4.331   3.589  -2.989
  167    HB2  ARG  20           HB2      ARG  20  -4.059   3.579  -5.485
  168    HB3  ARG  20           HB1      ARG  20  -5.651   2.834  -5.613
  169    HG2  ARG  20           HG2      ARG  20  -6.670   4.779  -4.501
  170    HG3  ARG  20           HG1      ARG  20  -5.079   5.522  -4.319
  171    HD2  ARG  20           HD2      ARG  20  -4.816   5.528  -6.783
  172    HD3  ARG  20           HD1      ARG  20  -6.429   4.832  -6.945
  173    HE   ARG  20           HE       ARG  20  -6.836   7.119  -5.422
  174   HH11  ARG  20          HH21      ARG  20  -5.359   6.358  -8.450
  175   HH12  ARG  20          HH22      ARG  20  -5.723   7.894  -9.162
  176   HH21  ARG  20          HH11      ARG  20  -7.317   9.125  -6.340
  177   HH22  ARG  20          HH12      ARG  20  -6.831   9.458  -7.969
  178    H    ASP  21           HN       ASP  21  -6.325   0.919  -3.993
  179    HA   ASP  21           HA       ASP  21  -8.778   1.940  -2.911
  180    HB2  ASP  21           HB2      ASP  21  -7.960  -0.852  -3.744
  181    HB3  ASP  21           HB1      ASP  21  -9.595  -0.410  -3.254
  182    H    PHE  22           HN       PHE  22  -6.526  -0.621  -1.841
  183    HA   PHE  22           HA       PHE  22  -7.841  -1.087   0.619
  184    HB2  PHE  22           HB2      PHE  22  -5.109  -1.644  -0.472
  185    HB3  PHE  22           HB1      PHE  22  -5.317  -1.802   1.263
  186    HD1  PHE  22           HD2      PHE  22  -7.681  -2.570  -1.548
  187    HD2  PHE  22           HD1      PHE  22  -5.340  -4.137   1.703
  188    HE1  PHE  22           HE2      PHE  22  -8.685  -4.800  -1.892
  189    HE2  PHE  22           HE1      PHE  22  -6.350  -6.359   1.351
  190    HZ   PHE  22           HZ       PHE  22  -8.024  -6.701  -0.445
  191    H    ILE  23           HN       ILE  23  -5.721   1.414  -0.449
  192    HA   ILE  23           HA       ILE  23  -4.876   2.365   2.130
  193    HB   ILE  23           HB       ILE  23  -4.940   3.390  -0.675
  194   HG12  ILE  23          HG12      ILE  23  -2.853   3.561   1.536
  195   HG13  ILE  23          HG11      ILE  23  -2.959   2.266   0.354
  196   HG21  ILE  23          HG21      ILE  23  -4.886   5.261   1.693
  197   HG22  ILE  23          HG22      ILE  23  -5.940   5.326   0.277
  198   HG23  ILE  23          HG23      ILE  23  -4.235   5.711   0.117
  199   HD11  ILE  23          HD11      ILE  23  -1.247   3.900  -0.296
  200   HD12  ILE  23          HD12      ILE  23  -2.454   5.184  -0.275
  201   HD13  ILE  23          HD13      ILE  23  -2.567   3.888  -1.457
  202    H    GLU  24           HN       GLU  24  -7.627   2.928   0.069
  203    HA   GLU  24           HA       GLU  24  -8.838   4.965   1.652
  204    HB2  GLU  24           HB2      GLU  24 -10.115   2.939  -0.203
  205    HB3  GLU  24           HB1      GLU  24 -11.006   4.243   0.568
  206    HG2  GLU  24           HG2      GLU  24  -9.487   5.894  -0.488
  207    HG3  GLU  24           HG1      GLU  24  -8.644   4.578  -1.306
  208    H    LYS  25           HN       LYS  25  -8.647   1.506   1.988
  209    HA   LYS  25           HA       LYS  25 -10.793   1.274   3.947
  210    HB2  LYS  25           HB2      LYS  25  -9.918  -0.633   2.533
  211    HB3  LYS  25           HB1      LYS  25  -8.454  -0.613   3.513
  212    HG2  LYS  25           HG2      LYS  25  -9.833  -1.005   5.548
  213    HG3  LYS  25           HG1      LYS  25 -11.274  -1.096   4.532
  214    HD2  LYS  25           HD2      LYS  25 -10.372  -3.022   3.348
  215    HD3  LYS  25           HD1      LYS  25  -8.852  -2.894   4.231
  216    HE2  LYS  25           HE2      LYS  25 -10.462  -4.640   5.127
  217    HE3  LYS  25           HE1      LYS  25  -9.919  -3.453   6.312
  218    HZ1  LYS  25           HZ1      LYS  25 -11.953  -2.546   6.468
  219    HZ2  LYS  25           HZ2      LYS  25 -12.477  -4.051   5.881
  220    HZ3  LYS  25           HZ3      LYS  25 -12.299  -2.738   4.818
  221    H    PHE  26           HN       PHE  26  -7.202   1.401   4.178
  222    HA   PHE  26           HA       PHE  26  -7.119   1.270   7.038
  223    HB2  PHE  26           HB2      PHE  26  -5.132   2.902   5.426
  224    HB3  PHE  26           HB1      PHE  26  -4.849   1.981   6.897
  225    HD1  PHE  26           HD1      PHE  26  -6.277  -0.629   6.054
  226    HD2  PHE  26           HD2      PHE  26  -3.487   1.928   3.992
  227    HE1  PHE  26           HE1      PHE  26  -5.508  -2.546   4.705
  228    HE2  PHE  26           HE2      PHE  26  -2.731  -0.010   2.634
  229    HZ   PHE  26           HZ       PHE  26  -3.738  -2.243   3.001
  230   H11A  DNS  27          H22       DNS  27   4.659   6.608   2.083
  231    H12  DNS  27           H23      DNS  27   5.519   5.105   2.434
  232    H13  DNS  27           H24      DNS  27   5.815   6.550   3.425
  233    H21  DNS  27           H21      DNS  27   3.776   4.718   5.723
  234    H22  DNS  27           H19      DNS  27   5.350   5.465   5.393
  235    H23  DNS  27           H20      DNS  27   4.947   3.911   4.657
  236    H4   DNS  27           H14      DNS  27   4.835   7.757   5.160
  237    H5   DNS  27           H15      DNS  27   3.351   9.671   5.811
  238    H6   DNS  27           H16      DNS  27   0.920   9.640   5.203
  239    HZ   DNS  27           HZ1      DNS  27  -2.525   7.889   2.905
  240    HE3  DNS  27           HE1      DNS  27  -3.044   6.576   4.733
  241    HE2  DNS  27           HE2      DNS  27  -3.331   8.000   5.716
  242    HD3  DNS  27           HD1      DNS  27  -5.345   8.511   4.407
  243    HD2  DNS  27           HD2      DNS  27  -5.059   7.087   3.404
  244    HG3  DNS  27           HG1      DNS  27  -5.294   5.624   5.334
  245    HG2  DNS  27           HG2      DNS  27  -5.428   7.011   6.416
  246    HB3  DNS  27           HB1      DNS  27  -7.520   7.682   5.381
  247    HB2  DNS  27           HB2      DNS  27  -7.366   6.421   4.158
  248    HA   DNS  27           HA       DNS  27  -7.578   5.922   7.145
  249    H    DNS  27           HN       DNS  27  -7.147   4.097   4.849
  250    H9   DNS  27           H9       DNS  27  -1.938   6.547   2.871
  251    H10  DNS  27           H10      DNS  27  -0.454   4.655   2.221
  252    H11  DNS  27           H11      DNS  27   1.972   4.683   2.831
  253    H    GLY  28           HN       GLY  28  -9.321   7.774   6.180
  254    HA2  GLY  28           HA2      GLY  28 -11.666   6.801   4.896
  255    HA3  GLY  28           HA1      GLY  28 -11.874   6.602   6.637
  256    H    ARG  29           HN       ARG  29 -10.991   8.739   7.842
  257    HA   ARG  29           HA       ARG  29 -12.792  10.850   7.070
  258    HB2  ARG  29           HB2      ARG  29 -12.054  10.409   9.421
  259    HB3  ARG  29           HB1      ARG  29 -10.440  10.980   8.987
  260    HG2  ARG  29           HG2      ARG  29 -11.310  13.172   8.433
  261    HG3  ARG  29           HG1      ARG  29 -12.961  12.626   8.694
  262    HD2  ARG  29           HD2      ARG  29 -10.794  12.650  10.801
  263    HD3  ARG  29           HD1      ARG  29 -12.030  13.892  10.651
  264    HE   ARG  29           HE       ARG  29 -12.273  11.302  11.931
  265   HH11  ARG  29          HH21      ARG  29 -14.040  13.511   9.947
  266   HH12  ARG  29          HH22      ARG  29 -15.576  12.804  10.324
  267   HH21  ARG  29          HH11      ARG  29 -14.255  10.392  12.426
  268   HH22  ARG  29          HH12      ARG  29 -15.697  11.044  11.722
  Start of MODEL    8
    1    H1   GLY   1           HT1      GLY   1   7.976   5.276  -8.588
    2    H2   GLY   1           HT2      GLY   1   7.737   5.233 -10.269
    3    H3   GLY   1           HT3      GLY   1   9.058   6.080  -9.618
    4    HA2  GLY   1           HA2      GLY   1   8.811   3.288 -10.402
    5    HA3  GLY   1           HA1      GLY   1  10.234   4.193  -9.805
    6    H    GLN   2           HN       GLN   2   9.455   5.024  -7.304
    7    HA   GLN   2           HA       GLN   2  11.427   3.266  -6.166
    8    HB2  GLN   2           HB2      GLN   2   9.415   5.131  -4.867
    9    HB3  GLN   2           HB1      GLN   2  10.685   4.289  -3.981
   10    HG2  GLN   2           HG2      GLN   2  11.493   6.508  -4.502
   11    HG3  GLN   2           HG1      GLN   2  12.372   5.363  -5.514
   12   HE21  GLN   2          HE21      GLN   2   9.262   7.207  -5.707
   13   HE22  GLN   2          HE22      GLN   2   9.471   7.663  -7.328
   14    H    GLN   3           HN       GLN   3  11.142   1.220  -5.449
   15    HA   GLN   3           HA       GLN   3   8.543  -0.045  -5.456
   16    HB2  GLN   3           HB2      GLN   3  11.193  -0.969  -4.301
   17    HB3  GLN   3           HB1      GLN   3   9.765  -1.987  -4.491
   18    HG2  GLN   3           HG2      GLN   3   9.795  -1.538  -6.935
   19    HG3  GLN   3           HG1      GLN   3  11.265  -0.587  -6.724
   20   HE21  GLN   3          HE21      GLN   3  13.261  -1.725  -6.378
   21   HE22  GLN   3          HE22      GLN   3  13.377  -3.416  -6.464
   22    H    TYR   4           HN       TYR   4   7.297  -0.707  -3.647
   23    HA   TYR   4           HA       TYR   4   7.304   1.058  -1.432
   24    HB2  TYR   4           HB2      TYR   4   5.782  -1.186  -0.617
   25    HB3  TYR   4           HB1      TYR   4   5.153   0.256  -1.402
   26    HD1  TYR   4           HD1      TYR   4   7.160  -2.750  -2.477
   27    HD2  TYR   4           HD2      TYR   4   3.725  -0.255  -3.239
   28    HE1  TYR   4           HE1      TYR   4   6.602  -4.112  -4.466
   29    HE2  TYR   4           HE2      TYR   4   3.184  -1.630  -5.225
   30    HH   TYR   4           HH       TYR   4   4.261  -3.126  -6.778
   31    H    THR   5           HN       THR   5   8.668   1.034   0.305
   32    HA   THR   5           HA       THR   5   9.854  -1.597   1.203
   33    HB   THR   5           HB       THR   5  11.805  -0.303   1.952
   34    HG1  THR   5           HG1      THR   5  11.070   1.939   0.542
   35   HG21  THR   5          HG21      THR   5  11.130   0.365  -0.915
   36   HG22  THR   5          HG22      THR   5  11.670  -1.225  -0.386
   37   HG23  THR   5          HG23      THR   5  12.738   0.169  -0.226
   38    H    ALA   6           HN       ALA   6   8.271   1.384   2.154
   39    HA   ALA   6           HA       ALA   6   8.239   0.481   5.037
   40    HB1  ALA   6           HB1      ALA   6   9.508   2.614   4.592
   41    HB2  ALA   6           HB2      ALA   6   8.112   2.833   5.647
   42    HB3  ALA   6           HB3      ALA   6   8.018   3.315   3.949
   43    H1   NAL   7           H1       NAL   7   3.630   4.836   1.820
   44    H3   NAL   7           H3       NAL   7   6.573   2.161   0.208
   45    H4   NAL   7           H4       NAL   7   7.860   4.066  -0.715
   46    H5   NAL   7           H5       NAL   7   8.136   6.613  -1.028
   47    H6   NAL   7           H6       NAL   7   7.295   8.912  -0.646
   48    H7   NAL   7           H7       NAL   7   5.188   9.286   0.614
   49    H8   NAL   7           H8       NAL   7   3.900   7.360   1.498
   50    H91  NAL   7           H91      NAL   7   3.198   2.489   1.386
   51    H92  NAL   7           H92      NAL   7   4.566   1.388   1.194
   52    H10  NAL   7           H10      NAL   7   4.177   3.298   3.529
   53    HN1  NAL   7           HN1      NAL   7   6.570   2.664   2.861
   54    H    ILE   8           HN       ILE   8   4.587  -0.151   2.779
   55    HA   ILE   8           HA       ILE   8   2.537  -0.802   4.830
   56    HB   ILE   8           HB       ILE   8   1.541  -2.340   2.840
   57   HG12  ILE   8          HG12      ILE   8   1.439  -1.068   0.723
   58   HG13  ILE   8          HG11      ILE   8   2.508   0.163   1.382
   59   HG21  ILE   8          HG21      ILE   8   0.261  -0.659   4.164
   60   HG22  ILE   8          HG22      ILE   8  -0.178  -0.639   2.455
   61   HG23  ILE   8          HG23      ILE   8   0.883   0.617   3.104
   62   HD11  ILE   8          HD11      ILE   8   3.540  -1.605  -0.149
   63   HD12  ILE   8          HD12      ILE   8   3.328  -2.731   1.176
   64   HD13  ILE   8          HD13      ILE   8   4.365  -1.321   1.382
   65    H    LYS   9           HN       LYS   9   3.705  -2.133   6.062
   66    HA   LYS   9           HA       LYS   9   5.685  -3.944   4.916
   67    HB2  LYS   9           HB2      LYS   9   6.112  -2.619   7.007
   68    HB3  LYS   9           HB1      LYS   9   4.891  -3.606   7.813
   69    HG2  LYS   9           HG2      LYS   9   6.181  -5.631   7.389
   70    HG3  LYS   9           HG1      LYS   9   7.352  -4.724   6.440
   71    HD2  LYS   9           HD2      LYS   9   8.350  -4.989   8.597
   72    HD3  LYS   9           HD1      LYS   9   7.794  -3.320   8.530
   73    HE2  LYS   9           HE2      LYS   9   5.914  -3.788   9.932
   74    HE3  LYS   9           HE1      LYS   9   6.101  -5.530   9.738
   75    HZ1  LYS   9           HZ1      LYS   9   8.295  -5.296  10.842
   76    HZ2  LYS   9           HZ2      LYS   9   6.972  -4.929  11.842
   77    HZ3  LYS   9           HZ3      LYS   9   7.912  -3.678  11.178
   78    H    GLY  10           HN       GLY  10   5.641  -6.209   5.147
   79    HA2  GLY  10           HA2      GLY  10   4.711  -8.343   5.391
   80    HA3  GLY  10           HA1      GLY  10   3.535  -7.635   6.492
   81    H    ARG  11           HN       ARG  11   2.812  -5.690   4.187
   82    HA   ARG  11           HA       ARG  11   1.279  -7.603   2.442
   83    HB2  ARG  11           HB2      ARG  11   0.159  -5.115   3.773
   84    HB3  ARG  11           HB1      ARG  11  -0.709  -6.184   2.671
   85    HG2  ARG  11           HG2      ARG  11  -0.321  -8.068   4.269
   86    HG3  ARG  11           HG1      ARG  11   0.405  -6.924   5.393
   87    HD2  ARG  11           HD2      ARG  11  -1.926  -5.620   4.966
   88    HD3  ARG  11           HD1      ARG  11  -2.486  -7.261   4.649
   89    HE   ARG  11           HE       ARG  11  -2.039  -6.135   7.213
   90   HH11  ARG  11          HH21      ARG  11  -1.222  -8.984   5.440
   91   HH12  ARG  11          HH22      ARG  11  -0.811  -9.893   6.851
   92   HH21  ARG  11          HH11      ARG  11  -1.531  -7.319   9.049
   93   HH22  ARG  11          HH12      ARG  11  -0.995  -8.957   8.890
   94    H    THR  12           HN       THR  12   2.498  -7.150   0.585
   95    HA   THR  12           HA       THR  12   2.669  -4.337  -0.298
   96    HB   THR  12           HB       THR  12   4.235  -5.776  -2.083
   97    HG1  THR  12           HG1      THR  12   5.486  -6.917  -0.220
   98   HG21  THR  12          HG21      THR  12   6.162  -4.874  -0.847
   99   HG22  THR  12          HG22      THR  12   5.135  -4.567   0.553
  100   HG23  THR  12          HG23      THR  12   4.874  -3.669  -0.941
  101    H    PHE  13           HN       PHE  13   2.164  -3.840  -2.468
  102    HA   PHE  13           HA       PHE  13  -0.040  -5.554  -3.558
  103    HB2  PHE  13           HB2      PHE  13   0.560  -2.600  -3.832
  104    HB3  PHE  13           HB1      PHE  13  -0.803  -3.426  -4.587
  105    HD1  PHE  13           HD1      PHE  13   0.785  -2.698  -1.267
  106    HD2  PHE  13           HD2      PHE  13  -2.802  -3.780  -3.354
  107    HE1  PHE  13           HE1      PHE  13  -0.510  -2.463   0.826
  108    HE2  PHE  13           HE2      PHE  13  -4.093  -3.545  -1.265
  109    HZ   PHE  13           HZ       PHE  13  -2.947  -2.873   0.821
  110    H    ARG  14           HN       ARG  14   0.169  -6.370  -5.590
  111    HA   ARG  14           HA       ARG  14   2.663  -5.924  -7.087
  112    HB2  ARG  14           HB2      ARG  14   1.507  -8.151  -7.111
  113    HB3  ARG  14           HB1      ARG  14   0.138  -7.407  -7.937
  114    HG2  ARG  14           HG2      ARG  14   1.546  -6.821  -9.839
  115    HG3  ARG  14           HG1      ARG  14   2.979  -7.423  -9.005
  116    HD2  ARG  14           HD2      ARG  14   1.917  -9.686  -8.915
  117    HD3  ARG  14           HD1      ARG  14   0.582  -9.058  -9.881
  118    HE   ARG  14           HE       ARG  14   2.837  -8.425 -11.370
  119   HH11  ARG  14          HH21      ARG  14   1.512 -11.275  -9.938
  120   HH12  ARG  14          HH22      ARG  14   2.158 -12.338 -11.142
  121   HH21  ARG  14          HH11      ARG  14   3.685  -9.803 -12.946
  122   HH22  ARG  14          HH12      ARG  14   3.387 -11.506 -12.844
  123    H    ASN  15           HN       ASN  15  -0.773  -5.143  -7.378
  124    HA   ASN  15           HA       ASN  15  -0.181  -3.150  -9.544
  125    HB2  ASN  15           HB2      ASN  15  -2.788  -3.126  -9.638
  126    HB3  ASN  15           HB1      ASN  15  -1.939  -4.496 -10.362
  127   HD21  ASN  15          HD21      ASN  15  -4.247  -5.436  -9.873
  128   HD22  ASN  15          HD22      ASN  15  -4.431  -6.202  -8.369
  129    H    GLU  16           HN       GLU  16  -0.204  -1.052  -8.959
  130    HA   GLU  16           HA       GLU  16  -0.731  -0.283  -6.259
  131    HB2  GLU  16           HB2      GLU  16  -0.573   1.385  -8.791
  132    HB3  GLU  16           HB1      GLU  16  -0.664   2.068  -7.167
  133    HG2  GLU  16           HG2      GLU  16   1.666   2.006  -7.797
  134    HG3  GLU  16           HG1      GLU  16   1.411   0.755  -6.582
  135    H    LYS  17           HN       LYS  17  -2.737  -0.795  -8.992
  136    HA   LYS  17           HA       LYS  17  -4.927   0.864  -8.482
  137    HB2  LYS  17           HB2      LYS  17  -4.589  -0.724 -10.450
  138    HB3  LYS  17           HB1      LYS  17  -5.140  -2.020  -9.397
  139    HG2  LYS  17           HG2      LYS  17  -7.250  -0.762  -8.988
  140    HG3  LYS  17           HG1      LYS  17  -6.718   0.475 -10.121
  141    HD2  LYS  17           HD2      LYS  17  -6.888  -2.435 -10.977
  142    HD3  LYS  17           HD1      LYS  17  -8.318  -1.411 -10.997
  143    HE2  LYS  17           HE2      LYS  17  -7.059   0.217 -12.453
  144    HE3  LYS  17           HE1      LYS  17  -5.743  -0.954 -12.540
  145    HZ1  LYS  17           HZ1      LYS  17  -6.833  -2.068 -14.085
  146    HZ2  LYS  17           HZ2      LYS  17  -8.035  -0.867 -14.092
  147    HZ3  LYS  17           HZ3      LYS  17  -8.195  -2.229 -13.089
  148    H    GLU  18           HN       GLU  18  -4.266  -2.401  -7.199
  149    HA   GLU  18           HA       GLU  18  -6.589  -2.441  -5.523
  150    HB2  GLU  18           HB2      GLU  18  -4.029  -4.049  -5.557
  151    HB3  GLU  18           HB1      GLU  18  -5.294  -4.340  -4.361
  152    HG2  GLU  18           HG2      GLU  18  -6.905  -4.849  -6.096
  153    HG3  GLU  18           HG1      GLU  18  -5.769  -4.369  -7.356
  154    H    LEU  19           HN       LEU  19  -3.329  -1.206  -5.115
  155    HA   LEU  19           HA       LEU  19  -3.487  -0.891  -2.246
  156    HB2  LEU  19           HB2      LEU  19  -1.325  -0.878  -3.335
  157    HB3  LEU  19           HB1      LEU  19  -1.808   0.455  -4.359
  158    HG   LEU  19           HG       LEU  19  -2.038   1.780  -2.145
  159   HD11  LEU  19          HD11      LEU  19  -1.803  -0.285  -0.692
  160   HD12  LEU  19          HD12      LEU  19  -0.787   1.079  -0.256
  161   HD13  LEU  19          HD13      LEU  19  -0.099  -0.281  -1.136
  162   HD21  LEU  19          HD21      LEU  19  -0.296   2.250  -3.779
  163   HD22  LEU  19          HD22      LEU  19   0.666   0.912  -3.152
  164   HD23  LEU  19          HD23      LEU  19   0.376   2.334  -2.150
  165    H    ARG  20           HN       ARG  20  -4.385   1.094  -5.037
  166    HA   ARG  20           HA       ARG  20  -4.960   3.523  -3.656
  167    HB2  ARG  20           HB2      ARG  20  -4.888   3.274  -6.148
  168    HB3  ARG  20           HB1      ARG  20  -6.406   2.384  -6.063
  169    HG2  ARG  20           HG2      ARG  20  -7.535   4.329  -5.098
  170    HG3  ARG  20           HG1      ARG  20  -6.014   5.223  -5.065
  171    HD2  ARG  20           HD2      ARG  20  -5.867   5.032  -7.531
  172    HD3  ARG  20           HD1      ARG  20  -7.416   4.188  -7.546
  173    HE   ARG  20           HE       ARG  20  -7.955   6.557  -6.199
  174   HH11  ARG  20          HH21      ARG  20  -6.560   5.664  -9.230
  175   HH12  ARG  20          HH22      ARG  20  -7.095   7.095 -10.046
  176   HH21  ARG  20          HH11      ARG  20  -8.659   8.425  -7.251
  177   HH22  ARG  20          HH12      ARG  20  -8.283   8.657  -8.926
  178    H    ASP  21           HN       ASP  21  -6.818   0.630  -4.217
  179    HA   ASP  21           HA       ASP  21  -9.244   1.593  -3.022
  180    HB2  ASP  21           HB2      ASP  21  -8.307  -1.208  -3.684
  181    HB3  ASP  21           HB1      ASP  21  -9.923  -0.822  -3.092
  182    H    PHE  22           HN       PHE  22  -6.748  -0.722  -1.940
  183    HA   PHE  22           HA       PHE  22  -7.817  -1.069   0.648
  184    HB2  PHE  22           HB2      PHE  22  -5.131  -1.486  -0.618
  185    HB3  PHE  22           HB1      PHE  22  -5.202  -1.524   1.137
  186    HD1  PHE  22           HD2      PHE  22  -7.719  -2.699  -1.387
  187    HD2  PHE  22           HD1      PHE  22  -4.962  -3.818   1.720
  188    HE1  PHE  22           HE2      PHE  22  -8.543  -5.024  -1.484
  189    HE2  PHE  22           HE1      PHE  22  -5.792  -6.137   1.613
  190    HZ   PHE  22           HZ       PHE  22  -7.585  -6.750   0.014
  191    H    ILE  23           HN       ILE  23  -6.008   1.488  -0.779
  192    HA   ILE  23           HA       ILE  23  -5.086   2.729   1.655
  193    HB   ILE  23           HB       ILE  23  -5.391   3.484  -1.226
  194   HG12  ILE  23          HG12      ILE  23  -3.145   3.951   0.776
  195   HG13  ILE  23          HG11      ILE  23  -3.296   2.508  -0.220
  196   HG21  ILE  23          HG21      ILE  23  -5.254   5.533   0.987
  197   HG22  ILE  23          HG22      ILE  23  -6.388   5.459  -0.366
  198   HG23  ILE  23          HG23      ILE  23  -4.710   5.888  -0.652
  199   HD11  ILE  23          HD11      ILE  23  -3.119   3.887  -2.247
  200   HD12  ILE  23          HD12      ILE  23  -1.720   4.126  -1.214
  201   HD13  ILE  23          HD13      ILE  23  -2.998   5.339  -1.265
  202    H    GLU  24           HN       GLU  24  -7.990   2.884  -0.276
  203    HA   GLU  24           HA       GLU  24  -9.236   5.025   1.118
  204    HB2  GLU  24           HB2      GLU  24 -10.497   2.678  -0.324
  205    HB3  GLU  24           HB1      GLU  24 -11.426   4.009   0.347
  206    HG2  GLU  24           HG2      GLU  24 -10.201   5.605  -1.061
  207    HG3  GLU  24           HG1      GLU  24  -9.231   4.293  -1.727
  208    H    LYS  25           HN       LYS  25  -8.795   1.658   1.898
  209    HA   LYS  25           HA       LYS  25 -10.726   1.639   4.099
  210    HB2  LYS  25           HB2      LYS  25  -8.437  -0.237   3.431
  211    HB3  LYS  25           HB1      LYS  25  -9.613  -0.522   4.705
  212    HG2  LYS  25           HG2      LYS  25 -10.543  -0.024   1.859
  213    HG3  LYS  25           HG1      LYS  25 -10.005  -1.627   2.347
  214    HD2  LYS  25           HD2      LYS  25 -11.686  -1.572   4.213
  215    HD3  LYS  25           HD1      LYS  25 -12.284  -0.041   3.579
  216    HE2  LYS  25           HE2      LYS  25 -12.823  -1.111   1.440
  217    HE3  LYS  25           HE1      LYS  25 -12.184  -2.645   2.033
  218    HZ1  LYS  25           HZ1      LYS  25 -14.720  -2.098   2.192
  219    HZ2  LYS  25           HZ2      LYS  25 -14.248  -1.280   3.604
  220    HZ3  LYS  25           HZ3      LYS  25 -13.937  -2.942   3.439
  221    H    PHE  26           HN       PHE  26  -7.139   1.856   3.899
  222    HA   PHE  26           HA       PHE  26  -6.724   2.074   6.720
  223    HB2  PHE  26           HB2      PHE  26  -5.023   3.552   4.687
  224    HB3  PHE  26           HB1      PHE  26  -4.525   2.878   6.232
  225    HD1  PHE  26           HD1      PHE  26  -5.943   0.104   5.879
  226    HD2  PHE  26           HD2      PHE  26  -3.412   2.447   3.296
  227    HE1  PHE  26           HE1      PHE  26  -5.202  -1.949   4.735
  228    HE2  PHE  26           HE2      PHE  26  -2.684   0.370   2.141
  229    HZ   PHE  26           HZ       PHE  26  -3.575  -1.822   2.876
  230   H11A  DNS  27          H22       DNS  27   0.914   4.745   0.056
  231    H12  DNS  27           H23      DNS  27   2.570   4.534  -0.522
  232    H13  DNS  27           H24      DNS  27   1.275   4.942  -1.669
  233    H21  DNS  27           H21      DNS  27   2.558   6.916  -2.421
  234    H22  DNS  27           H19      DNS  27   3.846   6.441  -1.299
  235    H23  DNS  27           H20      DNS  27   3.158   8.065  -1.206
  236    H4   DNS  27           H14      DNS  27   0.372   6.853  -2.650
  237    H5   DNS  27           H15      DNS  27  -1.737   8.204  -2.699
  238    H6   DNS  27           H16      DNS  27  -2.541   9.357  -0.628
  239    HZ   DNS  27           HZ1      DNS  27  -3.036   8.247   0.886
  240    HE3  DNS  27           HE1      DNS  27  -3.651   7.084   2.638
  241    HE2  DNS  27           HE2      DNS  27  -3.479   8.555   3.571
  242    HD3  DNS  27           HD1      DNS  27  -5.788   9.182   3.062
  243    HD2  DNS  27           HD2      DNS  27  -5.969   7.750   2.048
  244    HG3  DNS  27           HG1      DNS  27  -5.424   6.343   4.066
  245    HG2  DNS  27           HG2      DNS  27  -5.460   7.814   5.040
  246    HB3  DNS  27           HB1      DNS  27  -7.790   8.210   4.396
  247    HB2  DNS  27           HB2      DNS  27  -7.766   6.788   3.353
  248    HA   DNS  27           HA       DNS  27  -7.254   6.720   6.342
  249    H    DNS  27           HN       DNS  27  -7.140   4.642   4.264
  250    H9   DNS  27           H9       DNS  27  -0.914   9.691   3.902
  251    H10  DNS  27           H10      DNS  27   1.188   8.345   3.934
  252    H11  DNS  27           H11      DNS  27   1.985   7.199   1.860
  253    H    GLY  28           HN       GLY  28  -9.071   6.955   7.540
  254    HA2  GLY  28           HA2      GLY  28 -11.648   7.365   6.327
  255    HA3  GLY  28           HA1      GLY  28 -11.570   5.763   7.062
  256    H    ARG  29           HN       ARG  29 -10.562   5.845   9.384
  257    HA   ARG  29           HA       ARG  29 -12.199   7.709  10.954
  258    HB2  ARG  29           HB2      ARG  29 -10.184   5.600  11.792
  259    HB3  ARG  29           HB1      ARG  29 -11.235   6.488  12.895
  260    HG2  ARG  29           HG2      ARG  29 -13.215   5.616  11.651
  261    HG3  ARG  29           HG1      ARG  29 -12.126   4.649  10.655
  262    HD2  ARG  29           HD2      ARG  29 -13.006   3.269  12.468
  263    HD3  ARG  29           HD1      ARG  29 -11.279   3.535  12.715
  264    HE   ARG  29           HE       ARG  29 -12.477   5.590  14.143
  265   HH11  ARG  29          HH21      ARG  29 -12.748   2.149  14.021
  266   HH12  ARG  29          HH22      ARG  29 -13.177   1.994  15.692
  267   HH21  ARG  29          HH11      ARG  29 -13.035   5.400  16.322
  268   HH22  ARG  29          HH12      ARG  29 -13.340   3.832  16.993
  Start of MODEL    9
    1    H1   GLY   1           HT1      GLY   1  10.921   2.795 -10.413
    2    H2   GLY   1           HT2      GLY   1  12.278   3.098  -9.437
    3    H3   GLY   1           HT3      GLY   1  10.765   2.809  -8.723
    4    HA2  GLY   1           HA2      GLY   1  11.110   0.573 -10.356
    5    HA3  GLY   1           HA1      GLY   1  12.656   0.897  -9.513
    6    H    GLN   2           HN       GLN   2  12.277   2.056  -7.218
    7    HA   GLN   2           HA       GLN   2  12.878  -0.395  -5.833
    8    HB2  GLN   2           HB2      GLN   2  12.805   1.024  -3.782
    9    HB3  GLN   2           HB1      GLN   2  13.796   1.733  -5.056
   10    HG2  GLN   2           HG2      GLN   2  11.815   3.118  -5.744
   11    HG3  GLN   2           HG1      GLN   2  10.948   2.493  -4.342
   12   HE21  GLN   2          HE21      GLN   2  13.927   4.302  -5.226
   13   HE22  GLN   2          HE22      GLN   2  14.026   5.151  -3.759
   14    H    GLN   3           HN       GLN   3  11.552  -1.703  -4.585
   15    HA   GLN   3           HA       GLN   3   8.694  -1.535  -5.045
   16    HB2  GLN   3           HB2      GLN   3   8.570  -3.476  -3.484
   17    HB3  GLN   3           HB1      GLN   3   9.721  -3.717  -4.798
   18    HG2  GLN   3           HG2      GLN   3  11.564  -3.008  -3.283
   19    HG3  GLN   3           HG1      GLN   3  10.400  -2.859  -1.970
   20   HE21  GLN   3          HE21      GLN   3  12.577  -5.018  -3.387
   21   HE22  GLN   3          HE22      GLN   3  11.942  -6.464  -2.764
   22    H    TYR   4           HN       TYR   4   7.081  -1.088  -3.537
   23    HA   TYR   4           HA       TYR   4   7.573   1.040  -1.743
   24    HB2  TYR   4           HB2      TYR   4   5.050  -0.405  -1.221
   25    HB3  TYR   4           HB1      TYR   4   5.273   1.229  -1.796
   26    HD1  TYR   4           HD2      TYR   4   6.510   1.189  -4.292
   27    HD2  TYR   4           HD1      TYR   4   3.750  -1.715  -2.723
   28    HE1  TYR   4           HE2      TYR   4   5.911   0.507  -6.594
   29    HE2  TYR   4           HE1      TYR   4   3.162  -2.385  -5.028
   30    HH   TYR   4           HH       TYR   4   4.102  -2.318  -7.266
   31    H    THR   5           HN       THR   5   8.455   0.927   0.301
   32    HA   THR   5           HA       THR   5   8.190  -1.649   1.866
   33    HB   THR   5           HB       THR   5  10.373  -1.313   2.705
   34    HG1  THR   5           HG1      THR   5  11.449   0.712   2.321
   35   HG21  THR   5          HG21      THR   5  10.632  -0.132  -0.059
   36   HG22  THR   5          HG22      THR   5  10.223  -1.831   0.187
   37   HG23  THR   5          HG23      THR   5  11.764  -1.198   0.770
   38    H    ALA   6           HN       ALA   6   7.959   1.834   1.962
   39    HA   ALA   6           HA       ALA   6   7.504   1.913   4.897
   40    HB1  ALA   6           HB1      ALA   6   8.779   3.727   3.682
   41    HB2  ALA   6           HB2      ALA   6   7.388   4.326   4.586
   42    HB3  ALA   6           HB3      ALA   6   7.284   4.143   2.831
   43    H1   NAL   7           H1       NAL   7   2.691   4.798   0.487
   44    H3   NAL   7           H3       NAL   7   6.179   2.396  -0.203
   45    H4   NAL   7           H4       NAL   7   7.342   4.323  -1.250
   46    H5   NAL   7           H5       NAL   7   7.320   6.794  -1.996
   47    H6   NAL   7           H6       NAL   7   6.123   8.955  -2.181
   48    H7   NAL   7           H7       NAL   7   3.802   9.183  -1.332
   49    H8   NAL   7           H8       NAL   7   2.652   7.250  -0.289
   50    H91  NAL   7           H91      NAL   7   2.617   2.444   0.544
   51    H92  NAL   7           H92      NAL   7   4.101   1.486   0.555
   52    H10  NAL   7           H10      NAL   7   3.403   3.631   2.598
   53    HN1  NAL   7           HN1      NAL   7   5.890   2.777   1.929
   54    H    ILE   8           HN       ILE   8   4.276   0.181   2.436
   55    HA   ILE   8           HA       ILE   8   2.201  -0.391   4.463
   56    HB   ILE   8           HB       ILE   8   1.484  -2.334   2.753
   57   HG12  ILE   8          HG12      ILE   8   1.384  -1.519   0.437
   58   HG13  ILE   8          HG11      ILE   8   2.245  -0.049   0.878
   59   HG21  ILE   8          HG21      ILE   8  -0.390  -0.957   2.014
   60   HG22  ILE   8          HG22      ILE   8   0.495   0.520   2.402
   61   HG23  ILE   8          HG23      ILE   8  -0.026  -0.570   3.696
   62   HD11  ILE   8          HD11      ILE   8   4.271  -1.230   1.213
   63   HD12  ILE   8          HD12      ILE   8   3.574  -1.928  -0.246
   64   HD13  ILE   8          HD13      ILE   8   3.445  -2.795   1.271
   65    H    LYS   9           HN       LYS   9   3.149  -1.626   5.902
   66    HA   LYS   9           HA       LYS   9   5.516  -3.236   5.213
   67    HB2  LYS   9           HB2      LYS   9   4.379  -2.297   7.854
   68    HB3  LYS   9           HB1      LYS   9   5.731  -3.421   7.742
   69    HG2  LYS   9           HG2      LYS   9   6.984  -1.745   6.394
   70    HG3  LYS   9           HG1      LYS   9   5.654  -0.607   6.605
   71    HD2  LYS   9           HD2      LYS   9   5.958  -0.621   9.018
   72    HD3  LYS   9           HD1      LYS   9   7.190  -1.876   8.887
   73    HE2  LYS   9           HE2      LYS   9   8.244   0.330   9.146
   74    HE3  LYS   9           HE1      LYS   9   8.602  -0.339   7.554
   75    HZ1  LYS   9           HZ1      LYS   9   7.764   1.516   6.712
   76    HZ2  LYS   9           HZ2      LYS   9   7.206   2.040   8.229
   77    HZ3  LYS   9           HZ3      LYS   9   6.236   1.032   7.266
   78    H    GLY  10           HN       GLY  10   5.108  -5.317   4.673
