*HEADER    PROTEIN BINDING                         30-DEC-02   1NJ3              
*TITLE     STRUCTURE AND UBIQUITIN INTERACTIONS OF THE CONSERVED NZF             
*TITLE    2 DOMAIN OF NPL4                                                       
*COMPND    MOL_ID: 1;                                                            
*COMPND   2 MOLECULE: NPL4;                                                      
*COMPND   3 CHAIN: A;                                                            
*COMPND   4 FRAGMENT: NZF DOMAIN;                                                
*COMPND   5 ENGINEERED: YES                                                      
*SOURCE    MOL_ID: 1;                                                            
*SOURCE   2 ORGANISM_SCIENTIFIC: RATTUS NORVEGICUS;                              
*SOURCE   3 ORGANISM_COMMON: RAT;                                                
*SOURCE   4 GENE: NPL4;                                                          
*SOURCE   5 EXPRESSION_SYSTEM: ESCHERICHIA COLI;                                 
*SOURCE   6 EXPRESSION_SYSTEM_COMMON: BACTERIA;                                  
*SOURCE   7 EXPRESSION_SYSTEM_STRAIN: BL21(DE3);                                 
*SOURCE   8 EXPRESSION_SYSTEM_VECTOR_TYPE: PLASMID;                              
*SOURCE   9 EXPRESSION_SYSTEM_PLASMID: PGEX-4T                                   
*KEYWDS    NZF DOMAIN, NPL4, RUBREDOXIN KNUCKLE, BETA-RIBBON, ZINC-              
*KEYWDS   2 FINGER, UBIQUITIN                                                    
*EXPDTA    NMR, 20 STRUCTURES                                                    
*AUTHOR    B.WANG, S.L.ALAM, H.H.MEYER, M.PAYNE, T.L.STEMMLER,                   
*AUTHOR   2 D.R.DAVIS, W.I.SUNDQUIST                                             
*REVDAT   1   22-APR-03 1NJ3    0                                                
!removed all duplicates from pseudoatom calls only ..using pseudoatom calls
!add steroe assignments for Gly HAs 10/11/2002
!THR3
assign  (resid 3   and name HG2#)  (resid 17  and name   HA)  3.2  1.4  1.4
!ALA5
assign  (resid 5   and name   HN)  (resid 18  and name  HD#)  4.3  2.5  2.5
assign  (resid 5   and name   HA)  (resid 6   and name   HN)  2.3  0.5  0.5
assign  (resid 5   and name  HB#)  (resid 7   and name   HN)  4.4  2.6  2.6
!MET6
assign  (resid 6   and name   HN)  (resid 6   and name  HB1)  2.5  0.7  1.0 !added 0.3 6/28/2002
assign  (resid 6   and name   HN)  (resid 6   and name  HB2)  2.8  1.0  1.0
assign  (resid 6   and name   HN)  (resid 6   and name  HG1)  3.2  1.4  1.4
assign  (resid 6   and name   HN)  (resid 6   and name  HG2)  3.2  1.4  1.4
assign  (resid 6   and name   HN)  (resid 6   and name  HG#)  2.9  1.1  1.1
assign  (resid 6   and name   HN)  (resid 7   and name   HN)  3.2  1.4  1.4
assign  (resid 6   and name   HN)  (resid 18  and name  HD1)  3.9  2.1  2.1
assign  (resid 6   and name   HN)  (resid 18  and name  HD2)  3.9  2.1  2.1
assign  (resid 6   and name   HA)  (resid 6   and name  HB2)  2.4  0.6  0.6
assign  (resid 6   and name   HA)  (resid 6   and name  HG#)  2.9  1.1  1.1
assign  (resid 6   and name   HA)  (resid 7   and name   HN)  2.2  0.4  0.4
assign  (resid 6   and name   HA)  (resid 18  and name  HD1)  3.1  1.3  1.3
assign  (resid 6   and name   HA)  (resid 18  and name  HD2)  3.1  1.3  1.3
assign  (resid 6   and name   HA)  (resid 18  and name  HD#)  3.0  1.2  1.2
assign  (resid 6   and name  HB1)  (resid 7   and name   HN)  2.9  1.1  1.1
assign  (resid 6   and name  HB1)  (resid 17  and name HE21)  3.9  2.1  2.1
assign  (resid 6   and name  HB1)  (resid 17  and name HE22)  3.9  2.1  2.1
assign  (resid 6   and name  HB2)  (resid 7   and name   HN)  2.6  0.8  0.8
assign  (resid 6   and name  HG1)  (resid 7   and name   HN)  3.9  2.1  2.1
assign  (resid 6   and name  HG1)  (resid 18  and name  HD1)  4.6  2.8  2.8
assign  (resid 6   and name  HG1)  (resid 18  and name  HD2)  4.6  2.8  2.8
assign  (resid 6   and name  HG2)  (resid 7   and name   HN)  3.9  2.1  2.1
assign  (resid 6   and name  HG2)  (resid 18  and name  HD1)  4.6  2.8  2.8
assign  (resid 6   and name  HG2)  (resid 18  and name  HD2)  4.6  2.8  2.8
assign  (resid 6   and name  HG#)  (resid 7   and name  HE1)  4.3  2.5  2.5
assign  (resid 6   and name  HG#)  (resid 17  and name   HA)  3.6  1.8  1.8
assign  (resid 6   and name  HG#)  (resid 18  and name  HD#)  3.9  2.1  2.1
!TRP7
assign  (resid 7   and name   HN)  (resid 7   and name  HB2)  2.9  1.1  1.1
assign  (resid 7   and name   HN)  (resid 7   and name  HD1)  3.1  1.3  1.3
assign  (resid 7   and name   HN)  (resid 7   and name  HE1)  3.9  2.1  2.1
assign  (resid 7   and name   HN)  (resid 8   and name   HN)  3.5  1.7  1.7
assign  (resid 7   and name   HN)  (resid 16  and name   HN)  2.8  1.0  1.0
assign  (resid 7   and name   HN)  (resid 16  and name  HB1)  3.6  1.8  1.8
assign  (resid 7   and name   HN)  (resid 18  and name  HD#)  4.3  2.5  2.5
assign  (resid 7   and name   HA)  (resid 7   and name  HB1)  2.3  0.5  0.5
assign  (resid 7   and name   HA)  (resid 7   and name  HB2)  2.3  0.5  0.5
assign  (resid 7   and name   HA)  (resid 8   and name   HN)  2.2  0.4  0.4
assign  (resid 7   and name  HB1)  (resid 8   and name   HN)  2.7  0.9  0.9
assign  (resid 7   and name  HB2)  (resid 8   and name   HN)  3.0  1.2  1.2
assign  (resid 7   and name  HD1)  (resid 18  and name   HA)  2.5  0.7  0.7
assign  (resid 7   and name  HE3)  (resid 8   and name   HA)  2.9  1.1  1.1
assign  (resid 7   and name  HE3)  (resid 9   and name  HB2)  3.8  2.0  2.0
assign  (resid 7   and name  HE3)  (resid 30  and name   HA)  3.3  1.5  1.5
assign  (resid 7   and name  HE1)  (resid 16  and name  HB1)  3.4  1.6  1.6
assign  (resid 7   and name  HE1)  (resid 16  and name  HB2)  3.0  1.2  1.2
assign  (resid 7   and name  HE1)  (resid 17  and name   HN)  3.9  2.1  2.1
assign  (resid 7   and name  HE1)  (resid 18  and name   HA)  3.2  1.4  1.4
assign  (resid 7   and name  HE1)  (resid 18  and name  HD#)  4.3  2.5  2.5
assign  (resid 7   and name  HE1)  (resid 20  and name   HN)  3.2  1.4  1.4
assign  (resid 7   and name  HE1)  (resid 20  and name HG2#)  3.8  2.0  2.0
assign  (resid 7   and name  HE1)  (resid 30  and name  HB1)  3.9  2.1  2.1
assign  (resid 7   and name  HE1)  (resid 30  and name  HB2)  3.9  2.1  2.1
assign  (resid 7   and name  HE1)  (resid 30  and name  HD1)  3.9  2.1  2.1
assign  (resid 7   and name  HE1)  (resid 30  and name  HD2)  3.9  2.1  2.1
assign  (resid 7   and name  HE1)  (resid 30  and name  HD#)  3.8  2.0  2.0
assign  (resid 7   and name  HZ3)  (resid 16  and name  HB2)  3.8  2.0  2.0
assign  (resid 7   and name  HZ2)  (resid 16  and name  HB2)  3.7  1.9  1.9
assign  (resid 7   and name  HZ2)  (resid 20  and name HG2#)  4.1  2.3  2.3
assign  (resid 7   and name  HH2)  (resid 22  and name   HN)  3.9  2.1  2.1
assign  (resid 7   and name  HH2)  (resid 22  and name   HA)  3.0  1.2  1.2
assign  (resid 7   and name  HH2)  (resid 23  and name   HN)  3.4  1.6  1.6
assign  (resid 7   and name  HH2)  (resid 23  and name   HA)  3.0  1.2  1.2
assign  (resid 7   and name  HH2)  (resid 23  and name  HB1)  3.0  1.2  1.2
assign  (resid 7   and name  HH2)  (resid 23  and name  HB2)  3.7  1.9  1.9
assign  (resid 7   and name  HH2)  (resid 28  and name HD##)  5.1  3.3  3.3
assign  (resid 7   and name  HH2)  (resid 30  and name   HA)  3.7  1.9  1.9
!ALA8
assign  (resid 8   and name   HA)  (resid 9   and name   HN)  2.1  0.3  0.3
assign  (resid 8   and name   HA)  (resid 15  and name   HA)  2.2  0.4  0.4
!CYS9
assign  (resid 9   and name   HN)  (resid 9   and name   HA)  2.3  0.5  0.5