   79    HA2  GLY  10           HA2      GLY  10   4.546  -7.564   5.351
   80    HA3  GLY  10           HA1      GLY  10   3.296  -6.931   6.413
   81    H    ARG  11           HN       ARG  11   2.489  -5.130   3.963
   82    HA   ARG  11           HA       ARG  11   1.099  -7.264   2.345
   83    HB2  ARG  11           HB2      ARG  11  -0.177  -4.708   3.370
   84    HB3  ARG  11           HB1      ARG  11  -0.965  -5.961   2.423
   85    HG2  ARG  11           HG2      ARG  11   0.252  -6.467   5.160
   86    HG3  ARG  11           HG1      ARG  11  -1.432  -6.019   4.930
   87    HD2  ARG  11           HD2      ARG  11  -0.044  -8.530   3.951
   88    HD3  ARG  11           HD1      ARG  11  -1.375  -8.411   5.094
   89    HE   ARG  11           HE       ARG  11  -2.397  -7.265   2.788
   90   HH11  ARG  11          HH21      ARG  11  -0.863 -10.245   3.623
   91   HH12  ARG  11          HH22      ARG  11  -1.698 -11.163   2.415
   92   HH21  ARG  11          HH11      ARG  11  -3.491  -8.450   1.211
   93   HH22  ARG  11          HH12      ARG  11  -3.185 -10.147   1.051
   94    H    THR  12           HN       THR  12   2.337  -6.925   0.489
   95    HA   THR  12           HA       THR  12   2.437  -4.200  -0.653
   96    HB   THR  12           HB       THR  12   3.947  -5.885  -2.328
   97    HG1  THR  12           HG1      THR  12   3.888  -7.566  -0.913
   98   HG21  THR  12          HG21      THR  12   5.907  -4.807  -1.290
   99   HG22  THR  12          HG22      THR  12   4.906  -4.270   0.059
  100   HG23  THR  12          HG23      THR  12   4.615  -3.636  -1.561
  101    H    PHE  13           HN       PHE  13   1.966  -4.024  -2.989
  102    HA   PHE  13           HA       PHE  13  -0.164  -5.960  -3.892
  103    HB2  PHE  13           HB2      PHE  13  -0.015  -2.958  -4.292
  104    HB3  PHE  13           HB1      PHE  13  -1.299  -4.018  -4.877
  105    HD1  PHE  13           HD1      PHE  13   0.429  -2.826  -1.778
  106    HD2  PHE  13           HD2      PHE  13  -3.094  -4.653  -3.427
  107    HE1  PHE  13           HE1      PHE  13  -0.679  -2.724   0.436
  108    HE2  PHE  13           HE2      PHE  13  -4.200  -4.511  -1.222
  109    HZ   PHE  13           HZ       PHE  13  -2.984  -3.535   0.703
  110    H    ARG  14           HN       ARG  14   0.058  -6.732  -5.947
  111    HA   ARG  14           HA       ARG  14   2.513  -6.276  -7.395
  112    HB2  ARG  14           HB2      ARG  14  -0.126  -7.535  -8.231
  113    HB3  ARG  14           HB1      ARG  14   1.293  -7.488  -9.276
  114    HG2  ARG  14           HG2      ARG  14   2.588  -8.761  -7.632
  115    HG3  ARG  14           HG1      ARG  14   1.223  -8.751  -6.516
  116    HD2  ARG  14           HD2      ARG  14  -0.122 -10.044  -8.085
  117    HD3  ARG  14           HD1      ARG  14   1.166  -9.974  -9.289
  118    HE   ARG  14           HE       ARG  14   2.376 -11.122  -7.064
  119   HH11  ARG  14          HH21      ARG  14  -0.416 -11.741  -9.001
  120   HH12  ARG  14          HH22      ARG  14  -0.370 -13.455  -8.749
  121   HH21  ARG  14          HH11      ARG  14   2.444 -13.352  -6.728
  122   HH22  ARG  14          HH12      ARG  14   1.247 -14.365  -7.462
  123    H    ASN  15           HN       ASN  15  -0.808  -5.131  -7.717
  124    HA   ASN  15           HA       ASN  15   0.072  -3.037  -9.686
  125    HB2  ASN  15           HB2      ASN  15  -2.542  -2.751  -9.839
  126    HB3  ASN  15           HB1      ASN  15  -1.765  -4.073 -10.717
  127   HD21  ASN  15          HD21      ASN  15  -4.095  -4.953 -10.471
  128   HD22  ASN  15          HD22      ASN  15  -4.421  -5.875  -9.082
  129    H    GLU  16           HN       GLU  16   0.218  -1.005  -8.921
  130    HA   GLU  16           HA       GLU  16  -0.327  -0.432  -6.180
  131    HB2  GLU  16           HB2      GLU  16   0.143   1.380  -8.568
  132    HB3  GLU  16           HB1      GLU  16  -0.067   2.005  -6.932
  133    HG2  GLU  16           HG2      GLU  16   1.852   0.642  -6.169
  134    HG3  GLU  16           HG1      GLU  16   2.077   0.046  -7.814
  135    H    LYS  17           HN       LYS  17  -2.290  -0.511  -8.994
  136    HA   LYS  17           HA       LYS  17  -4.335   1.292  -8.372
  137    HB2  LYS  17           HB2      LYS  17  -4.041  -0.172 -10.475
  138    HB3  LYS  17           HB1      LYS  17  -4.835  -1.453  -9.566
  139    HG2  LYS  17           HG2      LYS  17  -6.742   0.187  -9.141
  140    HG3  LYS  17           HG1      LYS  17  -5.974   1.258 -10.312
  141    HD2  LYS  17           HD2      LYS  17  -6.954  -1.567 -10.839
  142    HD3  LYS  17           HD1      LYS  17  -7.707  -0.079 -11.413
  143    HE2  LYS  17           HE2      LYS  17  -6.448  -0.773 -13.286
  144    HE3  LYS  17           HE1      LYS  17  -5.357   0.380 -12.517
  145    HZ1  LYS  17           HZ1      LYS  17  -4.857  -2.271 -13.087
  146    HZ2  LYS  17           HZ2      LYS  17  -5.046  -2.210 -11.399
  147    HZ3  LYS  17           HZ3      LYS  17  -3.891  -1.226 -12.164
  148    H    GLU  18           HN       GLU  18  -3.976  -2.119  -7.407
  149    HA   GLU  18           HA       GLU  18  -6.346  -2.202  -5.825
  150    HB2  GLU  18           HB2      GLU  18  -3.839  -3.891  -5.813
  151    HB3  GLU  18           HB1      GLU  18  -5.255  -4.252  -4.818
  152    HG2  GLU  18           HG2      GLU  18  -6.651  -4.497  -6.780
  153    HG3  GLU  18           HG1      GLU  18  -5.351  -3.938  -7.831
  154    H    LEU  19           HN       LEU  19  -3.077  -1.149  -5.168
  155    HA   LEU  19           HA       LEU  19  -3.360  -1.101  -2.287
  156    HB2  LEU  19           HB2      LEU  19  -1.144  -1.142  -3.149
  157    HB3  LEU  19           HB1      LEU  19  -1.470   0.171  -4.254
  158    HG   LEU  19           HG       LEU  19  -1.662   1.689  -2.229
  159   HD11  LEU  19          HD11      LEU  19  -0.731   0.932  -0.123
  160   HD12  LEU  19          HD12      LEU  19  -0.410  -0.651  -0.815
  161   HD13  LEU  19          HD13      LEU  19  -2.067  -0.128  -0.558
  162   HD21  LEU  19          HD21      LEU  19   0.956   0.246  -2.636
  163   HD22  LEU  19          HD22      LEU  19   0.768   1.836  -1.897
  164   HD23  LEU  19          HD23      LEU  19   0.369   1.602  -3.599
  165    H    ARG  20           HN       ARG  20  -3.851   1.277  -4.891
  166    HA   ARG  20           HA       ARG  20  -4.341   3.557  -3.276
  167    HB2  ARG  20           HB2      ARG  20  -4.133   3.549  -5.781
  168    HB3  ARG  20           HB1      ARG  20  -5.745   2.842  -5.866
  169    HG2  ARG  20           HG2      ARG  20  -6.671   4.809  -4.684
  170    HG3  ARG  20           HG1      ARG  20  -5.056   5.517  -4.607
  171    HD2  ARG  20           HD2      ARG  20  -6.481   4.771  -7.175
  172    HD3  ARG  20           HD1      ARG  20  -6.414   6.403  -6.507
  173    HE   ARG  20           HE       ARG  20  -3.750   5.629  -6.658
  174   HH11  ARG  20          HH21      ARG  20  -6.434   5.793  -8.827
  175   HH12  ARG  20          HH22      ARG  20  -5.454   6.099 -10.222
  176   HH21  ARG  20          HH11      ARG  20  -2.464   6.027  -8.468
  177   HH22  ARG  20          HH12      ARG  20  -3.208   6.231 -10.019
  178    H    ASP  21           HN       ASP  21  -6.409   0.929  -4.255
  179    HA   ASP  21           HA       ASP  21  -8.814   1.983  -3.082
  180    HB2  ASP  21           HB2      ASP  21  -8.095  -0.796  -4.043
  181    HB3  ASP  21           HB1      ASP  21  -9.702  -0.332  -3.485
  182    H    PHE  22           HN       PHE  22  -6.624  -0.696  -2.169
  183    HA   PHE  22           HA       PHE  22  -7.881  -1.232   0.294
  184    HB2  PHE  22           HB2      PHE  22  -5.188  -1.777  -0.886
  185    HB3  PHE  22           HB1      PHE  22  -5.328  -1.970   0.855
  186    HD1  PHE  22           HD1      PHE  22  -7.712  -2.663  -1.951
  187    HD2  PHE  22           HD2      PHE  22  -5.471  -4.291   1.336
  188    HE1  PHE  22           HE1      PHE  22  -8.775  -4.865  -2.312
  189    HE2  PHE  22           HE2      PHE  22  -6.538  -6.487   0.971
  190    HZ   PHE  22           HZ       PHE  22  -8.193  -6.784  -0.852
  191    H    ILE  23           HN       ILE  23  -5.778   1.290  -0.700
  192    HA   ILE  23           HA       ILE  23  -4.934   2.155   1.921
  193    HB   ILE  23           HB       ILE  23  -4.952   3.262  -0.869
  194   HG12  ILE  23          HG12      ILE  23  -2.836   3.143   1.317
  195   HG13  ILE  23          HG11      ILE  23  -3.032   1.961   0.030
  196   HG21  ILE  23          HG21      ILE  23  -4.658   4.999   1.581
  197   HG22  ILE  23          HG22      ILE  23  -5.804   5.205   0.252
  198   HG23  ILE  23          HG23      ILE  23  -4.099   5.489  -0.013
  199   HD11  ILE  23          HD11      ILE  23  -1.263   3.447  -0.632
  200   HD12  ILE  23          HD12      ILE  23  -2.243   4.864  -0.246
  201   HD13  ILE  23          HD13      ILE  23  -2.669   3.842  -1.615
  202    H    GLU  24           HN       GLU  24  -7.653   2.812  -0.186
  203    HA   GLU  24           HA       GLU  24  -8.806   4.922   1.306
  204    HB2  GLU  24           HB2      GLU  24 -10.195   2.782  -0.329
  205    HB3  GLU  24           HB1      GLU  24 -11.042   4.136   0.397
  206    HG2  GLU  24           HG2      GLU  24  -9.668   5.720  -0.863
  207    HG3  GLU  24           HG1      GLU  24  -8.745   4.393  -1.566
  208    H    LYS  25           HN       LYS  25  -8.720   1.486   1.847
  209    HA   LYS  25           HA       LYS  25 -10.696   1.514   4.014
  210    HB2  LYS  25           HB2      LYS  25  -8.609  -0.548   3.238
  211    HB3  LYS  25           HB1      LYS  25  -9.845  -0.797   4.462
  212    HG2  LYS  25           HG2      LYS  25 -10.642   0.021   1.650
  213    HG3  LYS  25           HG1      LYS  25 -10.285  -1.664   2.010
  214    HD2  LYS  25           HD2      LYS  25 -11.997  -1.608   3.831
  215    HD3  LYS  25           HD1      LYS  25 -12.404   0.041   3.360
  216    HE2  LYS  25           HE2      LYS  25 -13.943  -1.596   2.329
  217    HE3  LYS  25           HE1      LYS  25 -13.010  -0.730   1.109
  218    HZ1  LYS  25           HZ1      LYS  25 -11.742  -2.555   0.643
  219    HZ2  LYS  25           HZ2      LYS  25 -13.212  -3.312   1.037
  220    HZ3  LYS  25           HZ3      LYS  25 -11.952  -3.249   2.176
  221    H    PHE  26           HN       PHE  26  -7.125   1.558   3.809
  222    HA   PHE  26           HA       PHE  26  -6.759   1.474   6.690
  223    HB2  PHE  26           HB2      PHE  26  -4.773   2.680   4.741
  224    HB3  PHE  26           HB1      PHE  26  -4.444   1.896   6.279
  225    HD1  PHE  26           HD1      PHE  26  -6.355  -0.573   5.761
  226    HD2  PHE  26           HD2      PHE  26  -3.290   1.343   3.412
  227    HE1  PHE  26           HE1      PHE  26  -5.932  -2.691   4.574
  228    HE2  PHE  26           HE2      PHE  26  -2.882  -0.794   2.218
  229    HZ   PHE  26           HZ       PHE  26  -4.201  -2.809   2.808
  230   H11A  DNS  27          H22       DNS  27   3.923   5.223   4.000
  231    H12  DNS  27           H23      DNS  27   3.449   6.407   5.222
  232    H13  DNS  27           H24      DNS  27   3.547   6.888   3.515
  233    H21  DNS  27           H21      DNS  27   2.486   3.752   4.570
  234    H22  DNS  27           H19      DNS  27   0.763   3.901   4.179
  235    H23  DNS  27           H20      DNS  27   1.372   4.531   5.713
  236    H4   DNS  27           H14      DNS  27   1.670   6.494   6.610
  237    H5   DNS  27           H15      DNS  27   0.138   8.311   7.407
  238    H6   DNS  27           H16      DNS  27  -1.341   9.514   5.781
  239    HZ   DNS  27           HZ1      DNS  27  -3.623   9.585   5.499
  240    HE3  DNS  27           HE1      DNS  27  -5.283   9.097   3.997
  241    HE2  DNS  27           HE2      DNS  27  -4.121   8.418   2.866
  242    HD3  DNS  27           HD1      DNS  27  -3.699   6.548   4.399
  243    HD2  DNS  27           HD2      DNS  27  -4.849   7.220   5.549
  244    HG3  DNS  27           HG1      DNS  27  -5.780   6.721   2.718
  245    HG2  DNS  27           HG2      DNS  27  -5.587   5.336   3.777
  246    HB3  DNS  27           HB1      DNS  27  -7.188   7.751   4.671
  247    HB2  DNS  27           HB2      DNS  27  -7.927   6.519   3.653
  248    HA   DNS  27           HA       DNS  27  -6.750   6.140   6.429
  249    H    DNS  27           HN       DNS  27  -7.453   4.040   4.421
  250    H9   DNS  27           H9       DNS  27  -2.093   9.211   1.037
  251    H10  DNS  27           H10      DNS  27  -0.564   7.399   0.250
  252    H11  DNS  27           H11      DNS  27   0.914   6.199   1.875
  253    H    GLY  28           HN       GLY  28  -8.276   6.931   7.777
  254    HA2  GLY  28           HA2      GLY  28 -10.919   7.605   7.101
  255    HA3  GLY  28           HA1      GLY  28 -10.984   5.961   7.740
  256    H    ARG  29           HN       ARG  29  -8.927   8.698   8.678
  257    HA   ARG  29           HA       ARG  29  -9.329   8.171  11.498
  258    HB2  ARG  29           HB2      ARG  29  -7.984  10.171  11.871
  259    HB3  ARG  29           HB1      ARG  29  -7.259   9.214  10.580
  260    HG2  ARG  29           HG2      ARG  29  -8.508  10.702   8.928
  261    HG3  ARG  29           HG1      ARG  29  -8.925  11.735  10.294
  262    HD2  ARG  29           HD2      ARG  29  -6.135  11.052   9.328
  263    HD3  ARG  29           HD1      ARG  29  -6.928  12.625   9.239
  264    HE   ARG  29           HE       ARG  29  -6.973  12.015  11.945
  265   HH11  ARG  29          HH21      ARG  29  -4.572  12.182   9.467
  266   HH12  ARG  29          HH22      ARG  29  -3.302  12.649  10.548
  267   HH21  ARG  29          HH11      ARG  29  -5.326  12.624  13.363
  268   HH22  ARG  29          HH12      ARG  29  -3.729  12.898  12.751
  Start of MODEL   10
    1    H1   GLY   1           HT1      GLY   1  13.243   2.112  -9.676
    2    H2   GLY   1           HT2      GLY   1  12.508   2.058  -8.145
    3    H3   GLY   1           HT3      GLY   1  11.556   2.233  -9.541
    4    HA2  GLY   1           HA2      GLY   1  11.603   0.047 -10.172
    5    HA3  GLY   1           HA1      GLY   1  13.167  -0.151  -9.325
    6    H    GLN   2           HN       GLN   2  13.046   0.865  -6.917
    7    HA   GLN   2           HA       GLN   2  13.000  -1.772  -5.773
    8    HB2  GLN   2           HB2      GLN   2  13.186  -0.564  -3.591
    9    HB3  GLN   2           HB1      GLN   2  14.370  -0.016  -4.777
   10    HG2  GLN   2           HG2      GLN   2  12.843   1.876  -5.365
   11    HG3  GLN   2           HG1      GLN   2  11.758   1.359  -4.075
   12   HE21  GLN   2          HE21      GLN   2  13.722   3.798  -4.496
   13   HE22  GLN   2          HE22      GLN   2  14.526   3.881  -3.003
   14    H    GLN   3           HN       GLN   3  11.402  -2.783  -4.524
   15    HA   GLN   3           HA       GLN   3   8.666  -2.033  -5.080
   16    HB2  GLN   3           HB2      GLN   3   9.642  -3.985  -2.975
   17    HB3  GLN   3           HB1      GLN   3   8.041  -3.925  -3.715
   18    HG2  GLN   3           HG2      GLN   3  10.620  -4.464  -5.222
   19    HG3  GLN   3           HG1      GLN   3   9.477  -5.702  -4.709
   20   HE21  GLN   3          HE21      GLN   3  10.178  -5.001  -7.511
   21   HE22  GLN   3          HE22      GLN   3   8.732  -4.509  -8.250
   22    H    TYR   4           HN       TYR   4   7.121  -1.218  -3.644
   23    HA   TYR   4           HA       TYR   4   8.005   0.762  -1.820
   24    HB2  TYR   4           HB2      TYR   4   5.215   0.062  -1.313
   25    HB3  TYR   4           HB1      TYR   4   5.847   1.487  -2.117
   26    HD1  TYR   4           HD2      TYR   4   6.851   0.997  -4.562
   27    HD2  TYR   4           HD1      TYR   4   3.770  -1.300  -2.632
   28    HE1  TYR   4           HE2      TYR   4   6.077   0.173  -6.765
   29    HE2  TYR   4           HE1      TYR   4   3.007  -2.114  -4.833
   30    HH   TYR   4           HH       TYR   4   3.394  -2.156  -7.018
   31    H    THR   5           HN       THR   5   8.734   0.468   0.259
   32    HA   THR   5           HA       THR   5   7.902  -2.027   1.756
   33    HB   THR   5           HB       THR   5  10.077  -2.156   2.656
   34    HG1  THR   5           HG1      THR   5  10.328  -0.046   3.301
   35   HG21  THR   5          HG21      THR   5  11.540  -2.241   0.776
   36   HG22  THR   5          HG22      THR   5  10.686  -0.928  -0.031
   37   HG23  THR   5          HG23      THR   5   9.931  -2.517   0.101
   38    H    ALA   6           HN       ALA   6   8.374   1.433   1.942
   39    HA   ALA   6           HA       ALA   6   7.912   1.586   4.847
   40    HB1  ALA   6           HB1      ALA   6   8.020   3.998   4.507
   41    HB2  ALA   6           HB2      ALA   6   7.842   3.808   2.759
   42    HB3  ALA   6           HB3      ALA   6   9.317   3.260   3.568
   43    H1   NAL   7           H1       NAL   7   3.302   4.952   0.506
   44    H3   NAL   7           H3       NAL   7   6.612   2.299  -0.143
   45    H4   NAL   7           H4       NAL   7   7.934   4.143  -1.152
   46    H5   NAL   7           H5       NAL   7   8.109   6.611  -1.883
   47    H6   NAL   7           H6       NAL   7   7.080   8.855  -2.076
   48    H7   NAL   7           H7       NAL   7   4.768   9.253  -1.264
   49    H8   NAL   7           H8       NAL   7   3.460   7.407  -0.251
   50    H91  NAL   7           H91      NAL   7   3.049   2.623   0.568
   51    H92  NAL   7           H92      NAL   7   4.451   1.550   0.554
   52    H10  NAL   7           H10      NAL   7   3.933   3.689   2.652
   53    HN1  NAL   7           HN1      NAL   7   6.332   2.647   1.934
   54    H    ILE   8           HN       ILE   8   4.545   0.195   2.406
   55    HA   ILE   8           HA       ILE   8   2.374  -0.283   4.384
   56    HB   ILE   8           HB       ILE   8   1.596  -2.143   2.608
   57   HG12  ILE   8          HG12      ILE   8   1.649  -1.289   0.306
   58   HG13  ILE   8          HG11      ILE   8   2.570   0.121   0.808
   59   HG21  ILE   8          HG21      ILE   8  -0.144  -0.615   1.821
   60   HG22  ILE   8          HG22      ILE   8   0.825   0.780   2.300
   61   HG23  ILE   8          HG23      ILE   8   0.170  -0.312   3.530
   62   HD11  ILE   8          HD11      ILE   8   3.934  -1.669  -0.289
   63   HD12  ILE   8          HD12      ILE   8   3.550  -2.741   1.043
   64   HD13  ILE   8          HD13      ILE   8   4.493  -1.270   1.326
   65    H    LYS   9           HN       LYS   9   3.644  -1.243   5.872
   66    HA   LYS   9           HA       LYS   9   5.738  -3.110   5.158
   67    HB2  LYS   9           HB2      LYS   9   5.897  -1.581   7.136
   68    HB3  LYS   9           HB1      LYS   9   4.623  -2.527   7.911
   69    HG2  LYS   9           HG2      LYS   9   6.007  -4.528   7.848
   70    HG3  LYS   9           HG1      LYS   9   7.253  -3.678   6.933
   71    HD2  LYS   9           HD2      LYS   9   7.617  -2.143   8.813
   72    HD3  LYS   9           HD1      LYS   9   6.337  -2.940   9.728
   73    HE2  LYS   9           HE2      LYS   9   7.619  -5.071   9.612
   74    HE3  LYS   9           HE1      LYS   9   8.920  -4.217   8.781
   75    HZ1  LYS   9           HZ1      LYS   9   8.228  -4.236  11.570
   76    HZ2  LYS   9           HZ2      LYS   9   8.451  -2.670  10.952
   77    HZ3  LYS   9           HZ3      LYS   9   9.692  -3.822  10.820
   78    H    GLY  10           HN       GLY  10   5.352  -5.207   4.672
   79    HA2  GLY  10           HA2      GLY  10   4.680  -7.426   5.279
   80    HA3  GLY  10           HA1      GLY  10   3.433  -6.765   6.326
   81    H    ARG  11           HN       ARG  11   2.671  -4.954   3.855
   82    HA   ARG  11           HA       ARG  11   1.283  -7.091   2.241
   83    HB2  ARG  11           HB2      ARG  11  -0.010  -4.554   3.294
   84    HB3  ARG  11           HB1      ARG  11  -0.773  -5.777   2.285
   85    HG2  ARG  11           HG2      ARG  11  -1.516  -6.574   4.339
   86    HG3  ARG  11           HG1      ARG  11   0.042  -7.394   4.325
   87    HD2  ARG  11           HD2      ARG  11  -0.254  -6.300   6.474
   88    HD3  ARG  11           HD1      ARG  11   1.004  -5.439   5.591
   89    HE   ARG  11           HE       ARG  11  -1.326  -4.081   4.929
   90   HH11  ARG  11          HH21      ARG  11   0.284  -5.025   7.835
   91   HH12  ARG  11          HH22      ARG  11  -0.296  -3.674   8.749
   92   HH21  ARG  11          HH11      ARG  11  -2.088  -2.316   6.111
   93   HH22  ARG  11          HH12      ARG  11  -1.638  -2.141   7.774
   94    H    THR  12           HN       THR  12   2.492  -6.751   0.362
   95    HA   THR  12           HA       THR  12   2.589  -4.023  -0.772
   96    HB   THR  12           HB       THR  12   4.040  -5.699  -2.498
   97    HG1  THR  12           HG1      THR  12   4.204  -6.558   0.185
   98   HG21  THR  12          HG21      THR  12   6.031  -4.665  -1.511
   99   HG22  THR  12          HG22      THR  12   5.103  -4.185  -0.090
  100   HG23  THR  12          HG23      THR  12   4.742  -3.469  -1.661
  101    H    PHE  13           HN       PHE  13   2.053  -3.833  -3.107
  102    HA   PHE  13           HA       PHE  13  -0.067  -5.791  -3.980
  103    HB2  PHE  13           HB2      PHE  13  -0.094  -2.776  -4.306
  104    HB3  PHE  13           HB1      PHE  13  -1.371  -3.896  -4.784
  105    HD1  PHE  13           HD1      PHE  13   0.559  -2.620  -1.847
  106    HD2  PHE  13           HD2      PHE  13  -2.999  -4.624  -3.187
  107    HE1  PHE  13           HE1      PHE  13  -0.354  -2.576   0.461
  108    HE2  PHE  13           HE2      PHE  13  -3.912  -4.541  -0.888
  109    HZ   PHE  13           HZ       PHE  13  -2.582  -3.505   0.928
  110    H    ARG  14           HN       ARG  14   0.150  -6.493  -6.054
  111    HA   ARG  14           HA       ARG  14   2.486  -5.802  -7.602
  112    HB2  ARG  14           HB2      ARG  14   1.230  -7.978  -7.863
  113    HB3  ARG  14           HB1      ARG  14  -0.084  -7.079  -8.625
  114    HG2  ARG  14           HG2      ARG  14   1.461  -6.311 -10.392
  115    HG3  ARG  14           HG1      ARG  14   2.778  -7.203  -9.630
  116    HD2  ARG  14           HD2      ARG  14   1.839  -8.525 -11.461
  117    HD3  ARG  14           HD1      ARG  14   1.484  -9.307  -9.921
  118    HE   ARG  14           HE       ARG  14  -0.736  -7.705 -10.385
  119   HH11  ARG  14          HH21      ARG  14   0.994 -10.143 -12.116
  120   HH12  ARG  14          HH22      ARG  14  -0.403 -10.713 -12.966
  121   HH21  ARG  14          HH11      ARG  14  -2.562  -8.439 -11.488
  122   HH22  ARG  14          HH12      ARG  14  -2.414  -9.749 -12.611
  123    H    ASN  15           HN       ASN  15  -0.904  -4.844  -7.684
  124    HA   ASN  15           HA       ASN  15  -0.305  -2.690  -9.689
  125    HB2  ASN  15           HB2      ASN  15  -2.972  -2.544  -9.482
  126    HB3  ASN  15           HB1      ASN  15  -2.215  -3.736 -10.545
  127   HD21  ASN  15          HD21      ASN  15  -4.115  -5.158 -10.235
  128   HD22  ASN  15          HD22      ASN  15  -4.297  -6.041  -8.797
  129    H    GLU  16           HN       GLU  16  -0.146  -0.658  -8.918
  130    HA   GLU  16           HA       GLU  16  -0.431  -0.123  -6.125
  131    HB2  GLU  16           HB2      GLU  16  -0.166   1.680  -8.547
  132    HB3  GLU  16           HB1      GLU  16  -0.296   2.338  -6.916
  133    HG2  GLU  16           HG2      GLU  16   1.787   0.271  -7.691
  134    HG3  GLU  16           HG1      GLU  16   2.085   2.006  -7.780
  135    H    LYS  17           HN       LYS  17  -2.702  -0.183  -8.729
  136    HA   LYS  17           HA       LYS  17  -4.626   1.610  -7.691
  137    HB2  LYS  17           HB2      LYS  17  -4.524  -0.468  -9.771
  138    HB3  LYS  17           HB1      LYS  17  -6.090  -0.469  -8.973
  139    HG2  LYS  17           HG2      LYS  17  -6.270   1.034 -10.830
  140    HG3  LYS  17           HG1      LYS  17  -6.190   2.040  -9.384
  141    HD2  LYS  17           HD2      LYS  17  -3.701   2.265  -9.783
  142    HD3  LYS  17           HD1      LYS  17  -3.929   1.427 -11.316
  143    HE2  LYS  17           HE2      LYS  17  -5.186   4.057 -10.489
  144    HE3  LYS  17           HE1      LYS  17  -3.960   3.817 -11.734
  145    HZ1  LYS  17           HZ1      LYS  17  -5.500   2.536 -13.019
  146    HZ2  LYS  17           HZ2      LYS  17  -6.234   4.017 -12.624
  147    HZ3  LYS  17           HZ3      LYS  17  -6.668   2.602 -11.790
  148    H    GLU  18           HN       GLU  18  -4.226  -1.905  -7.213
  149    HA   GLU  18           HA       GLU  18  -6.401  -2.243  -5.449
  150    HB2  GLU  18           HB2      GLU  18  -3.767  -3.716  -5.661
  151    HB3  GLU  18           HB1      GLU  18  -5.077  -4.231  -4.594
  152    HG2  GLU  18           HG2      GLU  18  -6.593  -4.425  -6.516
  153    HG3  GLU  18           HG1      GLU  18  -5.311  -3.880  -7.597
  154    H    LEU  19           HN       LEU  19  -3.182  -0.987  -4.959
  155    HA   LEU  19           HA       LEU  19  -3.328  -0.990  -2.050
  156    HB2  LEU  19           HB2      LEU  19  -1.145  -0.987  -2.986
  157    HB3  LEU  19           HB1      LEU  19  -1.532   0.305  -4.090
  158    HG   LEU  19           HG       LEU  19  -1.687   1.841  -2.076
  159   HD11  LEU  19          HD11      LEU  19  -0.680   1.129   0.007
  160   HD12  LEU  19          HD12      LEU  19  -0.352  -0.457  -0.670
  161   HD13  LEU  19          HD13      LEU  19  -2.011   0.042  -0.373
  162   HD21  LEU  19          HD21      LEU  19   0.943   0.441  -2.546
  163   HD22  LEU  19          HD22      LEU  19   0.749   2.037  -1.821
  164   HD23  LEU  19          HD23      LEU  19   0.303   1.774  -3.507
  165    H    ARG  20           HN       ARG  20  -4.026   1.321  -4.650
  166    HA   ARG  20           HA       ARG  20  -4.507   3.609  -3.027
  167    HB2  ARG  20           HB2      ARG  20  -4.449   3.244  -5.673
  168    HB3  ARG  20           HB1      ARG  20  -6.189   3.088  -5.483
  169    HG2  ARG  20           HG2      ARG  20  -4.464   5.464  -4.705
  170    HG3  ARG  20           HG1      ARG  20  -5.678   5.405  -5.979
  171    HD2  ARG  20           HD2      ARG  20  -7.362   4.823  -4.090
  172    HD3  ARG  20           HD1      ARG  20  -6.107   5.396  -2.987
  173    HE   ARG  20           HE       ARG  20  -6.335   7.433  -4.859
  174   HH11  ARG  20          HH21      ARG  20  -8.474   5.703  -2.770
  175   HH12  ARG  20          HH22      ARG  20  -9.555   7.039  -2.557
  176   HH21  ARG  20          HH11      ARG  20  -7.736   9.180  -4.588
  177   HH22  ARG  20          HH12      ARG  20  -9.138   9.006  -3.586
  178    H    ASP  21           HN       ASP  21  -6.522   0.924  -3.971
  179    HA   ASP  21           HA       ASP  21  -8.919   1.881  -2.714
  180    HB2  ASP  21           HB2      ASP  21  -9.010   0.282  -4.581
  181    HB3  ASP  21           HB1      ASP  21  -8.176  -0.918  -3.595
  182    H    PHE  22           HN       PHE  22  -6.586  -0.689  -1.851
  183    HA   PHE  22           HA       PHE  22  -7.764  -1.258   0.651
  184    HB2  PHE  22           HB2      PHE  22  -5.085  -1.732  -0.598
  185    HB3  PHE  22           HB1      PHE  22  -5.192  -1.939   1.143
  186    HD1  PHE  22           HD1      PHE  22  -7.641  -2.677  -1.601
  187    HD2  PHE  22           HD2      PHE  22  -5.225  -4.273   1.577
  188    HE1  PHE  22           HE1      PHE  22  -8.640  -4.909  -1.955
  189    HE2  PHE  22           HE2      PHE  22  -6.229  -6.497   1.219
  190    HZ   PHE  22           HZ       PHE  22  -7.938  -6.825  -0.547
  191    H    ILE  23           HN       ILE  23  -5.746   1.316  -0.421
  192    HA   ILE  23           HA       ILE  23  -4.809   2.199   2.155
  193    HB   ILE  23           HB       ILE  23  -5.010   3.320  -0.615
  194   HG12  ILE  23          HG12      ILE  23  -2.802   3.379   1.482
  195   HG13  ILE  23          HG11      ILE  23  -2.982   2.136   0.251
  196   HG21  ILE  23          HG21      ILE  23  -4.236   5.601   0.253
  197   HG22  ILE  23          HG22      ILE  23  -4.821   5.079   1.829
  198   HG23  ILE  23          HG23      ILE  23  -5.937   5.218   0.469
  199   HD11  ILE  23          HD11      ILE  23  -2.446   5.077  -0.227
  200   HD12  ILE  23          HD12      ILE  23  -2.745   3.900  -1.495
  201   HD13  ILE  23          HD13      ILE  23  -1.316   3.748  -0.483
  202    H    GLU  24           HN       GLU  24  -7.650   2.774   0.210
  203    HA   GLU  24           HA       GLU  24  -8.815   4.773   1.865
  204    HB2  GLU  24           HB2      GLU  24 -10.162   2.727   0.082
  205    HB3  GLU  24           HB1      GLU  24 -11.033   4.009   0.905
  206    HG2  GLU  24           HG2      GLU  24  -8.700   4.531  -0.964
  207    HG3  GLU  24           HG1      GLU  24 -10.382   4.536  -1.488
  208    H    LYS  25           HN       LYS  25  -8.538   1.325   2.179
  209    HA   LYS  25           HA       LYS  25 -10.552   1.053   4.274
  210    HB2  LYS  25           HB2      LYS  25  -9.707  -0.824   2.755
  211    HB3  LYS  25           HB1      LYS  25  -8.227  -0.812   3.706
  212    HG2  LYS  25           HG2      LYS  25  -9.462  -2.477   4.817
  213    HG3  LYS  25           HG1      LYS  25  -9.866  -1.060   5.778
  214    HD2  LYS  25           HD2      LYS  25 -11.976  -0.798   4.539
  215    HD3  LYS  25           HD1      LYS  25 -11.549  -2.152   3.495
  216    HE2  LYS  25           HE2      LYS  25 -13.070  -2.920   5.245
  217    HE3  LYS  25           HE1      LYS  25 -11.474  -3.628   5.498
  218    HZ1  LYS  25           HZ1      LYS  25 -12.499  -2.706   7.536
  219    HZ2  LYS  25           HZ2      LYS  25 -12.430  -1.159   6.838
  220    HZ3  LYS  25           HZ3      LYS  25 -10.997  -2.011   7.165
  221    H    PHE  26           HN       PHE  26  -6.961   1.217   4.252
  222    HA   PHE  26           HA       PHE  26  -6.696   1.086   7.111
  223    HB2  PHE  26           HB2      PHE  26  -4.781   2.646   5.350
  224    HB3  PHE  26           HB1      PHE  26  -4.423   1.731   6.810
  225    HD1  PHE  26           HD1      PHE  26  -5.978  -0.844   6.088
  226    HD2  PHE  26           HD2      PHE  26  -3.254   1.615   3.828
  227    HE1  PHE  26           HE1      PHE  26  -5.352  -2.794   4.711
  228    HE2  PHE  26           HE2      PHE  26  -2.641  -0.353   2.443
  229    HZ   PHE  26           HZ       PHE  26  -3.685  -2.556   2.896
  230   H11A  DNS  27          H22       DNS  27   4.036   3.602   5.133
  231    H12  DNS  27           H23      DNS  27   5.445   4.346   5.897
  232    H13  DNS  27           H24      DNS  27   5.059   4.714   4.204
  233    H21  DNS  27           H21      DNS  27   3.888   7.770   5.635
  234    H22  DNS  27           H19      DNS  27   4.569   6.996   4.192
  235    H23  DNS  27           H20      DNS  27   5.464   6.953   5.715
  236    H4   DNS  27           H14      DNS  27   3.150   5.702   2.997
  237    H5   DNS  27           H15      DNS  27   0.799   5.555   2.141
  238    H6   DNS  27           H16      DNS  27  -1.115   5.355   3.744
  239    HZ   DNS  27           HZ1      DNS  27  -1.432   6.850   5.049
  240    HE3  DNS  27           HE1      DNS  27  -2.699   7.608   3.350
  241    HE2  DNS  27           HE2      DNS  27  -3.184   5.925   3.376
  242    HD3  DNS  27           HD1      DNS  27  -4.602   8.231   4.737
  243    HD2  DNS  27           HD2      DNS  27  -5.153   7.342   3.317
  244    HG3  DNS  27           HG1      DNS  27  -5.068   5.237   4.816
  245    HG2  DNS  27           HG2      DNS  27  -4.930   6.351   6.176
  246    HB3  DNS  27           HB1      DNS  27  -7.036   7.464   5.426
  247    HB2  DNS  27           HB2      DNS  27  -7.200   6.243   4.163
  248    HA   DNS  27           HA       DNS  27  -7.127   5.735   7.158
  249    H    DNS  27           HN       DNS  27  -7.006   3.822   4.872
  250    H9   DNS  27           H9       DNS  27  -1.491   5.167   8.548
  251    H10  DNS  27           H10      DNS  27   0.855   5.321   9.387
  252    H11  DNS  27           H11      DNS  27   2.761   5.516   7.778
  253    H    GLY  28           HN       GLY  28  -8.874   7.490   5.389
  254    HA2  GLY  28           HA2      GLY  28 -11.405   6.153   5.054
  255    HA3  GLY  28           HA1      GLY  28 -11.358   7.016   6.591
  256    H    ARG  29           HN       ARG  29  -9.846   9.230   5.900
  257    HA   ARG  29           HA       ARG  29 -10.997  10.515   3.513
  258    HB2  ARG  29           HB2      ARG  29 -12.018  12.372   4.877
  259    HB3  ARG  29           HB1      ARG  29 -12.851  10.827   5.047
  260    HG2  ARG  29           HG2      ARG  29 -11.622  10.389   7.144
  261    HG3  ARG  29           HG1      ARG  29 -10.790  11.935   6.980
  262    HD2  ARG  29           HD2      ARG  29 -12.991  13.092   7.031
  263    HD3  ARG  29           HD1      ARG  29 -13.778  11.536   7.291
  264    HE   ARG  29           HE       ARG  29 -11.882  11.676   9.315
  265   HH11  ARG  29          HH21      ARG  29 -14.464  13.660   8.164
  266   HH12  ARG  29          HH22      ARG  29 -14.811  14.335   9.721
  267   HH21  ARG  29          HH11      ARG  29 -12.325  12.547  11.348
  268   HH22  ARG  29          HH12      ARG  29 -13.602  13.705  11.522
  Start of MODEL   11
    1    H1   GLY   1           HT1      GLY   1   9.648   1.695 -12.078
    2    H2   GLY   1           HT2      GLY   1   8.962   2.092 -10.576
    3    H3   GLY   1           HT3      GLY   1   8.633   0.586 -11.288
    4    HA2  GLY   1           HA2      GLY   1  10.747  -0.336 -10.906
    5    HA3  GLY   1           HA1      GLY   1  11.343   1.303 -10.507
    6    H    GLN   2           HN       GLN   2   9.644   2.593  -9.011
    7    HA   GLN   2           HA       GLN   2  11.341   2.219  -6.709
    8    HB2  GLN   2           HB2      GLN   2   8.689   3.674  -6.959
    9    HB3  GLN   2           HB1      GLN   2   9.815   3.827  -5.611
   10    HG2  GLN   2           HG2      GLN   2  11.547   4.683  -7.128
   11    HG3  GLN   2           HG1      GLN   2  10.454   4.493  -8.499
   12   HE21  GLN   2          HE21      GLN   2  10.427   6.068  -5.242
   13   HE22  GLN   2          HE22      GLN   2   9.613   7.462  -5.768
   14    H    GLN   3           HN       GLN   3  11.179   0.140  -5.856
   15    HA   GLN   3           HA       GLN   3   8.651  -1.220  -5.471
   16    HB2  GLN   3           HB2      GLN   3  11.351  -1.711  -4.175
   17    HB3  GLN   3           HB1      GLN   3   9.983  -2.824  -4.147
   18    HG2  GLN   3           HG2      GLN   3  10.031  -2.924  -6.624
   19    HG3  GLN   3           HG1      GLN   3  11.433  -1.853  -6.629
   20   HE21  GLN   3          HE21      GLN   3  12.692  -3.050  -4.246
   21   HE22  GLN   3          HE22      GLN   3  13.256  -4.581  -4.712
   22    H    TYR   4           HN       TYR   4   7.225  -0.915  -3.835
   23    HA   TYR   4           HA       TYR   4   7.591   1.104  -1.886
   24    HB2  TYR   4           HB2      TYR   4   5.489  -0.515  -0.908
   25    HB3  TYR   4           HB1      TYR   4   5.305   0.874  -1.966
   26    HD1  TYR   4           HD1      TYR   4   6.526  -2.672  -2.381
   27    HD2  TYR   4           HD2      TYR   4   3.903   0.423  -3.826
   28    HE1  TYR   4           HE1      TYR   4   5.757  -4.164  -4.197
   29    HE2  TYR   4           HE2      TYR   4   3.140  -1.082  -5.637
   30    HH   TYR   4           HH       TYR   4   4.312  -3.204  -6.876
   31    H    THR   5           HN       THR   5   8.723   1.028   0.001
   32    HA   THR   5           HA       THR   5   9.302  -1.657   1.264
   33    HB   THR   5           HB       THR   5  11.434  -0.830   1.903
   34    HG1  THR   5           HG1      THR   5  10.734   1.722   0.934
   35   HG21  THR   5          HG21      THR   5  12.490  -0.306  -0.174
   36   HG22  THR   5          HG22      THR   5  11.033   0.466  -0.791
   37   HG23  THR   5          HG23      THR   5  11.088  -1.289  -0.604
   38    H    ALA   6           HN       ALA   6   8.223   1.619   1.777
   39    HA   ALA   6           HA       ALA   6   8.010   1.187   4.748
   40    HB1  ALA   6           HB1      ALA   6   7.840   3.777   3.161
   41    HB2  ALA   6           HB2      ALA   6   9.317   3.177   3.927
   42    HB3  ALA   6           HB3      ALA   6   7.923   3.609   4.918
   43    H1   NAL   7           H1       NAL   7   3.266   4.764   0.957
   44    H3   NAL   7           H3       NAL   7   6.314   2.145  -0.539
   45    H4   NAL   7           H4       NAL   7   7.440   4.038  -1.676
   46    H5   NAL   7           H5       NAL   7   7.526   6.558  -2.232
   47    H6   NAL   7           H6       NAL   7   6.537   8.820  -2.031
   48    H7   NAL   7           H7       NAL   7   4.453   9.169  -0.728
   49    H8   NAL   7           H8       NAL   7   3.335   7.254   0.385
   50    H91  NAL   7           H91      NAL   7   2.961   2.361   0.701
   51    H92  NAL   7           H92      NAL   7   4.391   1.337   0.568
   52    H10  NAL   7           H10      NAL   7   3.934   3.400   2.757
   53    HN1  NAL   7           HN1      NAL   7   6.353   2.547   1.964
   54    H    ILE   8           HN       ILE   8   4.532  -0.073   2.276
   55    HA   ILE   8           HA       ILE   8   2.547  -0.666   4.405
   56    HB   ILE   8           HB       ILE   8   1.576  -2.385   2.572
   57   HG12  ILE   8          HG12      ILE   8   1.390  -1.323   0.358
   58   HG13  ILE   8          HG11      ILE   8   2.402   0.015   0.882
   59   HG21  ILE   8          HG21      ILE   8   0.794   0.549   2.582
   60   HG22  ILE   8          HG22      ILE   8   0.266  -0.637   3.786
   61   HG23  ILE   8          HG23      ILE   8  -0.226  -0.809   2.101
   62   HD11  ILE   8          HD11      ILE   8   4.333  -1.392   1.006
   63   HD12  ILE   8          HD12      ILE   8   3.531  -1.784  -0.512
   64   HD13  ILE   8          HD13      ILE   8   3.353  -2.852   0.868
   65    H    LYS   9           HN       LYS   9   3.740  -1.891   5.708
   66    HA   LYS   9           HA       LYS   9   5.754  -3.741   4.652
   67    HB2  LYS   9           HB2      LYS   9   6.267  -2.244   6.594
   68    HB3  LYS   9           HB1      LYS   9   5.074  -3.138   7.537
   69    HG2  LYS   9           HG2      LYS   9   6.333  -5.202   7.268
   70    HG3  LYS   9           HG1      LYS   9   7.473  -4.407   6.183
   71    HD2  LYS   9           HD2      LYS   9   8.113  -2.865   8.029
   72    HD3  LYS   9           HD1      LYS   9   7.033  -3.748   9.109
   73    HE2  LYS   9           HE2      LYS   9   8.316  -5.822   8.689
   74    HE3  LYS   9           HE1      LYS   9   9.408  -4.924   7.635
   75    HZ1  LYS   9           HZ1      LYS   9  10.573  -4.409   9.429
   76    HZ2  LYS   9           HZ2      LYS   9   9.425  -5.127  10.456
   77    HZ3  LYS   9           HZ3      LYS   9   9.260  -3.499   9.998
   78    H    GLY  10           HN       GLY  10   5.585  -5.943   4.718
   79    HA2  GLY  10           HA2      GLY  10   4.758  -8.076   5.280
   80    HA3  GLY  10           HA1      GLY  10   3.639  -7.320   6.407
   81    H    ARG  11           HN       ARG  11   2.742  -5.530   4.024
   82    HA   ARG  11           HA       ARG  11   1.150  -7.583   2.497
   83    HB2  ARG  11           HB2      ARG  11   0.074  -5.046   3.771
   84    HB3  ARG  11           HB1      ARG  11  -0.841  -6.139   2.733
   85    HG2  ARG  11           HG2      ARG  11  -0.436  -7.976   4.348
   86    HG3  ARG  11           HG1      ARG  11   0.408  -6.850   5.405
   87    HD2  ARG  11           HD2      ARG  11  -1.808  -5.433   5.239
   88    HD3  ARG  11           HD1      ARG  11  -2.540  -6.955   4.739
   89    HE   ARG  11           HE       ARG  11  -1.892  -6.187   7.413
   90   HH11  ARG  11          HH21      ARG  11  -1.604  -8.901   5.294
   91   HH12  ARG  11          HH22      ARG  11  -1.293 -10.020   6.575
   92   HH21  ARG  11          HH11      ARG  11  -1.514  -7.639   9.076
   93   HH22  ARG  11          HH12      ARG  11  -1.251  -9.311   8.710
   94    H    THR  12           HN       THR  12   2.270  -7.217   0.546
   95    HA   THR  12           HA       THR  12   2.334  -4.452  -0.505
   96    HB   THR  12           HB       THR  12   3.822  -5.963  -2.295
   97    HG1  THR  12           HG1      THR  12   4.404  -7.709  -1.339
   98   HG21  THR  12          HG21      THR  12   4.827  -4.649   0.252
   99   HG22  THR  12          HG22      THR  12   4.520  -3.826  -1.276
  100   HG23  THR  12          HG23      THR  12   5.806  -5.030  -1.166
  101    H    PHE  13           HN       PHE  13   1.793  -4.157  -2.760
  102    HA   PHE  13           HA       PHE  13  -0.358  -6.034  -3.709
  103    HB2  PHE  13           HB2      PHE  13  -0.164  -3.029  -4.069
  104    HB3  PHE  13           HB1      PHE  13  -1.508  -4.062  -4.561
  105    HD1  PHE  13           HD1      PHE  13   0.417  -2.822  -1.608
  106    HD2  PHE  13           HD2      PHE  13  -3.189  -4.721  -2.978
  107    HE1  PHE  13           HE1      PHE  13  -0.521  -2.723   0.684
  108    HE2  PHE  13           HE2      PHE  13  -4.133  -4.570  -0.697
  109    HZ   PHE  13           HZ       PHE  13  -2.792  -3.559   1.126
  110    H    ARG  14           HN       ARG  14  -0.098  -6.799  -5.753
  111    HA   ARG  14           HA       ARG  14   2.329  -6.351  -7.211
  112    HB2  ARG  14           HB2      ARG  14  -0.356  -7.520  -8.026
  113    HB3  ARG  14           HB1      ARG  14   0.990  -7.402  -9.156
  114    HG2  ARG  14           HG2      ARG  14   0.906  -9.627  -8.075
  115    HG3  ARG  14           HG1      ARG  14   2.393  -8.769  -7.682
  116    HD2  ARG  14           HD2      ARG  14   1.659  -8.283  -5.473
  117    HD3  ARG  14           HD1      ARG  14  -0.027  -8.639  -5.863
  118    HE   ARG  14           HE       ARG  14   1.289 -11.040  -6.316
  119   HH11  ARG  14          HH21      ARG  14   1.017  -8.784  -3.715
  120   HH12  ARG  14          HH22      ARG  14   1.206  -9.987  -2.481
  121   HH21  ARG  14          HH11      ARG  14   1.535 -12.614  -4.719
  122   HH22  ARG  14          HH12      ARG  14   1.499 -12.152  -3.049
  123    H    ASN  15           HN       ASN  15  -0.948  -5.060  -7.516
  124    HA   ASN  15           HA       ASN  15   0.045  -2.940  -9.404
  125    HB2  ASN  15           HB2      ASN  15  -2.593  -2.565  -9.543
  126    HB3  ASN  15           HB1      ASN  15  -1.803  -3.790 -10.536
  127   HD21  ASN  15          HD21      ASN  15  -4.059  -4.765 -10.476
  128   HD22  ASN  15          HD22      ASN  15  -4.446  -5.788  -9.179
  129    H    GLU  16           HN       GLU  16   0.240  -0.942  -8.610
  130    HA   GLU  16           HA       GLU  16  -0.265  -0.354  -5.876
  131    HB2  GLU  16           HB2      GLU  16   1.255   0.864  -7.656
  132    HB3  GLU  16           HB1      GLU  16  -0.195   1.783  -8.036
  133    HG2  GLU  16           HG2      GLU  16   1.034   1.558  -5.275
  134    HG3  GLU  16           HG1      GLU  16   1.264   2.919  -6.367
  135    H    LYS  17           HN       LYS  17  -2.262  -0.365  -8.673
  136    HA   LYS  17           HA       LYS  17  -4.318   1.397  -8.018
  137    HB2  LYS  17           HB2      LYS  17  -4.095   0.009 -10.136
  138    HB3  LYS  17           HB1      LYS  17  -4.718  -1.357  -9.219
  139    HG2  LYS  17           HG2      LYS  17  -6.809  -0.203  -8.786
  140    HG3  LYS  17           HG1      LYS  17  -6.186   1.287  -9.481
  141    HD2  LYS  17           HD2      LYS  17  -7.557   0.334 -11.185
  142    HD3  LYS  17           HD1      LYS  17  -5.903  -0.002 -11.681
  143    HE2  LYS  17           HE2      LYS  17  -6.069  -2.295 -10.994
  144    HE3  LYS  17           HE1      LYS  17  -7.566  -1.997 -10.110
  145    HZ1  LYS  17           HZ1      LYS  17  -8.689  -1.545 -12.161
  146    HZ2  LYS  17           HZ2      LYS  17  -7.918  -3.053 -12.281
  147    HZ3  LYS  17           HZ3      LYS  17  -7.249  -1.692 -13.044
  148    H    GLU  18           HN       GLU  18  -3.944  -2.019  -7.056
  149    HA   GLU  18           HA       GLU  18  -6.298  -2.097  -5.452
  150    HB2  GLU  18           HB2      GLU  18  -3.793  -3.776  -5.390
  151    HB3  GLU  18           HB1      GLU  18  -5.239  -4.138  -4.447
  152    HG2  GLU  18           HG2      GLU  18  -5.242  -3.830  -7.464
  153    HG3  GLU  18           HG1      GLU  18  -5.074  -5.382  -6.644
  154    H    LEU  19           HN       LEU  19  -2.974  -1.141  -4.783
  155    HA   LEU  19           HA       LEU  19  -3.331  -1.020  -1.923
  156    HB2  LEU  19           HB2      LEU  19  -1.078  -1.059  -2.693
  157    HB3  LEU  19           HB1      LEU  19  -1.356   0.236  -3.832
  158    HG   LEU  19           HG       LEU  19  -1.576   1.821  -1.935
  159   HD11  LEU  19          HD11      LEU  19  -0.780  -0.526  -0.223
  160   HD12  LEU  19          HD12      LEU  19  -2.364   0.228  -0.197
  161   HD13  LEU  19          HD13      LEU  19  -0.951   1.129   0.328
  162   HD21  LEU  19          HD21      LEU  19   0.929   0.140  -1.984
  163   HD22  LEU  19          HD22      LEU  19   0.816   1.722  -1.208
  164   HD23  LEU  19          HD23      LEU  19   0.598   1.576  -2.949
  165    H    ARG  20           HN       ARG  20  -3.931   1.175  -4.611
  166    HA   ARG  20           HA       ARG  20  -4.421   3.550  -3.104
  167    HB2  ARG  20           HB2      ARG  20  -4.198   3.402  -5.619
  168    HB3  ARG  20           HB1      ARG  20  -5.818   2.710  -5.661
  169    HG2  ARG  20           HG2      ARG  20  -6.663   4.755  -4.481
  170    HG3  ARG  20           HG1      ARG  20  -5.053   5.454  -4.607
  171    HD2  ARG  20           HD2      ARG  20  -5.313   4.928  -7.178
  172    HD3  ARG  20           HD1      ARG  20  -7.036   4.879  -6.814
  173    HE   ARG  20           HE       ARG  20  -5.437   7.229  -7.140
  174   HH11  ARG  20          HH21      ARG  20  -7.854   5.937  -5.034
  175   HH12  ARG  20          HH22      ARG  20  -8.238   7.472  -4.337
  176   HH21  ARG  20          HH11      ARG  20  -5.949   9.222  -6.255
  177   HH22  ARG  20          HH12      ARG  20  -7.171   9.329  -5.031
  178    H    ASP  21           HN       ASP  21  -6.373   0.795  -3.930
  179    HA   ASP  21           HA       ASP  21  -8.832   1.818  -2.861
  180    HB2  ASP  21           HB2      ASP  21  -8.831   0.074  -4.598
  181    HB3  ASP  21           HB1      ASP  21  -8.021  -1.032  -3.490
  182    H    PHE  22           HN       PHE  22  -6.504  -0.642  -1.719
  183    HA   PHE  22           HA       PHE  22  -7.761  -1.015   0.788
  184    HB2  PHE  22           HB2      PHE  22  -5.036  -1.564  -0.327
  185    HB3  PHE  22           HB1      PHE  22  -5.211  -1.638   1.421
  186    HD1  PHE  22           HD2      PHE  22  -7.585  -2.604  -1.322
  187    HD2  PHE  22           HD1      PHE  22  -5.200  -3.942   1.997
  188    HE1  PHE  22           HE2      PHE  22  -8.547  -4.868  -1.535
  189    HE2  PHE  22           HE1      PHE  22  -6.169  -6.200   1.777
  190    HZ   PHE  22           HZ       PHE  22  -7.844  -6.673   0.012
  191    H    ILE  23           HN       ILE  23  -5.718   1.480  -0.439
  192    HA   ILE  23           HA       ILE  23  -4.851   2.574   2.072
  193    HB   ILE  23           HB       ILE  23  -4.993   3.457  -0.776
  194   HG12  ILE  23          HG12      ILE  23  -2.883   3.769   1.398
  195   HG13  ILE  23          HG11      ILE  23  -2.958   2.454   0.239
  196   HG21  ILE  23          HG21      ILE  23  -6.039   5.409   0.114
  197   HG22  ILE  23          HG22      ILE  23  -4.357   5.833  -0.141
  198   HG23  ILE  23          HG23      ILE  23  -4.928   5.460   1.484
  199   HD11  ILE  23          HD11      ILE  23  -2.849   4.356  -1.552
  200   HD12  ILE  23          HD12      ILE  23  -1.375   3.888  -0.718
  201   HD13  ILE  23          HD13      ILE  23  -2.248   5.335  -0.222
  202    H    GLU  24           HN       GLU  24  -7.654   2.974   0.047
  203    HA   GLU  24           HA       GLU  24  -8.891   5.037   1.580
  204    HB2  GLU  24           HB2      GLU  24 -10.140   2.917  -0.186
  205    HB3  GLU  24           HB1      GLU  24 -11.058   4.216   0.557
  206    HG2  GLU  24           HG2      GLU  24  -8.655   4.704  -1.229
  207    HG3  GLU  24           HG1      GLU  24 -10.312   4.671  -1.824
  208    H    LYS  25           HN       LYS  25  -8.591   1.599   2.029
  209    HA   LYS  25           HA       LYS  25 -10.701   1.359   4.019
  210    HB2  LYS  25           HB2      LYS  25  -9.702  -0.555   2.645
  211    HB3  LYS  25           HB1      LYS  25  -8.290  -0.453   3.690
  212    HG2  LYS  25           HG2      LYS  25  -9.543  -2.101   4.801
  213    HG3  LYS  25           HG1      LYS  25 -10.063  -0.654   5.657
  214    HD2  LYS  25           HD2      LYS  25 -12.082  -0.530   4.247
  215    HD3  LYS  25           HD1      LYS  25 -11.538  -1.930   3.326
  216    HE2  LYS  25           HE2      LYS  25 -13.147  -2.673   4.984
  217    HE3  LYS  25           HE1      LYS  25 -11.550  -3.259   5.450
  218    HZ1  LYS  25           HZ1      LYS  25 -12.146  -0.649   6.481
  219    HZ2  LYS  25           HZ2      LYS  25 -11.561  -2.026   7.286
  220    HZ3  LYS  25           HZ3      LYS  25 -13.230  -1.833   7.029
  221    H    PHE  26           HN       PHE  26  -7.122   1.642   4.213
  222    HA   PHE  26           HA       PHE  26  -7.006   1.636   7.074
  223    HB2  PHE  26           HB2      PHE  26  -5.118   3.285   5.366
  224    HB3  PHE  26           HB1      PHE  26  -4.770   2.439   6.869
  225    HD1  PHE  26           HD1      PHE  26  -6.114  -0.262   6.137
  226    HD2  PHE  26           HD2      PHE  26  -3.436   2.320   3.960
  227    HE1  PHE  26           HE1      PHE  26  -5.289  -2.197   4.847
  228    HE2  PHE  26           HE2      PHE  26  -2.623   0.363   2.661
  229    HZ   PHE  26           HZ       PHE  26  -3.545  -1.890   3.116
  230   H11A  DNS  27          H22       DNS  27   4.547   3.701   5.356
  231    H12  DNS  27           H23      DNS  27   3.953   4.698   6.687
  232    H13  DNS  27           H24      DNS  27   3.744   5.244   5.009
  233    H21  DNS  27           H21      DNS  27   3.289   1.784   6.039
  234    H22  DNS  27           H19      DNS  27   1.552   1.922   6.376
  235    H23  DNS  27           H20      DNS  27   2.720   2.690   7.457
  236    H4   DNS  27           H14      DNS  27   2.191   4.769   8.092
  237    H5   DNS  27           H15      DNS  27   0.300   6.273   8.764
  238    H6   DNS  27           H16      DNS  27  -1.496   6.852   7.117
  239    HZ   DNS  27           HZ1      DNS  27  -4.222   6.167   3.540
  240    HE3  DNS  27           HE1      DNS  27  -4.289   8.984   4.017
  241    HE2  DNS  27           HE2      DNS  27  -4.248   8.552   2.316
  242    HD3  DNS  27           HD1      DNS  27  -6.559   8.737   3.327
  243    HD2  DNS  27           HD2      DNS  27  -6.221   7.211   2.506
  244    HG3  DNS  27           HG1      DNS  27  -5.767   6.111   4.624
  245    HG2  DNS  27           HG2      DNS  27  -5.924   7.636   5.497
  246    HB3  DNS  27           HB1      DNS  27  -8.272   7.793   4.916
  247    HB2  DNS  27           HB2      DNS  27  -8.155   6.384   3.862
  248    HA   DNS  27           HA       DNS  27  -7.600   6.319   6.846
  249    H    DNS  27           HN       DNS  27  -7.369   4.294   4.739
  250    H9   DNS  27           H9       DNS  27  -2.353   5.717   2.519
  251    H10  DNS  27           H10      DNS  27  -0.473   4.220   1.857
  252    H11  DNS  27           H11      DNS  27   1.321   3.640   3.503
  253    H    GLY  28           HN       GLY  28  -9.818   7.799   5.911
  254    HA2  GLY  28           HA2      GLY  28 -12.218   6.394   5.501
  255    HA3  GLY  28           HA1      GLY  28 -11.977   6.451   7.248
  256    H    ARG  29           HN       ARG  29 -11.141   8.830   7.902
  257    HA   ARG  29           HA       ARG  29 -13.360  10.596   7.343
  258    HB2  ARG  29           HB2      ARG  29 -10.696  11.082   8.712
  259    HB3  ARG  29           HB1      ARG  29 -12.022  12.246   8.677
  260    HG2  ARG  29           HG2      ARG  29 -13.476  10.737   9.880
  261    HG3  ARG  29           HG1      ARG  29 -12.305   9.424   9.754
  262    HD2  ARG  29           HD2      ARG  29 -12.322  10.582  11.995
  263    HD3  ARG  29           HD1      ARG  29 -10.750  10.572  11.196
  264    HE   ARG  29           HE       ARG  29 -11.907  12.962  10.377
  265   HH11  ARG  29          HH21      ARG  29 -11.253  11.402  13.389
  266   HH12  ARG  29          HH22      ARG  29 -11.031  12.884  14.256
  267   HH21  ARG  29          HH11      ARG  29 -11.620  14.899  11.498
  268   HH22  ARG  29          HH12      ARG  29 -11.239  14.862  13.187
  Start of MODEL   12
    1    H1   GLY   1           HT1      GLY   1  12.117   2.424 -11.201
    2    H2   GLY   1           HT2      GLY   1  11.421   2.854  -9.712
    3    H3   GLY   1           HT3      GLY   1  10.488   2.064 -10.891
    4    HA2  GLY   1           HA2      GLY   1  11.370  -0.033 -10.566
    5    HA3  GLY   1           HA1      GLY   1  12.813   0.712  -9.817
    6    H    GLN   2           HN       GLN   2  11.805   2.571  -8.095
    7    HA   GLN   2           HA       GLN   2  12.748   0.981  -5.891
    8    HB2  GLN   2           HB2      GLN   2  11.142   3.558  -5.828
    9    HB3  GLN   2           HB1      GLN   2  12.084   2.890  -4.495
   10    HG2  GLN   2           HG2      GLN   2  13.260   3.657  -7.184
   11    HG3  GLN   2           HG1      GLN   2  13.282   4.700  -5.763
   12   HE21  GLN   2          HE21      GLN   2  13.844   2.806  -3.732
   13   HE22  GLN   2          HE22      GLN   2  15.386   2.148  -3.999
   14    H    GLN   3           HN       GLN   3  11.562  -0.783  -5.274
   15    HA   GLN   3           HA       GLN   3   8.684  -0.907  -5.494
   16    HB2  GLN   3           HB2      GLN   3   8.891  -2.994  -4.167
   17    HB3  GLN   3           HB1      GLN   3   9.987  -2.958  -5.548
   18    HG2  GLN   3           HG2      GLN   3  11.804  -2.147  -4.024
   19    HG3  GLN   3           HG1      GLN   3  10.702  -2.356  -2.662
   20   HE21  GLN   3          HE21      GLN   3   9.946  -4.609  -2.210
   21   HE22  GLN   3          HE22      GLN   3  10.888  -5.927  -2.716
   22    H    TYR   4           HN       TYR   4   7.157  -0.853  -3.825
   23    HA   TYR   4           HA       TYR   4   7.506   1.161  -1.880
   24    HB2  TYR   4           HB2      TYR   4   5.311  -0.763  -1.348
   25    HB3  TYR   4           HB1      TYR   4   5.206   0.961  -1.635
   26    HD1  TYR   4           HD2      TYR   4   6.342   1.379  -4.254
   27    HD2  TYR   4           HD1      TYR   4   3.878  -1.875  -2.889
   28    HE1  TYR   4           HE2      TYR   4   5.611   0.949  -6.579
   29    HE2  TYR   4           HE1      TYR   4   3.154  -2.295  -5.218
   30    HH   TYR   4           HH       TYR   4   3.208  -1.572  -7.319
   31    H    THR   5           HN       THR   5   8.595   1.010   0.060
   32    HA   THR   5           HA       THR   5   8.846  -1.691   1.393
   33    HB   THR   5           HB       THR   5  11.013  -1.070   2.125
   34    HG1  THR   5           HG1      THR   5  11.732   1.139   1.680
   35   HG21  THR   5          HG21      THR   5  10.904   0.257  -0.580
   36   HG22  THR   5          HG22      THR   5  10.727  -1.490  -0.412
   37   HG23  THR   5          HG23      THR   5  12.216  -0.698   0.105
   38    H    ALA   6           HN       ALA   6   8.076   1.684   1.818
   39    HA   ALA   6           HA       ALA   6   7.753   1.361   4.785
   40    HB1  ALA   6           HB1      ALA   6   9.079   3.307   3.881
   41    HB2  ALA   6           HB2      ALA   6   7.680   3.792   4.839
   42    HB3  ALA   6           HB3      ALA   6   7.611   3.877   3.075
   43    H1   NAL   7           H1       NAL   7   3.078   4.868   0.774
   44    H3   NAL   7           H3       NAL   7   6.305   2.309  -0.436
   45    H4   NAL   7           H4       NAL   7   7.465   4.218  -1.510
   46    H5   NAL   7           H5       NAL   7   7.534   6.732  -2.094
   47    H6   NAL   7           H6       NAL   7   6.478   8.971  -2.004
   48    H7   NAL   7           H7       NAL   7   4.288   9.284  -0.879
   49    H8   NAL   7           H8       NAL   7   3.129   7.356   0.167
   50    H91  NAL   7           H91      NAL   7   2.845   2.473   0.571
   51    H92  NAL   7           H92      NAL   7   4.294   1.468   0.519
   52    H10  NAL   7           H10      NAL   7   3.729   3.560   2.655
   53    HN1  NAL   7           HN1      NAL   7   6.166   2.697   1.963
   54    H    ILE   8           HN       ILE   8   4.350   0.073   2.297
   55    HA   ILE   8           HA       ILE   8   2.283  -0.461   4.352
   56    HB   ILE   8           HB       ILE   8   1.403  -2.261   2.529
   57   HG12  ILE   8          HG12      ILE   8   1.257  -1.232   0.298
   58   HG13  ILE   8          HG11      ILE   8   2.228   0.133   0.828
   59   HG21  ILE   8          HG21      ILE   8   0.564   0.663   2.475
   60   HG22  ILE   8          HG22      ILE   8   0.018  -0.520   3.673
   61   HG23  ILE   8          HG23      ILE   8  -0.415  -0.720   1.977
   62   HD11  ILE   8          HD11      ILE   8   3.394  -1.689  -0.511
   63   HD12  ILE   8          HD12      ILE   8   3.243  -2.708   0.901
   64   HD13  ILE   8          HD13      ILE   8   4.185  -1.218   0.991
   65    H    LYS   9           HN       LYS   9   3.306  -1.711   5.726
   66    HA   LYS   9           HA       LYS   9   5.426  -3.557   4.856
   67    HB2  LYS   9           HB2      LYS   9   4.616  -2.507   7.575
   68    HB3  LYS   9           HB1      LYS   9   5.860  -3.737   7.349
   69    HG2  LYS   9           HG2      LYS   9   7.302  -2.245   6.185
   70    HG3  LYS   9           HG1      LYS   9   6.011  -1.088   5.876
   71    HD2  LYS   9           HD2      LYS   9   7.544  -0.309   7.664
   72    HD3  LYS   9           HD1      LYS   9   5.899  -0.525   8.257
   73    HE2  LYS   9           HE2      LYS   9   6.461  -2.584   9.344
   74    HE3  LYS   9           HE1      LYS   9   8.013  -2.682   8.510
   75    HZ1  LYS   9           HZ1      LYS   9   8.917  -1.042   9.807
   76    HZ2  LYS   9           HZ2      LYS   9   7.893  -1.804  10.929
   77    HZ3  LYS   9           HZ3      LYS   9   7.419  -0.348  10.193
   78    H    GLY  10           HN       GLY  10   5.382  -5.777   5.390
   79    HA2  GLY  10           HA2      GLY  10   4.441  -7.856   5.943
   80    HA3  GLY  10           HA1      GLY  10   3.235  -6.996   6.898
   81    H    ARG  11           HN       ARG  11   2.624  -5.373   4.360
   82    HA   ARG  11           HA       ARG  11   1.137  -7.438   2.770
   83    HB2  ARG  11           HB2      ARG  11   0.002  -4.774   3.696
   84    HB3  ARG  11           HB1      ARG  11  -0.836  -5.988   2.741
   85    HG2  ARG  11           HG2      ARG  11   0.231  -6.501   5.535
   86    HG3  ARG  11           HG1      ARG  11  -1.408  -5.966   5.224
   87    HD2  ARG  11           HD2      ARG  11  -0.129  -8.574   4.385
   88    HD3  ARG  11           HD1      ARG  11  -1.494  -8.358   5.463
   89    HE   ARG  11           HE       ARG  11  -1.577  -8.614   2.593
   90   HH11  ARG  11          HH21      ARG  11  -3.005  -6.807   5.168
   91   HH12  ARG  11          HH22      ARG  11  -4.357  -6.295   4.217
   92   HH21  ARG  11          HH11      ARG  11  -3.333  -7.966   1.365
   93   HH22  ARG  11          HH12      ARG  11  -4.545  -6.953   2.073
   94    H    THR  12           HN       THR  12   1.336  -7.060   0.583
   95    HA   THR  12           HA       THR  12   2.087  -4.385  -0.372
   96    HB   THR  12           HB       THR  12   3.685  -6.010  -1.984
   97    HG1  THR  12           HG1      THR  12   3.164  -7.683  -0.383
   98   HG21  THR  12          HG21      THR  12   5.589  -5.073  -0.782
   99   HG22  THR  12          HG22      THR  12   4.563  -4.675   0.596
  100   HG23  THR  12          HG23      THR  12   4.337  -3.839  -0.943
  101    H    PHE  13           HN       PHE  13   1.780  -4.171  -2.717
  102    HA   PHE  13           HA       PHE  13  -0.324  -6.045  -3.776
  103    HB2  PHE  13           HB2      PHE  13  -0.154  -3.045  -4.176
  104    HB3  PHE  13           HB1      PHE  13  -1.468  -4.114  -4.684
  105    HD1  PHE  13           HD1      PHE  13   0.336  -2.751  -1.713
  106    HD2  PHE  13           HD2      PHE  13  -3.174  -4.781  -3.132
  107    HE1  PHE  13           HE1      PHE  13  -0.675  -2.611   0.545
  108    HE2  PHE  13           HE2      PHE  13  -4.196  -4.584  -0.887
  109    HZ   PHE  13           HZ       PHE  13  -2.935  -3.485   0.941
  110    H    ARG  14           HN       ARG  14   0.043  -6.806  -5.791
  111    HA   ARG  14           HA       ARG  14   2.550  -6.296  -7.126
  112    HB2  ARG  14           HB2      ARG  14   1.170  -8.409  -7.417
  113    HB3  ARG  14           HB1      ARG  14   0.030  -7.465  -8.377
  114    HG2  ARG  14           HG2      ARG  14   1.887  -6.867  -9.928
  115    HG3  ARG  14           HG1      ARG  14   2.970  -7.899  -9.001
  116    HD2  ARG  14           HD2      ARG  14   1.078  -9.731  -9.446
  117    HD3  ARG  14           HD1      ARG  14   0.699  -8.693 -10.818
  118    HE   ARG  14           HE       ARG  14   2.854 -10.547 -10.670
  119   HH11  ARG  14          HH21      ARG  14   2.267  -7.267 -11.584
  120   HH12  ARG  14          HH22      ARG  14   3.739  -7.126 -12.480
  121   HH21  ARG  14          HH11      ARG  14   4.750 -10.377 -11.852
  122   HH22  ARG  14          HH12      ARG  14   5.136  -8.885 -12.641
  123    H    ASN  15           HN       ASN  15  -0.769  -5.192  -7.589
  124    HA   ASN  15           HA       ASN  15   0.151  -3.112  -9.549
  125    HB2  ASN  15           HB2      ASN  15  -2.450  -2.841  -9.777
  126    HB3  ASN  15           HB1      ASN  15  -1.656  -4.188 -10.596
  127   HD21  ASN  15          HD21      ASN  15  -4.009  -5.049 -10.373
  128   HD22  ASN  15          HD22      ASN  15  -4.362  -5.931  -8.967
  129    H    GLU  16           HN       GLU  16   0.269  -1.071  -8.821
  130    HA   GLU  16           HA       GLU  16  -0.312  -0.429  -6.112
  131    HB2  GLU  16           HB2      GLU  16   1.300   0.888  -7.420
  132    HB3  GLU  16           HB1      GLU  16   0.020   1.397  -8.519
  133    HG2  GLU  16           HG2      GLU  16  -1.080   2.660  -6.783
  134    HG3  GLU  16           HG1      GLU  16  -0.017   1.991  -5.546
  135    H    LYS  17           HN       LYS  17  -2.270  -0.610  -8.929
  136    HA   LYS  17           HA       LYS  17  -4.355   1.161  -8.374
  137    HB2  LYS  17           HB2      LYS  17  -4.115  -0.285 -10.432
  138    HB3  LYS  17           HB1      LYS  17  -4.676  -1.646  -9.466
  139    HG2  LYS  17           HG2      LYS  17  -6.802  -0.537  -9.035
  140    HG3  LYS  17           HG1      LYS  17  -6.239   0.931  -9.825
  141    HD2  LYS  17           HD2      LYS  17  -7.599  -0.158 -11.454
  142    HD3  LYS  17           HD1      LYS  17  -5.943  -0.482 -11.952
  143    HE2  LYS  17           HE2      LYS  17  -6.041  -2.734 -11.130
  144    HE3  LYS  17           HE1      LYS  17  -7.531  -2.422 -10.238
  145    HZ1  LYS  17           HZ1      LYS  17  -8.364  -1.785 -12.626
  146    HZ2  LYS  17           HZ2      LYS  17  -8.369  -3.396 -12.088
  147    HZ3  LYS  17           HZ3      LYS  17  -7.126  -2.841 -13.103
  148    H    GLU  18           HN       GLU  18  -3.910  -2.189  -7.250
  149    HA   GLU  18           HA       GLU  18  -6.285  -2.239  -5.660
  150    HB2  GLU  18           HB2      GLU  18  -3.763  -3.897  -5.542
  151    HB3  GLU  18           HB1      GLU  18  -5.217  -4.240  -4.599
  152    HG2  GLU  18           HG2      GLU  18  -6.525  -4.546  -6.615
  153    HG3  GLU  18           HG1      GLU  18  -5.175  -4.022  -7.621
  154    H    LEU  19           HN       LEU  19  -2.983  -1.195  -5.025
  155    HA   LEU  19           HA       LEU  19  -3.341  -1.003  -2.166
  156    HB2  LEU  19           HB2      LEU  19  -1.088  -1.061  -2.936
  157    HB3  LEU  19           HB1      LEU  19  -1.377   0.206  -4.107
  158    HG   LEU  19           HG       LEU  19  -1.598   1.843  -2.256
  159   HD11  LEU  19          HD11      LEU  19  -0.828  -0.472  -0.497
  160   HD12  LEU  19          HD12      LEU  19  -2.392   0.315  -0.478
  161   HD13  LEU  19          HD13      LEU  19  -0.955   1.195   0.024
  162   HD21  LEU  19          HD21      LEU  19   0.588   1.489  -3.288
  163   HD22  LEU  19          HD22      LEU  19   0.911   0.166  -2.170
  164   HD23  LEU  19          HD23      LEU  19   0.773   1.818  -1.566
  165    H    ARG  20           HN       ARG  20  -3.928   1.122  -4.917
  166    HA   ARG  20           HA       ARG  20  -4.422   3.537  -3.482
  167    HB2  ARG  20           HB2      ARG  20  -4.205   3.357  -5.978
  168    HB3  ARG  20           HB1      ARG  20  -5.793   2.593  -6.016
  169    HG2  ARG  20           HG2      ARG  20  -6.795   4.604  -4.997
  170    HG3  ARG  20           HG1      ARG  20  -5.206   5.369  -4.934
  171    HD2  ARG  20           HD2      ARG  20  -5.040   5.180  -7.403