assign  (resid 9   and name   HN)  (resid 9   and name  HB1)  2.3  0.5  0.5
assign  (resid 9   and name   HN)  (resid 9   and name  HB2)  2.4  0.6  0.6
assign  (resid 9   and name   HN)  (resid 10  and name   HN)  3.5  1.7  1.7
assign  (resid 9   and name   HN)  (resid 10  and name   HA)  3.6  1.8  1.8
assign  (resid 9   and name   HN)  (resid 13  and name   HN)  3.2  1.4  1.4
assign  (resid 9   and name   HN)  (resid 13  and name   HA)  3.0  1.2  1.2
assign  (resid 9   and name   HN)  (resid 14  and name  HB2)  3.9  2.1  2.1
assign  (resid 9   and name   HN)  (resid 15  and name   HN)  3.5  1.7  1.7
assign  (resid 9   and name   HN)  (resid 16  and name  HB1)  3.9  2.1  2.1
assign  (resid 9   and name   HN)  (resid 16  and name HD2#)  4.3  2.5  2.5
assign  (resid 9   and name   HA)  (resid 9   and name  HB2)  2.4  0.6  0.6
assign  (resid 9   and name   HA)  (resid 10  and name   HN)  2.3  0.5  0.5
assign  (resid 9   and name  HB1)  (resid 10  and name HE2#)  3.7  1.9  1.9
assign  (resid 9   and name  HB1)  (resid 13  and name   HN)  2.6  0.8  0.8
assign  (resid 9   and name  HB2)  (resid 10  and name   HN)  3.3  1.5  1.5
assign  (resid 9   and name  HB2)  (resid 11  and name   HN)  3.3  1.5  1.5
assign  (resid 9   and name  HB2)  (resid 12  and name   HN)  3.1  1.3  1.3
assign  (resid 9   and name  HB2)  (resid 13  and name   HN)  3.0  1.2  1.2
assign  (resid 9   and name  HB2)  (resid 14  and name   HN)  3.7  1.9  1.9
assign  (resid 9   and name  HB2)  (resid 16  and name HD2#)  3.5  1.7  1.7
!GLN10
assign  (resid 10  and name   HN)  (resid 10  and name  HB#)  2.7  0.9  0.9
assign  (resid 10  and name   HN)  (resid 10  and name  HG#)  3.5  1.7  1.7
assign  (resid 10  and name   HN)  (resid 10  and name HE2#)  4.3  2.5  2.5
assign  (resid 10  and name   HN)  (resid 11  and name   HN)  2.7  0.9  0.9
assign  (resid 10  and name   HN)  (resid 12  and name   HN)  3.5  1.7  1.7
assign  (resid 10  and name   HA)  (resid 11  and name   HA)  3.1  1.3  1.3
assign  (resid 10  and name   HA)  (resid 12  and name   HN)  3.6  1.8  1.8
assign  (resid 10  and name   HA)  (resid 13  and name   HN)  3.2  1.4  1.4
assign  (resid 10  and name  HG1)  (resid 11  and name   HN)  3.9  2.1  2.1
assign  (resid 10  and name  HG2)  (resid 11  and name   HN)  3.9  2.1  2.1
assign  (resid 10  and name HE2#)  (resid 12  and name   HN)  4.3  2.5  2.5
!HIS11
assign  (resid 11  and name   HN)  (resid 12  and name   HN)  2.5  0.7  0.7
assign  (resid 11  and name   HN)  (resid 12  and name   HA)  3.6  1.8  1.8
assign  (resid 11  and name   HN)  (resid 12  and name  HB2)  3.6  1.8  1.8
assign  (resid 11  and name   HN)  (resid 13  and name   HN)  3.0  1.2  1.2
assign  (resid 11  and name   HN)  (resid 13  and name   HA)  3.6  1.8  1.8
assign  (resid 11  and name   HN)  (resid 13  and name HG2#)  4.4  2.6  2.6
assign  (resid 11  and name   HN)  (resid 14  and name   HN)  3.4  1.6  1.6
assign  (resid 11  and name  HB#)  (resid 12  and name   HN)  3.1  1.3  1.3
!CYS12
assign  (resid 12  and name   HN)  (resid 12  and name  HB1)  2.7  0.9  0.9
assign  (resid 12  and name   HN)  (resid 12  and name  HB2)  2.6  0.8  0.8
assign  (resid 12  and name   HN)  (resid 13  and name   HN)  2.4  0.6  0.6
assign  (resid 12  and name   HN)  (resid 13  and name   HA)  3.1  1.3  1.3
assign  (resid 12  and name   HN)  (resid 13  and name HG2#)  4.4  2.6  2.6
assign  (resid 12  and name   HN)  (resid 14  and name   HN)  3.1  1.3  1.3
assign  (resid 12  and name   HA)  (resid 12  and name  HB1)  2.2  0.4  0.4
assign  (resid 12  and name   HA)  (resid 12  and name  HB2)  2.3  0.5  0.5
assign  (resid 12  and name   HA)  (resid 13  and name HG2#)  3.9  2.1  2.1
assign  (resid 12  and name   HA)  (resid 14  and name   HN)  3.4  1.6  1.6
assign  (resid 12  and name  HB1)  (resid 13  and name   HN)  3.1  1.3  1.3
assign  (resid 12  and name  HB2)  (resid 13  and name   HN)  3.3  1.5  1.5
!THR13
assign  (resid 13  and name   HN)  (resid 13  and name   HA)  2.2  0.4  0.4
assign  (resid 13  and name   HN)  (resid 13  and name   HB)  2.8  1.0  1.0
assign  (resid 13  and name   HN)  (resid 14  and name   HN)  2.7  0.9  0.9
assign  (resid 13  and name   HN)  (resid 26  and name   HN)  4.0  2.2  2.2
assign  (resid 13  and name   HA)  (resid 13  and name   HB)  2.2  0.4  0.4
assign  (resid 13  and name HG2#)  (resid 14  and name   HN)  4.4  2.6  2.6
!PHE14
assign  (resid 14  and name   HN)  (resid 14  and name  HB1)  2.3  0.5  0.5 
assign  (resid 14  and name   HN)  (resid 14  and name  HB2)  2.4  0.6  0.6 
assign  (resid 14  and name   HN)  (resid 15  and name   HN)  3.1  1.3  1.3
assign  (resid 14  and name   HN)  (resid 15  and name   HA)  3.4  1.6  1.6
assign  (resid 14  and name   HA)  (resid 14  and name  HB1)  2.4  0.6  0.6
assign  (resid 14  and name   HA)  (resid 15  and name   HN)  2.2  0.4  0.4
assign  (resid 14  and name   HA)  (resid 15  and name  HB2)  3.2  1.4  1.4
assign  (resid 14  and name  HB1)  (resid 15  and name   HN)  2.8  1.0  1.0
assign  (resid 14  and name  HB2)  (resid 15  and name   HN)  2.6  0.8  1.1 !added 0.3 6/28/200
assign  (resid 14  and name  HB2)  (resid 16  and name HD2#)  4.3  2.5  2.5
assign  (resid 14  and name  HD#)  (resid 16  and name   HA)  5.0  3.2  3.2
assign  (resid 14  and name  HD#)  (resid 16  and name HD2#)  5.4  3.6  3.6
assign  (resid 14  and name  HD#)  (resid 24  and name   HN)  5.0  3.2  3.2
assign  (resid 14  and name  HD#)  (resid 24  and name  HB1)  5.0  3.2  3.2
assign  (resid 14  and name  HD#)  (resid 24  and name  HB2)  5.0  3.2  3.2
assign  (resid 14  and name  HD#)  (resid 25  and name   HN)  5.0  3.2  3.2
assign  (resid 14  and name  HE#)  (resid 16  and name   HA)  4.6  2.8  2.8
assign  (resid 14  and name  HE#)  (resid 17  and name   HN)  5.0  3.2  3.2
assign  (resid 14  and name  HE#)  (resid 24  and name   HN)  5.0  3.2  3.2
assign  (resid 14  and name  HE#)  (resid 24  and name  HB1)  4.9  3.1  3.1
assign  (resid 14  and name  HE#)  (resid 24  and name  HB2)  5.0  3.2  3.2
assign  (resid 14  and name  HE#)  (resid 25  and name   HN)  5.0  3.2  3.2
!MET15
assign  (resid 15  and name   HN)  (resid 15  and name  HB1)  2.5  0.7  0.7
assign  (resid 15  and name   HN)  (resid 15  and name  HB2)  2.7  0.9  0.9
assign  (resid 15  and name   HN)  (resid 15  and name  HG#)  3.9  2.1  2.1
assign  (resid 15  and name   HN)  (resid 16  and name   HN)  3.2  1.5  1.5
assign  (resid 15  and name   HA)  (resid 16  and name   HN)  2.1  0.3  0.3
assign  (resid 15  and name   HA)  (resid 16  and name  HB1)  3.1  1.3  1.6 !added 0.3 10/10/2002
assign  (resid 15  and name  HB1)  (resid 16  and name   HN)  3.4  1.6  1.6
assign  (resid 15  and name  HB2)  (resid 16  and name   HN)  3.1  1.3  1.3
assign  (resid 15  and name  HG#)  (resid 16  and name   HN)  4.3  2.5  2.5
!ASN16
assign  (resid 16  and name   HN)  (resid 16  and name   HA)  2.4  0.6  0.6
assign  (resid 16  and name   HN)  (resid 16  and name  HB1)  2.4  0.6  0.6
assign  (resid 16  and name   HN)  (resid 16  and name  HB2)  2.5  0.7  0.7
assign  (resid 16  and name   HN)  (resid 16  and name HD2#)  4.3  2.5  2.5
assign  (resid 16  and name   HN)  (resid 17  and name   HA)  3.5  1.7  1.7
assign  (resid 16  and name   HA)  (resid 17  and name   HN)  2.2  0.4  0.4
assign  (resid 16  and name  HB1)  (resid 17  and name   HN)  3.0  1.2  1.2
assign  (resid 16  and name HD2#)  (resid 23  and name   HA)  3.4  1.6  1.6
assign  (resid 16  and name HD2#)  (resid 23  and name  HB1)  4.1  2.3  2.3
assign  (resid 16  and name HD2#)  (resid 23  and name  HB2)  4.3  2.5  2.5
assign  (resid 16  and name HD2#)  (resid 24  and name   HN)  4.3  2.5  2.5