  172    HD3  ARG  20           HD1      ARG  20  -6.661   4.486  -7.442
  173    HE   ARG  20           HE       ARG  20  -6.996   6.879  -6.078
  174   HH11  ARG  20          HH21      ARG  20  -5.639   5.898  -9.099
  175   HH12  ARG  20          HH22      ARG  20  -6.027   7.381  -9.903
  176   HH21  ARG  20          HH11      ARG  20  -7.507   8.816  -7.117
  177   HH22  ARG  20          HH12      ARG  20  -7.084   9.033  -8.782
  178    H    ASP  21           HN       ASP  21  -6.388   0.768  -4.231
  179    HA   ASP  21           HA       ASP  21  -8.837   1.830  -3.178
  180    HB2  ASP  21           HB2      ASP  21  -7.987  -1.003  -3.827
  181    HB3  ASP  21           HB1      ASP  21  -9.618  -0.553  -3.328
  182    H    PHE  22           HN       PHE  22  -6.519  -0.618  -1.984
  183    HA   PHE  22           HA       PHE  22  -7.766  -0.916   0.538
  184    HB2  PHE  22           HB2      PHE  22  -5.048  -1.507  -0.568
  185    HB3  PHE  22           HB1      PHE  22  -5.215  -1.530   1.179
  186    HD1  PHE  22           HD2      PHE  22  -7.605  -2.562  -1.523
  187    HD2  PHE  22           HD1      PHE  22  -5.206  -3.819   1.819
  188    HE1  PHE  22           HE2      PHE  22  -8.577  -4.829  -1.669
  189    HE2  PHE  22           HE1      PHE  22  -6.183  -6.079   1.664
  190    HZ   PHE  22           HZ       PHE  22  -7.871  -6.593  -0.078
  191    H    ILE  23           HN       ILE  23  -5.724   1.543  -0.755
  192    HA   ILE  23           HA       ILE  23  -4.844   2.696   1.728
  193    HB   ILE  23           HB       ILE  23  -4.978   3.503  -1.142
  194   HG12  ILE  23          HG12      ILE  23  -2.881   3.901   1.029
  195   HG13  ILE  23          HG11      ILE  23  -2.948   2.539  -0.072
  196   HG21  ILE  23          HG21      ILE  23  -4.926   5.567   1.061
  197   HG22  ILE  23          HG22      ILE  23  -6.034   5.477  -0.313
  198   HG23  ILE  23          HG23      ILE  23  -4.352   5.899  -0.572
  199   HD11  ILE  23          HD11      ILE  23  -2.820   4.322  -1.953
  200   HD12  ILE  23          HD12      ILE  23  -1.353   3.959  -1.056
  201   HD13  ILE  23          HD13      ILE  23  -2.284   5.407  -0.678
  202    H    GLU  24           HN       GLU  24  -7.648   3.059  -0.306
  203    HA   GLU  24           HA       GLU  24  -8.869   5.179   1.153
  204    HB2  GLU  24           HB2      GLU  24 -10.142   2.991  -0.510
  205    HB3  GLU  24           HB1      GLU  24 -11.051   4.323   0.186
  206    HG2  GLU  24           HG2      GLU  24  -8.662   4.726  -1.641
  207    HG3  GLU  24           HG1      GLU  24 -10.325   4.676  -2.219
  208    H    LYS  25           HN       LYS  25  -8.588   1.763   1.747
  209    HA   LYS  25           HA       LYS  25 -10.682   1.636   3.771
  210    HB2  LYS  25           HB2      LYS  25  -9.794  -0.353   2.478
  211    HB3  LYS  25           HB1      LYS  25  -8.314  -0.234   3.426
  212    HG2  LYS  25           HG2      LYS  25  -9.659  -0.490   5.510
  213    HG3  LYS  25           HG1      LYS  25 -11.105  -0.702   4.522
  214    HD2  LYS  25           HD2      LYS  25 -10.145  -2.686   3.474
  215    HD3  LYS  25           HD1      LYS  25  -8.636  -2.453   4.359
  216    HE2  LYS  25           HE2      LYS  25 -11.334  -2.903   5.668
  217    HE3  LYS  25           HE1      LYS  25 -10.126  -4.162   5.416
  218    HZ1  LYS  25           HZ1      LYS  25  -8.714  -2.173   6.588
  219    HZ2  LYS  25           HZ2      LYS  25  -9.342  -3.533   7.387
  220    HZ3  LYS  25           HZ3      LYS  25 -10.208  -2.071   7.383
  221    H    PHE  26           HN       PHE  26  -7.091   1.855   3.905
  222    HA   PHE  26           HA       PHE  26  -6.934   1.922   6.761
  223    HB2  PHE  26           HB2      PHE  26  -5.032   3.482   4.988
  224    HB3  PHE  26           HB1      PHE  26  -4.689   2.677   6.514
  225    HD1  PHE  26           HD1      PHE  26  -6.077  -0.019   5.897
  226    HD2  PHE  26           HD2      PHE  26  -3.400   2.442   3.586
  227    HE1  PHE  26           HE1      PHE  26  -5.299  -2.011   4.668
  228    HE2  PHE  26           HE2      PHE  26  -2.633   0.429   2.350
  229    HZ   PHE  26           HZ       PHE  26  -3.579  -1.794   2.901
  230   H11A  DNS  27          H22       DNS  27  -1.228   1.619   5.326
  231    H12  DNS  27           H23      DNS  27  -2.597   2.566   5.914
  232    H13  DNS  27           H24      DNS  27  -1.562   1.694   7.066
  233    H21  DNS  27           H21      DNS  27   0.871   2.205   6.904
  234    H22  DNS  27           H19      DNS  27   1.344   3.874   6.535
  235    H23  DNS  27           H20      DNS  27   0.994   2.750   5.218
  236    H4   DNS  27           H14      DNS  27  -0.520   2.997   3.573
  237    H5   DNS  27           H15      DNS  27  -1.007   4.727   1.826
  238    H6   DNS  27           H16      DNS  27  -1.724   7.029   2.499
  239    HZ   DNS  27           HZ1      DNS  27  -3.969   7.652   4.076
  240    HE3  DNS  27           HE1      DNS  27  -4.835   9.925   3.291
  241    HE2  DNS  27           HE2      DNS  27  -4.493   9.255   1.703
  242    HD3  DNS  27           HD1      DNS  27  -6.864   8.911   2.604
  243    HD2  DNS  27           HD2      DNS  27  -6.041   7.466   2.012
  244    HG3  DNS  27           HG1      DNS  27  -5.559   6.697   4.220
  245    HG2  DNS  27           HG2      DNS  27  -5.945   8.261   4.938
  246    HB3  DNS  27           HB1      DNS  27  -8.293   7.992   4.450
  247    HB2  DNS  27           HB2      DNS  27  -7.985   6.538   3.499
  248    HA   DNS  27           HA       DNS  27  -7.178   6.662   6.415
  249    H    DNS  27           HN       DNS  27  -7.089   4.613   4.406
  250    H9   DNS  27           H9       DNS  27  -2.490   9.229   6.719
  251    H10  DNS  27           H10      DNS  27  -2.009   7.496   8.451
  252    H11  DNS  27           H11      DNS  27  -1.291   5.198   7.772
  253    H    GLY  28           HN       GLY  28  -8.702   6.299   8.001
  254    HA2  GLY  28           HA2      GLY  28 -11.371   7.093   7.624
  255    HA3  GLY  28           HA1      GLY  28 -11.364   5.331   7.519
  256    H    ARG  29           HN       ARG  29  -9.422   7.519   9.533
  257    HA   ARG  29           HA       ARG  29  -9.903   5.858  11.903
  258    HB2  ARG  29           HB2      ARG  29  -8.491   8.529  11.608
  259    HB3  ARG  29           HB1      ARG  29  -8.449   7.497  13.038
  260    HG2  ARG  29           HG2      ARG  29  -7.414   5.693  11.717
  261    HG3  ARG  29           HG1      ARG  29  -7.465   6.713  10.278
  262    HD2  ARG  29           HD2      ARG  29  -5.234   6.804  11.293
  263    HD3  ARG  29           HD1      ARG  29  -6.024   8.375  11.424
  264    HE   ARG  29           HE       ARG  29  -6.681   7.105  13.801
  265   HH11  ARG  29          HH21      ARG  29  -3.776   7.806  12.069
  266   HH12  ARG  29          HH22      ARG  29  -2.804   7.943  13.497
  267   HH21  ARG  29          HH11      ARG  29  -5.424   7.280  15.668
  268   HH22  ARG  29          HH12      ARG  29  -3.736   7.645  15.531
  Start of MODEL   13
    1    H1   GLY   1           HT1      GLY   1   8.435   1.998 -10.909
    2    H2   GLY   1           HT2      GLY   1   9.606   2.733 -11.896
    3    H3   GLY   1           HT3      GLY   1   9.413   3.239 -10.286
    4    HA2  GLY   1           HA2      GLY   1  10.247   0.431 -11.131
    5    HA3  GLY   1           HA1      GLY   1  11.320   1.734 -10.541
    6    H    GLN   2           HN       GLN   2  10.163   3.120  -8.656
    7    HA   GLN   2           HA       GLN   2  11.847   1.887  -6.674
    8    HB2  GLN   2           HB2      GLN   2  11.223   4.344  -6.786
    9    HB3  GLN   2           HB1      GLN   2   9.625   3.900  -6.190
   10    HG2  GLN   2           HG2      GLN   2  10.929   4.570  -4.279
   11    HG3  GLN   2           HG1      GLN   2  10.771   2.817  -4.200
   12   HE21  GLN   2          HE21      GLN   2  12.724   1.874  -3.617
   13   HE22  GLN   2          HE22      GLN   2  14.257   2.418  -4.100
   14    H    GLN   3           HN       GLN   3  11.314  -0.079  -5.831
   15    HA   GLN   3           HA       GLN   3   8.590  -1.030  -5.654
   16    HB2  GLN   3           HB2      GLN   3   9.506  -2.987  -4.598
   17    HB3  GLN   3           HB1      GLN   3  10.638  -2.503  -5.853
   18    HG2  GLN   3           HG2      GLN   3  10.916  -2.009  -2.868
   19    HG3  GLN   3           HG1      GLN   3  11.898  -3.074  -3.865
   20   HE21  GLN   3          HE21      GLN   3  12.201  -0.227  -2.342
   21   HE22  GLN   3          HE22      GLN   3  13.185   0.619  -3.437
   22    H    TYR   4           HN       TYR   4   7.269  -1.204  -3.802
   23    HA   TYR   4           HA       TYR   4   7.539   0.897  -1.894
   24    HB2  TYR   4           HB2      TYR   4   5.585  -0.847  -0.845
   25    HB3  TYR   4           HB1      TYR   4   5.275   0.522  -1.902
   26    HD1  TYR   4           HD1      TYR   4   6.668  -2.963  -2.302
   27    HD2  TYR   4           HD2      TYR   4   3.882  -0.015  -3.748
   28    HE1  TYR   4           HE1      TYR   4   5.933  -4.521  -4.074
   29    HE2  TYR   4           HE2      TYR   4   3.154  -1.588  -5.517
   30    HH   TYR   4           HH       TYR   4   4.810  -4.644  -6.059
   31    H    THR   5           HN       THR   5   8.734   0.902  -0.056
   32    HA   THR   5           HA       THR   5   9.487  -1.732   1.220
   33    HB   THR   5           HB       THR   5  11.583  -0.748   1.829
   34    HG1  THR   5           HG1      THR   5  10.219   1.581   1.211
   35   HG21  THR   5          HG21      THR   5  12.565  -0.276  -0.332
   36   HG22  THR   5          HG22      THR   5  10.992   0.177  -0.985
   37   HG23  THR   5          HG23      THR   5  11.317  -1.502  -0.557
   38    H    ALA   6           HN       ALA   6   8.260   1.497   1.701
   39    HA   ALA   6           HA       ALA   6   8.097   1.075   4.681
   40    HB1  ALA   6           HB1      ALA   6   7.929   3.669   3.101
   41    HB2  ALA   6           HB2      ALA   6   9.405   3.067   3.869
   42    HB3  ALA   6           HB3      ALA   6   8.009   3.497   4.858
   43    H1   NAL   7           H1       NAL   7   3.431   4.840   0.877
   44    H3   NAL   7           H3       NAL   7   6.379   2.059  -0.537
   45    H4   NAL   7           H4       NAL   7   7.570   3.872  -1.734
   46    H5   NAL   7           H5       NAL   7   7.743   6.366  -2.382
   47    H6   NAL   7           H6       NAL   7   6.835   8.668  -2.259
   48    H7   NAL   7           H7       NAL   7   4.770   9.138  -0.963
   49    H8   NAL   7           H8       NAL   7   3.589   7.304   0.221
   50    H91  NAL   7           H91      NAL   7   3.044   2.440   0.710
   51    H92  NAL   7           H92      NAL   7   4.440   1.365   0.619
   52    H10  NAL   7           H10      NAL   7   4.046   3.522   2.728
   53    HN1  NAL   7           HN1      NAL   7   6.449   2.738   2.049
   54    H    ILE   8           HN       ILE   8   4.528   0.020   2.371
   55    HA   ILE   8           HA       ILE   8   2.524  -0.438   4.512
   56    HB   ILE   8           HB       ILE   8   1.513  -2.193   2.735
   57   HG12  ILE   8          HG12      ILE   8   1.362  -1.198   0.486
   58   HG13  ILE   8          HG11      ILE   8   2.411   0.125   0.969
   59   HG21  ILE   8          HG21      ILE   8   0.241  -0.379   3.879
   60   HG22  ILE   8          HG22      ILE   8  -0.239  -0.580   2.193
   61   HG23  ILE   8          HG23      ILE   8   0.817   0.760   2.651
   62   HD11  ILE   8          HD11      ILE   8   3.474  -1.760  -0.363
   63   HD12  ILE   8          HD12      ILE   8   3.277  -2.767   1.058
   64   HD13  ILE   8          HD13      ILE   8   4.298  -1.327   1.131
   65    H    LYS   9           HN       LYS   9   3.670  -1.662   5.858
   66    HA   LYS   9           HA       LYS   9   5.644  -3.589   4.865
   67    HB2  LYS   9           HB2      LYS   9   6.185  -2.053   6.768
   68    HB3  LYS   9           HB1      LYS   9   4.963  -2.888   7.728
   69    HG2  LYS   9           HG2      LYS   9   6.165  -4.991   7.529
   70    HG3  LYS   9           HG1      LYS   9   7.330  -4.262   6.423
   71    HD2  LYS   9           HD2      LYS   9   7.988  -2.670   8.234
   72    HD3  LYS   9           HD1      LYS   9   6.904  -3.525   9.332
   73    HE2  LYS   9           HE2      LYS   9   9.235  -4.328   9.562
   74    HE3  LYS   9           HE1      LYS   9   8.169  -5.607   8.982
   75    HZ1  LYS   9           HZ1      LYS   9  10.476  -4.714   7.783
   76    HZ2  LYS   9           HZ2      LYS   9   9.220  -4.092   6.822
   77    HZ3  LYS   9           HZ3      LYS   9   9.323  -5.762   7.113
   78    H    GLY  10           HN       GLY  10   5.411  -5.782   4.983
   79    HA2  GLY  10           HA2      GLY  10   4.521  -7.874   5.602
   80    HA3  GLY  10           HA1      GLY  10   3.409  -7.057   6.691
   81    H    ARG  11           HN       ARG  11   2.594  -5.309   4.246
   82    HA   ARG  11           HA       ARG  11   0.966  -7.361   2.755
   83    HB2  ARG  11           HB2      ARG  11  -0.089  -4.740   3.863
   84    HB3  ARG  11           HB1      ARG  11  -1.007  -5.939   2.953
   85    HG2  ARG  11           HG2      ARG  11  -0.649  -7.592   4.733
   86    HG3  ARG  11           HG1      ARG  11   0.314  -6.425   5.640
   87    HD2  ARG  11           HD2      ARG  11  -1.620  -4.935   5.833
   88    HD3  ARG  11           HD1      ARG  11  -2.591  -6.040   4.860
   89    HE   ARG  11           HE       ARG  11  -1.696  -7.614   6.966
   90   HH11  ARG  11          HH21      ARG  11  -3.363  -4.608   6.619
   91   HH12  ARG  11          HH22      ARG  11  -4.256  -4.783   8.093
   92   HH21  ARG  11          HH11      ARG  11  -2.854  -7.853   8.888
   93   HH22  ARG  11          HH12      ARG  11  -3.967  -6.619   9.376
   94    H    THR  12           HN       THR  12   2.107  -7.083   0.806
   95    HA   THR  12           HA       THR  12   2.256  -4.354  -0.328
   96    HB   THR  12           HB       THR  12   3.737  -5.931  -2.049
   97    HG1  THR  12           HG1      THR  12   4.986  -7.236  -0.592
   98   HG21  THR  12          HG21      THR  12   4.479  -3.805  -1.056
   99   HG22  THR  12          HG22      THR  12   5.727  -5.042  -0.889
  100   HG23  THR  12          HG23      THR  12   4.726  -4.605   0.496
  101    H    PHE  13           HN       PHE  13   1.764  -4.125  -2.604
  102    HA   PHE  13           HA       PHE  13  -0.420  -5.983  -3.514
  103    HB2  PHE  13           HB2      PHE  13  -0.133  -2.998  -3.984
  104    HB3  PHE  13           HB1      PHE  13  -1.494  -4.011  -4.477
  105    HD1  PHE  13           HD1      PHE  13   0.368  -2.675  -1.519
  106    HD2  PHE  13           HD2      PHE  13  -3.217  -4.604  -2.912
  107    HE1  PHE  13           HE1      PHE  13  -0.653  -2.439   0.728
  108    HE2  PHE  13           HE2      PHE  13  -4.234  -4.323  -0.675
  109    HZ   PHE  13           HZ       PHE  13  -2.944  -3.230   1.135
  110    H    ARG  14           HN       ARG  14  -0.135  -6.843  -5.522
  111    HA   ARG  14           HA       ARG  14   2.325  -6.418  -6.972
  112    HB2  ARG  14           HB2      ARG  14   0.856  -8.516  -7.121
  113    HB3  ARG  14           HB1      ARG  14  -0.249  -7.573  -8.121
  114    HG2  ARG  14           HG2      ARG  14   1.096  -8.624  -9.738
  115    HG3  ARG  14           HG1      ARG  14   1.887  -7.062  -9.576
  116    HD2  ARG  14           HD2      ARG  14   3.217  -8.508  -7.635
  117    HD3  ARG  14           HD1      ARG  14   2.890  -9.769  -8.815
  118    HE   ARG  14           HE       ARG  14   4.916  -7.803  -9.033
  119   HH11  ARG  14          HH21      ARG  14   2.311  -9.055 -10.927
  120   HH12  ARG  14          HH22      ARG  14   2.977  -8.509 -12.426
  121   HH21  ARG  14          HH11      ARG  14   5.795  -7.113 -10.979
  122   HH22  ARG  14          HH12      ARG  14   4.947  -7.420 -12.457
  123    H    ASN  15           HN       ASN  15  -0.981  -5.270  -7.326
  124    HA   ASN  15           HA       ASN  15  -0.116  -3.270  -9.393
  125    HB2  ASN  15           HB2      ASN  15  -2.836  -3.032  -9.337
  126    HB3  ASN  15           HB1      ASN  15  -2.002  -4.153 -10.415
  127   HD21  ASN  15          HD21      ASN  15  -4.623  -4.120  -8.504
  128   HD22  ASN  15          HD22      ASN  15  -4.608  -5.711  -7.911
  129    H    GLU  16           HN       GLU  16   0.083  -1.208  -8.705
  130    HA   GLU  16           HA       GLU  16  -0.395  -0.516  -5.976
  131    HB2  GLU  16           HB2      GLU  16   0.001   1.236  -8.425
  132    HB3  GLU  16           HB1      GLU  16  -0.055   1.859  -6.778
  133    HG2  GLU  16           HG2      GLU  16   2.269   1.555  -7.372
  134    HG3  GLU  16           HG1      GLU  16   1.845   0.309  -6.200
  135    H    LYS  17           HN       LYS  17  -2.427  -0.618  -8.756
  136    HA   LYS  17           HA       LYS  17  -4.399   1.262  -8.107
  137    HB2  LYS  17           HB2      LYS  17  -4.274  -0.123 -10.210
  138    HB3  LYS  17           HB1      LYS  17  -4.911  -1.482  -9.286
  139    HG2  LYS  17           HG2      LYS  17  -6.908  -0.122  -8.694
  140    HG3  LYS  17           HG1      LYS  17  -6.293   1.197  -9.685
  141    HD2  LYS  17           HD2      LYS  17  -6.704  -1.567 -10.876
  142    HD3  LYS  17           HD1      LYS  17  -8.051  -0.445 -10.738
  143    HE2  LYS  17           HE2      LYS  17  -6.705   1.248 -12.023
  144    HE3  LYS  17           HE1      LYS  17  -5.474   0.011 -12.276
  145    HZ1  LYS  17           HZ1      LYS  17  -8.208  -0.732 -12.924
  146    HZ2  LYS  17           HZ2      LYS  17  -6.755  -1.110 -13.721
  147    HZ3  LYS  17           HZ3      LYS  17  -7.480   0.410 -13.945
  148    H    GLU  18           HN       GLU  18  -4.051  -2.121  -7.049
  149    HA   GLU  18           HA       GLU  18  -6.387  -2.169  -5.434
  150    HB2  GLU  18           HB2      GLU  18  -5.118  -4.180  -6.223
  151    HB3  GLU  18           HB1      GLU  18  -3.853  -3.773  -5.066
  152    HG2  GLU  18           HG2      GLU  18  -5.512  -3.929  -3.227
  153    HG3  GLU  18           HG1      GLU  18  -6.749  -4.370  -4.402
  154    H    LEU  19           HN       LEU  19  -3.070  -1.156  -4.835
  155    HA   LEU  19           HA       LEU  19  -3.379  -0.874  -1.982
  156    HB2  LEU  19           HB2      LEU  19  -1.152  -0.988  -2.813
  157    HB3  LEU  19           HB1      LEU  19  -1.455   0.246  -4.014
  158    HG   LEU  19           HG       LEU  19  -1.628   1.924  -2.161
  159   HD11  LEU  19          HD11      LEU  19  -0.812   1.321   0.063
  160   HD12  LEU  19          HD12      LEU  19  -0.642  -0.348  -0.453
  161   HD13  LEU  19          HD13      LEU  19  -2.239   0.370  -0.328
  162   HD21  LEU  19          HD21      LEU  19   0.476   1.569  -3.386
  163   HD22  LEU  19          HD22      LEU  19   0.929   0.325  -2.220
  164   HD23  LEU  19          HD23      LEU  19   0.775   2.004  -1.702
  165    H    ARG  20           HN       ARG  20  -3.973   1.213  -4.771
  166    HA   ARG  20           HA       ARG  20  -4.434   3.654  -3.368
  167    HB2  ARG  20           HB2      ARG  20  -4.239   3.406  -5.869
  168    HB3  ARG  20           HB1      ARG  20  -5.852   2.696  -5.871
  169    HG2  ARG  20           HG2      ARG  20  -6.746   4.774  -4.834
  170    HG3  ARG  20           HG1      ARG  20  -5.132   5.483  -4.905
  171    HD2  ARG  20           HD2      ARG  20  -6.664   4.467  -7.314
  172    HD3  ARG  20           HD1      ARG  20  -6.581   6.161  -6.827
  173    HE   ARG  20           HE       ARG  20  -3.921   5.383  -7.009
  174   HH11  ARG  20          HH21      ARG  20  -6.695   5.311  -9.068
  175   HH12  ARG  20          HH22      ARG  20  -5.776   5.467 -10.527
  176   HH21  ARG  20          HH11      ARG  20  -2.714   5.585  -8.904
  177   HH22  ARG  20          HH12      ARG  20  -3.524   5.623 -10.434
  178    H    ASP  21           HN       ASP  21  -6.457   0.904  -4.066
  179    HA   ASP  21           HA       ASP  21  -8.874   2.023  -2.999
  180    HB2  ASP  21           HB2      ASP  21  -8.940   0.228  -4.681
  181    HB3  ASP  21           HB1      ASP  21  -8.144  -0.865  -3.551
  182    H    PHE  22           HN       PHE  22  -6.598  -0.463  -1.810
  183    HA   PHE  22           HA       PHE  22  -7.826  -0.734   0.718
  184    HB2  PHE  22           HB2      PHE  22  -5.125  -1.366  -0.412
  185    HB3  PHE  22           HB1      PHE  22  -5.277  -1.385   1.339
  186    HD1  PHE  22           HD1      PHE  22  -7.701  -2.389  -1.344
  187    HD2  PHE  22           HD2      PHE  22  -5.304  -3.669   1.989
  188    HE1  PHE  22           HE1      PHE  22  -8.708  -4.640  -1.478
  189    HE2  PHE  22           HE2      PHE  22  -6.317  -5.913   1.849
  190    HZ   PHE  22           HZ       PHE  22  -8.021  -6.410   0.117
  191    H    ILE  23           HN       ILE  23  -5.755   1.684  -0.599
  192    HA   ILE  23           HA       ILE  23  -4.850   2.837   1.877
  193    HB   ILE  23           HB       ILE  23  -4.982   3.633  -1.000
  194   HG12  ILE  23          HG12      ILE  23  -2.848   3.948   1.149
  195   HG13  ILE  23          HG11      ILE  23  -2.975   2.592   0.037
  196   HG21  ILE  23          HG21      ILE  23  -4.854   5.692   1.206
  197   HG22  ILE  23          HG22      ILE  23  -5.963   5.641  -0.170
  198   HG23  ILE  23          HG23      ILE  23  -4.268   6.010  -0.425
  199   HD11  ILE  23          HD11      ILE  23  -1.303   4.094  -0.828
  200   HD12  ILE  23          HD12      ILE  23  -2.388   5.475  -0.656
  201   HD13  ILE  23          HD13      ILE  23  -2.725   4.234  -1.854
  202    H    GLU  24           HN       GLU  24  -7.650   3.232  -0.158
  203    HA   GLU  24           HA       GLU  24  -8.828   5.388   1.285
  204    HB2  GLU  24           HB2      GLU  24 -10.152   3.213  -0.357
  205    HB3  GLU  24           HB1      GLU  24 -11.021   4.578   0.325
  206    HG2  GLU  24           HG2      GLU  24  -9.535   6.132  -0.909
  207    HG3  GLU  24           HG1      GLU  24  -8.715   4.752  -1.637
  208    H    LYS  25           HN       LYS  25  -8.606   1.973   1.903
  209    HA   LYS  25           HA       LYS  25 -10.699   1.897   3.930
  210    HB2  LYS  25           HB2      LYS  25  -9.865  -0.116   2.645
  211    HB3  LYS  25           HB1      LYS  25  -8.373  -0.022   3.578
  212    HG2  LYS  25           HG2      LYS  25  -9.692  -0.250   5.675
  213    HG3  LYS  25           HG1      LYS  25 -11.162  -0.416   4.713
  214    HD2  LYS  25           HD2      LYS  25 -10.234  -2.416   3.620
  215    HD3  LYS  25           HD1      LYS  25  -8.752  -2.251   4.564
  216    HE2  LYS  25           HE2      LYS  25  -9.976  -2.588   6.638
  217    HE3  LYS  25           HE1      LYS  25 -11.512  -2.602   5.770
  218    HZ1  LYS  25           HZ1      LYS  25  -9.395  -4.503   5.023
  219    HZ2  LYS  25           HZ2      LYS  25 -11.079  -4.644   4.847
  220    HZ3  LYS  25           HZ3      LYS  25 -10.365  -4.822   6.378
  221    H    PHE  26           HN       PHE  26  -7.102   2.038   4.054
  222    HA   PHE  26           HA       PHE  26  -6.927   2.108   6.906
  223    HB2  PHE  26           HB2      PHE  26  -5.022   3.646   5.116
  224    HB3  PHE  26           HB1      PHE  26  -4.674   2.848   6.644
  225    HD1  PHE  26           HD1      PHE  26  -6.107   0.159   6.033
  226    HD2  PHE  26           HD2      PHE  26  -3.388   2.581   3.728
  227    HE1  PHE  26           HE1      PHE  26  -5.353  -1.845   4.807
  228    HE2  PHE  26           HE2      PHE  26  -2.646   0.556   2.495
  229    HZ   PHE  26           HZ       PHE  26  -3.624  -1.652   3.046
  230   H11A  DNS  27          H22       DNS  27   1.726   2.616   8.315
  231    H12  DNS  27           H23      DNS  27   0.426   2.847   9.484
  232    H13  DNS  27           H24      DNS  27   0.703   4.057   8.215
  233    H21  DNS  27           H21      DNS  27  -1.563   2.401   9.198
  234    H22  DNS  27           H19      DNS  27  -1.395   0.770   8.530
  235    H23  DNS  27           H20      DNS  27  -2.336   1.980   7.653
  236    H4   DNS  27           H14      DNS  27   0.436   1.465   5.111
  237    H5   DNS  27           H15      DNS  27  -0.075   2.712   3.006
  238    H6   DNS  27           H16      DNS  27  -1.290   4.889   3.088
  239    HZ   DNS  27           HZ1      DNS  27  -2.508   8.782   4.973
  240    HE3  DNS  27           HE1      DNS  27  -4.151  10.020   4.018
  241    HE2  DNS  27           HE2      DNS  27  -3.506   9.136   2.644
  242    HD3  DNS  27           HD1      DNS  27  -6.098   9.127   3.072
  243    HD2  DNS  27           HD2      DNS  27  -5.307   7.619   2.609
  244    HG3  DNS  27           HG1      DNS  27  -5.287   6.809   4.859
  245    HG2  DNS  27           HG2      DNS  27  -5.702   8.393   5.516
  246    HB3  DNS  27           HB1      DNS  27  -7.931   8.282   4.631
  247    HB2  DNS  27           HB2      DNS  27  -7.548   6.859   3.660
  248    HA   DNS  27           HA       DNS  27  -7.305   6.798   6.681
  249    H    DNS  27           HN       DNS  27  -7.072   4.797   4.555
  250    H9   DNS  27           H9       DNS  27  -3.101   7.639   6.572
  251    H10  DNS  27           H10      DNS  27  -2.608   6.427   8.691
  252    H11  DNS  27           H11      DNS  27  -1.393   4.255   8.651
  253    H    GLY  28           HN       GLY  28  -9.299   4.570   6.568
  254    HA2  GLY  28           HA2      GLY  28 -11.640   6.103   7.183
  255    HA3  GLY  28           HA1      GLY  28 -11.811   5.386   5.580
  256    H    ARG  29           HN       ARG  29 -10.323   4.159   8.576
  257    HA   ARG  29           HA       ARG  29 -11.332   1.501   8.169
  258    HB2  ARG  29           HB2      ARG  29 -10.513   1.040  10.427
  259    HB3  ARG  29           HB1      ARG  29  -9.330   2.015   9.556
  260    HG2  ARG  29           HG2      ARG  29 -10.377   4.064  10.649
  261    HG3  ARG  29           HG1      ARG  29 -11.303   2.959  11.661
  262    HD2  ARG  29           HD2      ARG  29  -9.232   1.970  12.522
  263    HD3  ARG  29           HD1      ARG  29  -8.277   3.017  11.473
  264    HE   ARG  29           HE       ARG  29  -9.833   4.784  12.947
  265   HH11  ARG  29          HH21      ARG  29  -7.659   2.189  13.637
  266   HH12  ARG  29          HH22      ARG  29  -7.128   2.863  15.142
  267   HH21  ARG  29          HH11      ARG  29  -9.146   5.671  14.906
  268   HH22  ARG  29          HH12      ARG  29  -7.968   4.832  15.859
  Start of MODEL   14
    1    H1   GLY   1           HT1      GLY   1  11.755  -0.098 -11.056
    2    H2   GLY   1           HT2      GLY   1  13.143  -0.103 -10.076
    3    H3   GLY   1           HT3      GLY   1  12.994   1.028 -11.335
    4    HA2  GLY   1           HA2      GLY   1  12.045   2.554 -10.030
    5    HA3  GLY   1           HA1      GLY   1  10.848   1.305  -9.573
    6    H    GLN   2           HN       GLN   2  11.744   3.115  -7.717
    7    HA   GLN   2           HA       GLN   2  12.576   1.314  -5.627
    8    HB2  GLN   2           HB2      GLN   2  12.781   3.844  -5.593
    9    HB3  GLN   2           HB1      GLN   2  11.045   3.916  -5.303
   10    HG2  GLN   2           HG2      GLN   2  12.121   4.043  -3.153
   11    HG3  GLN   2           HG1      GLN   2  11.419   2.432  -3.276
   12   HE21  GLN   2          HE21      GLN   2  14.508   4.216  -3.519
   13   HE22  GLN   2          HE22      GLN   2  15.497   2.861  -3.262
   14    H    GLN   3           HN       GLN   3  11.298  -0.424  -5.138
   15    HA   GLN   3           HA       GLN   3   8.426  -0.420  -5.461
   16    HB2  GLN   3           HB2      GLN   3  10.104  -2.315  -3.790
   17    HB3  GLN   3           HB1      GLN   3   8.487  -2.613  -4.434
   18    HG2  GLN   3           HG2      GLN   3   9.393  -2.374  -6.740
   19    HG3  GLN   3           HG1      GLN   3  11.010  -2.181  -6.061
   20   HE21  GLN   3          HE21      GLN   3  11.642  -4.215  -7.197
   21   HE22  GLN   3          HE22      GLN   3  11.188  -5.716  -6.550
   22    H    TYR   4           HN       TYR   4   6.840  -0.324  -3.830
   23    HA   TYR   4           HA       TYR   4   7.341   1.490  -1.702
   24    HB2  TYR   4           HB2      TYR   4   4.872   0.077  -1.186
   25    HB3  TYR   4           HB1      TYR   4   5.057   1.675  -1.877
   26    HD1  TYR   4           HD2      TYR   4   5.763   1.770  -4.403
   27    HD2  TYR   4           HD1      TYR   4   3.857  -1.608  -2.550
   28    HE1  TYR   4           HE2      TYR   4   5.010   0.972  -6.624
   29    HE2  TYR   4           HE1      TYR   4   3.112  -2.399  -4.770
   30    HH   TYR   4           HH       TYR   4   3.064  -2.000  -6.946
   31    H    THR   5           HN       THR   5   8.374   1.016   0.209
   32    HA   THR   5           HA       THR   5   8.190  -1.792   1.317
   33    HB   THR   5           HB       THR   5  10.426  -1.610   2.056
   34    HG1  THR   5           HG1      THR   5  11.138   0.852   1.406
   35   HG21  THR   5          HG21      THR   5  10.576   0.048  -0.454
   36   HG22  THR   5          HG22      THR   5  10.090  -1.647  -0.520
   37   HG23  THR   5          HG23      THR   5  11.688  -1.206   0.085
   38    H    ALA   6           HN       ALA   6   8.009   1.623   2.027
   39    HA   ALA   6           HA       ALA   6   7.718   1.175   4.956
   40    HB1  ALA   6           HB1      ALA   6   7.708   3.607   5.099
   41    HB2  ALA   6           HB2      ALA   6   7.534   3.756   3.347
   42    HB3  ALA   6           HB3      ALA   6   9.034   3.125   4.042
   43    H1   NAL   7           H1       NAL   7   2.894   4.905   1.342
   44    H3   NAL   7           H3       NAL   7   6.094   2.440  -0.095
   45    H4   NAL   7           H4       NAL   7   7.256   4.427  -1.024
   46    H5   NAL   7           H5       NAL   7   7.313   6.975  -1.441
   47    H6   NAL   7           H6       NAL   7   6.249   9.198  -1.196
   48    H7   NAL   7           H7       NAL   7   4.070   9.429  -0.030
   49    H8   NAL   7           H8       NAL   7   2.929   7.432   0.900
   50    H91  NAL   7           H91      NAL   7   2.667   2.541   1.015
   51    H92  NAL   7           H92      NAL   7   4.116   1.545   0.851
   52    H10  NAL   7           H10      NAL   7   3.625   3.492   3.139
   53    HN1  NAL   7           HN1      NAL   7   6.020   2.621   2.273
   54    H    ILE   8           HN       ILE   8   4.305   0.045   2.633
   55    HA   ILE   8           HA       ILE   8   2.202  -0.620   4.630
   56    HB   ILE   8           HB       ILE   8   1.426  -2.377   2.743
   57   HG12  ILE   8          HG12      ILE   8   1.372  -1.339   0.516
   58   HG13  ILE   8          HG11      ILE   8   2.281   0.048   1.099
   59   HG21  ILE   8          HG21      ILE   8   0.550   0.530   2.689
   60   HG22  ILE   8          HG22      ILE   8  -0.034  -0.679   3.842
   61   HG23  ILE   8          HG23      ILE   8  -0.384  -0.855   2.122
   62   HD11  ILE   8          HD11      ILE   8   3.329  -2.795   1.120
   63   HD12  ILE   8          HD12      ILE   8   4.251  -1.319   1.426
   64   HD13  ILE   8          HD13      ILE   8   3.624  -1.654  -0.177
   65    H    LYS   9           HN       LYS   9   3.539  -1.659   6.017
   66    HA   LYS   9           HA       LYS   9   5.626  -3.449   5.080
   67    HB2  LYS   9           HB2      LYS   9   5.877  -1.978   7.104
   68    HB3  LYS   9           HB1      LYS   9   4.693  -3.000   7.922
   69    HG2  LYS   9           HG2      LYS   9   6.136  -4.960   7.633
   70    HG3  LYS   9           HG1      LYS   9   7.287  -4.004   6.708
   71    HD2  LYS   9           HD2      LYS   9   8.262  -4.024   8.861
   72    HD3  LYS   9           HD1      LYS   9   7.415  -2.482   8.840
   73    HE2  LYS   9           HE2      LYS   9   7.034  -3.732  10.951
   74    HE3  LYS   9           HE1      LYS   9   5.531  -3.480  10.072
   75    HZ1  LYS   9           HZ1      LYS   9   5.393  -5.670   9.491
   76    HZ2  LYS   9           HZ2      LYS   9   6.164  -5.820  10.997
   77    HZ3  LYS   9           HZ3      LYS   9   7.069  -5.924   9.563
   78    H    GLY  10           HN       GLY  10   5.457  -5.622   4.855
   79    HA2  GLY  10           HA2      GLY  10   4.754  -7.829   5.352
   80    HA3  GLY  10           HA1      GLY  10   3.532  -7.187   6.441
   81    H    ARG  11           HN       ARG  11   2.667  -5.355   4.045
   82    HA   ARG  11           HA       ARG  11   1.275  -7.466   2.402
   83    HB2  ARG  11           HB2      ARG  11  -0.035  -4.993   3.574
   84    HB3  ARG  11           HB1      ARG  11  -0.816  -6.228   2.586
   85    HG2  ARG  11           HG2      ARG  11  -0.362  -7.920   4.309
   86    HG3  ARG  11           HG1      ARG  11   0.462  -6.711   5.294
   87    HD2  ARG  11           HD2      ARG  11  -2.453  -6.631   4.461
   88    HD3  ARG  11           HD1      ARG  11  -1.851  -7.018   6.073
   89    HE   ARG  11           HE       ARG  11  -0.755  -4.526   5.534
   90   HH11  ARG  11          HH21      ARG  11  -3.915  -5.921   5.516
   91   HH12  ARG  11          HH22      ARG  11  -4.711  -4.443   5.939
   92   HH21  ARG  11          HH11      ARG  11  -1.782  -2.593   6.085
   93   HH22  ARG  11          HH12      ARG  11  -3.505  -2.561   6.260
   94    H    THR  12           HN       THR  12   2.459  -7.023   0.519
   95    HA   THR  12           HA       THR  12   2.428  -4.256  -0.525
   96    HB   THR  12           HB       THR  12   3.999  -5.748  -2.285
   97    HG1  THR  12           HG1      THR  12   4.388  -7.508  -1.224
   98   HG21  THR  12          HG21      THR  12   4.942  -4.327   0.226
   99   HG22  THR  12          HG22      THR  12   4.572  -3.540  -1.309
  100   HG23  THR  12          HG23      THR  12   5.918  -4.676  -1.200
  101    H    PHE  13           HN       PHE  13   1.920  -4.006  -2.823
  102    HA   PHE  13           HA       PHE  13  -0.171  -5.963  -3.753
  103    HB2  PHE  13           HB2      PHE  13  -0.019  -2.963  -4.157
  104    HB3  PHE  13           HB1      PHE  13  -1.319  -4.023  -4.712
  105    HD1  PHE  13           HD1      PHE  13   0.436  -2.742  -1.671
  106    HD2  PHE  13           HD2      PHE  13  -3.047  -4.730  -3.207
  107    HE1  PHE  13           HE1      PHE  13  -0.625  -2.646   0.567
  108    HE2  PHE  13           HE2      PHE  13  -4.114  -4.586  -0.982
  109    HZ   PHE  13           HZ       PHE  13  -2.892  -3.531   0.897
  110    H    ARG  14           HN       ARG  14   0.097  -6.782  -5.766
  111    HA   ARG  14           HA       ARG  14   2.532  -6.320  -7.233
  112    HB2  ARG  14           HB2      ARG  14   1.178  -8.417  -7.475
  113    HB3  ARG  14           HB1      ARG  14  -0.083  -7.483  -8.282
  114    HG2  ARG  14           HG2      ARG  14   1.437  -6.900 -10.091
  115    HG3  ARG  14           HG1      ARG  14   2.784  -7.682  -9.259
  116    HD2  ARG  14           HD2      ARG  14   1.561  -9.848  -9.380
  117    HD3  ARG  14           HD1      ARG  14   0.284  -9.050 -10.296
  118    HE   ARG  14           HE       ARG  14   2.597  -8.470 -11.723
  119   HH11  ARG  14          HH21      ARG  14   1.029 -11.312 -10.540
  120   HH12  ARG  14          HH22      ARG  14   1.610 -12.323 -11.821
  121   HH21  ARG  14          HH11      ARG  14   3.361  -9.779 -13.397
  122   HH22  ARG  14          HH12      ARG  14   2.929 -11.456 -13.437
  123    H    ASN  15           HN       ASN  15  -0.797  -5.199  -7.604
  124    HA   ASN  15           HA       ASN  15   0.098  -3.111  -9.571
  125    HB2  ASN  15           HB2      ASN  15  -2.540  -2.867  -9.747
  126    HB3  ASN  15           HB1      ASN  15  -1.701  -4.123 -10.660
  127   HD21  ASN  15          HD21      ASN  15  -3.952  -5.142 -10.525
  128   HD22  ASN  15          HD22      ASN  15  -4.293  -6.109  -9.173
  129    H    GLU  16           HN       GLU  16   0.205  -1.075  -8.842
  130    HA   GLU  16           HA       GLU  16  -0.354  -0.442  -6.130
  131    HB2  GLU  16           HB2      GLU  16   1.233   0.912  -7.374
  132    HB3  GLU  16           HB1      GLU  16   0.008   1.331  -8.570
  133    HG2  GLU  16           HG2      GLU  16  -1.205   2.677  -6.991
  134    HG3  GLU  16           HG1      GLU  16  -0.249   2.072  -5.641
  135    H    LYS  17           HN       LYS  17  -2.338  -0.642  -8.923
  136    HA   LYS  17           HA       LYS  17  -4.443   1.098  -8.355
  137    HB2  LYS  17           HB2      LYS  17  -4.183  -0.371 -10.408
  138    HB3  LYS  17           HB1      LYS  17  -4.752  -1.718  -9.430
  139    HG2  LYS  17           HG2      LYS  17  -6.880  -0.611  -9.027
  140    HG3  LYS  17           HG1      LYS  17  -6.312   0.857  -9.811
  141    HD2  LYS  17           HD2      LYS  17  -7.661  -0.235 -11.448
  142    HD3  LYS  17           HD1      LYS  17  -6.001  -0.549 -11.938
  143    HE2  LYS  17           HE2      LYS  17  -6.090  -2.803 -11.119
  144    HE3  LYS  17           HE1      LYS  17  -7.590  -2.500 -10.240
  145    HZ1  LYS  17           HZ1      LYS  17  -7.488  -3.590 -12.662
  146    HZ2  LYS  17           HZ2      LYS  17  -7.665  -1.955 -13.085
  147    HZ3  LYS  17           HZ3      LYS  17  -8.817  -2.706 -12.087
  148    H    GLU  18           HN       GLU  18  -3.960  -2.251  -7.234
  149    HA   GLU  18           HA       GLU  18  -6.320  -2.312  -5.624
  150    HB2  GLU  18           HB2      GLU  18  -3.794  -3.965  -5.562
  151    HB3  GLU  18           HB1      GLU  18  -5.206  -4.309  -4.559
  152    HG2  GLU  18           HG2      GLU  18  -5.314  -4.103  -7.583
  153    HG3  GLU  18           HG1      GLU  18  -5.096  -5.625  -6.719
  154    H    LEU  19           HN       LEU  19  -3.043  -1.208  -5.035
  155    HA   LEU  19           HA       LEU  19  -3.338  -1.052  -2.159
  156    HB2  LEU  19           HB2      LEU  19  -1.113  -1.117  -3.002
  157    HB3  LEU  19           HB1      LEU  19  -1.432   0.168  -4.144
  158    HG   LEU  19           HG       LEU  19  -1.616   1.760  -2.216
  159   HD11  LEU  19          HD11      LEU  19  -0.560  -0.548  -0.600
  160   HD12  LEU  19          HD12      LEU  19  -2.191   0.083  -0.455
  161   HD13  LEU  19          HD13      LEU  19  -0.817   1.087  -0.020
  162   HD21  LEU  19          HD21      LEU  19   0.803   1.805  -1.726
  163   HD22  LEU  19          HD22      LEU  19   0.483   1.539  -3.438
  164   HD23  LEU  19          HD23      LEU  19   0.950   0.186  -2.411
  165    H    ARG  20           HN       ARG  20  -3.957   1.118  -4.875
  166    HA   ARG  20           HA       ARG  20  -4.434   3.518  -3.413
  167    HB2  ARG  20           HB2      ARG  20  -4.249   3.299  -5.917
  168    HB3  ARG  20           HB1      ARG  20  -5.853   2.582  -5.929
  169    HG2  ARG  20           HG2      ARG  20  -5.298   5.320  -4.729
  170    HG3  ARG  20           HG1      ARG  20  -5.705   5.106  -6.425
  171    HD2  ARG  20           HD2      ARG  20  -7.755   3.685  -5.195
  172    HD3  ARG  20           HD1      ARG  20  -7.490   4.992  -4.050
  173    HE   ARG  20           HE       ARG  20  -8.873   5.215  -6.505
  174   HH11  ARG  20          HH21      ARG  20  -6.280   6.791  -4.853
  175   HH12  ARG  20          HH22      ARG  20  -6.456   8.269  -5.732
  176   HH21  ARG  20          HH11      ARG  20  -9.115   7.136  -7.637
  177   HH22  ARG  20          HH12      ARG  20  -8.061   8.468  -7.300
  178    H    ASP  21           HN       ASP  21  -6.447   0.781  -4.189
  179    HA   ASP  21           HA       ASP  21  -8.855   1.838  -3.039
  180    HB2  ASP  21           HB2      ASP  21  -8.071  -0.979  -3.819
  181    HB3  ASP  21           HB1      ASP  21  -9.683  -0.520  -3.271
  182    H    PHE  22           HN       PHE  22  -6.564  -0.699  -1.985
  183    HA   PHE  22           HA       PHE  22  -7.775  -1.087   0.537
  184    HB2  PHE  22           HB2      PHE  22  -5.082  -1.652  -0.637
  185    HB3  PHE  22           HB1      PHE  22  -5.213  -1.739   1.110
  186    HD1  PHE  22           HD2      PHE  22  -7.663  -2.653  -1.576
  187    HD2  PHE  22           HD1      PHE  22  -5.207  -4.050   1.666
  188    HE1  PHE  22           HE2      PHE  22  -8.654  -4.906  -1.790
  189    HE2  PHE  22           HE1      PHE  22  -6.204  -6.297   1.446
  190    HZ   PHE  22           HZ       PHE  22  -7.929  -6.735  -0.280
  191    H    ILE  23           HN       ILE  23  -5.722   1.402  -0.675
  192    HA   ILE  23           HA       ILE  23  -4.824   2.446   1.852
  193    HB   ILE  23           HB       ILE  23  -4.970   3.388  -0.985
  194   HG12  ILE  23          HG12      ILE  23  -2.801   3.603   1.141
  195   HG13  ILE  23          HG11      ILE  23  -2.966   2.266   0.014
  196   HG21  ILE  23          HG21      ILE  23  -4.203   5.721  -0.247
  197   HG22  ILE  23          HG22      ILE  23  -4.828   5.300   1.346
  198   HG23  ILE  23          HG23      ILE  23  -5.911   5.357  -0.048
  199   HD11  ILE  23          HD11      ILE  23  -2.430   5.156  -0.706
  200   HD12  ILE  23          HD12      ILE  23  -2.688   3.865  -1.870
  201   HD13  ILE  23          HD13      ILE  23  -1.282   3.823  -0.814
  202    H    GLU  24           HN       GLU  24  -7.629   2.920  -0.171
  203    HA   GLU  24           HA       GLU  24  -8.802   5.030   1.330
  204    HB2  GLU  24           HB2      GLU  24 -10.136   2.876  -0.330
  205    HB3  GLU  24           HB1      GLU  24 -11.013   4.212   0.395
  206    HG2  GLU  24           HG2      GLU  24  -8.653   4.602  -1.474
  207    HG3  GLU  24           HG1      GLU  24 -10.328   4.579  -2.019
  208    H    LYS  25           HN       LYS  25  -8.548   1.615   1.883
  209    HA   LYS  25           HA       LYS  25 -10.596   1.497   3.960
  210    HB2  LYS  25           HB2      LYS  25  -9.746  -0.474   2.566
  211    HB3  LYS  25           HB1      LYS  25  -8.290  -0.430   3.551
  212    HG2  LYS  25           HG2      LYS  25  -9.571  -2.000   4.737
  213    HG3  LYS  25           HG1      LYS  25  -9.997  -0.521   5.590
  214    HD2  LYS  25           HD2      LYS  25 -12.057  -0.326   4.243
  215    HD3  LYS  25           HD1      LYS  25 -11.610  -1.768   3.336
  216    HE2  LYS  25           HE2      LYS  25 -13.191  -2.405   5.061
  217    HE3  LYS  25           HE1      LYS  25 -11.608  -3.050   5.490
  218    HZ1  LYS  25           HZ1      LYS  25 -13.222  -1.280   6.949
  219    HZ2  LYS  25           HZ2      LYS  25 -11.789  -0.469   6.529
  220    HZ3  LYS  25           HZ3      LYS  25 -11.720  -1.937   7.383
  221    H    PHE  26           HN       PHE  26  -6.998   1.620   3.998
  222    HA   PHE  26           HA       PHE  26  -6.821   1.646   6.868
  223    HB2  PHE  26           HB2      PHE  26  -4.784   3.035   5.103
  224    HB3  PHE  26           HB1      PHE  26  -4.519   2.181   6.615
  225    HD1  PHE  26           HD1      PHE  26  -6.034  -0.384   6.087
  226    HD2  PHE  26           HD2      PHE  26  -3.374   1.889   3.572
  227    HE1  PHE  26           HE1      PHE  26  -5.450  -2.435   4.841
  228    HE2  PHE  26           HE2      PHE  26  -2.803  -0.178   2.321
  229    HZ   PHE  26           HZ       PHE  26  -3.836  -2.338   2.966
  230   H11A  DNS  27          H22       DNS  27   0.581   4.601   8.773
  231    H12  DNS  27           H23      DNS  27   1.954   3.623   9.304
  232    H13  DNS  27           H24      DNS  27   0.580   2.851   8.484
  233    H21  DNS  27           H21      DNS  27   3.371   3.050   6.033
  234    H22  DNS  27           H19      DNS  27   2.340   1.919   6.929
  235    H23  DNS  27           H20      DNS  27   3.575   2.848   7.785
  236    H4   DNS  27           H14      DNS  27   0.131   2.018   6.461
  237    H5   DNS  27           H15      DNS  27  -1.493   2.263   4.574
  238    H6   DNS  27           H16      DNS  27  -1.599   4.398   3.268
  239    HZ   DNS  27           HZ1      DNS  27  -2.085   6.188   4.277
  240    HE3  DNS  27           HE1      DNS  27  -2.827   8.213   4.746
  241    HE2  DNS  27           HE2      DNS  27  -2.693   8.688   3.064
  242    HD3  DNS  27           HD1      DNS  27  -5.007   8.802   3.700
  243    HD2  DNS  27           HD2      DNS  27  -4.812   7.442   2.593
  244    HG3  DNS  27           HG1      DNS  27  -4.811   5.867   4.437
  245    HG2  DNS  27           HG2      DNS  27  -4.806   7.177   5.617
  246    HB3  DNS  27           HB1      DNS  27  -7.008   7.940   4.732
  247    HB2  DNS  27           HB2      DNS  27  -7.024   6.556   3.638
  248    HA   DNS  27           HA       DNS  27  -6.807   6.333   6.655
  249    H    DNS  27           HN       DNS  27  -6.708   4.339   4.506
  250    H9   DNS  27           H9       DNS  27   0.772   8.591   3.462
  251    H10  DNS  27           H10      DNS  27   2.388   8.335   5.347
  252    H11  DNS  27           H11      DNS  27   2.486   6.199   6.646
  253    H    GLY  28           HN       GLY  28  -8.646   7.048   7.588
  254    HA2  GLY  28           HA2      GLY  28 -11.051   7.690   6.255
  255    HA3  GLY  28           HA1      GLY  28 -11.233   6.049   6.876
  256    H    ARG  29           HN       ARG  29  -9.718   9.023   8.168
  257    HA   ARG  29           HA       ARG  29 -10.516   8.436  10.872
  258    HB2  ARG  29           HB2      ARG  29  -9.696  11.077   9.621
  259    HB3  ARG  29           HB1      ARG  29  -9.780  10.747  11.352
  260    HG2  ARG  29           HG2      ARG  29  -8.100   8.944  11.075
  261    HG3  ARG  29           HG1      ARG  29  -7.989   9.330   9.357
  262    HD2  ARG  29           HD2      ARG  29  -7.300  11.165  11.668
  263    HD3  ARG  29           HD1      ARG  29  -6.168  10.443  10.525
  264    HE   ARG  29           HE       ARG  29  -7.933  11.860   8.915
  265   HH11  ARG  29          HH21      ARG  29  -5.937  12.547  11.650
  266   HH12  ARG  29          HH22      ARG  29  -5.663  14.196  11.198
  267   HH21  ARG  29          HH11      ARG  29  -7.581  14.007   8.317
  268   HH22  ARG  29          HH12      ARG  29  -6.592  15.022   9.313
  Start of MODEL   15
    1    H1   GLY   1           HT1      GLY   1  11.291   0.608 -12.148
    2    H2   GLY   1           HT2      GLY   1  10.340  -0.640 -11.500
    3    H3   GLY   1           HT3      GLY   1  11.890  -0.340 -10.875
    4    HA2  GLY   1           HA2      GLY   1  10.605   2.151 -10.695
    5    HA3  GLY   1           HA1      GLY   1   9.506   0.877 -10.089
    6    H    GLN   2           HN       GLN   2  10.547   2.750  -8.374
    7    HA   GLN   2           HA       GLN   2  11.627   0.981  -6.351
    8    HB2  GLN   2           HB2      GLN   2  11.914   3.474  -6.357
    9    HB3  GLN   2           HB1      GLN   2  10.201   3.633  -5.971
   10    HG2  GLN   2           HG2      GLN   2  10.510   2.408  -3.888
   11    HG3  GLN   2           HG1      GLN   2  12.198   2.089  -4.291
   12   HE21  GLN   2          HE21      GLN   2  10.331   5.148  -4.641
   13   HE22  GLN   2          HE22      GLN   2  11.353   6.061  -3.638
   14    H    GLN   3           HN       GLN   3  10.348  -0.750  -5.773
   15    HA   GLN   3           HA       GLN   3   7.460  -0.622  -5.684
   16    HB2  GLN   3           HB2      GLN   3   9.282  -2.640  -4.336
   17    HB3  GLN   3           HB1      GLN   3   7.558  -2.829  -4.662
   18    HG2  GLN   3           HG2      GLN   3   8.673  -4.012  -6.418
   19    HG3  GLN   3           HG1      GLN   3   8.122  -2.502  -7.141
   20   HE21  GLN   3          HE21      GLN   3  10.001  -3.122  -8.707
   21   HE22  GLN   3          HE22      GLN   3  11.550  -2.562  -8.297
   22    H    TYR   4           HN       TYR   4   6.128  -0.546  -3.844
   23    HA   TYR   4           HA       TYR   4   6.902   1.243  -1.800
   24    HB2  TYR   4           HB2      TYR   4   4.578  -0.621  -1.371
   25    HB3  TYR   4           HB1      TYR   4   4.654   1.114  -1.132
   26    HD1  TYR   4           HD2      TYR   4   4.550   2.664  -3.093
   27    HD2  TYR   4           HD1      TYR   4   3.973  -1.574  -3.507
   28    HE1  TYR   4           HE2      TYR   4   3.580   3.012  -5.348
   29    HE2  TYR   4           HE1      TYR   4   3.022  -1.228  -5.760
   30    HH   TYR   4           HH       TYR   4   1.862   0.639  -6.997
   31    H    THR   5           HN       THR   5   8.222   0.791  -0.036
   32    HA   THR   5           HA       THR   5   8.295  -2.039   1.034
   33    HB   THR   5           HB       THR   5  10.596  -1.752   1.507
   34    HG1  THR   5           HG1      THR   5  10.440   0.314   2.405
   35   HG21  THR   5          HG21      THR   5  11.579  -1.303  -0.610
   36   HG22  THR   5          HG22      THR   5  10.341  -0.118  -1.012
   37   HG23  THR   5          HG23      THR   5   9.943  -1.837  -1.002
   38    H    ALA   6           HN       ALA   6   8.066   1.357   1.853
   39    HA   ALA   6           HA       ALA   6   8.122   0.798   4.786
   40    HB1  ALA   6           HB1      ALA   6   7.768   3.440   3.307
   41    HB2  ALA   6           HB2      ALA   6   9.333   2.790   3.813
   42    HB3  ALA   6           HB3      ALA   6   8.127   3.223   5.024
   43    H1   NAL   7           H1       NAL   7   2.985   4.746   1.787
   44    H3   NAL   7           H3       NAL   7   6.033   2.305   0.014
   45    H4   NAL   7           H4       NAL   7   7.066   4.297  -1.042
   46    H5   NAL   7           H5       NAL   7   7.067   6.847  -1.449
   47    H6   NAL   7           H6       NAL   7   6.030   9.066  -1.075
   48    H7   NAL   7           H7       NAL   7   3.989   9.281   0.323
   49    H8   NAL   7           H8       NAL   7   2.964   7.275   1.361
   50    H91  NAL   7           H91      NAL   7   2.731   2.375   1.455
   51    H92  NAL   7           H92      NAL   7   4.172   1.393   1.169
   52    H10  NAL   7           H10      NAL   7   3.897   3.340   3.488
   53    HN1  NAL   7           HN1      NAL   7   6.193   2.537   2.461
   54    H    ILE   8           HN       ILE   8   4.506  -0.122   3.030
   55    HA   ILE   8           HA       ILE   8   2.510  -0.733   5.118
   56    HB   ILE   8           HB       ILE   8   1.652  -2.535   3.296
   57   HG12  ILE   8          HG12      ILE   8   1.480  -1.525   1.058
   58   HG13  ILE   8          HG11      ILE   8   2.399  -0.122   1.586
   59   HG21  ILE   8          HG21      ILE   8   0.236  -0.827   4.451
   60   HG22  ILE   8          HG22      ILE   8  -0.209  -1.050   2.759
   61   HG23  ILE   8          HG23      ILE   8   0.735   0.363   3.239
   62   HD11  ILE   8          HD11      ILE   8   3.562  -2.903   1.760
   63   HD12  ILE   8          HD12      ILE   8   4.411  -1.355   1.707
   64   HD13  ILE   8          HD13      ILE   8   3.624  -1.982   0.269
   65    H    LYS   9           HN       LYS   9   3.293  -2.272   6.361
   66    HA   LYS   9           HA       LYS   9   5.637  -3.847   5.509
   67    HB2  LYS   9           HB2      LYS   9   5.806  -2.440   7.569
   68    HB3  LYS   9           HB1      LYS   9   4.545  -3.435   8.298
   69    HG2  LYS   9           HG2      LYS   9   5.931  -5.421   8.125
   70    HG3  LYS   9           HG1      LYS   9   7.161  -4.535   7.225
   71    HD2  LYS   9           HD2      LYS   9   7.466  -3.035   9.203
   72    HD3  LYS   9           HD1      LYS   9   6.331  -4.046  10.100
   73    HE2  LYS   9           HE2      LYS   9   7.801  -6.005   9.736
   74    HE3  LYS   9           HE1      LYS   9   8.945  -4.976   8.873
   75    HZ1  LYS   9           HZ1      LYS   9   8.433  -5.196  11.713
   76    HZ2  LYS   9           HZ2      LYS   9   8.601  -3.605  11.142
   77    HZ3  LYS   9           HZ3      LYS   9   9.846  -4.734  10.896
   78    H    GLY  10           HN       GLY  10   5.505  -6.032   5.287
   79    HA2  GLY  10           HA2      GLY  10   4.719  -8.238   5.635
   80    HA3  GLY  10           HA1      GLY  10   3.446  -7.606   6.674
   81    H    ARG  11           HN       ARG  11   2.806  -5.644   4.345
   82    HA   ARG  11           HA       ARG  11   1.458  -7.583   2.476
   83    HB2  ARG  11           HB2      ARG  11   0.192  -5.150   3.779
   84    HB3  ARG  11           HB1      ARG  11  -0.570  -6.158   2.554
   85    HG2  ARG  11           HG2      ARG  11   0.395  -7.187   5.245
   86    HG3  ARG  11           HG1      ARG  11  -1.264  -6.703   4.918
   87    HD2  ARG  11           HD2      ARG  11  -1.107  -8.426   2.924
   88    HD3  ARG  11           HD1      ARG  11   0.245  -9.086   3.846
   89    HE   ARG  11           HE       ARG  11  -1.790  -8.853   5.717
   90   HH11  ARG  11          HH21      ARG  11  -1.399 -10.307   2.608
   91   HH12  ARG  11          HH22      ARG  11  -2.518 -11.591   2.923
   92   HH21  ARG  11          HH11      ARG  11  -3.251 -10.524   6.140
   93   HH22  ARG  11          HH12      ARG  11  -3.565 -11.714   4.921
   94    H    THR  12           HN       THR  12   2.802  -7.085   0.725
   95    HA   THR  12           HA       THR  12   3.072  -4.265  -0.071
   96    HB   THR  12           HB       THR  12   4.562  -5.879  -1.870
   97    HG1  THR  12           HG1      THR  12   5.123  -7.543  -0.767
   98   HG21  THR  12          HG21      THR  12   5.553  -4.443   0.618
   99   HG22  THR  12          HG22      THR  12   5.219  -3.654  -0.923
  100   HG23  THR  12          HG23      THR  12   6.509  -4.854  -0.808
  101    H    PHE  13           HN       PHE  13   2.769  -3.736  -2.346
  102    HA   PHE  13           HA       PHE  13   0.489  -5.285  -3.562
  103    HB2  PHE  13           HB2      PHE  13   1.107  -2.318  -3.470
  104    HB3  PHE  13           HB1      PHE  13  -0.163  -3.017  -4.475
  105    HD1  PHE  13           HD1      PHE  13   1.058  -2.908  -0.913
  106    HD2  PHE  13           HD2      PHE  13  -2.314  -3.333  -3.543
  107    HE1  PHE  13           HE1      PHE  13  -0.470  -2.913   1.031
  108    HE2  PHE  13           HE2      PHE  13  -3.829  -3.349  -1.596
  109    HZ   PHE  13           HZ       PHE  13  -2.906  -3.116   0.679
  110    H    ARG  14           HN       ARG  14   0.740  -5.920  -5.642
  111    HA   ARG  14           HA       ARG  14   3.256  -5.254  -7.073
  112    HB2  ARG  14           HB2      ARG  14   0.931  -7.069  -7.820
  113    HB3  ARG  14           HB1      ARG  14   2.432  -6.917  -8.731
  114    HG2  ARG  14           HG2      ARG  14   2.226  -7.829  -5.844
  115    HG3  ARG  14           HG1      ARG  14   2.432  -8.903  -7.220
  116    HD2  ARG  14           HD2      ARG  14   4.540  -7.279  -7.689
  117    HD3  ARG  14           HD1      ARG  14   4.439  -7.066  -5.944
  118    HE   ARG  14           HE       ARG  14   5.548  -9.313  -7.278
  119   HH11  ARG  14          HH21      ARG  14   3.308  -8.625  -4.740
  120   HH12  ARG  14          HH22      ARG  14   3.394 -10.215  -4.069
  121   HH21  ARG  14          HH11      ARG  14   5.683 -11.369  -6.395
  122   HH22  ARG  14          HH12      ARG  14   4.741 -11.763  -4.995
  123    H    ASN  15           HN       ASN  15  -0.249  -4.854  -7.338
  124    HA   ASN  15           HA       ASN  15   0.102  -2.905  -9.593
  125    HB2  ASN  15           HB2      ASN  15  -2.496  -3.144  -9.630
  126    HB3  ASN  15           HB1      ASN  15  -1.523  -4.452 -10.313
  127   HD21  ASN  15          HD21      ASN  15  -3.708  -5.603  -9.740
  128   HD22  ASN  15          HD22      ASN  15  -3.791  -6.315  -8.201
  129    H    GLU  16           HN       GLU  16  -0.124  -0.802  -9.125
  130    HA   GLU  16           HA       GLU  16  -0.683   0.080  -6.465
  131    HB2  GLU  16           HB2      GLU  16   0.626   1.404  -8.159
  132    HB3  GLU  16           HB1      GLU  16  -0.881   1.696  -9.027
  133    HG2  GLU  16           HG2      GLU  16  -1.823   2.846  -7.098
  134    HG3  GLU  16           HG1      GLU  16  -0.396   2.461  -6.136
  135    H    LYS  17           HN       LYS  17  -2.668  -0.789  -9.126
  136    HA   LYS  17           HA       LYS  17  -4.981   0.711  -8.655
  137    HB2  LYS  17           HB2      LYS  17  -4.459  -0.974 -10.548
  138    HB3  LYS  17           HB1      LYS  17  -5.039  -2.216  -9.447
  139    HG2  LYS  17           HG2      LYS  17  -7.197  -1.039  -9.235
  140    HG3  LYS  17           HG1      LYS  17  -6.633   0.218 -10.331
  141    HD2  LYS  17           HD2      LYS  17  -6.625  -2.686 -11.214
  142    HD3  LYS  17           HD1      LYS  17  -8.109  -1.744 -11.295
  143    HE2  LYS  17           HE2      LYS  17  -6.884  -0.033 -12.676
  144    HE3  LYS  17           HE1      LYS  17  -5.491  -1.113 -12.701
  145    HZ1  LYS  17           HZ1      LYS  17  -7.980  -1.288 -14.138
  146    HZ2  LYS  17           HZ2      LYS  17  -7.493  -2.750 -13.421
  147    HZ3  LYS  17           HZ3      LYS  17  -6.463  -1.947 -14.509
  148    H    GLU  18           HN       GLU  18  -4.037  -2.441  -7.260
  149    HA   GLU  18           HA       GLU  18  -6.339  -2.612  -5.557
  150    HB2  GLU  18           HB2      GLU  18  -3.661  -4.017  -5.558
  151    HB3  GLU  18           HB1      GLU  18  -4.905  -4.374  -4.357
  152    HG2  GLU  18           HG2      GLU  18  -6.470  -5.027  -6.098
  153    HG3  GLU  18           HG1      GLU  18  -5.335  -4.534  -7.355
  154    H    LEU  19           HN       LEU  19  -3.122  -1.229  -5.159
  155    HA   LEU  19           HA       LEU  19  -3.358  -0.828  -2.310
  156    HB2  LEU  19           HB2      LEU  19  -1.182  -0.845  -3.385
  157    HB3  LEU  19           HB1      LEU  19  -1.644   0.504  -4.398
  158    HG   LEU  19           HG       LEU  19  -1.916   1.804  -2.180
  159   HD11  LEU  19          HD11      LEU  19  -1.773  -0.188  -0.678
  160   HD12  LEU  19          HD12      LEU  19  -0.584   1.051  -0.301
  161   HD13  LEU  19          HD13      LEU  19  -0.099  -0.386  -1.191
  162   HD21  LEU  19          HD21      LEU  19   0.821   0.913  -3.081
  163   HD22  LEU  19          HD22      LEU  19   0.491   2.347  -2.110
  164   HD23  LEU  19          HD23      LEU  19  -0.108   2.248  -3.764
  165    H    ARG  20           HN       ARG  20  -4.300   1.042  -5.149
  166    HA   ARG  20           HA       ARG  20  -4.879   3.496  -3.800
  167    HB2  ARG  20           HB2      ARG  20  -4.778   3.306  -6.267
  168    HB3  ARG  20           HB1      ARG  20  -6.206   2.278  -6.241
  169    HG2  ARG  20           HG2      ARG  20  -6.798   4.596  -6.832
  170    HG3  ARG  20           HG1      ARG  20  -7.543   4.137  -5.307
  171    HD2  ARG  20           HD2      ARG  20  -6.094   5.513  -4.048
  172    HD3  ARG  20           HD1      ARG  20  -4.860   5.536  -5.311
  173    HE   ARG  20           HE       ARG  20  -7.047   6.786  -6.481
  174   HH11  ARG  20          HH21      ARG  20  -5.178   7.168  -3.601
  175   HH12  ARG  20          HH22      ARG  20  -5.424   8.880  -3.513
  176   HH21  ARG  20          HH11      ARG  20  -7.374   9.018  -6.377
  177   HH22  ARG  20          HH12      ARG  20  -6.666   9.926  -5.082
  178    H    ASP  21           HN       ASP  21  -6.671   0.561  -4.322
  179    HA   ASP  21           HA       ASP  21  -9.126   1.484  -3.154
  180    HB2  ASP  21           HB2      ASP  21  -8.120  -1.304  -3.768
  181    HB3  ASP  21           HB1      ASP  21  -9.747  -0.946  -3.192
  182    H    PHE  22           HN       PHE  22  -6.581  -0.762  -2.025
  183    HA   PHE  22           HA       PHE  22  -7.668  -1.080   0.560
  184    HB2  PHE  22           HB2      PHE  22  -4.958  -1.477  -0.655
  185    HB3  PHE  22           HB1      PHE  22  -5.062  -1.494   1.097
  186    HD1  PHE  22           HD1      PHE  22  -7.422  -2.751  -1.536
  187    HD2  PHE  22           HD2      PHE  22  -4.900  -3.762   1.798
  188    HE1  PHE  22           HE1      PHE  22  -8.226  -5.083  -1.629
  189    HE2  PHE  22           HE2      PHE  22  -5.711  -6.087   1.698
  190    HZ   PHE  22           HZ       PHE  22  -7.374  -6.760  -0.012
  191    H    ILE  23           HN       ILE  23  -5.883   1.481  -0.898
  192    HA   ILE  23           HA       ILE  23  -4.988   2.777   1.512
  193    HB   ILE  23           HB       ILE  23  -5.330   3.499  -1.373
  194   HG12  ILE  23          HG12      ILE  23  -3.098   4.092   0.608
  195   HG13  ILE  23          HG11      ILE  23  -3.199   2.612  -0.336
  196   HG21  ILE  23          HG21      ILE  23  -5.236   5.580   0.811
  197   HG22  ILE  23          HG22      ILE  23  -6.396   5.446  -0.515
  198   HG23  ILE  23          HG23      ILE  23  -4.738   5.923  -0.845
  199   HD11  ILE  23          HD11      ILE  23  -1.685   4.311  -1.357
  200   HD12  ILE  23          HD12      ILE  23  -3.059   5.399  -1.522
  201   HD13  ILE  23          HD13      ILE  23  -3.025   3.884  -2.408
  202    H    GLU  24           HN       GLU  24  -7.901   2.857  -0.411
  203    HA   GLU  24           HA       GLU  24  -9.202   4.952   1.008
  204    HB2  GLU  24           HB2      GLU  24 -10.404   2.588  -0.458
  205    HB3  GLU  24           HB1      GLU  24 -11.361   3.898   0.216
  206    HG2  GLU  24           HG2      GLU  24 -10.093   5.522  -1.168
  207    HG3  GLU  24           HG1      GLU  24  -9.194   4.188  -1.887
  208    H    LYS  25           HN       LYS  25  -8.628   1.608   1.756
  209    HA   LYS  25           HA       LYS  25 -10.578   1.455   3.926
  210    HB2  LYS  25           HB2      LYS  25  -9.671  -0.541   2.653
  211    HB3  LYS  25           HB1      LYS  25  -8.138  -0.300   3.487
  212    HG2  LYS  25           HG2      LYS  25  -9.330  -0.522   5.671
  213    HG3  LYS  25           HG1      LYS  25 -10.818  -0.875   4.791
  214    HD2  LYS  25           HD2      LYS  25  -9.790  -2.845   3.774
  215    HD3  LYS  25           HD1      LYS  25  -8.253  -2.475   4.557
  216    HE2  LYS  25           HE2      LYS  25  -9.558  -4.216   5.781
  217    HE3  LYS  25           HE1      LYS  25  -9.254  -2.781   6.760
  218    HZ1  LYS  25           HZ1      LYS  25 -11.730  -3.097   5.172
  219    HZ2  LYS  25           HZ2      LYS  25 -11.430  -2.030   6.460
  220    HZ3  LYS  25           HZ3      LYS  25 -11.600  -3.695   6.755
  221    H    PHE  26           HN       PHE  26  -7.001   1.871   3.779
  222    HA   PHE  26           HA       PHE  26  -6.642   2.084   6.611
  223    HB2  PHE  26           HB2      PHE  26  -4.967   3.648   4.624
  224    HB3  PHE  26           HB1      PHE  26  -4.469   2.962   6.163
  225    HD1  PHE  26           HD1      PHE  26  -5.754   0.151   5.773
  226    HD2  PHE  26           HD2      PHE  26  -3.335   2.623   3.203
  227    HE1  PHE  26           HE1      PHE  26  -4.931  -1.858   4.604
  228    HE2  PHE  26           HE2      PHE  26  -2.524   0.593   2.028
  229    HZ   PHE  26           HZ       PHE  26  -3.318  -1.645   2.738
  230   H11A  DNS  27          H22       DNS  27   0.693   4.536   6.602
  231    H12  DNS  27           H23      DNS  27   1.587   5.215   5.238
  232    H13  DNS  27           H24      DNS  27   1.708   3.481   5.601
  233    H21  DNS  27           H21      DNS  27  -0.202   2.130   5.517
  234    H22  DNS  27           H19      DNS  27  -1.525   2.536   4.410
  235    H23  DNS  27           H20      DNS  27  -1.502   3.224   6.037
  236    H4   DNS  27           H14      DNS  27  -1.480   5.294   6.711
  237    H5   DNS  27           H15      DNS  27  -2.878   7.350   6.404
  238    H6   DNS  27           H16      DNS  27  -3.094   8.402   4.142
  239    HZ   DNS  27           HZ1      DNS  27  -4.183   7.885   3.027
  240    HE3  DNS  27           HE1      DNS  27  -5.431   9.837   2.376
  241    HE2  DNS  27           HE2      DNS  27  -5.459   9.203   0.741
  242    HD3  DNS  27           HD1      DNS  27  -7.546   8.760   2.054
  243    HD2  DNS  27           HD2      DNS  27  -6.779   7.307   1.414
  244    HG3  DNS  27           HG1      DNS  27  -5.887   6.704   3.548
  245    HG2  DNS  27           HG2      DNS  27  -6.207   8.302   4.224
  246    HB3  DNS  27           HB1      DNS  27  -8.593   7.931   4.166
  247    HB2  DNS  27           HB2      DNS  27  -8.390   6.421   3.277
  248    HA   DNS  27           HA       DNS  27  -7.144   6.813   6.013
  249    H    DNS  27           HN       DNS  27  -7.120   4.646   4.156
  250    H9   DNS  27           H9       DNS  27  -1.332   7.386  -0.234
  251    H10  DNS  27           H10      DNS  27   0.058   5.340   0.089
  252    H11  DNS  27           H11      DNS  27   0.267   4.299   2.352
  253    H    GLY  28           HN       GLY  28  -8.591   7.243   7.593
  254    HA2  GLY  28           HA2      GLY  28 -11.424   7.100   7.268
  255    HA3  GLY  28           HA1      GLY  28 -10.879   5.658   8.126
  256    H    ARG  29           HN       ARG  29  -9.177   6.284   9.941
  257    HA   ARG  29           HA       ARG  29 -10.560   7.869  11.885
  258    HB2  ARG  29           HB2      ARG  29  -7.771   6.699  11.729
  259    HB3  ARG  29           HB1      ARG  29  -8.114   7.875  12.991
  260    HG2  ARG  29           HG2      ARG  29  -8.484   5.645  13.873
  261    HG3  ARG  29           HG1      ARG  29 -10.035   6.468  13.743
  262    HD2  ARG  29           HD2      ARG  29  -8.975   4.610  11.596
  263    HD3  ARG  29           HD1      ARG  29 -10.005   4.063  12.916