!GLN17
assign  (resid 17  and name   HN)  (resid 17  and name  HB1)  2.5  0.7  1.0 !added 0.3 10/10/2002
assign  (resid 17  and name   HN)  (resid 17  and name  HB2)  2.9  1.1  1.1
assign  (resid 17  and name   HN)  (resid 17  and name  HG1)  2.8  1.0  1.0
assign  (resid 17  and name   HN)  (resid 17  and name  HG2)  2.8  1.0  1.0
assign  (resid 17  and name   HN)  (resid 17  and name  HG#)  2.7  0.9  0.9
assign  (resid 17  and name   HN)  (resid 17  and name HE2#)  4.3  2.5  2.5
assign  (resid 17  and name   HN)  (resid 18  and name  HD1)  3.9  2.1  2.1
assign  (resid 17  and name   HN)  (resid 18  and name  HD2)  3.9  2.1  2.1
assign  (resid 17  and name   HN)  (resid 20  and name HG2#)  4.0  2.2  2.2
assign  (resid 17  and name   HA)  (resid 17  and name  HB2)  2.3  0.5  0.5
assign  (resid 17  and name   HA)  (resid 17  and name HE21)  3.9  2.1  2.1
assign  (resid 17  and name   HA)  (resid 17  and name HE22)  3.9  2.1  2.1
assign  (resid 17  and name   HA)  (resid 18  and name  HD#)  2.2  0.4  0.4
assign  (resid 17  and name  HB1)  (resid 18  and name  HD#)  3.9  2.1  2.1
assign  (resid 17  and name  HB1)  (resid 20  and name   HN)  3.1  1.3  1.3
assign  (resid 17  and name  HB2)  (resid 17  and name  HG#)  2.2  0.4  0.4
assign  (resid 17  and name  HB2)  (resid 17  and name HE21)  3.9  2.1  2.1
assign  (resid 17  and name  HB2)  (resid 17  and name HE22)  3.9  2.1  2.1
assign  (resid 17  and name  HB2)  (resid 18  and name  HD#)  3.2  1.4  1.4
assign  (resid 17  and name  HB2)  (resid 20  and name   HN)  3.5  1.7  1.7
assign  (resid 17  and name  HG#)  (resid 20  and name   HN)  4.3  2.5  2.5
!GLY19
assign  (resid 19  and name   HN)  (resid 20  and name   HN)  3.1  1.3  1.3
assign  (resid 19  and name   HN)  (resid 20  and name   HB)  3.6  1.8  1.8
assign  (resid 19  and name   HA1)  (resid 20  and name   HN)  2.9  1.2  1.2 !added 10/7/2002
assign  (resid 19  and name   HA2)  (resid 20  and name   HN)  2.8  1.0  1.0 !added
!THR20
assign  (resid 20  and name   HN)  (resid 20  and name   HB)  2.7  0.9  0.9
assign  (resid 20  and name   HN)  (resid 20  and name HG2#)  3.3  1.5  1.5
assign  (resid 20  and name   HA)  (resid 20  and name   HB)  2.3  0.5  0.5
assign  (resid 20  and name   HA)  (resid 22  and name   HN)  3.4  1.6  1.6
assign  (resid 20  and name   HA)  (resid 23  and name   HN)  3.5  1.7  1.7
assign  (resid 20  and name   HB)  (resid 22  and name   HN)  2.8  1.0  1.0
assign  (resid 20  and name   HB)  (resid 23  and name   HN)  2.9  1.1  1.1
assign  (resid 20  and name HG2#)  (resid 22  and name   HN)  3.9  2.1  2.1
assign  (resid 20  and name HG2#)  (resid 24  and name   HN)  4.4  2.6  2.6
!GLY21
assign  (resid 21  and name  HA1)  (resid 30  and name  HB1)  3.9  2.1  2.1
assign  (resid 21  and name  HA1)  (resid 30  and name  HB2)  4.3  2.5  2.5
assign  (resid 21  and name  HA1)  (resid 30  and name  HD#)  4.8  3.0  3.0
assign  (resid 21  and name  HA1)  (resid 7   and name  HZ2)  3.1  1.3  1.3 !added 10/11/2002
!HIS22
assign  (resid 22  and name   HN)  (resid 22  and name  HB2)  2.8  1.0  1.0
assign  (resid 22  and name   HN)  (resid 22  and name  HD2)  3.6  1.8  1.8
assign  (resid 22  and name   HN)  (resid 23  and name   HN)  3.3  1.5  1.5
assign  (resid 22  and name   HA)  (resid 22  and name  HB1)  2.4  0.6  0.6
assign  (resid 22  and name   HA)  (resid 23  and name   HN)  2.7  0.9  0.9
assign  (resid 22  and name   HA)  (resid 28  and name   HN)  3.5  1.7  1.7
assign  (resid 22  and name   HA)  (resid 29  and name   HA)  2.1  0.3  0.3
assign  (resid 22  and name   HA)  (resid 30  and name   HN)  2.6  0.8  0.8
assign  (resid 22  and name  HB1)  (resid 23  and name   HN)  2.7  0.9  0.9
assign  (resid 22  and name  HB1)  (resid 29  and name   HA)  3.0  1.2  1.2
assign  (resid 22  and name  HB1)  (resid 30  and name   HN)  3.9  2.1  2.1
assign  (resid 22  and name  HB2)  (resid 23  and name   HN)  2.7  0.9  0.9
assign  (resid 22  and name  HB2)  (resid 29  and name   HA)  3.2  1.5  1.5
assign  (resid 22  and name  HD2)  (resid 27  and name   HA)  3.2  1.4  1.4
assign  (resid 22  and name  HD2)  (resid 29  and name   HA)  3.0  1.2  1.2
assign  (resid 22  and name  HD2)  (resid 29  and name  HD#)  3.7  1.9  1.9
!CYS23
assign  (resid 23  and name   HN)  (resid 23  and name  HB1)  2.7  0.9  0.9
assign  (resid 23  and name   HN)  (resid 23  and name  HB2)  2.5  0.7  0.7
assign  (resid 23  and name   HN)  (resid 24  and name   HN)  3.5  1.7  1.7
assign  (resid 23  and name   HN)  (resid 27  and name   HN)  3.1  1.3  1.3
assign  (resid 23  and name   HN)  (resid 28  and name   HN)  3.0  1.2  1.2
assign  (resid 23  and name   HA)  (resid 24  and name   HN)  2.2  0.4  0.4
assign  (resid 23  and name   HA)  (resid 24  and name   HA)  3.1  1.3  1.3
assign  (resid 23  and name   HA)  (resid 25  and name   HN)  3.3  1.5  1.5
assign  (resid 23  and name  HB1)  (resid 24  and name   HN)  3.1  1.3  1.3
assign  (resid 23  and name  HB1)  (resid 26  and name   HN)  3.1  1.3  1.3
assign  (resid 23  and name  HB1)  (resid 27  and name   HN)  2.9  1.1  1.1
assign  (resid 23  and name  HB1)  (resid 28  and name   HN)  3.4  1.6  1.6
assign  (resid 23  and name  HB2)  (resid 24  and name   HN)  3.3  1.5  1.5
assign  (resid 23  and name  HB2)  (resid 25  and name   HN)  3.2  1.4  1.4
assign  (resid 23  and name  HB2)  (resid 26  and name   HN)  2.8  1.0  1.0
assign  (resid 23  and name  HB2)  (resid 27  and name   HN)  2.5  0.7  0.7
assign  (resid 23  and name  HB2)  (resid 28  and name   HN)  2.8  1.0  1.0
!GLU24
assign  (resid 24  and name   HN)  (resid 24  and name  HB1)  2.6  0.8  0.8
assign  (resid 24  and name   HN)  (resid 24  and name  HB2)  2.5  0.7  0.7
assign  (resid 24  and name   HN)  (resid 24  and name  HG1)  3.6  1.8  1.8
assign  (resid 24  and name   HN)  (resid 24  and name  HG2)  3.6  1.8  1.8
assign  (resid 24  and name   HN)  (resid 24  and name  HG#)  3.1  1.3  1.3
assign  (resid 24  and name   HN)  (resid 25  and name   HN)  2.6  0.8  0.8
assign  (resid 24  and name   HN)  (resid 25  and name  HB#)  3.8  2.0  2.0
assign  (resid 24  and name   HN)  (resid 26  and name   HN)  3.4  1.6  1.6
assign  (resid 24  and name   HA)  (resid 24  and name  HB2)  2.4  0.5  0.5
assign  (resid 24  and name  HB1)  (resid 25  and name   HN)  3.1  1.3  1.3
assign  (resid 24  and name  HB2)  (resid 25  and name   HN)  3.1  1.3  1.3
assign  (resid 24  and name  HG#)  (resid 25  and name   HN)  4.3  2.5  2.5
!MET25
assign  (resid 25  and name   HN)  (resid 25  and name  HB#)  2.6  0.8  0.8
assign  (resid 25  and name   HN)  (resid 25  and name  HG1)  3.6  1.8  1.8
assign  (resid 25  and name   HN)  (resid 25  and name  HG2)  3.6  1.8  1.8
assign  (resid 25  and name   HN)  (resid 25  and name  HG#)  3.5  1.7  1.7
assign  (resid 25  and name   HN)  (resid 26  and name   HN)  2.5  0.7  0.7
assign  (resid 25  and name   HN)  (resid 26  and name  HB2)  3.5  1.7  2.0 !loosened rnd16 0.3 A
assign  (resid 25  and name   HN)  (resid 27  and name   HN)  2.9  1.1  1.1
assign  (resid 25  and name  HB#)  (resid 26  and name   HN)  2.7  0.9  0.9
assign  (resid 25  and name  HG#)  (resid 26  and name   HN)  4.3  2.5  2.5
!CYS26
assign  (resid 26  and name   HN)  (resid 26  and name  HB2)  2.6  0.8  0.8
assign  (resid 26  and name   HN)  (resid 27  and name   HN)  2.4  0.6  0.6
assign  (resid 26  and name   HN)  (resid 28  and name   HN)  3.3  1.5  1.5
assign  (resid 26  and name   HA)  (resid 26  and name  HB1)  2.2  0.4  0.4
assign  (resid 26  and name   HA)  (resid 26  and name  HB2)  2.3  0.5  0.5
assign  (resid 26  and name  HB2)  (resid 27  and name   HN)  3.3  1.5  1.5
!SER27
assign  (resid 27  and name   HN)  (resid 27  and name   HA)  2.3  0.5  0.5
assign  (resid 27  and name   HN)  (resid 27  and name  HB1)  3.0  1.2  1.2
assign  (resid 27  and name   HN)  (resid 27  and name  HB2)  3.0  1.2  1.2
assign  (resid 27  and name   HN)  (resid 28  and name   HN)  2.7  0.9  0.9
assign  (resid 27  and name   HN)  (resid 28  and name  HB1)  3.3  1.5  1.8 !loosened rnd16 0.3A
assign  (resid 27  and name   HA)  (resid 27  and name  HB#)  2.2  0.4  0.4
assign  (resid 27  and name  HB#)  (resid 28  and name   HN)  3.0  1.2  1.2
!LEU28
assign  (resid 28  and name   HN)  (resid 28  and name  HB1)  2.4  0.6  0.9 !added 0.3 6/28/2002
assign  (resid 28  and name   HN)  (resid 28  and name  HB2)  2.8  1.0  1.0
assign  (resid 28  and name   HN)  (resid 28  and name   HG)  2.7  0.9  0.9
assign  (resid 28  and name   HN)  (resid 28  and name HD1#)  4.2  2.4  2.4
assign  (resid 28  and name   HN)  (resid 28  and name HD2#)  4.2  2.4  2.4
assign  (resid 28  and name   HN)  (resid 28  and name HD##)  4.1  2.3  2.3
assign  (resid 28  and name   HN)  (resid 29  and name  HD#)  4.3  2.5  2.5
assign  (resid 28  and name   HA)  (resid 29  and name  HD1)  2.3  0.5  0.5
assign  (resid 28  and name   HA)  (resid 29  and name  HD2)  2.3  0.5  0.5
assign  (resid 28  and name   HA)  (resid 29  and name  HD#)  2.2  0.4  0.4
assign  (resid 28  and name  HB2)  (resid 29  and name  HD1)  3.1  1.3  1.3
assign  (resid 28  and name  HB2)  (resid 29  and name  HD2)  3.1  1.3  1.3
assign  (resid 28  and name  HB2)  (resid 29  and name  HD#)  2.8  1.0  1.0
assign  (resid 28  and name HD##)  (resid 29  and name  HD#)  4.3  2.5  2.5
!PRO29
assign  (resid 29  and name   HA)  (resid 30  and name   HN)  2.2  0.4  0.4
assign  (resid 29  and name  HB#)  (resid 30  and name   HN)  2.9  1.1  1.1
assign  (resid 29  and name  HB#)  (resid 31  and name   HN)  3.5  1.7  1.7
!ARG30
assign  (resid 30  and name   HN)  (resid 30  and name  HB1)  2.4  0.6  0.6
assign  (resid 30  and name   HN)  (resid 30  and name  HB2)  2.4  0.6  0.6
assign  (resid 30  and name   HN)  (resid 30  and name  HG#)  3.7  1.9  1.9
assign  (resid 30  and name   HN)  (resid 30  and name  HD#)  3.6  1.8  1.8
assign  (resid 30  and name   HN)  (resid 31  and name   HB)  3.2  1.4  1.4
assign  (resid 30  and name   HA)  (resid 30  and name  HB1)  2.4  0.6  0.6
assign  (resid 30  and name   HA)  (resid 30  and name  HG#)  2.8  1.0  1.0
assign  (resid 30  and name   HA)  (resid 31  and name   HN)  2.5  0.7  0.7
assign  (resid 30  and name   HA)  (resid 31  and name   HA)  3.1  1.3  1.3
assign  (resid 30  and name  HB1)  (resid 30  and name  HD#)  2.9  1.1  1.1
assign  (resid 30  and name  HB1)  (resid 31  and name   HN)  3.2  1.4  1.4
assign  (resid 30  and name  HB2)  (resid 31  and name   HN)  2.8  1.0  1.0
assign  (resid 30  and name  HG#)  (resid 31  and name   HN)  3.5  1.7  1.7
assign  (resid 30  and name  HD#)  (resid 31  and name   HN)  4.3  2.5  2.5
!THR31
assign  (resid 31  and name   HN)  (resid 31  and name   HB)  2.8  1.0  1.0


## HBOND RESTRAINTS####

!CYS9
assign  (resid 14   and name  O)  (resid 9   and name  N) 2.8 0.4 0.9
assign  (resid 14   and name  O)  (resid 9   and name HN) 1.8 0.4 0.9

!N16
assign  (resid 7   and name  O)  (resid 16  and name  N) 2.8 0.4 0.9
assign  (resid 7   and name  O)  (resid 16  and name HN) 1.8 0.4 0.9


!T20
assign  (resid 17   and name  O)  (resid 20  and name  N) 2.8 0.4 0.9
assign  (resid 17   and name  O)  (resid 20  and name HN) 1.8 0.4 0.9

!G19
assign  (resid 19   and name  O)  (resid 21  and name  N) 2.8 0.4 0.9
assign  (resid 19   and name  O)  (resid 21  and name HN) 1.8 0.4 0.9


####ZINC RESTRAINTS####

!CYS9
assign  (resid 9   and name   SG)  (resid 12  and name   SG)  3.96  0.18  0.18
assign  (resid 9   and name   SG)  (resid 23  and name   SG)  3.96  0.18  0.18
assign  (resid 9   and name   SG)  (resid 26  and name   SG)  3.96  0.18  0.18
!CYS12
assign  (resid 12  and name   SG)  (resid 23  and name   SG)  3.96  0.18  0.18
assign  (resid 12  and name   SG)  (resid 26  and name   SG)  3.96  0.18  0.18
!CYS23
assign  (resid 23  and name   SG)  (resid 26  and name   SG)  3.96  0.18  0.18
! ZN restraints
assign  (resid 32  and name   "ZN+2")  (resid 9   and name   SG)  2.35  0.02  0.02
assign  (resid 32  and name   "ZN+2")  (resid 12  and name   SG)  2.35  0.02  0.02
assign  (resid 32  and name   "ZN+2")  (resid 23  and name   SG)  2.35  0.02  0.02
assign  (resid 32  and name   "ZN+2")  (resid 26  and name   SG)  2.35  0.02  0.02
! Zn CB restraints
assign  (resid 32  and name   "ZN+2")  (resid 9   and name   CB)  3.43  0.18  0.18
assign  (resid 32  and name   "ZN+2")  (resid 12  and name   CB)  3.43  0.18  0.18
assign  (resid 32  and name   "ZN+2")  (resid 23  and name   CB)  3.43  0.18  0.18
assign  (resid 32  and name   "ZN+2")  (resid 26  and name   CB)  3.43  0.18  0.18


  Entry H atom name         Submitted Coord H atom name
  Start of MODEL    1
    1   1H    GLY   1          1H        GLY   1 -12.006   5.743  -6.870
    2   2H    GLY   1          2H        GLY   1 -12.694   4.296  -6.327
    3   3H    GLY   1          3H        GLY   1 -12.401   5.553  -5.235
    4   1HA   GLY   1          1HA       GLY   1 -14.011   6.954  -6.424
    5   2HA   GLY   1          2HA       GLY   1 -14.360   5.582  -7.464
    6    H    SER   2           H        SER   2 -14.471   6.724  -4.125
    7    HA   SER   2           HA       SER   2 -15.864   6.242  -2.394
    8   1HB   SER   2          1HB       SER   2 -17.642   6.875  -3.930
    9   2HB   SER   2          2HB       SER   2 -17.647   5.258  -4.634
   10    HG   SER   2           HG       SER   2 -18.481   6.067  -2.062
   11    H    THR   3           H        THR   3 -14.395   4.683  -1.571
   12    HA   THR   3           HA       THR   3 -15.386   1.924  -1.827
   13    HB   THR   3           HB       THR   3 -13.270   2.182  -3.074
   14    HG1  THR   3           HG1      THR   3 -13.100   0.205  -2.427
   15   1HG2  THR   3          1HG2      THR   3 -11.168   2.427  -1.735
   16   2HG2  THR   3          2HG2      THR   3 -12.169   3.034  -0.415
   17   3HG2  THR   3          3HG2      THR   3 -12.110   3.903  -1.948
   18    H    SER   4           H        SER   4 -13.798   0.703   0.041
   19    HA   SER   4           HA       SER   4 -15.056   1.465   2.461
   20   1HB   SER   4          1HB       SER   4 -13.120  -0.617   1.615
   21   2HB   SER   4          2HB       SER   4 -13.119  -0.200   3.327
   22    HG   SER   4           HG       SER   4 -15.494  -0.802   1.913
   23    H    ALA   5           H        ALA   5 -11.548   1.021   2.201
   24    HA   ALA   5           HA       ALA   5 -10.988   3.736   2.980
   25   1HB   ALA   5          1HB       ALA   5 -10.540   1.499   4.949
   26   2HB   ALA   5          2HB       ALA   5 -11.606   2.890   5.143
   27   3HB   ALA   5          3HB       ALA   5  -9.858   3.118   5.098
   28    H    MET   6           H        MET   6  -9.346   4.151   1.652
   29    HA   MET   6           HA       MET   6  -7.549   2.145   0.720
   30   1HB   MET   6          1HB       MET   6  -7.581   5.147   0.475
   31   2HB   MET   6          2HB       MET   6  -6.358   4.145  -0.272
   32   1HG   MET   6          1HG       MET   6  -7.685   4.022  -2.039
   33   2HG   MET   6          2HG       MET   6  -8.729   2.981  -1.074
   34   1HE   MET   6          1HE       MET   6  -9.386   7.407  -2.083
   35   2HE   MET   6          2HE       MET   6  -8.489   6.250  -3.065
   36   3HE   MET   6          3HE       MET   6  -7.844   6.773  -1.509