  264    HE   ARG  29           HE       ARG  29 -11.389   6.214  11.824
  265   HH11  ARG  29          HH21      ARG  29 -10.025   3.259  10.668
  266   HH12  ARG  29          HH22      ARG  29 -11.204   3.053   9.416
  267   HH21  ARG  29          HH11      ARG  29 -12.933   5.955  10.200
  268   HH22  ARG  29          HH12      ARG  29 -12.850   4.579   9.153
  Start of MODEL   16
    1    H1   GLY   1           HT1      GLY   1  10.721   3.109  -8.652
    2    H2   GLY   1           HT2      GLY   1  11.460   3.302 -10.170
    3    H3   GLY   1           HT3      GLY   1  12.414   3.173  -8.769
    4    HA2  GLY   1           HA2      GLY   1  10.901   1.071 -10.314
    5    HA3  GLY   1           HA1      GLY   1  12.503   1.015  -9.517
    6    H    GLN   2           HN       GLN   2  12.385   1.898  -7.073
    7    HA   GLN   2           HA       GLN   2  12.620  -0.779  -6.047
    8    HB2  GLN   2           HB2      GLN   2  12.307   1.829  -4.524
    9    HB3  GLN   2           HB1      GLN   2  12.898   0.306  -3.858
   10    HG2  GLN   2           HG2      GLN   2  14.801   0.342  -5.410
   11    HG3  GLN   2           HG1      GLN   2  14.205   1.840  -6.125
   12   HE21  GLN   2          HE21      GLN   2  16.010   3.152  -5.436
   13   HE22  GLN   2          HE22      GLN   2  16.300   3.504  -3.801
   14    H    GLN   3           HN       GLN   3  11.133  -2.021  -4.911
   15    HA   GLN   3           HA       GLN   3   8.332  -1.397  -5.244
   16    HB2  GLN   3           HB2      GLN   3   9.517  -3.493  -3.404
   17    HB3  GLN   3           HB1      GLN   3   7.894  -3.466  -4.100
   18    HG2  GLN   3           HG2      GLN   3   8.904  -3.610  -6.374
   19    HG3  GLN   3           HG1      GLN   3  10.499  -3.745  -5.631
   20   HE21  GLN   3          HE21      GLN   3   7.370  -5.419  -5.993
   21   HE22  GLN   3          HE22      GLN   3   7.948  -6.947  -5.530
   22    H    TYR   4           HN       TYR   4   6.822  -0.864  -3.642
   23    HA   TYR   4           HA       TYR   4   7.666   1.001  -1.689
   24    HB2  TYR   4           HB2      TYR   4   4.981  -0.068  -1.132
   25    HB3  TYR   4           HB1      TYR   4   5.422   1.528  -1.695
   26    HD1  TYR   4           HD2      TYR   4   6.424   1.478  -4.232
   27    HD2  TYR   4           HD1      TYR   4   3.527  -1.254  -2.604
   28    HE1  TYR   4           HE2      TYR   4   5.629   0.952  -6.517
   29    HE2  TYR   4           HE1      TYR   4   2.746  -1.773  -4.893
   30    HH   TYR   4           HH       TYR   4   3.129  -0.011  -7.417
   31    H    THR   5           HN       THR   5   8.625   0.550   0.272
   32    HA   THR   5           HA       THR   5   8.020  -2.089   1.622
   33    HB   THR   5           HB       THR   5  10.265  -2.207   2.327
   34    HG1  THR   5           HG1      THR   5  10.758   0.427   1.476
   35   HG21  THR   5          HG21      THR   5  10.650  -0.734  -0.273
   36   HG22  THR   5          HG22      THR   5   9.912  -2.337  -0.245
   37   HG23  THR   5          HG23      THR   5  11.562  -2.111   0.339
   38    H    ALA   6           HN       ALA   6   8.401   1.362   2.041
   39    HA   ALA   6           HA       ALA   6   8.111   1.248   4.985
   40    HB1  ALA   6           HB1      ALA   6   8.033   3.655   3.116
   41    HB2  ALA   6           HB2      ALA   6   9.517   2.997   3.819
   42    HB3  ALA   6           HB3      ALA   6   8.273   3.678   4.867
   43    H1   NAL   7           H1       NAL   7   3.385   4.986   1.213
   44    H3   NAL   7           H3       NAL   7   6.549   2.360  -0.008
   45    H4   NAL   7           H4       NAL   7   7.818   4.272  -0.954
   46    H5   NAL   7           H5       NAL   7   7.987   6.799  -1.450
   47    H6   NAL   7           H6       NAL   7   7.001   9.067  -1.321
   48    H7   NAL   7           H7       NAL   7   4.787   9.418  -0.255
   49    H8   NAL   7           H8       NAL   7   3.532   7.499   0.690
   50    H91  NAL   7           H91      NAL   7   3.082   2.643   1.020
   51    H92  NAL   7           H92      NAL   7   4.478   1.569   0.865
   52    H10  NAL   7           H10      NAL   7   4.102   3.588   3.115
   53    HN1  NAL   7           HN1      NAL   7   6.431   2.513   2.211
   54    H    ILE   8           HN       ILE   8   4.622   0.102   2.666
   55    HA   ILE   8           HA       ILE   8   2.562  -0.437   4.722
   56    HB   ILE   8           HB       ILE   8   1.658  -2.197   2.891
   57   HG12  ILE   8          HG12      ILE   8   1.565  -1.181   0.643
   58   HG13  ILE   8          HG11      ILE   8   2.563   0.166   1.180
   59   HG21  ILE   8          HG21      ILE   8   0.304  -0.416   4.007
   60   HG22  ILE   8          HG22      ILE   8  -0.117  -0.621   2.307
   61   HG23  ILE   8          HG23      ILE   8   0.889   0.744   2.804
   62   HD11  ILE   8          HD11      ILE   8   4.491  -1.194   1.345
   63   HD12  ILE   8          HD12      ILE   8   3.695  -1.758  -0.123
   64   HD13  ILE   8          HD13      ILE   8   3.543  -2.684   1.356
   65    H    LYS   9           HN       LYS   9   3.537  -1.774   6.068
   66    HA   LYS   9           HA       LYS   9   5.732  -3.499   5.177
   67    HB2  LYS   9           HB2      LYS   9   5.894  -2.010   7.237
   68    HB3  LYS   9           HB1      LYS   9   4.744  -3.099   8.006
   69    HG2  LYS   9           HG2      LYS   9   6.791  -4.023   8.707
   70    HG3  LYS   9           HG1      LYS   9   6.451  -4.994   7.280
   71    HD2  LYS   9           HD2      LYS   9   7.947  -3.578   5.932
   72    HD3  LYS   9           HD1      LYS   9   8.224  -2.524   7.318
   73    HE2  LYS   9           HE2      LYS   9   9.282  -4.331   8.544
   74    HE3  LYS   9           HE1      LYS   9   8.878  -5.483   7.271
   75    HZ1  LYS   9           HZ1      LYS   9  10.359  -4.475   5.795
   76    HZ2  LYS   9           HZ2      LYS   9  11.208  -4.523   7.266
   77    HZ3  LYS   9           HZ3      LYS   9  10.503  -3.071   6.735
   78    H    GLY  10           HN       GLY  10   5.648  -5.710   5.157
   79    HA2  GLY  10           HA2      GLY  10   4.826  -7.885   5.517
   80    HA3  GLY  10           HA1      GLY  10   3.589  -7.212   6.573
   81    H    ARG  11           HN       ARG  11   2.876  -5.325   4.190
   82    HA   ARG  11           HA       ARG  11   1.455  -7.342   2.459
   83    HB2  ARG  11           HB2      ARG  11   0.227  -4.847   3.674
   84    HB3  ARG  11           HB1      ARG  11  -0.578  -5.974   2.580
   85    HG2  ARG  11           HG2      ARG  11  -0.270  -7.789   4.230
   86    HG3  ARG  11           HG1      ARG  11   0.514  -6.653   5.328
   87    HD2  ARG  11           HD2      ARG  11  -2.339  -6.485   4.314
   88    HD3  ARG  11           HD1      ARG  11  -1.837  -6.899   5.953
   89    HE   ARG  11           HE       ARG  11  -0.678  -4.416   5.511
   90   HH11  ARG  11          HH21      ARG  11  -3.850  -5.767   5.291
   91   HH12  ARG  11          HH22      ARG  11  -4.650  -4.283   5.686
   92   HH21  ARG  11          HH11      ARG  11  -1.711  -2.476   6.028
   93   HH22  ARG  11          HH12      ARG  11  -3.441  -2.422   6.103
   94    H    THR  12           HN       THR  12   2.714  -6.917   0.621
   95    HA   THR  12           HA       THR  12   2.889  -4.133  -0.339
   96    HB   THR  12           HB       THR  12   4.355  -5.728  -2.129
   97    HG1  THR  12           HG1      THR  12   4.059  -7.448  -0.624
   98   HG21  THR  12          HG21      THR  12   5.054  -3.539  -1.160
   99   HG22  THR  12          HG22      THR  12   6.333  -4.752  -1.057
  100   HG23  THR  12          HG23      THR  12   5.385  -4.346   0.373
  101    H    PHE  13           HN       PHE  13   2.435  -3.749  -2.619
  102    HA   PHE  13           HA       PHE  13   0.128  -5.423  -3.585
  103    HB2  PHE  13           HB2      PHE  13   0.723  -2.463  -3.834
  104    HB3  PHE  13           HB1      PHE  13  -0.619  -3.270  -4.642
  105    HD1  PHE  13           HD1      PHE  13   0.904  -2.726  -1.251
  106    HD2  PHE  13           HD2      PHE  13  -2.668  -3.538  -3.481
  107    HE1  PHE  13           HE1      PHE  13  -0.434  -2.540   0.818
  108    HE2  PHE  13           HE2      PHE  13  -4.005  -3.354  -1.416
  109    HZ   PHE  13           HZ       PHE  13  -2.885  -2.840   0.726
  110    H    ARG  14           HN       ARG  14   0.233  -6.211  -5.632
  111    HA   ARG  14           HA       ARG  14   2.695  -5.815  -7.205
  112    HB2  ARG  14           HB2      ARG  14   0.133  -7.354  -7.780
  113    HB3  ARG  14           HB1      ARG  14   1.558  -7.360  -8.819
  114    HG2  ARG  14           HG2      ARG  14   2.912  -8.301  -7.001
  115    HG3  ARG  14           HG1      ARG  14   1.522  -8.244  -5.916
  116    HD2  ARG  14           HD2      ARG  14   1.612  -9.821  -8.503
  117    HD3  ARG  14           HD1      ARG  14   1.895 -10.511  -6.905
  118    HE   ARG  14           HE       ARG  14  -0.568  -9.240  -6.672
  119   HH11  ARG  14          HH21      ARG  14   0.855 -11.596  -8.758
  120   HH12  ARG  14          HH22      ARG  14  -0.639 -12.415  -9.068
  121   HH21  ARG  14          HH11      ARG  14  -2.522 -10.298  -7.069
  122   HH22  ARG  14          HH12      ARG  14  -2.550 -11.680  -8.112
  123    H    ASN  15           HN       ASN  15  -0.752  -5.044  -7.381
  124    HA   ASN  15           HA       ASN  15  -0.245  -3.094  -9.607
  125    HB2  ASN  15           HB2      ASN  15  -2.857  -3.091  -9.616
  126    HB3  ASN  15           HB1      ASN  15  -2.014  -4.460 -10.350
  127   HD21  ASN  15          HD21      ASN  15  -4.307  -5.400  -9.778
  128   HD22  ASN  15          HD22      ASN  15  -4.433  -6.161  -8.265
  129    H    GLU  16           HN       GLU  16  -0.270  -0.993  -9.078
  130    HA   GLU  16           HA       GLU  16  -0.718  -0.140  -6.386
  131    HB2  GLU  16           HB2      GLU  16   0.673   1.054  -8.182
  132    HB3  GLU  16           HB1      GLU  16  -0.852   1.624  -8.857
  133    HG2  GLU  16           HG2      GLU  16  -1.392   2.592  -6.581
  134    HG3  GLU  16           HG1      GLU  16   0.251   2.180  -6.091
  135    H    LYS  17           HN       LYS  17  -2.797  -0.744  -9.052
  136    HA   LYS  17           HA       LYS  17  -4.979   0.922  -8.525
  137    HB2  LYS  17           HB2      LYS  17  -4.674  -0.703 -10.471
  138    HB3  LYS  17           HB1      LYS  17  -5.210  -1.979  -9.382
  139    HG2  LYS  17           HG2      LYS  17  -7.292  -0.580  -8.941
  140    HG3  LYS  17           HG1      LYS  17  -6.782   0.465 -10.260
  141    HD2  LYS  17           HD2      LYS  17  -7.229  -2.529 -10.534
  142    HD3  LYS  17           HD1      LYS  17  -8.440  -1.315 -10.930
  143    HE2  LYS  17           HE2      LYS  17  -5.780  -1.800 -12.298
  144    HE3  LYS  17           HE1      LYS  17  -7.390  -1.859 -13.003
  145    HZ1  LYS  17           HZ1      LYS  17  -5.766   0.473 -12.285
  146    HZ2  LYS  17           HZ2      LYS  17  -7.458   0.605 -12.207
  147    HZ3  LYS  17           HZ3      LYS  17  -6.702   0.192 -13.672
  148    H    GLU  18           HN       GLU  18  -4.308  -2.337  -7.232
  149    HA   GLU  18           HA       GLU  18  -6.582  -2.361  -5.502
  150    HB2  GLU  18           HB2      GLU  18  -4.016  -3.956  -5.586
  151    HB3  GLU  18           HB1      GLU  18  -5.228  -4.231  -4.331
  152    HG2  GLU  18           HG2      GLU  18  -6.908  -4.776  -5.990
  153    HG3  GLU  18           HG1      GLU  18  -5.823  -4.327  -7.303
  154    H    LEU  19           HN       LEU  19  -3.331  -1.096  -5.174
  155    HA   LEU  19           HA       LEU  19  -3.431  -0.758  -2.303
  156    HB2  LEU  19           HB2      LEU  19  -1.307  -0.798  -3.459
  157    HB3  LEU  19           HB1      LEU  19  -1.780   0.569  -4.446
  158    HG   LEU  19           HG       LEU  19  -1.953   1.825  -2.161
  159   HD11  LEU  19          HD11      LEU  19  -0.617   1.054  -0.358
  160   HD12  LEU  19          HD12      LEU  19   0.045  -0.258  -1.326
  161   HD13  LEU  19          HD13      LEU  19  -1.639  -0.302  -0.814
  162   HD21  LEU  19          HD21      LEU  19  -0.305   2.457  -3.786
  163   HD22  LEU  19          HD22      LEU  19   0.670   1.036  -3.413
  164   HD23  LEU  19          HD23      LEU  19   0.511   2.335  -2.229
  165    H    ARG  20           HN       ARG  20  -4.341   1.255  -5.081
  166    HA   ARG  20           HA       ARG  20  -4.848   3.678  -3.647
  167    HB2  ARG  20           HB2      ARG  20  -6.084   2.513  -6.157
  168    HB3  ARG  20           HB1      ARG  20  -6.506   4.114  -5.551
  169    HG2  ARG  20           HG2      ARG  20  -4.218   4.878  -5.778
  170    HG3  ARG  20           HG1      ARG  20  -3.668   3.254  -6.192
  171    HD2  ARG  20           HD2      ARG  20  -5.078   3.299  -8.220
  172    HD3  ARG  20           HD1      ARG  20  -5.603   4.933  -7.813
  173    HE   ARG  20           HE       ARG  20  -2.830   5.108  -7.854
  174   HH11  ARG  20          HH21      ARG  20  -5.300   4.022 -10.011
  175   HH12  ARG  20          HH22      ARG  20  -4.416   4.440 -11.440
  176   HH21  ARG  20          HH11      ARG  20  -1.670   5.658  -9.709
  177   HH22  ARG  20          HH12      ARG  20  -2.363   5.365 -11.270
  178    H    ASP  21           HN       ASP  21  -6.774   0.834  -4.237
  179    HA   ASP  21           HA       ASP  21  -9.160   1.822  -2.983
  180    HB2  ASP  21           HB2      ASP  21  -9.255   0.042  -4.679
  181    HB3  ASP  21           HB1      ASP  21  -8.340  -1.023  -3.615
  182    H    PHE  22           HN       PHE  22  -6.695  -0.562  -1.979
  183    HA   PHE  22           HA       PHE  22  -7.736  -0.944   0.615
  184    HB2  PHE  22           HB2      PHE  22  -5.066  -1.361  -0.682
  185    HB3  PHE  22           HB1      PHE  22  -5.134  -1.458   1.068
  186    HD1  PHE  22           HD2      PHE  22  -7.663  -2.527  -1.491
  187    HD2  PHE  22           HD1      PHE  22  -4.917  -3.770   1.579
  188    HE1  PHE  22           HE2      PHE  22  -8.509  -4.840  -1.663
  189    HE2  PHE  22           HE1      PHE  22  -5.768  -6.076   1.397
  190    HZ   PHE  22           HZ       PHE  22  -7.566  -6.622  -0.221
  191    H    ILE  23           HN       ILE  23  -5.895   1.608  -0.785
  192    HA   ILE  23           HA       ILE  23  -4.922   2.780   1.662
  193    HB   ILE  23           HB       ILE  23  -5.247   3.602  -1.198
  194   HG12  ILE  23          HG12      ILE  23  -2.974   4.011   0.786
  195   HG13  ILE  23          HG11      ILE  23  -3.155   2.580  -0.224
  196   HG21  ILE  23          HG21      ILE  23  -6.208   5.572  -0.286
  197   HG22  ILE  23          HG22      ILE  23  -4.526   5.983  -0.583
  198   HG23  ILE  23          HG23      ILE  23  -5.060   5.602   1.054
  199   HD11  ILE  23          HD11      ILE  23  -2.980   3.972  -2.239
  200   HD12  ILE  23          HD12      ILE  23  -1.569   4.198  -1.215
  201   HD13  ILE  23          HD13      ILE  23  -2.843   5.417  -1.247
  202    H    GLU  24           HN       GLU  24  -7.845   3.033  -0.230
  203    HA   GLU  24           HA       GLU  24  -9.035   5.161   1.230
  204    HB2  GLU  24           HB2      GLU  24 -10.356   2.868  -0.246
  205    HB3  GLU  24           HB1      GLU  24 -11.252   4.201   0.464
  206    HG2  GLU  24           HG2      GLU  24 -10.009   5.805  -0.925
  207    HG3  GLU  24           HG1      GLU  24  -9.083   4.484  -1.637
  208    H    LYS  25           HN       LYS  25  -8.633   1.773   1.926
  209    HA   LYS  25           HA       LYS  25 -10.539   1.718   4.142
  210    HB2  LYS  25           HB2      LYS  25  -9.916  -0.348   2.930
  211    HB3  LYS  25           HB1      LYS  25  -8.253  -0.163   3.479
  212    HG2  LYS  25           HG2      LYS  25  -8.876  -0.489   5.779
  213    HG3  LYS  25           HG1      LYS  25 -10.592  -0.373   5.396
  214    HD2  LYS  25           HD2      LYS  25  -9.996  -2.717   5.711
  215    HD3  LYS  25           HD1      LYS  25 -10.403  -2.439   4.020
  216    HE2  LYS  25           HE2      LYS  25  -8.121  -2.528   3.343
  217    HE3  LYS  25           HE1      LYS  25  -7.534  -2.311   4.994
  218    HZ1  LYS  25           HZ1      LYS  25  -7.707  -4.475   5.403
  219    HZ2  LYS  25           HZ2      LYS  25  -7.855  -4.686   3.724
  220    HZ3  LYS  25           HZ3      LYS  25  -9.245  -4.593   4.698
  221    H    PHE  26           HN       PHE  26  -6.951   1.905   3.911
  222    HA   PHE  26           HA       PHE  26  -6.517   2.075   6.740
  223    HB2  PHE  26           HB2      PHE  26  -4.771   3.513   4.716
  224    HB3  PHE  26           HB1      PHE  26  -4.294   2.793   6.247
  225    HD1  PHE  26           HD1      PHE  26  -5.774   0.083   5.895
  226    HD2  PHE  26           HD2      PHE  26  -3.252   2.379   3.258
  227    HE1  PHE  26           HE1      PHE  26  -5.118  -1.980   4.716
  228    HE2  PHE  26           HE2      PHE  26  -2.612   0.293   2.068
  229    HZ   PHE  26           HZ       PHE  26  -3.542  -1.882   2.814
  230   H11A  DNS  27          H22       DNS  27   2.246   3.926   7.491
  231    H12  DNS  27           H23      DNS  27   2.525   4.328   5.794
  232    H13  DNS  27           H24      DNS  27   2.781   2.666   6.366
  233    H21  DNS  27           H21      DNS  27  -0.660   2.148   7.359
  234    H22  DNS  27           H19      DNS  27  -0.739   3.908   7.547
  235    H23  DNS  27           H20      DNS  27   0.595   3.007   8.273
  236    H4   DNS  27           H14      DNS  27  -0.143   2.621   3.745
  237    H5   DNS  27           H15      DNS  27  -1.140   4.238   2.122
  238    H6   DNS  27           H16      DNS  27  -1.382   6.651   2.730
  239    HZ   DNS  27           HZ1      DNS  27  -3.310   8.352   4.738
  240    HE3  DNS  27           HE1      DNS  27  -3.238   8.883   2.087
  241    HE2  DNS  27           HE2      DNS  27  -3.420   7.138   2.172
  242    HD3  DNS  27           HD1      DNS  27  -5.214   9.240   3.396
  243    HD2  DNS  27           HD2      DNS  27  -5.622   8.063   2.145
  244    HG3  DNS  27           HG1      DNS  27  -5.122   6.245   3.852
  245    HG2  DNS  27           HG2      DNS  27  -5.009   7.517   5.068
  246    HB3  DNS  27           HB1      DNS  27  -7.331   8.246   4.424
  247    HB2  DNS  27           HB2      DNS  27  -7.432   6.835   3.370
  248    HA   DNS  27           HA       DNS  27  -6.895   6.735   6.355
  249    H    DNS  27           HN       DNS  27  -6.871   4.641   4.286
  250    H9   DNS  27           H9       DNS  27  -0.362   9.299   6.596
  251    H10  DNS  27           H10      DNS  27   0.635   7.710   8.237
  252    H11  DNS  27           H11      DNS  27   0.896   5.303   7.665
  253    H    GLY  28           HN       GLY  28  -8.833   5.333   7.302
  254    HA2  GLY  28           HA2      GLY  28 -11.202   6.898   7.053
  255    HA3  GLY  28           HA1      GLY  28 -11.404   5.428   6.098
  256    H    ARG  29           HN       ARG  29  -9.983   6.191   9.299
  257    HA   ARG  29           HA       ARG  29 -10.224   5.087  11.355
  258    HB2  ARG  29           HB2      ARG  29 -13.014   4.438  10.358
  259    HB3  ARG  29           HB1      ARG  29 -12.482   4.610  12.031
  260    HG2  ARG  29           HG2      ARG  29 -12.562   6.820   9.949
  261    HG3  ARG  29           HG1      ARG  29 -13.681   6.626  11.296
  262    HD2  ARG  29           HD2      ARG  29 -12.156   8.212  12.138
  263    HD3  ARG  29           HD1      ARG  29 -11.500   6.707  12.781
  264    HE   ARG  29           HE       ARG  29 -10.228   7.025  10.322
  265   HH11  ARG  29          HH21      ARG  29 -10.668   8.896  13.192
  266   HH12  ARG  29          HH22      ARG  29  -9.158   9.729  13.036
  267   HH21  ARG  29          HH11      ARG  29  -8.257   8.105  10.108
  268   HH22  ARG  29          HH12      ARG  29  -7.795   9.281  11.292
  Start of MODEL   17
    1    H1   GLY   1           HT1      GLY   1  10.609   2.297 -11.381
    2    H2   GLY   1           HT2      GLY   1   9.690   3.582 -12.003
    3    H3   GLY   1           HT3      GLY   1   8.933   2.122 -11.582
    4    HA2  GLY   1           HA2      GLY   1   9.521   4.477  -9.972
    5    HA3  GLY   1           HA1      GLY   1   8.628   2.987  -9.546
    6    H    GLN   2           HN       GLN   2  10.172   4.244  -7.673
    7    HA   GLN   2           HA       GLN   2  11.834   2.060  -6.809
    8    HB2  GLN   2           HB2      GLN   2  10.461   4.179  -5.126
    9    HB3  GLN   2           HB1      GLN   2  11.836   3.189  -4.636
   10    HG2  GLN   2           HG2      GLN   2  13.214   4.178  -6.400
   11    HG3  GLN   2           HG1      GLN   2  11.839   5.120  -6.975
   12   HE21  GLN   2          HE21      GLN   2  14.571   5.788  -5.512
   13   HE22  GLN   2          HE22      GLN   2  14.081   6.889  -4.316
   14    H    GLN   3           HN       GLN   3  11.296   0.223  -5.658
   15    HA   GLN   3           HA       GLN   3   8.521  -0.581  -5.541
   16    HB2  GLN   3           HB2      GLN   3  10.419  -2.182  -5.803
   17    HB3  GLN   3           HB1      GLN   3  10.911  -1.828  -4.147
   18    HG2  GLN   3           HG2      GLN   3   8.814  -2.678  -3.278
   19    HG3  GLN   3           HG1      GLN   3   8.171  -2.879  -4.909
   20   HE21  GLN   3          HE21      GLN   3   7.920  -5.233  -4.380
   21   HE22  GLN   3          HE22      GLN   3   9.274  -6.252  -4.450
   22    H    TYR   4           HN       TYR   4   7.156  -0.651  -3.764
   23    HA   TYR   4           HA       TYR   4   7.525   1.278  -1.730
   24    HB2  TYR   4           HB2      TYR   4   5.508  -0.450  -0.768
   25    HB3  TYR   4           HB1      TYR   4   5.248   0.975  -1.759
   26    HD1  TYR   4           HD1      TYR   4   6.590  -2.496  -2.378
   27    HD2  TYR   4           HD2      TYR   4   3.788   0.544  -3.581
   28    HE1  TYR   4           HE1      TYR   4   5.828  -3.931  -4.238
   29    HE2  TYR   4           HE2      TYR   4   3.027  -0.907  -5.435
   30    HH   TYR   4           HH       TYR   4   4.614  -4.000  -6.127
   31    H    THR   5           HN       THR   5   8.667   1.153   0.145
   32    HA   THR   5           HA       THR   5   9.402  -1.565   1.243
   33    HB   THR   5           HB       THR   5  11.501  -0.662   1.899
   34    HG1  THR   5           HG1      THR   5  11.817   1.681   1.436
   35   HG21  THR   5          HG21      THR   5  10.972   0.710  -0.737
   36   HG22  THR   5          HG22      THR   5  11.155  -1.041  -0.610
   37   HG23  THR   5          HG23      THR   5  12.492   0.024  -0.170
   38    H    ALA   6           HN       ALA   6   8.171   1.620   1.947
   39    HA   ALA   6           HA       ALA   6   7.998   0.997   4.889
   40    HB1  ALA   6           HB1      ALA   6   7.793   3.686   3.482
   41    HB2  ALA   6           HB2      ALA   6   9.279   3.054   4.206
   42    HB3  ALA   6           HB3      ALA   6   7.881   3.400   5.223
   43    H1   NAL   7           H1       NAL   7   3.227   4.822   1.347
   44    H3   NAL   7           H3       NAL   7   6.242   2.275  -0.336
   45    H4   NAL   7           H4       NAL   7   7.351   4.222  -1.395
   46    H5   NAL   7           H5       NAL   7   7.432   6.767  -1.828
   47    H6   NAL   7           H6       NAL   7   6.450   9.018  -1.495
   48    H7   NAL   7           H7       NAL   7   4.392   9.303  -0.138
   49    H8   NAL   7           H8       NAL   7   3.291   7.336   0.899
   50    H91  NAL   7           H91      NAL   7   2.916   2.427   0.966
   51    H92  NAL   7           H92      NAL   7   4.350   1.416   0.780
   52    H10  NAL   7           H10      NAL   7   3.900   3.375   3.064
   53    HN1  NAL   7           HN1      NAL   7   6.319   2.622   2.256
   54    H    ILE   8           HN       ILE   8   4.495  -0.070   2.435
   55    HA   ILE   8           HA       ILE   8   2.511  -0.761   4.531
   56    HB   ILE   8           HB       ILE   8   1.550  -2.401   2.617
   57   HG12  ILE   8          HG12      ILE   8   1.363  -1.233   0.455
   58   HG13  ILE   8          HG11      ILE   8   2.370   0.081   1.045
   59   HG21  ILE   8          HG21      ILE   8   0.755   0.528   2.766
   60   HG22  ILE   8          HG22      ILE   8   0.227  -0.718   3.907
   61   HG23  ILE   8          HG23      ILE   8  -0.257  -0.808   2.214
   62   HD11  ILE   8          HD11      ILE   8   3.327  -2.779   0.900
   63   HD12  ILE   8          HD12      ILE   8   4.301  -1.322   1.102
   64   HD13  ILE   8          HD13      ILE   8   3.501  -1.650  -0.431
   65    H    LYS   9           HN       LYS   9   3.682  -2.061   5.777
   66    HA   LYS   9           HA       LYS   9   5.718  -3.846   4.634
   67    HB2  LYS   9           HB2      LYS   9   5.071  -3.030   7.474
   68    HB3  LYS   9           HB1      LYS   9   6.265  -4.266   7.085
   69    HG2  LYS   9           HG2      LYS   9   7.646  -2.707   5.899
   70    HG3  LYS   9           HG1      LYS   9   6.386  -1.477   5.895
   71    HD2  LYS   9           HD2      LYS   9   8.055  -0.927   7.591
   72    HD3  LYS   9           HD1      LYS   9   6.532  -1.344   8.375
   73    HE2  LYS   9           HE2      LYS   9   7.344  -3.478   9.056
   74    HE3  LYS   9           HE1      LYS   9   8.704  -3.413   7.932
   75    HZ1  LYS   9           HZ1      LYS   9   8.346  -2.048  10.502
   76    HZ2  LYS   9           HZ2      LYS   9   9.282  -1.292   9.303
   77    HZ3  LYS   9           HZ3      LYS   9   9.714  -2.833   9.875
   78    H    GLY  10           HN       GLY  10   5.654  -6.069   4.795
   79    HA2  GLY  10           HA2      GLY  10   4.811  -8.215   5.229
   80    HA3  GLY  10           HA1      GLY  10   3.681  -7.497   6.371
   81    H    ARG  11           HN       ARG  11   2.776  -5.646   4.047
   82    HA   ARG  11           HA       ARG  11   1.218  -7.661   2.442
   83    HB2  ARG  11           HB2      ARG  11   0.067  -5.174   3.747
   84    HB3  ARG  11           HB1      ARG  11  -0.811  -6.335   2.751
   85    HG2  ARG  11           HG2      ARG  11  -0.245  -8.117   4.402
   86    HG3  ARG  11           HG1      ARG  11   0.506  -6.898   5.425
   87    HD2  ARG  11           HD2      ARG  11  -1.846  -5.676   5.180
   88    HD3  ARG  11           HD1      ARG  11  -2.422  -7.300   4.811
   89    HE   ARG  11           HE       ARG  11  -1.839  -6.276   7.405
   90   HH11  ARG  11          HH21      ARG  11  -1.225  -9.081   5.484
   91   HH12  ARG  11          HH22      ARG  11  -0.766 -10.056   6.836
   92   HH21  ARG  11          HH11      ARG  11  -1.271  -7.544   9.163
   93   HH22  ARG  11          HH12      ARG  11  -0.801  -9.193   8.914
   94    H    THR  12           HN       THR  12   2.315  -7.208   0.507
   95    HA   THR  12           HA       THR  12   2.320  -4.408  -0.452
   96    HB   THR  12           HB       THR  12   3.865  -5.817  -2.274
   97    HG1  THR  12           HG1      THR  12   4.297  -7.633  -1.345
   98   HG21  THR  12          HG21      THR  12   5.813  -4.858  -1.116
   99   HG22  THR  12          HG22      THR  12   4.828  -4.559   0.316
  100   HG23  THR  12          HG23      THR  12   4.491  -3.691  -1.181
  101    H    PHE  13           HN       PHE  13   1.777  -4.069  -2.706
  102    HA   PHE  13           HA       PHE  13  -0.325  -5.983  -3.693
  103    HB2  PHE  13           HB2      PHE  13  -0.176  -2.975  -4.053
  104    HB3  PHE  13           HB1      PHE  13  -1.505  -4.031  -4.540
  105    HD1  PHE  13           HD1      PHE  13   0.390  -2.721  -1.597
  106    HD2  PHE  13           HD2      PHE  13  -3.157  -4.739  -2.947
  107    HE1  PHE  13           HE1      PHE  13  -0.557  -2.622   0.690
  108    HE2  PHE  13           HE2      PHE  13  -4.110  -4.587  -0.670
  109    HZ   PHE  13           HZ       PHE  13  -2.801  -3.515   1.140
  110    H    ARG  14           HN       ARG  14  -0.043  -6.732  -5.747
  111    HA   ARG  14           HA       ARG  14   2.391  -6.169  -7.187
  112    HB2  ARG  14           HB2      ARG  14  -0.207  -7.495  -8.044
  113    HB3  ARG  14           HB1      ARG  14   1.210  -7.386  -9.088
  114    HG2  ARG  14           HG2      ARG  14   2.544  -8.646  -7.465
  115    HG3  ARG  14           HG1      ARG  14   1.179  -8.698  -6.350
  116    HD2  ARG  14           HD2      ARG  14   1.286 -10.806  -7.555
  117    HD3  ARG  14           HD1      ARG  14  -0.137  -9.914  -8.095
  118    HE   ARG  14           HE       ARG  14   1.840  -9.156  -9.888
  119   HH11  ARG  14          HH21      ARG  14   0.525 -12.135  -8.737
  120   HH12  ARG  14          HH22      ARG  14   0.815 -12.985 -10.219
  121   HH21  ARG  14          HH11      ARG  14   2.223 -10.251 -11.823
  122   HH22  ARG  14          HH12      ARG  14   1.776 -11.919 -11.964
  123    H    ASN  15           HN       ASN  15  -0.958  -5.096  -7.474
  124    HA   ASN  15           HA       ASN  15  -0.148  -2.988  -9.455
  125    HB2  ASN  15           HB2      ASN  15  -2.768  -2.744  -9.546
  126    HB3  ASN  15           HB1      ASN  15  -1.996  -4.064 -10.430
  127   HD21  ASN  15          HD21      ASN  15  -4.261  -5.042 -10.137
  128   HD22  ASN  15          HD22      ASN  15  -4.553  -5.922  -8.714
  129    H    GLU  16           HN       GLU  16  -0.006  -0.955  -8.699
  130    HA   GLU  16           HA       GLU  16  -0.490  -0.357  -5.956
  131    HB2  GLU  16           HB2      GLU  16   1.075   0.988  -7.289
  132    HB3  GLU  16           HB1      GLU  16  -0.237   1.502  -8.349
  133    HG2  GLU  16           HG2      GLU  16  -1.298   2.741  -6.572
  134    HG3  GLU  16           HG1      GLU  16  -0.201   2.063  -5.371
  135    H    LYS  17           HN       LYS  17  -2.536  -0.508  -8.712
  136    HA   LYS  17           HA       LYS  17  -4.611   1.240  -8.054
  137    HB2  LYS  17           HB2      LYS  17  -4.346  -0.278 -10.131
  138    HB3  LYS  17           HB1      LYS  17  -5.064  -1.545  -9.155
  139    HG2  LYS  17           HG2      LYS  17  -7.096  -0.748  -9.888
  140    HG3  LYS  17           HG1      LYS  17  -6.863   0.562  -8.744
  141    HD2  LYS  17           HD2      LYS  17  -5.937   0.635 -11.642
  142    HD3  LYS  17           HD1      LYS  17  -7.452   1.320 -11.064
  143    HE2  LYS  17           HE2      LYS  17  -5.967   3.167 -11.091
  144    HE3  LYS  17           HE1      LYS  17  -5.976   2.675  -9.400
  145    HZ1  LYS  17           HZ1      LYS  17  -3.846   2.045  -9.505
  146    HZ2  LYS  17           HZ2      LYS  17  -3.773   2.981 -10.919
  147    HZ3  LYS  17           HZ3      LYS  17  -4.024   1.305 -11.021
  148    H    GLU  18           HN       GLU  18  -4.092  -2.115  -6.999
  149    HA   GLU  18           HA       GLU  18  -6.410  -2.231  -5.334
  150    HB2  GLU  18           HB2      GLU  18  -3.856  -3.843  -5.328
  151    HB3  GLU  18           HB1      GLU  18  -5.268  -4.225  -4.338
  152    HG2  GLU  18           HG2      GLU  18  -6.645  -4.512  -6.316
  153    HG3  GLU  18           HG1      GLU  18  -5.327  -3.976  -7.356
  154    H    LEU  19           HN       LEU  19  -3.095  -1.169  -4.778
  155    HA   LEU  19           HA       LEU  19  -3.375  -1.002  -1.909
  156    HB2  LEU  19           HB2      LEU  19  -1.148  -1.033  -2.752
  157    HB3  LEU  19           HB1      LEU  19  -1.481   0.243  -3.899
  158    HG   LEU  19           HG       LEU  19  -1.658   1.856  -2.018
  159   HD11  LEU  19          HD11      LEU  19  -0.758  -0.459  -0.313
  160   HD12  LEU  19          HD12      LEU  19  -2.350   0.276  -0.229
  161   HD13  LEU  19          HD13      LEU  19  -0.927   1.201   0.225
  162   HD21  LEU  19          HD21      LEU  19   0.487   1.544  -3.147
  163   HD22  LEU  19          HD22      LEU  19   0.875   0.215  -2.057
  164   HD23  LEU  19          HD23      LEU  19   0.738   1.858  -1.431
  165    H    ARG  20           HN       ARG  20  -4.081   1.130  -4.622
  166    HA   ARG  20           HA       ARG  20  -4.558   3.530  -3.149
  167    HB2  ARG  20           HB2      ARG  20  -4.398   3.377  -5.652
  168    HB3  ARG  20           HB1      ARG  20  -5.980   2.599  -5.658
  169    HG2  ARG  20           HG2      ARG  20  -6.973   4.591  -4.590
  170    HG3  ARG  20           HG1      ARG  20  -5.389   5.370  -4.567
  171    HD2  ARG  20           HD2      ARG  20  -5.295   5.203  -7.041
  172    HD3  ARG  20           HD1      ARG  20  -6.907   4.487  -7.039
  173    HE   ARG  20           HE       ARG  20  -7.232   6.871  -5.651
  174   HH11  ARG  20          HH21      ARG  20  -5.952   5.921  -8.715
  175   HH12  ARG  20          HH22      ARG  20  -6.382   7.403  -9.500