   37    H    TRP   7           H        TRP   7  -5.092   2.775   0.791
   38    HA   TRP   7           HA       TRP   7  -4.355   3.694   3.466
   39   1HB   TRP   7          1HB       TRP   7  -2.727   1.821   3.695
   40   2HB   TRP   7          2HB       TRP   7  -4.407   1.324   3.758
   41    HD1  TRP   7           HD1      TRP   7  -5.359   0.055   1.480
   42    HE1  TRP   7           HE1      TRP   7  -4.103  -1.479  -0.174
   43    HE3  TRP   7           HE3      TRP   7  -0.550   1.404   2.598
   44    HZ2  TRP   7           HZ2      TRP   7  -1.442  -2.050  -0.884
   45    HZ3  TRP   7           HZ3      TRP   7   1.292   0.318   1.378
   46    HH2  TRP   7           HH2      TRP   7   0.859  -1.367  -0.337
   47    H    ALA   8           H        ALA   8  -2.069   4.136   3.716
   48    HA   ALA   8           HA       ALA   8  -0.898   5.106   1.190
   49   1HB   ALA   8          1HB       ALA   8   0.248   6.801   2.513
   50   2HB   ALA   8          2HB       ALA   8  -0.448   6.138   3.992
   51   3HB   ALA   8          3HB       ALA   8  -1.493   6.879   2.780
   52    H    CYS   9           H        CYS   9   0.768   3.949   0.502
   53    HA   CYS   9           HA       CYS   9   2.049   1.974   2.045
   54   1HB   CYS   9          1HB       CYS   9   1.795   2.072  -0.490
   55   2HB   CYS   9          2HB       CYS   9   3.158   3.190  -0.474
   56    H    GLN  10           H        GLN  10   4.397   1.838   2.422
   57    HA   GLN  10           HA       GLN  10   5.500   4.459   3.169
   58   1HB   GLN  10          1HB       GLN  10   6.203   1.903   4.592
   59   2HB   GLN  10          2HB       GLN  10   6.414   3.559   5.143
   60   1HG   GLN  10          1HG       GLN  10   4.569   3.228   6.334
   61   2HG   GLN  10          2HG       GLN  10   3.701   3.385   4.808
   62   1HE2  GLN  10          1HE2      GLN  10   2.943   1.538   3.773
   63   2HE2  GLN  10          2HE2      GLN  10   2.811   0.018   4.583
   64    H    HIS  11           H        HIS  11   5.866   3.105   0.649
   65    HA   HIS  11           HA       HIS  11   8.787   2.850   0.720
   66   1HB   HIS  11          1HB       HIS  11   7.655   0.563   0.644
   67   2HB   HIS  11          2HB       HIS  11   7.062   1.015  -0.951
   68    HD1  HIS  11           HD1      HIS  11   8.694   0.878  -2.891
   69    HD2  HIS  11           HD2      HIS  11  10.469   0.183   0.797
   70    HE1  HIS  11           HE1      HIS  11  10.997   0.023  -3.410
   71    HE2  HIS  11           HE2      HIS  11  12.082  -0.308  -1.163
   72    H    CYS  12           H        CYS  12   6.021   2.782  -1.515
   73    HA   CYS  12           HA       CYS  12   7.446   4.394  -3.441
   74   1HB   CYS  12          1HB       CYS  12   5.295   4.156  -4.703
   75   2HB   CYS  12          2HB       CYS  12   6.096   2.641  -4.352
   76    H    THR  13           H        THR  13   5.051   4.670  -0.971
   77    HA   THR  13           HA       THR  13   4.157   6.437   0.097
   78    HB   THR  13           HB       THR  13   5.185   8.471   0.045
   79    HG1  THR  13           HG1      THR  13   4.908   9.393  -1.840
   80   1HG2  THR  13          1HG2      THR  13   7.443   7.317  -1.453
   81   2HG2  THR  13          2HG2      THR  13   6.909   6.458  -0.009
   82   3HG2  THR  13          3HG2      THR  13   7.411   8.145   0.105
   83    H    PHE  14           H        PHE  14   2.738   5.199  -1.907
   84    HA   PHE  14           HA       PHE  14   1.189   7.436  -3.016
   85   1HB   PHE  14          1HB       PHE  14   2.353   6.138  -4.765
   86   2HB   PHE  14          2HB       PHE  14   1.532   4.686  -4.219
   87    HD1  PHE  14           HD1      PHE  14  -0.295   4.027  -5.429
   88    HD2  PHE  14           HD2      PHE  14   0.663   8.169  -5.243
   89    HE1  PHE  14           HE1      PHE  14  -2.170   4.524  -6.942
   90    HE2  PHE  14           HE2      PHE  14  -1.212   8.675  -6.754
   91    HZ   PHE  14           HZ       PHE  14  -2.632   6.851  -7.605
   92    H    MET  15           H        MET  15  -1.102   6.817  -3.437
   93    HA   MET  15           HA       MET  15  -2.182   5.524  -1.067
   94   1HB   MET  15          1HB       MET  15  -3.171   7.642  -1.784
   95   2HB   MET  15          2HB       MET  15  -3.542   6.962  -3.362
   96   1HG   MET  15          1HG       MET  15  -4.649   5.494  -1.071
   97   2HG   MET  15          2HG       MET  15  -5.287   7.120  -1.313
   98   1HE   MET  15          1HE       MET  15  -6.726   6.984  -4.895
   99   2HE   MET  15          2HE       MET  15  -4.970   7.104  -4.776
  100   3HE   MET  15          3HE       MET  15  -5.994   7.983  -3.640
  101    H    ASN  16           H        ASN  16  -3.619   3.800  -1.094
  102    HA   ASN  16           HA       ASN  16  -3.744   2.259  -3.581
  103   1HB   ASN  16          1HB       ASN  16  -1.857   1.725  -1.775
  104   2HB   ASN  16          2HB       ASN  16  -3.173   0.810  -1.069
  105   1HD2  ASN  16          1HD2      ASN  16  -1.318   1.295  -4.006
  106   2HD2  ASN  16          2HD2      ASN  16  -1.516  -0.305  -4.621
  107    H    GLN  17           H        GLN  17  -5.439   0.733  -3.691
  108    HA   GLN  17           HA       GLN  17  -7.825   1.493  -2.397
  109   1HB   GLN  17          1HB       GLN  17  -7.015  -0.636  -4.264
  110   2HB   GLN  17          2HB       GLN  17  -8.524  -0.865  -3.403
  111   1HG   GLN  17          1HG       GLN  17  -7.911   1.642  -4.932
  112   2HG   GLN  17          2HG       GLN  17  -8.631   0.226  -5.695
  113   1HE2  GLN  17          1HE2      GLN  17  -9.237   3.075  -4.076
  114   2HE2  GLN  17          2HE2      GLN  17 -10.897   2.810  -3.679
  115    HA   PRO  18           HA       PRO  18  -7.925  -0.997   1.242
  116   1HB   PRO  18          1HB       PRO  18 -10.501  -1.789   1.401
  117   2HB   PRO  18          2HB       PRO  18 -10.010  -0.109   1.646
  118   1HG   PRO  18          1HG       PRO  18 -11.170  -1.408  -0.788
  119   2HG   PRO  18          2HG       PRO  18 -11.558   0.165  -0.065
  120   1HD   PRO  18          1HD       PRO  18  -9.927  -0.114  -2.222
  121   2HD   PRO  18          2HD       PRO  18  -9.752   1.199  -1.043
  122    H    GLY  19           H        GLY  19  -8.481  -2.455  -1.780
  123   1HA   GLY  19          1HA       GLY  19  -8.529  -5.142  -0.560
  124   2HA   GLY  19          2HA       GLY  19  -9.104  -4.770  -2.179
  125    H    THR  20           H        THR  20  -6.551  -2.949  -2.212
  126    HA   THR  20           HA       THR  20  -4.849  -5.011  -3.380
  127    HB   THR  20           HB       THR  20  -3.524  -2.807  -3.970
  128    HG1  THR  20           HG1      THR  20  -4.748  -1.371  -2.788
  129   1HG2  THR  20          1HG2      THR  20  -4.721  -4.288  -5.575
  130   2HG2  THR  20          2HG2      THR  20  -4.695  -2.578  -6.009
  131   3HG2  THR  20          3HG2      THR  20  -6.154  -3.292  -5.323
  132    H    GLY  21           H        GLY  21  -4.684  -5.550  -0.848
  133   1HA   GLY  21          1HA       GLY  21  -3.185  -4.142   0.940
  134   2HA   GLY  21          2HA       GLY  21  -3.075  -5.884   0.778
  135    H    HIS  22           H        HIS  22  -2.034  -5.707  -1.969
  136    HA   HIS  22           HA       HIS  22   0.728  -5.492  -1.284
  137   1HB   HIS  22          1HB       HIS  22  -0.734  -6.056  -3.860
  138   2HB   HIS  22          2HB       HIS  22   1.016  -5.876  -3.816
  139    HD1  HIS  22           HD1      HIS  22  -1.569  -7.925  -1.902
  140    HD2  HIS  22           HD2      HIS  22   2.235  -8.261  -3.538
  141    HE1  HIS  22           HE1      HIS  22  -0.865 -10.303  -1.482
  142    HE2  HIS  22           HE2      HIS  22   1.475 -10.459  -2.404
  143    H    CYS  23           H        CYS  23   0.233  -4.174  -4.396
  144    HA   CYS  23           HA       CYS  23  -0.278  -1.521  -3.927
  145   1HB   CYS  23          1HB       CYS  23   2.167  -2.174  -2.761
  146   2HB   CYS  23          2HB       CYS  23   2.589  -1.383  -4.260
  147    H    GLU  24           H        GLU  24   0.058  -0.180  -5.731
  148    HA   GLU  24           HA       GLU  24   0.678  -1.670  -8.183
  149   1HB   GLU  24          1HB       GLU  24  -1.372   0.258  -7.462
  150   2HB   GLU  24          2HB       GLU  24  -0.504   0.753  -8.908
  151   1HG   GLU  24          1HG       GLU  24  -1.723  -1.972  -8.551
  152   2HG   GLU  24          2HG       GLU  24  -2.560  -0.614  -9.301
  153    H    MET  25           H        MET  25   2.603  -0.368  -6.316
  154    HA   MET  25           HA       MET  25   3.931   1.317  -8.316
  155   1HB   MET  25          1HB       MET  25   3.180   2.023  -5.543
  156   2HB   MET  25          2HB       MET  25   4.816   2.452  -6.022
  157   1HG   MET  25          1HG       MET  25   3.424   4.326  -6.436
  158   2HG   MET  25          2HG       MET  25   3.857   3.627  -7.995
  159   1HE   MET  25          1HE       MET  25   0.939   2.896  -9.767
  160   2HE   MET  25          2HE       MET  25   2.611   3.442  -9.633
  161   3HE   MET  25          3HE       MET  25   1.291   4.605  -9.508
  162    H    CYS  26           H        CYS  26   4.514  -0.081  -5.058
  163    HA   CYS  26           HA       CYS  26   7.222  -0.708  -5.807
  164   1HB   CYS  26          1HB       CYS  26   7.214  -1.768  -3.504
  165   2HB   CYS  26          2HB       CYS  26   6.983  -0.034  -3.565
  166    H    SER  27           H        SER  27   4.319  -2.558  -4.901
  167    HA   SER  27           HA       SER  27   3.580  -4.543  -5.893
  168   1HB   SER  27          1HB       SER  27   5.440  -4.268  -7.654
  169   2HB   SER  27          2HB       SER  27   6.412  -5.280  -6.587
  170    HG   SER  27           HG       SER  27   4.777  -6.880  -6.760
  171    H    LEU  28           H        LEU  28   4.348  -3.825  -3.314
  172    HA   LEU  28           HA       LEU  28   5.294  -6.365  -2.198
  173   1HB   LEU  28          1HB       LEU  28   5.928  -3.545  -1.669
  174   2HB   LEU  28          2HB       LEU  28   5.711  -4.530  -0.262
  175    HG   LEU  28           HG       LEU  28   7.654  -5.106  -2.487
  176   1HD1  LEU  28          1HD1      LEU  28   7.936  -3.679   0.122
  177   2HD1  LEU  28          2HD1      LEU  28   8.569  -3.250  -1.467
  178   3HD1  LEU  28          3HD1      LEU  28   9.296  -4.570  -0.559
  179   1HD2  LEU  28          1HD2      LEU  28   7.550  -6.364   0.244
  180   2HD2  LEU  28          2HD2      LEU  28   8.519  -6.851  -1.146
  181   3HD2  LEU  28          3HD2      LEU  28   6.772  -7.072  -1.170
  182    HA   PRO  29           HA       PRO  29   1.588  -6.485   0.212
  183   1HB   PRO  29          1HB       PRO  29   2.386  -7.432   2.596
  184   2HB   PRO  29          2HB       PRO  29   2.479  -8.412   1.127
  185   1HG   PRO  29          1HG       PRO  29   4.642  -6.914   2.548
  186   2HG   PRO  29          2HG       PRO  29   4.697  -8.516   1.793
  187   1HD   PRO  29          1HD       PRO  29   5.636  -6.205   0.617
  188   2HD   PRO  29          2HD       PRO  29   5.130  -7.647  -0.280
  189    H    ARG  30           H        ARG  30   0.383  -5.624   2.027
  190    HA   ARG  30           HA       ARG  30   1.074  -2.934   2.626
  191   1HB   ARG  30          1HB       ARG  30  -1.259  -4.362   2.544
  192   2HB   ARG  30          2HB       ARG  30  -1.024  -4.151   4.267
  193   1HG   ARG  30          1HG       ARG  30  -0.969  -1.767   4.036
  194   2HG   ARG  30          2HG       ARG  30  -1.002  -1.898   2.277
  195   1HD   ARG  30          1HD       ARG  30  -3.197  -1.337   3.440
  196   2HD   ARG  30          2HD       ARG  30  -3.225  -2.653   2.267
  197    HE   ARG  30           HE       ARG  30  -3.800  -4.075   3.953
  198   1HH1  ARG  30          1HH1      ARG  30  -2.405  -1.205   5.363
  199   2HH1  ARG  30          2HH1      ARG  30  -2.756  -1.682   6.990
  200   1HH2  ARG  30          1HH2      ARG  30  -4.264  -4.705   6.093
  201   2HH2  ARG  30          2HH2      ARG  30  -3.811  -3.669   7.405
  202    H    THR  31           H        THR  31   2.006  -5.804   3.968
  203    HA   THR  31           HA       THR  31   3.079  -4.438   6.296
  204    HB   THR  31           HB       THR  31   1.272  -6.850   6.413
  205    HG1  THR  31           HG1      THR  31  -0.058  -5.494   7.284
  206   1HG2  THR  31          1HG2      THR  31   1.751  -7.076   8.766
  207   2HG2  THR  31          2HG2      THR  31   2.952  -5.787   8.675
  208   3HG2  THR  31          3HG2      THR  31   3.225  -7.310   7.828
  Start of MODEL    2
    1   1H    GLY   1          1H        GLY   1 -18.253   6.755  -0.747
    2   2H    GLY   1          2H        GLY   1 -17.739   5.819  -2.058
    3   3H    GLY   1          3H        GLY   1 -17.180   5.470  -0.501
    4   1HA   GLY   1          1HA       GLY   1 -19.551   5.030   0.145
    5   2HA   GLY   1          2HA       GLY   1 -19.917   5.102  -1.572
    6    H    SER   2           H        SER   2 -18.590   3.618  -2.970
    7    HA   SER   2           HA       SER   2 -18.916   0.967  -2.127
    8   1HB   SER   2          1HB       SER   2 -17.253   2.101  -4.388
    9   2HB   SER   2          2HB       SER   2 -17.598   0.386  -4.173
   10    HG   SER   2           HG       SER   2 -19.810   0.871  -4.392
   11    H    THR   3           H        THR   3 -15.830   2.619  -2.831
   12    HA   THR   3           HA       THR   3 -14.196   0.657  -1.683
   13    HB   THR   3           HB       THR   3 -13.626   3.612  -1.978
   14    HG1  THR   3           HG1      THR   3 -13.036   1.491  -3.760
   15   1HG2  THR   3          1HG2      THR   3 -11.527   1.531  -2.209
   16   2HG2  THR   3          2HG2      THR   3 -12.049   2.027  -0.599
   17   3HG2  THR   3          3HG2      THR   3 -11.401   3.221  -1.723
   18    H    SER   4           H        SER   4 -13.713   0.158   0.355
   19    HA   SER   4           HA       SER   4 -15.041   1.375   2.530
   20   1HB   SER   4          1HB       SER   4 -13.008  -0.771   2.199
   21   2HB   SER   4          2HB       SER   4 -13.141  -0.032   3.795
   22    HG   SER   4           HG       SER   4 -14.618  -1.613   3.858
   23    H    ALA   5           H        ALA   5 -11.515   0.994   2.372
   24    HA   ALA   5           HA       ALA   5 -11.052   3.819   2.677
   25   1HB   ALA   5          1HB       ALA   5 -11.628   3.333   4.956
   26   2HB   ALA   5          2HB       ALA   5  -9.886   3.596   4.859
   27   3HB   ALA   5          3HB       ALA   5 -10.525   1.957   4.987
   28    H    MET   6           H        MET   6  -9.287   4.225   1.530
   29    HA   MET   6           HA       MET   6  -7.521   2.150   0.685
   30   1HB   MET   6          1HB       MET   6  -7.554   5.138   0.340
   31   2HB   MET   6          2HB       MET   6  -6.231   4.160  -0.257
   32   1HG   MET   6          1HG       MET   6  -7.431   3.326  -1.968
   33   2HG   MET   6          2HG       MET   6  -8.923   3.266  -1.031
   34   1HE   MET   6          1HE       MET   6  -8.093   5.241  -4.416
   35   2HE   MET   6          2HE       MET   6  -6.765   4.680  -3.400
   36   3HE   MET   6          3HE       MET   6  -7.076   6.407  -3.571