  176   HH21  ARG  20          HH11      ARG  20  -7.798   8.806  -6.665
  177   HH22  ARG  20          HH12      ARG  20  -7.426   9.035  -8.341
  178    H    ASP  21           HN       ASP  21  -6.498   0.738  -3.872
  179    HA   ASP  21           HA       ASP  21  -8.940   1.753  -2.757
  180    HB2  ASP  21           HB2      ASP  21  -8.065  -1.061  -3.447
  181    HB3  ASP  21           HB1      ASP  21  -9.690  -0.638  -2.911
  182    H    PHE  22           HN       PHE  22  -6.557  -0.665  -1.637
  183    HA   PHE  22           HA       PHE  22  -7.741  -1.009   0.908
  184    HB2  PHE  22           HB2      PHE  22  -5.029  -1.527  -0.256
  185    HB3  PHE  22           HB1      PHE  22  -5.174  -1.587   1.494
  186    HD1  PHE  22           HD2      PHE  22  -7.607  -2.620  -1.174
  187    HD2  PHE  22           HD1      PHE  22  -5.077  -3.892   2.062
  188    HE1  PHE  22           HE2      PHE  22  -8.524  -4.904  -1.348
  189    HE2  PHE  22           HE1      PHE  22  -5.999  -6.172   1.879
  190    HZ   PHE  22           HZ       PHE  22  -7.725  -6.688   0.176
  191    H    ILE  23           HN       ILE  23  -5.760   1.487  -0.414
  192    HA   ILE  23           HA       ILE  23  -4.850   2.645   2.052
  193    HB   ILE  23           HB       ILE  23  -5.070   3.469  -0.808
  194   HG12  ILE  23          HG12      ILE  23  -2.910   3.836   1.307
  195   HG13  ILE  23          HG11      ILE  23  -2.999   2.505   0.166
  196   HG21  ILE  23          HG21      ILE  23  -4.977   5.510   1.415
  197   HG22  ILE  23          HG22      ILE  23  -6.112   5.428   0.065
  198   HG23  ILE  23          HG23      ILE  23  -4.441   5.866  -0.225
  199   HD11  ILE  23          HD11      ILE  23  -2.944   4.360  -1.656
  200   HD12  ILE  23          HD12      ILE  23  -1.447   3.963  -0.824
  201   HD13  ILE  23          HD13      ILE  23  -2.365   5.395  -0.360
  202    H    GLU  24           HN       GLU  24  -7.709   2.975   0.087
  203    HA   GLU  24           HA       GLU  24  -8.928   5.063   1.596
  204    HB2  GLU  24           HB2      GLU  24 -10.213   2.856  -0.033
  205    HB3  GLU  24           HB1      GLU  24 -11.123   4.166   0.699
  206    HG2  GLU  24           HG2      GLU  24  -8.809   4.623  -1.210
  207    HG3  GLU  24           HG1      GLU  24 -10.491   4.543  -1.726
  208    H    LYS  25           HN       LYS  25  -8.527   1.666   2.141
  209    HA   LYS  25           HA       LYS  25 -10.536   1.415   4.227
  210    HB2  LYS  25           HB2      LYS  25  -9.263  -0.410   2.753
  211    HB3  LYS  25           HB1      LYS  25  -8.103  -0.385   4.074
  212    HG2  LYS  25           HG2      LYS  25 -11.069  -1.019   4.257
  213    HG3  LYS  25           HG1      LYS  25  -9.728  -2.138   4.491
  214    HD2  LYS  25           HD2      LYS  25  -8.980  -0.597   6.417
  215    HD3  LYS  25           HD1      LYS  25 -10.564   0.165   6.273
  216    HE2  LYS  25           HE2      LYS  25 -10.658  -1.569   7.986
  217    HE3  LYS  25           HE1      LYS  25 -11.635  -2.059   6.602
  218    HZ1  LYS  25           HZ1      LYS  25  -8.913  -2.874   6.339
  219    HZ2  LYS  25           HZ2      LYS  25 -10.332  -3.803   6.240
  220    HZ3  LYS  25           HZ3      LYS  25  -9.615  -3.499   7.751
  221    H    PHE  26           HN       PHE  26  -6.957   1.815   4.246
  222    HA   PHE  26           HA       PHE  26  -6.742   1.968   7.110
  223    HB2  PHE  26           HB2      PHE  26  -4.885   3.476   5.248
  224    HB3  PHE  26           HB1      PHE  26  -4.502   2.694   6.777
  225    HD1  PHE  26           HD1      PHE  26  -5.924  -0.004   6.233
  226    HD2  PHE  26           HD2      PHE  26  -3.285   2.406   3.826
  227    HE1  PHE  26           HE1      PHE  26  -5.193  -2.017   5.009
  228    HE2  PHE  26           HE2      PHE  26  -2.564   0.374   2.596
  229    HZ   PHE  26           HZ       PHE  26  -3.514  -1.835   3.197
  230   H11A  DNS  27          H22       DNS  27   2.192   5.210   5.525
  231    H12  DNS  27           H23      DNS  27   2.318   3.469   5.249
  232    H13  DNS  27           H24      DNS  27   1.382   4.083   6.630
  233    H21  DNS  27           H21      DNS  27  -0.656   2.935   5.923
  234    H22  DNS  27           H19      DNS  27   0.308   2.197   4.631
  235    H23  DNS  27           H20      DNS  27  -1.180   3.060   4.230
  236    H4   DNS  27           H14      DNS  27  -0.745   4.837   7.126
  237    H5   DNS  27           H15      DNS  27  -2.139   6.873   7.564
  238    H6   DNS  27           H16      DNS  27  -2.504   8.564   5.751
  239    HZ   DNS  27           HZ1      DNS  27  -4.413   9.269   4.527
  240    HE3  DNS  27           HE1      DNS  27  -4.374   9.205   1.900
  241    HE2  DNS  27           HE2      DNS  27  -3.990   7.530   2.268
  242    HD3  DNS  27           HD1      DNS  27  -6.436   9.094   3.108
  243    HD2  DNS  27           HD2      DNS  27  -6.368   7.659   2.084
  244    HG3  DNS  27           HG1      DNS  27  -5.561   6.330   3.996
  245    HG2  DNS  27           HG2      DNS  27  -5.617   7.763   5.024
  246    HB3  DNS  27           HB1      DNS  27  -8.059   7.961   4.552
  247    HB2  DNS  27           HB2      DNS  27  -7.978   6.460   3.630
  248    HA   DNS  27           HA       DNS  27  -7.132   6.670   6.538
  249    H    DNS  27           HN       DNS  27  -7.028   4.505   4.621
  250    H9   DNS  27           H9       DNS  27  -1.091   8.958   1.169
  251    H10  DNS  27           H10      DNS  27   0.298   6.927   0.737
  252    H11  DNS  27           H11      DNS  27   0.666   5.242   2.550
  253    H    GLY  28           HN       GLY  28  -9.789   6.891   4.420
  254    HA2  GLY  28           HA2      GLY  28 -11.943   5.580   5.428
  255    HA3  GLY  28           HA1      GLY  28 -11.673   6.786   6.691
  256    H    ARG  29           HN       ARG  29 -10.967   9.016   5.357
  257    HA   ARG  29           HA       ARG  29 -13.484   9.791   4.031
  258    HB2  ARG  29           HB2      ARG  29 -10.971  11.353   4.703
  259    HB3  ARG  29           HB1      ARG  29 -12.431  12.059   4.006
  260    HG2  ARG  29           HG2      ARG  29 -13.728  11.211   5.955
  261    HG3  ARG  29           HG1      ARG  29 -12.232  10.625   6.672
  262    HD2  ARG  29           HD2      ARG  29 -11.417  13.120   6.330
  263    HD3  ARG  29           HD1      ARG  29 -13.141  13.480   6.275
  264    HE   ARG  29           HE       ARG  29 -11.598  12.980   8.624
  265   HH11  ARG  29          HH21      ARG  29 -14.616  12.079   7.203
  266   HH12  ARG  29          HH22      ARG  29 -15.269  11.472   8.685
  267   HH21  ARG  29          HH11      ARG  29 -12.452  12.216  10.551
  268   HH22  ARG  29          HH12      ARG  29 -14.053  11.557  10.576
  Start of MODEL   18
    1    H1   GLY   1           HT1      GLY   1  12.008  -1.006 -10.413
    2    H2   GLY   1           HT2      GLY   1  13.658  -1.171 -10.044
    3    H3   GLY   1           HT3      GLY   1  12.588  -0.533  -8.889
    4    HA2  GLY   1           HA2      GLY   1  11.692  -3.146  -9.865
    5    HA3  GLY   1           HA1      GLY   1  13.266  -3.125  -9.014
    6    H    GLN   2           HN       GLN   2  13.032  -1.042  -7.251
    7    HA   GLN   2           HA       GLN   2  13.063  -2.942  -5.096
    8    HB2  GLN   2           HB2      GLN   2  13.336  -1.047  -3.628
    9    HB3  GLN   2           HB1      GLN   2  14.267  -0.732  -5.085
   10    HG2  GLN   2           HG2      GLN   2  11.543   0.428  -4.396
   11    HG3  GLN   2           HG1      GLN   2  13.072   1.290  -4.460
   12   HE21  GLN   2          HE21      GLN   2  10.464  -0.009  -6.416
   13   HE22  GLN   2          HE22      GLN   2  11.031   0.586  -7.902
   14    H    GLN   3           HN       GLN   3  11.438  -3.638  -3.769
   15    HA   GLN   3           HA       GLN   3   8.679  -3.022  -4.529
   16    HB2  GLN   3           HB2      GLN   3   8.078  -4.625  -2.742
   17    HB3  GLN   3           HB1      GLN   3   9.261  -5.299  -3.865
   18    HG2  GLN   3           HG2      GLN   3  11.076  -4.625  -2.258
   19    HG3  GLN   3           HG1      GLN   3   9.822  -4.148  -1.114
   20   HE21  GLN   3          HE21      GLN   3   7.950  -6.268  -1.576
   21   HE22  GLN   3          HE22      GLN   3   8.654  -7.724  -1.059
   22    H    TYR   4           HN       TYR   4   7.141  -2.003  -3.214
   23    HA   TYR   4           HA       TYR   4   8.048   0.224  -1.720
   24    HB2  TYR   4           HB2      TYR   4   5.253  -0.461  -1.107
   25    HB3  TYR   4           HB1      TYR   4   5.871   0.909  -2.002
   26    HD1  TYR   4           HD2      TYR   4   7.031   0.082  -4.382
   27    HD2  TYR   4           HD1      TYR   4   3.697  -1.742  -2.364
   28    HE1  TYR   4           HE2      TYR   4   6.267  -0.908  -6.520
   29    HE2  TYR   4           HE1      TYR   4   2.944  -2.720  -4.500
   30    HH   TYR   4           HH       TYR   4   4.274  -1.775  -7.535
   31    H    THR   5           HN       THR   5   8.721   0.306   0.399
   32    HA   THR   5           HA       THR   5   7.975  -1.970   2.248
   33    HB   THR   5           HB       THR   5  10.137  -1.836   3.197
   34    HG1  THR   5           HG1      THR   5  11.009   0.034   3.432
   35   HG21  THR   5          HG21      THR   5  10.671  -1.117   0.311
   36   HG22  THR   5          HG22      THR   5  10.051  -2.699   0.790
   37   HG23  THR   5          HG23      THR   5  11.635  -2.162   1.354
   38    H    ALA   6           HN       ALA   6   8.297   1.498   1.904
   39    HA   ALA   6           HA       ALA   6   7.706   2.046   4.753
   40    HB1  ALA   6           HB1      ALA   6   7.779   3.964   2.381
   41    HB2  ALA   6           HB2      ALA   6   9.200   3.532   3.345
   42    HB3  ALA   6           HB3      ALA   6   7.854   4.387   4.097
   43    H1   NAL   7           H1       NAL   7   3.368   4.751  -0.295
   44    H3   NAL   7           H3       NAL   7   6.740   2.102  -0.352
   45    H4   NAL   7           H4       NAL   7   8.118   3.827  -1.488
   46    H5   NAL   7           H5       NAL   7   8.325   6.186  -2.515
   47    H6   NAL   7           H6       NAL   7   7.290   8.367  -3.070
   48    H7   NAL   7           H7       NAL   7   4.919   8.819  -2.490
   49    H8   NAL   7           H8       NAL   7   3.556   7.091  -1.351
   50    H91  NAL   7           H91      NAL   7   3.130   2.454   0.069
   51    H92  NAL   7           H92      NAL   7   4.534   1.404   0.282
   52    H10  NAL   7           H10      NAL   7   3.893   3.803   2.038
   53    HN1  NAL   7           HN1      NAL   7   6.320   2.659   1.623
   54    H    ILE   8           HN       ILE   8   4.489   0.320   2.379
   55    HA   ILE   8           HA       ILE   8   2.218   0.141   4.245
   56    HB   ILE   8           HB       ILE   8   1.526  -1.961   2.732
   57   HG12  ILE   8          HG12      ILE   8   1.734  -1.484   0.326
   58   HG13  ILE   8          HG11      ILE   8   2.622  -0.002   0.661
   59   HG21  ILE   8          HG21      ILE   8   0.788   0.870   1.903
   60   HG22  ILE   8          HG22      ILE   8   0.071   0.009   3.272
   61   HG23  ILE   8          HG23      ILE   8  -0.166  -0.589   1.632
   62   HD11  ILE   8          HD11      ILE   8   3.949  -2.131  -0.017
   63   HD12  ILE   8          HD12      ILE   8   3.665  -2.668   1.630
   64   HD13  ILE   8          HD13      ILE   8   4.553  -1.166   1.325
   65    H    LYS   9           HN       LYS   9   2.641  -1.276   5.784
   66    HA   LYS   9           HA       LYS   9   5.246  -2.508   5.913
   67    HB2  LYS   9           HB2      LYS   9   4.152  -1.430   7.889
   68    HB3  LYS   9           HB1      LYS   9   2.987  -2.757   7.910
   69    HG2  LYS   9           HG2      LYS   9   4.756  -4.377   8.289
   70    HG3  LYS   9           HG1      LYS   9   5.991  -3.131   8.100
   71    HD2  LYS   9           HD2      LYS   9   5.102  -1.948  10.077
   72    HD3  LYS   9           HD1      LYS   9   3.876  -3.201  10.273
   73    HE2  LYS   9           HE2      LYS   9   6.874  -3.650  10.369
   74    HE3  LYS   9           HE1      LYS   9   5.801  -3.604  11.767
   75    HZ1  LYS   9           HZ1      LYS   9   4.543  -5.453  10.705
   76    HZ2  LYS   9           HZ2      LYS   9   6.122  -5.864  11.177
   77    HZ3  LYS   9           HZ3      LYS   9   5.772  -5.564   9.542
   78    H    GLY  10           HN       GLY  10   5.517  -4.340   4.716
   79    HA2  GLY  10           HA2      GLY  10   5.364  -6.620   4.213
   80    HA3  GLY  10           HA1      GLY  10   4.260  -6.780   5.573
   81    H    ARG  11           HN       ARG  11   2.498  -4.626   4.165
   82    HA   ARG  11           HA       ARG  11   1.006  -6.604   2.495
   83    HB2  ARG  11           HB2      ARG  11   0.338  -3.927   3.750
   84    HB3  ARG  11           HB1      ARG  11  -0.677  -4.569   2.463
   85    HG2  ARG  11           HG2      ARG  11  -1.641  -5.240   4.573
   86    HG3  ARG  11           HG1      ARG  11  -0.958  -6.675   3.817
   87    HD2  ARG  11           HD2      ARG  11   0.984  -6.590   5.247
   88    HD3  ARG  11           HD1      ARG  11   0.514  -5.010   5.877
   89    HE   ARG  11           HE       ARG  11  -1.646  -6.639   6.488
   90   HH11  ARG  11          HH21      ARG  11   1.766  -6.714   7.018
   91   HH12  ARG  11          HH22      ARG  11   1.646  -7.581   8.512
   92   HH21  ARG  11          HH11      ARG  11  -1.815  -7.769   8.433
   93   HH22  ARG  11          HH12      ARG  11  -0.380  -8.178   9.313
   94    H    THR  12           HN       THR  12   2.093  -6.647   0.500
   95    HA   THR  12           HA       THR  12   2.487  -4.077  -0.921
   96    HB   THR  12           HB       THR  12   3.821  -5.983  -2.441
   97    HG1  THR  12           HG1      THR  12   3.278  -7.122  -0.152
   98   HG21  THR  12          HG21      THR  12   5.879  -5.101  -1.406
   99   HG22  THR  12          HG22      THR  12   4.926  -4.417  -0.087
  100   HG23  THR  12          HG23      THR  12   4.727  -3.803  -1.727
  101    H    PHE  13           HN       PHE  13   1.994  -4.088  -3.233
  102    HA   PHE  13           HA       PHE  13  -0.227  -5.964  -3.997
  103    HB2  PHE  13           HB2      PHE  13  -0.154  -2.962  -4.428
  104    HB3  PHE  13           HB1      PHE  13  -1.472  -4.055  -4.859
  105    HD1  PHE  13           HD1      PHE  13   0.516  -2.742  -1.964
  106    HD2  PHE  13           HD2      PHE  13  -3.115  -4.673  -3.230
  107    HE1  PHE  13           HE1      PHE  13  -0.389  -2.597   0.341
  108    HE2  PHE  13           HE2      PHE  13  -4.012  -4.484  -0.935
  109    HZ   PHE  13           HZ       PHE  13  -2.641  -3.435   0.842
  110    H    ARG  14           HN       ARG  14  -0.031  -6.747  -6.044
  111    HA   ARG  14           HA       ARG  14   2.345  -6.256  -7.581
  112    HB2  ARG  14           HB2      ARG  14   0.857  -8.322  -7.800
  113    HB3  ARG  14           HB1      ARG  14  -0.294  -7.313  -8.672
  114    HG2  ARG  14           HG2      ARG  14   0.938  -8.257 -10.441
  115    HG3  ARG  14           HG1      ARG  14   1.779  -6.730 -10.214
  116    HD2  ARG  14           HD2      ARG  14   3.363  -8.611 -10.430
  117    HD3  ARG  14           HD1      ARG  14   3.489  -7.874  -8.837
  118    HE   ARG  14           HE       ARG  14   1.647  -9.928  -8.490
  119   HH11  ARG  14          HH21      ARG  14   4.863  -9.617  -9.713
  120   HH12  ARG  14          HH22      ARG  14   5.336 -11.216  -9.243
  121   HH21  ARG  14          HH11      ARG  14   2.252 -12.014  -7.875
  122   HH22  ARG  14          HH12      ARG  14   3.858 -12.571  -8.204
  123    H    ASN  15           HN       ASN  15  -0.962  -5.051  -7.791
  124    HA   ASN  15           HA       ASN  15  -0.095  -2.935  -9.745
  125    HB2  ASN  15           HB2      ASN  15  -2.756  -2.632  -9.758
  126    HB3  ASN  15           HB1      ASN  15  -1.976  -3.835 -10.787
  127   HD21  ASN  15          HD21      ASN  15  -4.091  -5.005 -10.661
  128   HD22  ASN  15          HD22      ASN  15  -4.415  -5.984  -9.313
  129    H    GLU  16           HN       GLU  16   0.099  -0.916  -8.958
  130    HA   GLU  16           HA       GLU  16  -0.353  -0.359  -6.196
  131    HB2  GLU  16           HB2      GLU  16   0.041   1.466  -8.589
  132    HB3  GLU  16           HB1      GLU  16  -0.113   2.084  -6.944
  133    HG2  GLU  16           HG2      GLU  16   1.834   0.742  -6.247
  134    HG3  GLU  16           HG1      GLU  16   1.990   0.108  -7.886
  135    H    LYS  17           HN       LYS  17  -2.408  -0.406  -8.940
  136    HA   LYS  17           HA       LYS  17  -4.424   1.392  -8.229
  137    HB2  LYS  17           HB2      LYS  17  -4.109  -0.250 -10.317
  138    HB3  LYS  17           HB1      LYS  17  -5.163  -1.301  -9.386
  139    HG2  LYS  17           HG2      LYS  17  -6.733  -0.091 -10.659
  140    HG3  LYS  17           HG1      LYS  17  -6.693   0.842  -9.167
  141    HD2  LYS  17           HD2      LYS  17  -6.450   2.566 -10.739
  142    HD3  LYS  17           HD1      LYS  17  -4.757   2.197 -10.434
  143    HE2  LYS  17           HE2      LYS  17  -5.120   2.346 -12.836
  144    HE3  LYS  17           HE1      LYS  17  -4.786   0.666 -12.425
  145    HZ1  LYS  17           HZ1      LYS  17  -6.923   0.044 -12.808
  146    HZ2  LYS  17           HZ2      LYS  17  -6.819   1.328 -13.916
  147    HZ3  LYS  17           HZ3      LYS  17  -7.571   1.560 -12.409
  148    H    GLU  18           HN       GLU  18  -4.011  -2.016  -7.280
  149    HA   GLU  18           HA       GLU  18  -6.329  -2.133  -5.631
  150    HB2  GLU  18           HB2      GLU  18  -3.790  -3.769  -5.614
  151    HB3  GLU  18           HB1      GLU  18  -5.219  -4.159  -4.654
  152    HG2  GLU  18           HG2      GLU  18  -5.269  -3.838  -7.669
  153    HG3  GLU  18           HG1      GLU  18  -5.060  -5.390  -6.859
  154    H    LEU  19           HN       LEU  19  -3.059  -1.032  -5.070
  155    HA   LEU  19           HA       LEU  19  -3.277  -0.957  -2.177
  156    HB2  LEU  19           HB2      LEU  19  -1.083  -1.025  -3.082
  157    HB3  LEU  19           HB1      LEU  19  -1.421   0.265  -4.210
  158    HG   LEU  19           HG       LEU  19  -1.559   1.826  -2.213
  159   HD11  LEU  19          HD11      LEU  19  -1.940   0.054  -0.492
  160   HD12  LEU  19          HD12      LEU  19  -0.591   1.117  -0.112
  161   HD13  LEU  19          HD13      LEU  19  -0.287  -0.486  -0.767
  162   HD21  LEU  19          HD21      LEU  19   1.040   0.359  -2.646
  163   HD22  LEU  19          HD22      LEU  19   0.879   1.965  -1.937
  164   HD23  LEU  19          HD23      LEU  19   0.440   1.697  -3.625
  165    H    ARG  20           HN       ARG  20  -3.853   1.361  -4.812
  166    HA   ARG  20           HA       ARG  20  -4.307   3.670  -3.211
  167    HB2  ARG  20           HB2      ARG  20  -4.133   3.627  -5.724
  168    HB3  ARG  20           HB1      ARG  20  -5.752   2.931  -5.772
  169    HG2  ARG  20           HG2      ARG  20  -6.625   4.922  -4.568
  170    HG3  ARG  20           HG1      ARG  20  -5.006   5.623  -4.583
  171    HD2  ARG  20           HD2      ARG  20  -6.578   4.841  -7.053
  172    HD3  ARG  20           HD1      ARG  20  -6.416   6.488  -6.440
  173    HE   ARG  20           HE       ARG  20  -3.794   5.618  -6.718
  174   HH11  ARG  20          HH21      ARG  20  -6.592   5.806  -8.736
  175   HH12  ARG  20          HH22      ARG  20  -5.684   6.032 -10.194
  176   HH21  ARG  20          HH11      ARG  20  -2.602   5.911  -8.612
  177   HH22  ARG  20          HH12      ARG  20  -3.428   6.091 -10.124
  178    H    ASP  21           HN       ASP  21  -6.370   1.018  -4.133
  179    HA   ASP  21           HA       ASP  21  -8.765   2.063  -2.948
  180    HB2  ASP  21           HB2      ASP  21  -8.861   0.441  -4.798
  181    HB3  ASP  21           HB1      ASP  21  -8.084  -0.768  -3.780
  182    H    PHE  22           HN       PHE  22  -6.524  -0.561  -2.013
  183    HA   PHE  22           HA       PHE  22  -7.760  -1.063   0.474
  184    HB2  PHE  22           HB2      PHE  22  -5.077  -1.636  -0.728
  185    HB3  PHE  22           HB1      PHE  22  -5.216  -1.814   1.017
  186    HD1  PHE  22           HD2      PHE  22  -7.621  -2.519  -1.773
  187    HD2  PHE  22           HD1      PHE  22  -5.362  -4.131   1.509
  188    HE1  PHE  22           HE2      PHE  22  -8.692  -4.723  -2.110
  189    HE2  PHE  22           HE1      PHE  22  -6.436  -6.325   1.169
  190    HZ   PHE  22           HZ       PHE  22  -8.105  -6.631  -0.640
  191    H    ILE  23           HN       ILE  23  -5.652   1.435  -0.597
  192    HA   ILE  23           HA       ILE  23  -4.726   2.324   1.979
  193    HB   ILE  23           HB       ILE  23  -4.862   3.412  -0.807
  194   HG12  ILE  23          HG12      ILE  23  -2.685   3.423   1.325
  195   HG13  ILE  23          HG11      ILE  23  -2.878   2.188   0.086
  196   HG21  ILE  23          HG21      ILE  23  -4.650   5.205   1.614
  197   HG22  ILE  23          HG22      ILE  23  -5.754   5.350   0.243
  198   HG23  ILE  23          HG23      ILE  23  -4.046   5.685   0.029
  199   HD11  ILE  23          HD11      ILE  23  -2.551   3.940  -1.652
  200   HD12  ILE  23          HD12      ILE  23  -1.152   3.760  -0.602
  201   HD13  ILE  23          HD13      ILE  23  -2.257   5.115  -0.376
  202    H    GLU  24           HN       GLU  24  -7.517   2.963  -0.014
  203    HA   GLU  24           HA       GLU  24  -8.656   4.995   1.627
  204    HB2  GLU  24           HB2      GLU  24 -10.013   3.017  -0.223
  205    HB3  GLU  24           HB1      GLU  24 -10.863   4.322   0.590
  206    HG2  GLU  24           HG2      GLU  24  -9.399   5.975  -0.493
  207    HG3  GLU  24           HG1      GLU  24  -8.520   4.681  -1.304
  208    H    LYS  25           HN       LYS  25  -8.500   1.535   1.916
  209    HA   LYS  25           HA       LYS  25 -10.602   1.305   3.924
  210    HB2  LYS  25           HB2      LYS  25  -9.806  -0.592   2.453
  211    HB3  LYS  25           HB1      LYS  25  -8.313  -0.617   3.387
  212    HG2  LYS  25           HG2      LYS  25  -9.633  -1.022   5.455
  213    HG3  LYS  25           HG1      LYS  25 -11.107  -1.062   4.486
  214    HD2  LYS  25           HD2      LYS  25 -10.264  -2.976   3.223
  215    HD3  LYS  25           HD1      LYS  25  -8.738  -2.913   4.103
  216    HE2  LYS  25           HE2      LYS  25 -10.334  -4.636   4.994
  217    HE3  LYS  25           HE1      LYS  25  -9.853  -3.434   6.192
  218    HZ1  LYS  25           HZ1      LYS  25 -12.415  -4.083   5.472
  219    HZ2  LYS  25           HZ2      LYS  25 -12.134  -2.592   4.707
  220    HZ3  LYS  25           HZ3      LYS  25 -11.936  -2.738   6.388
  221    H    PHE  26           HN       PHE  26  -7.004   1.355   4.058
  222    HA   PHE  26           HA       PHE  26  -6.840   1.162   6.909
  223    HB2  PHE  26           HB2      PHE  26  -4.880   2.794   5.265
  224    HB3  PHE  26           HB1      PHE  26  -4.565   1.850   6.715
  225    HD1  PHE  26           HD1      PHE  26  -6.066  -0.727   5.871
  226    HD2  PHE  26           HD2      PHE  26  -3.280   1.811   3.781
  227    HE1  PHE  26           HE1      PHE  26  -5.368  -2.635   4.472
  228    HE2  PHE  26           HE2      PHE  26  -2.596  -0.117   2.370
  229    HZ   PHE  26           HZ       PHE  26  -3.635  -2.338   2.731
  230   H11A  DNS  27          H22       DNS  27   5.273   5.116   5.080
  231    H12  DNS  27           H23      DNS  27   5.234   4.943   3.323
  232    H13  DNS  27           H24      DNS  27   3.771   4.621   4.279
  233    H21  DNS  27           H21      DNS  27   5.131   8.499   3.411
  234    H22  DNS  27           H19      DNS  27   5.750   7.050   2.597
  235    H23  DNS  27           H20      DNS  27   6.240   7.398   4.258
  236    H4   DNS  27           H14      DNS  27   4.104   5.989   1.434
  237    H5   DNS  27           H15      DNS  27   2.036   6.261   0.045
  238    H6   DNS  27           H16      DNS  27  -0.043   7.223   1.059
  239    HZ   DNS  27           HZ1      DNS  27  -3.347   9.440   3.529
  240    HE3  DNS  27           HE1      DNS  27  -2.786   6.784   4.478
  241    HE2  DNS  27           HE2      DNS  27  -3.132   7.969   5.725
  242    HD3  DNS  27           HD1      DNS  27  -5.219   8.587   4.528
  243    HD2  DNS  27           HD2      DNS  27  -4.888   7.321   3.345
  244    HG3  DNS  27           HG1      DNS  27  -5.015   5.605   5.048
  245    HG2  DNS  27           HG2      DNS  27  -5.127   6.811   6.329
  246    HB3  DNS  27           HB1      DNS  27  -7.271   7.605   5.370
  247    HB2  DNS  27           HB2      DNS  27  -7.173   6.346   4.137
  248    HA   DNS  27           HA       DNS  27  -7.185   5.825   7.128
  249    H    DNS  27           HN       DNS  27  -6.900   4.037   4.791
  250    H9   DNS  27           H9       DNS  27  -1.203   8.896   5.427
  251    H10  DNS  27           H10      DNS  27   0.858   8.612   6.799
  252    H11  DNS  27           H11      DNS  27   2.924   7.630   5.787
  253    H    GLY  28           HN       GLY  28  -9.132   6.512   7.897
  254    HA2  GLY  28           HA2      GLY  28 -11.454   6.921   6.254
  255    HA3  GLY  28           HA1      GLY  28 -11.593   5.388   7.115
  256    H    ARG  29           HN       ARG  29 -10.512   8.711   7.898
  257    HA   ARG  29           HA       ARG  29 -12.137   8.588  10.437
  258    HB2  ARG  29           HB2      ARG  29  -9.623  10.201   9.887
  259    HB3  ARG  29           HB1      ARG  29 -10.491  10.115  11.414
  260    HG2  ARG  29           HG2      ARG  29  -9.322   7.642  10.091
  261    HG3  ARG  29           HG1      ARG  29  -8.377   8.643  11.185
  262    HD2  ARG  29           HD2      ARG  29 -10.934   7.150  11.847
  263    HD3  ARG  29           HD1      ARG  29  -9.321   6.820  12.460
  264    HE   ARG  29           HE       ARG  29  -9.782   9.441  13.230
  265   HH11  ARG  29          HH21      ARG  29 -11.423   6.420  13.561
  266   HH12  ARG  29          HH22      ARG  29 -12.148   6.832  15.079
  267   HH21  ARG  29          HH11      ARG  29 -10.722   9.989  15.208
  268   HH22  ARG  29          HH12      ARG  29 -11.751   8.851  16.010
  Start of MODEL   19
    1    H1   GLY   1           HT1      GLY   1  10.994   3.313  -9.083
    2    H2   GLY   1           HT2      GLY   1  11.034   3.047 -10.760
    3    H3   GLY   1           HT3      GLY   1  12.465   3.421  -9.923
    4    HA2  GLY   1           HA2      GLY   1  11.191   0.851 -10.433
    5    HA3  GLY   1           HA1      GLY   1  12.751   1.225  -9.642
    6    H    GLN   2           HN       GLN   2  12.099   2.754  -7.492
    7    HA   GLN   2           HA       GLN   2  12.890   0.599  -5.762
    8    HB2  GLN   2           HB2      GLN   2  13.370   3.027  -5.344
    9    HB3  GLN   2           HB1      GLN   2  11.661   3.259  -4.974
   10    HG2  GLN   2           HG2      GLN   2  11.801   1.681  -3.122
   11    HG3  GLN   2           HG1      GLN   2  13.473   1.300  -3.533
   12   HE21  GLN   2          HE21      GLN   2  15.102   3.045  -3.211
   13   HE22  GLN   2          HE22      GLN   2  14.784   4.310  -2.127
   14    H    GLN   3           HN       GLN   3  11.584  -1.001  -5.032
   15    HA   GLN   3           HA       GLN   3   8.712  -0.902  -5.336
   16    HB2  GLN   3           HB2      GLN   3   8.739  -3.039  -4.047
   17    HB3  GLN   3           HB1      GLN   3   9.842  -3.046  -5.422
   18    HG2  GLN   3           HG2      GLN   3  11.714  -2.445  -3.889
   19    HG3  GLN   3           HG1      GLN   3  10.597  -2.546  -2.528
   20   HE21  GLN   3          HE21      GLN   3  11.153  -4.469  -1.465
   21   HE22  GLN   3          HE22      GLN   3  11.322  -5.976  -2.229
   22    H    TYR   4           HN       TYR   4   7.143  -0.759  -3.705
   23    HA   TYR   4           HA       TYR   4   7.625   1.157  -1.685
   24    HB2  TYR   4           HB2      TYR   4   5.221  -0.493  -1.216
   25    HB3  TYR   4           HB1      TYR   4   5.314   1.211  -1.584
   26    HD1  TYR   4           HD2      TYR   4   6.440   1.507  -4.154
   27    HD2  TYR   4           HD1      TYR   4   3.840  -1.637  -2.780
   28    HE1  TYR   4           HE2      TYR   4   5.728   1.068  -6.484
   29    HE2  TYR   4           HE1      TYR   4   3.136  -2.064  -5.113
   30    HH   TYR   4           HH       TYR   4   4.396  -1.582  -7.536
   31    H    THR   5           HN       THR   5   8.669   0.832   0.262
   32    HA   THR   5           HA       THR   5   8.569  -1.909   1.538
   33    HB   THR   5           HB       THR   5  10.780  -1.572   2.331
   34    HG1  THR   5           HG1      THR   5  11.625   0.349   2.614
   35   HG21  THR   5          HG21      THR   5  12.066  -1.330   0.344
   36   HG22  THR   5          HG22      THR   5  10.900  -0.212  -0.356
   37   HG23  THR   5          HG23      THR   5  10.501  -1.925  -0.216
   38    H    ALA   6           HN       ALA   6   8.252   1.535   2.023
   39    HA   ALA   6           HA       ALA   6   7.876   1.230   4.974
   40    HB1  ALA   6           HB1      ALA   6   7.843   3.742   3.250
   41    HB2  ALA   6           HB2      ALA   6   9.291   3.101   4.039
   42    HB3  ALA   6           HB3      ALA   6   7.933   3.665   5.013
   43    H1   NAL   7           H1       NAL   7   3.341   4.935   0.984
   44    H3   NAL   7           H3       NAL   7   6.516   2.294  -0.169
   45    H4   NAL   7           H4       NAL   7   7.798   4.194  -1.126
   46    H5   NAL   7           H5       NAL   7   7.978   6.719  -1.635
   47    H6   NAL   7           H6       NAL   7   6.996   8.991  -1.531
   48    H7   NAL   7           H7       NAL   7   4.770   9.351  -0.494
   49    H8   NAL   7           H8       NAL   7   3.501   7.439   0.447
   50    H91  NAL   7           H91      NAL   7   3.038   2.575   0.753
   51    H92  NAL   7           H92      NAL   7   4.447   1.513   0.686
   52    H10  NAL   7           H10      NAL   7   3.934   3.565   2.876
   53    HN1  NAL   7           HN1      NAL   7   6.339   2.587   2.144
   54    H    ILE   8           HN       ILE   8   4.494   0.078   2.461
   55    HA   ILE   8           HA       ILE   8   2.366  -0.462   4.454
   56    HB   ILE   8           HB       ILE   8   1.510  -2.218   2.604
   57   HG12  ILE   8          HG12      ILE   8   1.480  -1.178   0.350
   58   HG13  ILE   8          HG11      ILE   8   2.522   0.114   0.914
   59   HG21  ILE   8          HG21      ILE   8   0.762   0.724   2.475
   60   HG22  ILE   8          HG22      ILE   8   0.131  -0.426   3.663
   61   HG23  ILE   8          HG23      ILE   8  -0.234  -0.637   1.950
   62   HD11  ILE   8          HD11      ILE   8   3.564  -1.862  -0.378
   63   HD12  ILE   8          HD12      ILE   8   3.363  -2.778   1.099
   64   HD13  ILE   8          HD13      ILE   8   4.383  -1.326   1.088
   65    H    LYS   9           HN       LYS   9   3.390  -1.724   5.845
   66    HA   LYS   9           HA       LYS   9   5.557  -3.500   4.992
   67    HB2  LYS   9           HB2      LYS   9   5.805  -2.026   7.003
   68    HB3  LYS   9           HB1      LYS   9   4.543  -2.972   7.793
   69    HG2  LYS   9           HG2      LYS   9   5.887  -4.994   7.634
   70    HG3  LYS   9           HG1      LYS   9   7.116  -4.146   6.694
   71    HD2  LYS   9           HD2      LYS   9   7.539  -2.643   8.610
   72    HD3  LYS   9           HD1      LYS   9   6.324  -3.509   9.552
   73    HE2  LYS   9           HE2      LYS   9   8.614  -4.306  10.068
   74    HE3  LYS   9           HE1      LYS   9   7.625  -5.583   9.361
   75    HZ1  LYS   9           HZ1      LYS   9   8.890  -5.660   7.536
   76    HZ2  LYS   9           HZ2      LYS   9  10.059  -4.862   8.477
   77    HZ3  LYS   9           HZ3      LYS   9   9.050  -3.975   7.436
   78    H    GLY  10           HN       GLY  10   5.365  -5.679   4.834
   79    HA2  GLY  10           HA2      GLY  10   4.559  -7.853   5.284
   80    HA3  GLY  10           HA1      GLY  10   3.342  -7.167   6.353
   81    H    ARG  11           HN       ARG  11   2.600  -5.296   3.953
   82    HA   ARG  11           HA       ARG  11   1.161  -7.333   2.271
   83    HB2  ARG  11           HB2      ARG  11  -0.302  -6.368   4.115
   84    HB3  ARG  11           HB1      ARG  11  -0.113  -4.802   3.343
   85    HG2  ARG  11           HG2      ARG  11  -2.174  -5.724   2.525
   86    HG3  ARG  11           HG1      ARG  11  -1.015  -5.833   1.208
   87    HD2  ARG  11           HD2      ARG  11  -0.850  -8.177   1.386
   88    HD3  ARG  11           HD1      ARG  11  -1.358  -8.191   3.076
   89    HE   ARG  11           HE       ARG  11  -3.574  -7.226   1.705
   90   HH11  ARG  11          HH21      ARG  11  -1.518  -9.997   1.536
   91   HH12  ARG  11          HH22      ARG  11  -2.764 -11.045   0.943
   92   HH21  ARG  11          HH11      ARG  11  -5.203  -8.582   0.930
   93   HH22  ARG  11          HH12      ARG  11  -4.847 -10.245   0.600
   94    H    THR  12           HN       THR  12   2.377  -6.942   0.433
   95    HA   THR  12           HA       THR  12   2.514  -4.184  -0.623
   96    HB   THR  12           HB       THR  12   4.023  -5.804  -2.348
   97    HG1  THR  12           HG1      THR  12   4.579  -7.478  -1.257
   98   HG21  THR  12          HG21      THR  12   5.992  -4.801  -1.222
   99   HG22  THR  12          HG22      THR  12   4.954  -4.272   0.102
  100   HG23  THR  12          HG23      THR  12   4.725  -3.608  -1.515
  101    H    PHE  13           HN       PHE  13   2.043  -3.944  -2.955
  102    HA   PHE  13           HA       PHE  13  -0.069  -5.874  -3.902
  103    HB2  PHE  13           HB2      PHE  13  -0.016  -2.860  -4.219
  104    HB3  PHE  13           HB1      PHE  13  -1.310  -3.949  -4.727
  105    HD1  PHE  13           HD1      PHE  13   0.552  -2.644  -1.765
  106    HD2  PHE  13           HD2      PHE  13  -2.935  -4.733  -3.151
  107    HE1  PHE  13           HE1      PHE  13  -0.405  -2.602   0.528
  108    HE2  PHE  13           HE2      PHE  13  -3.897  -4.649  -0.873
  109    HZ   PHE  13           HZ       PHE  13  -2.623  -3.571   0.957
  110    H    ARG  14           HN       ARG  14   0.203  -6.597  -5.948
  111    HA   ARG  14           HA       ARG  14   2.560  -5.841  -7.475
  112    HB2  ARG  14           HB2      ARG  14   1.493  -8.116  -7.658
  113    HB3  ARG  14           HB1      ARG  14   0.098  -7.361  -8.433
  114    HG2  ARG  14           HG2      ARG  14   1.509  -6.566 -10.267
  115    HG3  ARG  14           HG1      ARG  14   2.944  -7.223  -9.479
  116    HD2  ARG  14           HD2      ARG  14   1.973  -9.495  -9.624
  117    HD3  ARG  14           HD1      ARG  14   0.561  -8.830 -10.445
  118    HE   ARG  14           HE       ARG  14   2.702  -7.961 -11.986
  119   HH11  ARG  14          HH21      ARG  14   1.546 -10.987 -10.788
  120   HH12  ARG  14          HH22      ARG  14   2.157 -11.899 -12.127
  121   HH21  ARG  14          HH11      ARG  14   3.504  -9.139 -13.738
  122   HH22  ARG  14          HH12      ARG  14   3.265 -10.854 -13.795
  123    H    ASN  15           HN       ASN  15  -0.859  -5.073  -7.491
  124    HA   ASN  15           HA       ASN  15  -0.478  -3.045  -9.668
  125    HB2  ASN  15           HB2      ASN  15  -3.234  -3.356  -8.650
  126    HB3  ASN  15           HB1      ASN  15  -2.647  -3.492 -10.308
  127   HD21  ASN  15          HD21      ASN  15  -4.431  -5.242  -8.355
  128   HD22  ASN  15          HD22      ASN  15  -3.848  -6.810  -8.641
  129    H    GLU  16           HN       GLU  16  -0.299  -0.947  -9.006
  130    HA   GLU  16           HA       GLU  16  -0.443  -0.278  -6.204
  131    HB2  GLU  16           HB2      GLU  16   0.994   0.989  -7.762
  132    HB3  GLU  16           HB1      GLU  16  -0.423   1.511  -8.671
  133    HG2  GLU  16           HG2      GLU  16  -1.243   2.802  -6.798
  134    HG3  GLU  16           HG1      GLU  16  -0.006   2.134  -5.735
  135    H    LYS  17           HN       LYS  17  -2.791  -0.447  -8.749
  136    HA   LYS  17           HA       LYS  17  -4.693   1.379  -7.726
  137    HB2  LYS  17           HB2      LYS  17  -4.645  -0.791  -9.724
  138    HB3  LYS  17           HB1      LYS  17  -6.198  -0.718  -8.902
  139    HG2  LYS  17           HG2      LYS  17  -6.368   0.698 -10.829
  140    HG3  LYS  17           HG1      LYS  17  -6.260   1.765  -9.430
  141    HD2  LYS  17           HD2      LYS  17  -3.818   2.023  -9.846
  142    HD3  LYS  17           HD1      LYS  17  -3.970   0.999 -11.273
  143    HE2  LYS  17           HE2      LYS  17  -5.314   3.676 -10.816
  144    HE3  LYS  17           HE1      LYS  17  -4.039   3.319 -11.982
  145    HZ1  LYS  17           HZ1      LYS  17  -6.848   2.915 -12.203
  146    HZ2  LYS  17           HZ2      LYS  17  -5.999   1.470 -12.481
  147    HZ3  LYS  17           HZ3      LYS  17  -5.655   2.853 -13.407
  148    H    GLU  18           HN       GLU  18  -4.286  -2.122  -7.154
  149    HA   GLU  18           HA       GLU  18  -6.402  -2.424  -5.353
  150    HB2  GLU  18           HB2      GLU  18  -4.981  -4.230  -6.447
  151    HB3  GLU  18           HB1      GLU  18  -3.755  -3.880  -5.235
  152    HG2  GLU  18           HG2      GLU  18  -5.045  -5.717  -4.394
  153    HG3  GLU  18           HG1      GLU  18  -5.535  -4.299  -3.472
  154    H    LEU  19           HN       LEU  19  -3.173  -1.135  -4.958
  155    HA   LEU  19           HA       LEU  19  -3.299  -1.048  -2.050
  156    HB2  LEU  19           HB2      LEU  19  -1.107  -1.057  -2.973
  157    HB3  LEU  19           HB1      LEU  19  -1.494   0.207  -4.116
  158    HG   LEU  19           HG       LEU  19  -1.642   1.822  -2.209
  159   HD11  LEU  19          HD11      LEU  19  -0.770   1.173  -0.019
  160   HD12  LEU  19          HD12      LEU  19  -0.577  -0.476  -0.584
  161   HD13  LEU  19          HD13      LEU  19  -2.185   0.202  -0.406
  162   HD21  LEU  19          HD21      LEU  19   0.784   1.890  -1.758
  163   HD22  LEU  19          HD22      LEU  19   0.443   1.586  -3.460
  164   HD23  LEU  19          HD23      LEU  19   0.933   0.259  -2.411
  165    H    ARG  20           HN       ARG  20  -4.086   1.099  -4.739
  166    HA   ARG  20           HA       ARG  20  -4.569   3.483  -3.238
  167    HB2  ARG  20           HB2      ARG  20  -4.452   3.317  -5.757
  168    HB3  ARG  20           HB1      ARG  20  -6.048   2.571  -5.724
  169    HG2  ARG  20           HG2      ARG  20  -6.933   4.596  -4.560
  170    HG3  ARG  20           HG1      ARG  20  -5.342   5.344  -4.714
  171    HD2  ARG  20           HD2      ARG  20  -7.010   4.357  -7.044
  172    HD3  ARG  20           HD1      ARG  20  -6.909   6.040  -6.527
  173    HE   ARG  20           HE       ARG  20  -4.259   5.290  -6.900
  174   HH11  ARG  20          HH21      ARG  20  -7.163   5.235  -8.770
  175   HH12  ARG  20          HH22      ARG  20  -6.346   5.433 -10.285
  176   HH21  ARG  20          HH11      ARG  20  -3.184   5.549  -8.867
  177   HH22  ARG  20          HH12      ARG  20  -4.095   5.611 -10.339
  178    H    ASP  21           HN       ASP  21  -6.509   0.687  -3.983
  179    HA   ASP  21           HA       ASP  21  -8.928   1.665  -2.789
  180    HB2  ASP  21           HB2      ASP  21  -8.980  -0.084  -4.520
  181    HB3  ASP  21           HB1      ASP  21  -8.098  -1.172  -3.451
  182    H    PHE  22           HN       PHE  22  -6.503  -0.754  -1.752
  183    HA   PHE  22           HA       PHE  22  -7.627  -1.147   0.812
  184    HB2  PHE  22           HB2      PHE  22  -4.945  -1.627  -0.426
  185    HB3  PHE  22           HB1      PHE  22  -5.034  -1.702   1.324
  186    HD1  PHE  22           HD1      PHE  22  -7.597  -2.722  -1.212
  187    HD2  PHE  22           HD2      PHE  22  -4.826  -4.024   1.813
  188    HE1  PHE  22           HE1      PHE  22  -8.491  -5.016  -1.374
  189    HE2  PHE  22           HE2      PHE  22  -5.731  -6.314   1.645
  190    HZ   PHE  22           HZ       PHE  22  -7.564  -6.820   0.053
  191    H    ILE  23           HN       ILE  23  -5.711   1.393  -0.512
  192    HA   ILE  23           HA       ILE  23  -4.767   2.516   1.966
  193    HB   ILE  23           HB       ILE  23  -5.022   3.380  -0.884
  194   HG12  ILE  23          HG12      ILE  23  -2.819   3.741   1.187
  195   HG13  ILE  23          HG11      ILE  23  -2.946   2.379   0.085
  196   HG21  ILE  23          HG21      ILE  23  -6.033   5.333   0.020
  197   HG22  ILE  23          HG22      ILE  23  -4.352   5.764  -0.244
  198   HG23  ILE  23          HG23      ILE  23  -4.910   5.372   1.382
  199   HD11  ILE  23          HD11      ILE  23  -1.340   4.029  -0.763
  200   HD12  ILE  23          HD12      ILE  23  -2.587   5.274  -0.727
  201   HD13  ILE  23          HD13      ILE  23  -2.730   3.914  -1.831
  202    H    GLU  24           HN       GLU  24  -7.645   2.841   0.028
  203    HA   GLU  24           HA       GLU  24  -8.850   4.937   1.529
  204    HB2  GLU  24           HB2      GLU  24 -10.148   2.725  -0.082
  205    HB3  GLU  24           HB1      GLU  24 -11.050   4.045   0.644
  206    HG2  GLU  24           HG2      GLU  24  -8.736   4.480  -1.271
  207    HG3  GLU  24           HG1      GLU  24 -10.419   4.401  -1.786
  208    H    LYS  25           HN       LYS  25  -8.497   1.525   2.116
  209    HA   LYS  25           HA       LYS  25 -10.501   1.399   4.240
  210    HB2  LYS  25           HB2      LYS  25  -9.825  -0.627   2.991
  211    HB3  LYS  25           HB1      LYS  25  -8.188  -0.463   3.620
  212    HG2  LYS  25           HG2      LYS  25  -8.913  -0.863   5.877
  213    HG3  LYS  25           HG1      LYS  25 -10.611  -0.732   5.422
  214    HD2  LYS  25           HD2      LYS  25 -10.030  -3.085   5.686
  215    HD3  LYS  25           HD1      LYS  25 -10.362  -2.751   3.988
  216    HE2  LYS  25           HE2      LYS  25  -8.052  -2.823   3.411
  217    HE3  LYS  25           HE1      LYS  25  -7.539  -2.662   5.092
  218    HZ1  LYS  25           HZ1      LYS  25  -7.662  -4.841   5.372
  219    HZ2  LYS  25           HZ2      LYS  25  -7.881  -4.996   3.696
  220    HZ3  LYS  25           HZ3      LYS  25  -9.228  -4.921   4.728
  221    H    PHE  26           HN       PHE  26  -6.905   1.593   4.179
  222    HA   PHE  26           HA       PHE  26  -6.590   1.659   7.024
  223    HB2  PHE  26           HB2      PHE  26  -4.793   3.221   5.142
  224    HB3  PHE  26           HB1      PHE  26  -4.363   2.434   6.654
  225    HD1  PHE  26           HD1      PHE  26  -5.781  -0.279   6.107
  226    HD2  PHE  26           HD2      PHE  26  -3.195   2.184   3.694
  227    HE1  PHE  26           HE1      PHE  26  -5.040  -2.271   4.857
  228    HE2  PHE  26           HE2      PHE  26  -2.469   0.170   2.436
  229    HZ   PHE  26           HZ       PHE  26  -3.386  -2.054   3.027
  230   H11A  DNS  27          H22       DNS  27   1.583   2.424   7.875
  231    H12  DNS  27           H23      DNS  27   0.935   2.350   6.233
  232    H13  DNS  27           H24      DNS  27   0.004   3.148   7.519
  233    H21  DNS  27           H21      DNS  27   2.983   3.353   5.401
  234    H22  DNS  27           H19      DNS  27   3.632   3.493   7.046
  235    H23  DNS  27           H20      DNS  27   3.510   4.931   6.026
  236    H4   DNS  27           H14      DNS  27   1.013   3.497   4.276
  237    H5   DNS  27           H15      DNS  27  -0.349   4.905   2.713
  238    H6   DNS  27           H16      DNS  27  -1.190   7.146   3.450
  239    HZ   DNS  27           HZ1      DNS  27  -3.553   8.213   5.487
  240    HE3  DNS  27           HE1      DNS  27  -3.237   8.578   2.748
  241    HE2  DNS  27           HE2      DNS  27  -3.311   6.855   3.075
  242    HD3  DNS  27           HD1      DNS  27  -5.336   8.941   3.895
  243    HD2  DNS  27           HD2      DNS  27  -5.547   7.656   2.706
  244    HG3  DNS  27           HG1      DNS  27  -5.134   5.990   4.558
  245    HG2  DNS  27           HG2      DNS  27  -5.166   7.334   5.700
  246    HB3  DNS  27           HB1      DNS  27  -7.451   7.911   4.948
  247    HB2  DNS  27           HB2      DNS  27  -7.424   6.547   3.829
  248    HA   DNS  27           HA       DNS  27  -7.087   6.321   6.837
  249    H    DNS  27           HN       DNS  27  -6.891   4.330   4.672
  250    H9   DNS  27           H9       DNS  27  -0.875   9.708   7.509
  251    H10  DNS  27           H10      DNS  27   0.486   8.302   9.061
  252    H11  DNS  27           H11      DNS  27   1.342   6.069   8.321
  253    H    GLY  28           HN       GLY  28  -9.014   7.609   7.192
  254    HA2  GLY  28           HA2      GLY  28 -11.477   6.055   7.041
  255    HA3  GLY  28           HA1      GLY  28 -11.316   7.684   7.698
  256    H    ARG  29           HN       ARG  29 -10.480   9.215   5.693
  257    HA   ARG  29           HA       ARG  29 -12.784   9.276   3.866
  258    HB2  ARG  29           HB2      ARG  29 -10.390  11.070   4.344
  259    HB3  ARG  29           HB1      ARG  29 -11.292  11.246   2.845
  260    HG2  ARG  29           HG2      ARG  29 -12.137  12.793   4.555
  261    HG3  ARG  29           HG1      ARG  29 -13.368  11.614   4.113
  262    HD2  ARG  29           HD2      ARG  29 -11.556  11.179   6.499
  263    HD3  ARG  29           HD1      ARG  29 -13.056  12.093   6.630
  264    HE   ARG  29           HE       ARG  29 -13.792   9.720   5.363
  265   HH11  ARG  29          HH21      ARG  29 -12.190  10.640   8.281
  266   HH12  ARG  29          HH22      ARG  29 -12.738   9.258   9.170
  267   HH21  ARG  29          HH11      ARG  29 -14.512   7.917   6.511
  268   HH22  ARG  29          HH12      ARG  29 -14.051   7.718   8.170
  Start of MODEL   20
    1    H1   GLY   1           HT1      GLY   1   6.444   3.434  -9.415
    2    H2   GLY   1           HT2      GLY   1   6.630   3.413 -11.103
    3    H3   GLY   1           HT3      GLY   1   7.252   4.707 -10.195
    4    HA2  GLY   1           HA2      GLY   1   8.382   2.048 -10.803
    5    HA3  GLY   1           HA1      GLY   1   9.161   3.532 -10.177
    6    H    GLN   2           HN       GLN   2   8.023   4.346  -7.979
    7    HA   GLN   2           HA       GLN   2  10.267   3.420  -6.429
    8    HB2  GLN   2           HB2      GLN   2   9.090   5.611  -6.079
    9    HB3  GLN   2           HB1      GLN   2   7.715   4.721  -5.423
   10    HG2  GLN   2           HG2      GLN   2   9.092   3.818  -3.631
   11    HG3  GLN   2           HG1      GLN   2  10.538   4.553  -4.325
   12   HE21  GLN   2          HE21      GLN   2   9.385   5.107  -1.639
   13   HE22  GLN   2          HE22      GLN   2   9.013   6.763  -1.619
   14    H    GLN   3           HN       GLN   3  10.423   1.380  -5.629
   15    HA   GLN   3           HA       GLN   3   8.141  -0.373  -5.360
   16    HB2  GLN   3           HB2      GLN   3  10.910  -0.668  -4.155
   17    HB3  GLN   3           HB1      GLN   3   9.723  -1.955  -4.381
   18    HG2  GLN   3           HG2      GLN   3   9.796  -1.580  -6.829
   19    HG3  GLN   3           HG1      GLN   3  11.015  -0.327  -6.592
   20   HE21  GLN   3          HE21      GLN   3  11.386  -2.874  -8.068
   21   HE22  GLN   3          HE22      GLN   3  12.626  -3.711  -7.266
   22    H    TYR   4           HN       TYR   4   6.980  -0.898  -3.517
   23    HA   TYR   4           HA       TYR   4   6.865   1.012  -1.423
   24    HB2  TYR   4           HB2      TYR   4   5.641  -1.593  -0.740
   25    HB3  TYR   4           HB1      TYR   4   4.871  -0.020  -0.882
   26    HD1  TYR   4           HD1      TYR   4   6.148  -2.940  -2.817
   27    HD2  TYR   4           HD2      TYR   4   3.643   0.562  -2.879
   28    HE1  TYR   4           HE1      TYR   4   5.237  -3.622  -5.018
   29    HE2  TYR   4           HE2      TYR   4   2.738  -0.132  -5.073
   30    HH   TYR   4           HH       TYR   4   3.588  -3.238  -6.526
   31    H    THR   5           HN       THR   5   8.261   1.181   0.292
   32    HA   THR   5           HA       THR   5   9.630  -1.314   1.308
   33    HB   THR   5           HB       THR   5  11.506   0.138   1.939
   34    HG1  THR   5           HG1      THR   5  11.230   2.202   1.987
   35   HG21  THR   5          HG21      THR   5  10.712   0.619  -0.938
   36   HG22  THR   5          HG22      THR   5  11.394  -0.895  -0.346
   37   HG23  THR   5          HG23      THR   5  12.349   0.587  -0.288
   38    H    ALA   6           HN       ALA   6   7.862   1.597   2.110
   39    HA   ALA   6           HA       ALA   6   7.919   0.873   5.041
   40    HB1  ALA   6           HB1      ALA   6   9.016   3.066   4.449
   41    HB2  ALA   6           HB2      ALA   6   7.614   3.243   5.506
   42    HB3  ALA   6           HB3      ALA   6   7.471   3.610   3.783
   43    H1   NAL   7           H1       NAL   7   2.920   4.657   1.630
   44    H3   NAL   7           H3       NAL   7   6.107   2.209   0.129
   45    H4   NAL   7           H4       NAL   7   7.169   4.178  -0.937
   46    H5   NAL   7           H5       NAL   7   7.157   6.713  -1.426
   47    H6   NAL   7           H6       NAL   7   6.069   8.925  -1.185
   48    H7   NAL   7           H7       NAL   7   3.948   9.151   0.085
   49    H8   NAL   7           H8       NAL   7   2.892   7.161   1.124
   50    H91  NAL   7           H91      NAL   7   2.724   2.252   1.321
   51    H92  NAL   7           H92      NAL   7   4.194   1.285   1.168
   52    H10  NAL   7           H10      NAL   7   3.646   3.270   3.410
   53    HN1  NAL   7           HN1      NAL   7   6.079   2.782   2.753
   54    H    ILE   8           HN       ILE   8   4.326  -0.177   2.845
   55    HA   ILE   8           HA       ILE   8   2.327  -0.876   4.920
   56    HB   ILE   8           HB       ILE   8   1.451  -2.574   3.008
   57   HG12  ILE   8          HG12      ILE   8   1.277  -1.430   0.827
   58   HG13  ILE   8          HG11      ILE   8   2.237  -0.089   1.425
   59   HG21  ILE   8          HG21      ILE   8   0.050  -0.925   4.248
   60   HG22  ILE   8          HG22      ILE   8  -0.387  -1.031   2.541
   61   HG23  ILE   8          HG23      ILE   8   0.576   0.334   3.119
   62   HD11  ILE   8          HD11      ILE   8   3.300  -2.908   1.390
   63   HD12  ILE   8          HD12      ILE   8   4.209  -1.402   1.493
   64   HD13  ILE   8          HD13      ILE   8   3.414  -1.857  -0.010
   65    H    LYS   9           HN       LYS   9   3.381  -2.231   6.187
   66    HA   LYS   9           HA       LYS   9   5.548  -3.927   5.154
   67    HB2  LYS   9           HB2      LYS   9   5.910  -2.520   7.194
   68    HB3  LYS   9           HB1      LYS   9   4.691  -3.491   8.022
   69    HG2  LYS   9           HG2      LYS   9   6.020  -5.505   7.728
   70    HG3  LYS   9           HG1      LYS   9   7.195  -4.632   6.745
   71    HD2  LYS   9           HD2      LYS   9   7.708  -3.173   8.686
   72    HD3  LYS   9           HD1      LYS   9   6.577  -4.105   9.667
   73    HE2  LYS   9           HE2      LYS   9   8.889  -4.888  10.019
   74    HE3  LYS   9           HE1      LYS   9   7.907  -6.146   9.267
   75    HZ1  LYS   9           HZ1      LYS   9  10.275  -5.075   8.320
   76    HZ2  LYS   9           HZ2      LYS   9   9.061  -4.486   7.289
   77    HZ3  LYS   9           HZ3      LYS   9   9.245  -6.160   7.519
   78    H    GLY  10           HN       GLY  10   5.446  -6.147   5.127
   79    HA2  GLY  10           HA2      GLY  10   4.620  -8.319   5.540
   80    HA3  GLY  10           HA1      GLY  10   3.395  -7.629   6.601
   81    H    ARG  11           HN       ARG  11   2.690  -5.738   4.237
   82    HA   ARG  11           HA       ARG  11   1.262  -7.719   2.475
   83    HB2  ARG  11           HB2      ARG  11   0.020  -5.224   3.683
   84    HB3  ARG  11           HB1      ARG  11  -0.780  -6.386   2.624
   85    HG2  ARG  11           HG2      ARG  11  -0.474  -8.153   4.307
   86    HG3  ARG  11           HG1      ARG  11   0.364  -7.015   5.364
   87    HD2  ARG  11           HD2      ARG  11  -1.955  -7.191   6.081
   88    HD3  ARG  11           HD1      ARG  11  -1.690  -5.591   5.387
   89    HE   ARG  11           HE       ARG  11  -2.578  -7.112   3.241
   90   HH11  ARG  11          HH21      ARG  11  -3.692  -6.400   6.432
   91   HH12  ARG  11          HH22      ARG  11  -5.368  -6.534   6.016
   92   HH21  ARG  11          HH11      ARG  11  -4.760  -7.288   2.688
   93   HH22  ARG  11          HH12      ARG  11  -5.972  -7.035   3.899
   94    H    THR  12           HN       THR  12   2.558  -7.260   0.664
   95    HA   THR  12           HA       THR  12   2.771  -4.456  -0.216
   96    HB   THR  12           HB       THR  12   4.287  -5.987  -2.005
   97    HG1  THR  12           HG1      THR  12   5.538  -7.176  -0.301
   98   HG21  THR  12          HG21      THR  12   5.228  -4.703   0.587
   99   HG22  THR  12          HG22      THR  12   4.967  -3.850  -0.933
  100   HG23  THR  12          HG23      THR  12   6.235  -5.071  -0.816
  101    H    PHE  13           HN       PHE  13   2.402  -3.983  -2.471
  102    HA   PHE  13           HA       PHE  13   0.102  -5.572  -3.582
  103    HB2  PHE  13           HB2      PHE  13   0.790  -2.622  -3.687
  104    HB3  PHE  13           HB1      PHE  13  -0.532  -3.353  -4.597
  105    HD1  PHE  13           HD1      PHE  13   0.821  -2.997  -1.105
  106    HD2  PHE  13           HD2      PHE  13  -2.643  -3.615  -3.559
  107    HE1  PHE  13           HE1      PHE  13  -0.631  -2.855   0.893
  108    HE2  PHE  13           HE2      PHE  13  -4.086  -3.479  -1.565
  109    HZ   PHE  13           HZ       PHE  13  -3.074  -3.075   0.652
  110    H    ARG  14           HN       ARG  14   0.294  -6.328  -5.627
  111    HA   ARG  14           HA       ARG  14   2.805  -5.881  -7.106
  112    HB2  ARG  14           HB2      ARG  14   2.064  -7.594  -8.591
  113    HB3  ARG  14           HB1      ARG  14   1.498  -8.108  -7.005
  114    HG2  ARG  14           HG2      ARG  14  -0.741  -6.998  -7.595
  115    HG3  ARG  14           HG1      ARG  14  -0.129  -6.849  -9.239
  116    HD2  ARG  14           HD2      ARG  14  -1.465  -8.898  -9.003
  117    HD3  ARG  14           HD1      ARG  14   0.222  -9.295  -9.328
  118    HE   ARG  14           HE       ARG  14   0.048  -9.279  -6.552
  119   HH11  ARG  14          HH21      ARG  14  -1.595 -10.838  -9.161
  120   HH12  ARG  14          HH22      ARG  14  -1.969 -12.260  -8.247
  121   HH21  ARG  14          HH11      ARG  14  -0.434 -11.128  -5.351
  122   HH22  ARG  14          HH12      ARG  14  -1.312 -12.424  -6.093
  123    H    ASN  15           HN       ASN  15  -0.641  -5.130  -7.422
  124    HA   ASN  15           HA       ASN  15  -0.043  -3.142  -9.591
  125    HB2  ASN  15           HB2      ASN  15  -2.674  -3.172  -9.699
  126    HB3  ASN  15           HB1      ASN  15  -1.761  -4.471 -10.471
  127   HD21  ASN  15          HD21      ASN  15  -3.947  -5.610 -10.092
  128   HD22  ASN  15          HD22      ASN  15  -4.148  -6.416  -8.612
  129    H    GLU  16           HN       GLU  16  -0.127  -1.041  -9.058
  130    HA   GLU  16           HA       GLU  16  -0.684  -0.202  -6.387
  131    HB2  GLU  16           HB2      GLU  16  -0.585   1.379  -8.979
  132    HB3  GLU  16           HB1      GLU  16  -0.709   2.120  -7.385
  133    HG2  GLU  16           HG2      GLU  16   1.622   2.122  -8.018
  134    HG3  GLU  16           HG1      GLU  16   1.411   0.924  -6.744
  135    H    LYS  17           HN       LYS  17  -2.678  -0.855  -9.102
  136    HA   LYS  17           HA       LYS  17  -4.907   0.757  -8.630
  137    HB2  LYS  17           HB2      LYS  17  -4.485  -0.901 -10.551
  138    HB3  LYS  17           HB1      LYS  17  -5.097  -2.149  -9.475
  139    HG2  LYS  17           HG2      LYS  17  -7.205  -0.879  -9.200
  140    HG3  LYS  17           HG1      LYS  17  -6.609   0.353 -10.307
  141    HD2  LYS  17           HD2      LYS  17  -6.747  -2.553 -11.179
  142    HD3  LYS  17           HD1      LYS  17  -8.182  -1.535 -11.249
  143    HE2  LYS  17           HE2      LYS  17  -6.883   0.104 -12.650
  144    HE3  LYS  17           HE1      LYS  17  -5.552  -1.050 -12.688
  145    HZ1  LYS  17           HZ1      LYS  17  -6.708  -2.492 -13.987
  146    HZ2  LYS  17           HZ2      LYS  17  -7.373  -1.030 -14.540
  147    HZ3  LYS  17           HZ3      LYS  17  -8.225  -1.986 -13.423
  148    H    GLU  18           HN       GLU  18  -4.189  -2.475  -7.278
  149    HA   GLU  18           HA       GLU  18  -6.521  -2.500  -5.606
  150    HB2  GLU  18           HB2      GLU  18  -3.971  -4.116  -5.653
  151    HB3  GLU  18           HB1      GLU  18  -5.180  -4.369  -4.394
  152    HG2  GLU  18           HG2      GLU  18  -5.818  -4.480  -7.359
  153    HG3  GLU  18           HG1      GLU  18  -5.391  -5.902  -6.407
  154    H    LEU  19           HN       LEU  19  -3.266  -1.256  -5.205
  155    HA   LEU  19           HA       LEU  19  -3.444  -0.904  -2.338
  156    HB2  LEU  19           HB2      LEU  19  -1.288  -0.965  -3.458
  157    HB3  LEU  19           HB1      LEU  19  -1.726   0.429  -4.423
  158    HG   LEU  19           HG       LEU  19  -1.955   1.625  -2.105
  159   HD11  LEU  19          HD11      LEU  19  -1.660  -0.527  -0.806
  160   HD12  LEU  19          HD12      LEU  19  -0.621   0.803  -0.312
  161   HD13  LEU  19          HD13      LEU  19   0.028  -0.492  -1.312
  162   HD21  LEU  19          HD21      LEU  19   0.440   2.227  -2.140
  163   HD22  LEU  19          HD22      LEU  19  -0.258   2.219  -3.759
  164   HD23  LEU  19          HD23      LEU  19   0.741   0.869  -3.224
  165    H    ARG  20           HN       ARG  20  -4.289   1.079  -5.148
  166    HA   ARG  20           HA       ARG  20  -4.819   3.520  -3.768
  167    HB2  ARG  20           HB2      ARG  20  -4.744   3.269  -6.262
  168    HB3  ARG  20           HB1      ARG  20  -6.281   2.410  -6.181
  169    HG2  ARG  20           HG2      ARG  20  -7.369   4.379  -5.214
  170    HG3  ARG  20           HG1      ARG  20  -5.830   5.241  -5.183
  171    HD2  ARG  20           HD2      ARG  20  -5.689   5.032  -7.653
  172    HD3  ARG  20           HD1      ARG  20  -7.264   4.239  -7.658
  173    HE   ARG  20           HE       ARG  20  -7.722   6.628  -6.318
  174   HH11  ARG  20          HH21      ARG  20  -6.360   5.686  -9.349
  175   HH12  ARG  20          HH22      ARG  20  -6.852   7.132 -10.167
  176   HH21  ARG  20          HH11      ARG  20  -8.367   8.516  -7.372
  177   HH22  ARG  20          HH12      ARG  20  -7.986   8.732  -9.048
  178    H    ASP  21           HN       ASP  21  -6.729   0.654  -4.333
  179    HA   ASP  21           HA       ASP  21  -9.134   1.676  -3.134
  180    HB2  ASP  21           HB2      ASP  21  -9.227  -0.123  -4.802
  181    HB3  ASP  21           HB1      ASP  21  -8.307  -1.177  -3.733
  182    H    PHE  22           HN       PHE  22  -6.714  -0.745  -2.059
  183    HA   PHE  22           HA       PHE  22  -7.773  -1.073   0.527
  184    HB2  PHE  22           HB2      PHE  22  -5.074  -1.505  -0.704
  185    HB3  PHE  22           HB1      PHE  22  -5.179  -1.569   1.049
  186    HD1  PHE  22           HD1      PHE  22  -7.583  -2.691  -1.608
  187    HD2  PHE  22           HD2      PHE  22  -5.061  -3.862   1.676
  188    HE1  PHE  22           HE1      PHE  22  -8.441  -4.998  -1.765
  189    HE2  PHE  22           HE2      PHE  22  -5.928  -6.163   1.510
  190    HZ   PHE  22           HZ       PHE  22  -7.619  -6.743  -0.208
  191    H    ILE  23           HN       ILE  23  -5.968   1.485  -0.874
  192    HA   ILE  23           HA       ILE  23  -5.034   2.708   1.573
  193    HB   ILE  23           HB       ILE  23  -5.294   3.464  -1.311
  194   HG12  ILE  23          HG12      ILE  23  -3.070   3.959   0.702
  195   HG13  ILE  23          HG11      ILE  23  -3.217   2.484  -0.249
  196   HG21  ILE  23          HG21      ILE  23  -6.298   5.443  -0.456
  197   HG22  ILE  23          HG22      ILE  23  -4.615   5.859  -0.749
  198   HG23  ILE  23          HG23      ILE  23  -5.163   5.521   0.893
  199   HD11  ILE  23          HD11      ILE  23  -2.955   5.267  -1.424
  200   HD12  ILE  23          HD12      ILE  23  -2.976   3.752  -2.315
  201   HD13  ILE  23          HD13      ILE  23  -1.628   4.122  -1.250
  202    H    GLU  24           HN       GLU  24  -7.891   2.838  -0.399
  203    HA   GLU  24           HA       GLU  24  -9.199   4.970   0.905
  204    HB2  GLU  24           HB2      GLU  24 -10.986   4.440  -0.464
  205    HB3  GLU  24           HB1      GLU  24  -9.847   3.316  -1.194
  206    HG2  GLU  24           HG2      GLU  24 -10.685   1.573   0.473
  207    HG3  GLU  24           HG1      GLU  24 -11.950   2.714   0.908
  208    H    LYS  25           HN       LYS  25  -8.720   1.634   1.812
  209    HA   LYS  25           HA       LYS  25 -10.608   1.684   4.056
  210    HB2  LYS  25           HB2      LYS  25  -8.330  -0.222   3.415
  211    HB3  LYS  25           HB1      LYS  25  -9.493  -0.451   4.715
  212    HG2  LYS  25           HG2      LYS  25 -11.332  -0.393   2.992
  213    HG3  LYS  25           HG1      LYS  25 -10.089  -0.359   1.742
  214    HD2  LYS  25           HD2      LYS  25  -9.167  -2.487   2.621
  215    HD3  LYS  25           HD1      LYS  25 -10.460  -2.533   3.819
  216    HE2  LYS  25           HE2      LYS  25 -10.883  -2.479   0.816
  217    HE3  LYS  25           HE1      LYS  25 -10.982  -3.924   1.822
  218    HZ1  LYS  25           HZ1      LYS  25 -12.742  -2.835   3.104
  219    HZ2  LYS  25           HZ2      LYS  25 -13.166  -3.011   1.468
  220    HZ3  LYS  25           HZ3      LYS  25 -12.676  -1.497   2.064
  221    H    PHE  26           HN       PHE  26  -7.021   1.879   3.779
  222    HA   PHE  26           HA       PHE  26  -6.547   2.185   6.579
  223    HB2  PHE  26           HB2      PHE  26  -4.887   3.597   4.469
  224    HB3  PHE  26           HB1      PHE  26  -4.357   2.961   6.020
  225    HD1  PHE  26           HD1      PHE  26  -5.862   0.184   5.710
  226    HD2  PHE  26           HD2      PHE  26  -3.252   2.446   3.131
  227    HE1  PHE  26           HE1      PHE  26  -5.151  -1.896   4.593
  228    HE2  PHE  26           HE2      PHE  26  -2.554   0.344   2.009
  229    HZ   PHE  26           HZ       PHE  26  -3.502  -1.823   2.749
  230   H11A  DNS  27          H22       DNS  27   0.526   4.124   7.049
  231    H12  DNS  27           H23      DNS  27   1.551   4.687   5.725
  232    H13  DNS  27           H24      DNS  27   1.493   2.958   6.127
  233    H21  DNS  27           H21      DNS  27  -1.712   3.020   6.447
  234    H22  DNS  27           H19      DNS  27  -0.562   1.776   5.920
  235    H23  DNS  27           H20      DNS  27  -1.805   2.349   4.804
  236    H4   DNS  27           H14      DNS  27  -1.533   5.145   6.998
  237    H5   DNS  27           H15      DNS  27  -2.693   7.316   6.530
  238    H6   DNS  27           H16      DNS  27  -2.697   8.269   4.216
  239    HZ   DNS  27           HZ1      DNS  27  -3.735   7.650   2.995
  240    HE3  DNS  27           HE1      DNS  27  -4.747   9.783   2.589
  241    HE2  DNS  27           HE2      DNS  27  -4.841   9.361   0.889
  242    HD3  DNS  27           HD1      DNS  27  -6.978   9.014   2.119
  243    HD2  DNS  27           HD2      DNS  27  -6.368   7.544   1.361
  244    HG3  DNS  27           HG1      DNS  27  -5.574   6.673   3.447
  245    HG2  DNS  27           HG2      DNS  27  -5.771   8.228   4.258
  246    HB3  DNS  27           HB1      DNS  27  -8.202   8.083   4.014
  247    HB2  DNS  27           HB2      DNS  27  -8.047   6.566   3.128
  248    HA   DNS  27           HA       DNS  27  -6.941   6.877   5.935
  249    H    DNS  27           HN       DNS  27  -7.016   4.686   4.062
  250    H9   DNS  27           H9       DNS  27  -0.856   6.855  -0.021
  251    H10  DNS  27           H10      DNS  27   0.291   4.694   0.465
  252    H11  DNS  27           H11      DNS  27   0.293   3.759   2.782
  253    H    GLY  28           HN       GLY  28  -8.376   6.921   7.610
  254    HA2  GLY  28           HA2      GLY  28 -11.130   7.412   7.255
  255    HA3  GLY  28           HA1      GLY  28 -10.962   5.682   7.555
  256    H    ARG  29           HN       ARG  29  -9.044   5.470   9.424
  257    HA   ARG  29           HA       ARG  29 -10.348   6.389  11.828
  258    HB2  ARG  29           HB2      ARG  29  -7.550   5.268  11.468
  259    HB3  ARG  29           HB1      ARG  29  -8.414   5.401  12.997
  260    HG2  ARG  29           HG2      ARG  29  -9.322   3.767  10.608
  261    HG3  ARG  29           HG1      ARG  29  -8.549   3.107  12.042
  262    HD2  ARG  29           HD2      ARG  29 -10.572   4.419  13.266
  263    HD3  ARG  29           HD1      ARG  29 -11.354   4.134  11.713
  264    HE   ARG  29           HE       ARG  29 -11.014   2.213  13.774
  265   HH11  ARG  29          HH21      ARG  29 -10.497   2.508  10.371
  266   HH12  ARG  29          HH22      ARG  29 -10.404   0.802  10.113
  267   HH21  ARG  29          HH11      ARG  29 -10.921  -0.003  13.440
  268   HH22  ARG  29          HH12      ARG  29 -10.655  -0.618  11.843