   37    H    TRP   7           H        TRP   7  -5.037   2.820   0.772
   38    HA   TRP   7           HA       TRP   7  -4.351   3.725   3.464
   39   1HB   TRP   7          1HB       TRP   7  -2.720   1.847   3.712
   40   2HB   TRP   7          2HB       TRP   7  -4.405   1.362   3.776
   41    HD1  TRP   7           HD1      TRP   7  -5.360   0.050   1.543
   42    HE1  TRP   7           HE1      TRP   7  -4.118  -1.493  -0.112
   43    HE3  TRP   7           HE3      TRP   7  -0.548   1.453   2.572
   44    HZ2  TRP   7           HZ2      TRP   7  -1.462  -2.050  -0.857
   45    HZ3  TRP   7           HZ3      TRP   7   1.284   0.369   1.335
   46    HH2  TRP   7           HH2      TRP   7   0.841  -1.339  -0.352
   47    H    ALA   8           H        ALA   8  -2.070   4.176   3.751
   48    HA   ALA   8           HA       ALA   8  -0.870   5.157   1.245
   49   1HB   ALA   8          1HB       ALA   8  -1.469   6.879   2.923
   50   2HB   ALA   8          2HB       ALA   8   0.257   6.838   2.563
   51   3HB   ALA   8          3HB       ALA   8  -0.350   6.124   4.058
   52    H    CYS   9           H        CYS   9   0.761   3.966   0.532
   53    HA   CYS   9           HA       CYS   9   2.031   1.968   2.056
   54   1HB   CYS   9          1HB       CYS   9   1.750   2.021  -0.459
   55   2HB   CYS   9          2HB       CYS   9   3.075   3.182  -0.497
   56    H    GLN  10           H        GLN  10   4.346   1.792   2.467
   57    HA   GLN  10           HA       GLN  10   5.520   4.397   3.160
   58   1HB   GLN  10          1HB       GLN  10   5.540   1.783   4.649
   59   2HB   GLN  10          2HB       GLN  10   6.760   3.013   4.951
   60   1HG   GLN  10          1HG       GLN  10   3.789   3.270   5.325
   61   2HG   GLN  10          2HG       GLN  10   5.026   3.224   6.580
   62   1HE2  GLN  10          1HE2      GLN  10   3.619   5.120   4.008
   63   2HE2  GLN  10          2HE2      GLN  10   4.248   6.645   4.521
   64    H    HIS  11           H        HIS  11   5.853   3.070   0.655
   65    HA   HIS  11           HA       HIS  11   8.760   2.694   0.719
   66   1HB   HIS  11          1HB       HIS  11   7.174   0.518   0.479
   67   2HB   HIS  11          2HB       HIS  11   7.265   1.004  -1.210
   68    HD1  HIS  11           HD1      HIS  11   9.956   1.515  -1.929
   69    HD2  HIS  11           HD2      HIS  11   9.144  -1.191   1.118
   70    HE1  HIS  11           HE1      HIS  11  12.017   0.090  -1.734
   71    HE2  HIS  11           HE2      HIS  11  11.536  -1.482   0.174
   72    H    CYS  12           H        CYS  12   5.961   2.834  -1.473
   73    HA   CYS  12           HA       CYS  12   7.476   4.392  -3.387
   74   1HB   CYS  12          1HB       CYS  12   5.300   4.261  -4.655
   75   2HB   CYS  12          2HB       CYS  12   6.091   2.726  -4.371
   76    H    THR  13           H        THR  13   4.910   4.675  -1.057
   77    HA   THR  13           HA       THR  13   4.136   6.479   0.092
   78    HB   THR  13           HB       THR  13   6.448   7.494  -0.667
   79    HG1  THR  13           HG1      THR  13   5.818   8.522   1.033
   80   1HG2  THR  13          1HG2      THR  13   5.006   9.769  -1.735
   81   2HG2  THR  13          2HG2      THR  13   4.982   8.381  -2.821
   82   3HG2  THR  13          3HG2      THR  13   6.520   9.036  -2.262
   83    H    PHE  14           H        PHE  14   2.748   5.231  -1.997
   84    HA   PHE  14           HA       PHE  14   1.119   7.464  -2.992
   85   1HB   PHE  14          1HB       PHE  14   2.270   6.262  -4.804
   86   2HB   PHE  14          2HB       PHE  14   1.532   4.759  -4.275
   87    HD1  PHE  14           HD1      PHE  14   0.472   8.220  -5.189
   88    HD2  PHE  14           HD2      PHE  14  -0.291   4.042  -5.457
   89    HE1  PHE  14           HE1      PHE  14  -1.462   8.671  -6.641
   90    HE2  PHE  14           HE2      PHE  14  -2.227   4.484  -6.909
   91    HZ   PHE  14           HZ       PHE  14  -2.814   6.801  -7.503
   92    H    MET  15           H        MET  15  -1.168   6.816  -3.381
   93    HA   MET  15           HA       MET  15  -2.163   5.426  -1.030
   94   1HB   MET  15          1HB       MET  15  -3.171   7.580  -1.755
   95   2HB   MET  15          2HB       MET  15  -3.691   6.813  -3.249
   96   1HG   MET  15          1HG       MET  15  -5.334   5.597  -2.219
   97   2HG   MET  15          2HG       MET  15  -4.520   5.616  -0.655
   98   1HE   MET  15          1HE       MET  15  -4.828   9.148  -2.527
   99   2HE   MET  15          2HE       MET  15  -6.584   9.309  -2.459
  100   3HE   MET  15          3HE       MET  15  -5.855   7.978  -3.357
  101    H    ASN  16           H        ASN  16  -3.622   3.709  -1.090
  102    HA   ASN  16           HA       ASN  16  -3.733   2.212  -3.606
  103   1HB   ASN  16          1HB       ASN  16  -1.860   1.666  -1.769
  104   2HB   ASN  16          2HB       ASN  16  -3.177   0.710  -1.127
  105   1HD2  ASN  16          1HD2      ASN  16  -1.337   1.349  -4.053
  106   2HD2  ASN  16          2HD2      ASN  16  -1.462  -0.245  -4.704
  107    H    GLN  17           H        GLN  17  -5.419   0.651  -3.719
  108    HA   GLN  17           HA       GLN  17  -7.814   1.412  -2.452
  109   1HB   GLN  17          1HB       GLN  17  -6.987  -0.753  -4.270
  110   2HB   GLN  17          2HB       GLN  17  -8.509  -0.954  -3.424
  111   1HG   GLN  17          1HG       GLN  17  -7.852   1.509  -5.009
  112   2HG   GLN  17          2HG       GLN  17  -8.592   0.083  -5.734
  113   1HE2  GLN  17          1HE2      GLN  17  -9.157   2.988  -4.204
  114   2HE2  GLN  17          2HE2      GLN  17 -10.822   2.761  -3.803
  115    HA   PRO  18           HA       PRO  18  -7.942  -0.985   1.244
  116   1HB   PRO  18          1HB       PRO  18 -10.521  -1.788   1.381
  117   2HB   PRO  18          2HB       PRO  18 -10.034  -0.106   1.617
  118   1HG   PRO  18          1HG       PRO  18 -11.155  -1.426  -0.825
  119   2HG   PRO  18          2HG       PRO  18 -11.562   0.149  -0.119
  120   1HD   PRO  18          1HD       PRO  18  -9.905  -0.120  -2.247
  121   2HD   PRO  18          2HD       PRO  18  -9.731   1.183  -1.055
  122    H    GLY  19           H        GLY  19  -8.496  -2.505  -1.755
  123   1HA   GLY  19          1HA       GLY  19  -8.500  -5.168  -0.480
  124   2HA   GLY  19          2HA       GLY  19  -9.105  -4.836  -2.095
  125    H    THR  20           H        THR  20  -6.563  -2.979  -2.156
  126    HA   THR  20           HA       THR  20  -4.856  -5.020  -3.352
  127    HB   THR  20           HB       THR  20  -3.557  -2.852  -3.997
  128    HG1  THR  20           HG1      THR  20  -4.716  -1.454  -2.638
  129   1HG2  THR  20          1HG2      THR  20  -4.791  -2.577  -5.964
  130   2HG2  THR  20          2HG2      THR  20  -6.282  -3.128  -5.201
  131   3HG2  THR  20          3HG2      THR  20  -4.978  -4.272  -5.518
  132    H    GLY  21           H        GLY  21  -4.679  -5.561  -0.815
  133   1HA   GLY  21          1HA       GLY  21  -3.176  -4.156   0.968
  134   2HA   GLY  21          2HA       GLY  21  -3.056  -5.895   0.797
  135    H    HIS  22           H        HIS  22  -2.028  -5.700  -1.953
  136    HA   HIS  22           HA       HIS  22   0.736  -5.471  -1.277
  137   1HB   HIS  22          1HB       HIS  22  -0.726  -6.031  -3.855
  138   2HB   HIS  22          2HB       HIS  22   1.025  -5.858  -3.803
  139    HD1  HIS  22           HD1      HIS  22  -1.572  -7.899  -1.896
  140    HD2  HIS  22           HD2      HIS  22   2.230  -8.252  -3.535
  141    HE1  HIS  22           HE1      HIS  22  -0.880 -10.280  -1.480
  142    HE2  HIS  22           HE2      HIS  22   1.458 -10.447  -2.404
  143    H    CYS  23           H        CYS  23   0.222  -4.152  -4.386
  144    HA   CYS  23           HA       CYS  23  -0.292  -1.497  -3.900
  145   1HB   CYS  23          1HB       CYS  23   2.159  -2.143  -2.762
  146   2HB   CYS  23          2HB       CYS  23   2.578  -1.377  -4.274
  147    H    GLU  24           H        GLU  24   0.154  -0.105  -5.693
  148    HA   GLU  24           HA       GLU  24   0.674  -1.607  -8.166
  149   1HB   GLU  24          1HB       GLU  24  -1.349   0.336  -7.409
  150   2HB   GLU  24          2HB       GLU  24  -0.498   0.828  -8.866
  151   1HG   GLU  24          1HG       GLU  24  -1.429  -0.784 -10.108
  152   2HG   GLU  24          2HG       GLU  24  -1.313  -1.984  -8.822
  153    H    MET  25           H        MET  25   2.614  -0.291  -6.302
  154    HA   MET  25           HA       MET  25   3.939   1.376  -8.319
  155   1HB   MET  25          1HB       MET  25   3.194   2.092  -5.557
  156   2HB   MET  25          2HB       MET  25   4.851   2.477  -6.002
  157   1HG   MET  25          1HG       MET  25   3.500   4.388  -6.425
  158   2HG   MET  25          2HG       MET  25   3.980   3.699  -7.975
  159   1HE   MET  25          1HE       MET  25   0.942   3.817  -9.825
  160   2HE   MET  25          2HE       MET  25   2.673   4.088  -9.630
  161   3HE   MET  25          3HE       MET  25   1.524   5.302  -9.070
  162    H    CYS  26           H        CYS  26   4.506  -0.110  -5.101
  163    HA   CYS  26           HA       CYS  26   7.219  -0.730  -5.872
  164   1HB   CYS  26          1HB       CYS  26   7.206  -1.810  -3.561
  165   2HB   CYS  26          2HB       CYS  26   7.051  -0.068  -3.629
  166    H    SER  27           H        SER  27   4.314  -2.552  -4.911
  167    HA   SER  27           HA       SER  27   3.537  -4.527  -5.898
  168   1HB   SER  27          1HB       SER  27   5.375  -4.275  -7.684
  169   2HB   SER  27          2HB       SER  27   6.351  -5.296  -6.629
  170    HG   SER  27           HG       SER  27   4.568  -6.074  -8.386
  171    H    LEU  28           H        LEU  28   4.346  -3.815  -3.330
  172    HA   LEU  28           HA       LEU  28   5.283  -6.365  -2.225
  173   1HB   LEU  28          1HB       LEU  28   5.939  -3.550  -1.697
  174   2HB   LEU  28          2HB       LEU  28   5.728  -4.536  -0.290
  175    HG   LEU  28           HG       LEU  28   7.648  -5.121  -2.532
  176   1HD1  LEU  28          1HD1      LEU  28   9.243  -4.636  -0.454
  177   2HD1  LEU  28          2HD1      LEU  28   7.898  -3.570  -0.024
  178   3HD1  LEU  28          3HD1      LEU  28   8.725  -3.375  -1.572
  179   1HD2  LEU  28          1HD2      LEU  28   7.555  -6.382   0.196
  180   2HD2  LEU  28          2HD2      LEU  28   8.510  -6.877  -1.205
  181   3HD2  LEU  28          3HD2      LEU  28   6.761  -7.083  -1.209
  182    HA   PRO  29           HA       PRO  29   1.598  -6.470   0.217
  183   1HB   PRO  29          1HB       PRO  29   2.412  -7.403   2.601
  184   2HB   PRO  29          2HB       PRO  29   2.486  -8.393   1.138
  185   1HG   PRO  29          1HG       PRO  29   4.670  -6.899   2.529
  186   2HG   PRO  29          2HG       PRO  29   4.710  -8.505   1.782
  187   1HD   PRO  29          1HD       PRO  29   5.650  -6.207   0.585
  188   2HD   PRO  29          2HD       PRO  29   5.126  -7.648  -0.299
  189    H    ARG  30           H        ARG  30   0.412  -5.606   2.048
  190    HA   ARG  30           HA       ARG  30   1.100  -2.909   2.618
  191   1HB   ARG  30          1HB       ARG  30  -1.226  -4.353   2.581
  192   2HB   ARG  30          2HB       ARG  30  -0.968  -4.123   4.299
  193   1HG   ARG  30          1HG       ARG  30  -0.937  -1.742   4.044
  194   2HG   ARG  30          2HG       ARG  30  -0.982  -1.889   2.286
  195   1HD   ARG  30          1HD       ARG  30  -3.173  -1.331   3.449
  196   2HD   ARG  30          2HD       ARG  30  -3.200  -2.671   2.302
  197    HE   ARG  30           HE       ARG  30  -3.733  -4.073   4.023
  198   1HH1  ARG  30          1HH1      ARG  30  -2.423  -1.127   5.359
  199   2HH1  ARG  30          2HH1      ARG  30  -2.776  -1.565   6.997
  200   1HH2  ARG  30          1HH2      ARG  30  -4.199  -4.651   6.176
  201   2HH2  ARG  30          2HH2      ARG  30  -3.784  -3.565   7.461
  202    H    THR  31           H        THR  31   2.068  -5.764   3.966
  203    HA   THR  31           HA       THR  31   3.164  -4.375   6.271
  204    HB   THR  31           HB       THR  31   1.374  -6.796   6.429
  205    HG1  THR  31           HG1      THR  31   0.052  -5.453   7.337
  206   1HG2  THR  31          1HG2      THR  31   1.890  -7.023   8.767
  207   2HG2  THR  31          2HG2      THR  31   3.061  -5.708   8.671
  208   3HG2  THR  31          3HG2      THR  31   3.363  -7.222   7.819
  Start of MODEL    3
    1   1H    GLY   1          1H        GLY   1 -20.391   1.354   1.724
    2   2H    GLY   1          2H        GLY   1 -19.428   2.358   0.762
    3   3H    GLY   1          3H        GLY   1 -18.772   0.953   1.437
    4   1HA   GLY   1          1HA       GLY   1 -20.396  -0.369   0.119
    5   2HA   GLY   1          2HA       GLY   1 -20.829   1.128  -0.692
    6    H    SER   2           H        SER   2 -19.235  -1.565  -1.230
    7    HA   SER   2           HA       SER   2 -17.690  -2.212  -2.769
    8   1HB   SER   2          1HB       SER   2 -18.709   0.091  -3.835
    9   2HB   SER   2          2HB       SER   2 -16.992   0.480  -3.742
   10    HG   SER   2           HG       SER   2 -17.289  -0.526  -5.677
   11    H    THR   3           H        THR   3 -16.481   1.027  -1.900
   12    HA   THR   3           HA       THR   3 -13.981  -0.249  -1.021
   13    HB   THR   3           HB       THR   3 -14.472   2.610  -1.879
   14    HG1  THR   3           HG1      THR   3 -14.237   1.821  -3.792
   15   1HG2  THR   3          1HG2      THR   3 -12.471   1.878  -0.270
   16   2HG2  THR   3          2HG2      THR   3 -12.313   3.123  -1.509
   17   3HG2  THR   3          3HG2      THR   3 -11.750   1.483  -1.830
   18    H    SER   4           H        SER   4 -13.317  -0.068   1.034
   19    HA   SER   4           HA       SER   4 -15.065   1.316   2.908
   20   1HB   SER   4          1HB       SER   4 -13.882  -1.117   3.059
   21   2HB   SER   4          2HB       SER   4 -12.700  -0.140   3.929
   22    HG   SER   4           HG       SER   4 -15.359  -0.721   4.569
   23    H    ALA   5           H        ALA   5 -11.522   0.951   2.744
   24    HA   ALA   5           HA       ALA   5 -11.122   3.802   2.785
   25   1HB   ALA   5          1HB       ALA   5 -11.621   3.303   5.157
   26   2HB   ALA   5          2HB       ALA   5  -9.992   3.934   4.910
   27   3HB   ALA   5          3HB       ALA   5 -10.237   2.210   5.187
   28    H    MET   6           H        MET   6  -9.344   4.229   1.652
   29    HA   MET   6           HA       MET   6  -7.630   2.138   0.748
   30   1HB   MET   6          1HB       MET   6  -7.638   5.126   0.429
   31   2HB   MET   6          2HB       MET   6  -6.331   4.147  -0.203
   32   1HG   MET   6          1HG       MET   6  -7.506   3.729  -2.023
   33   2HG   MET   6          2HG       MET   6  -8.763   2.974  -1.047
   34   1HE   MET   6          1HE       MET   6 -10.677   5.474   0.325
   35   2HE   MET   6          2HE       MET   6 -10.646   3.803  -0.239
   36   3HE   MET   6          3HE       MET   6 -11.625   5.001  -1.086
   37    H    TRP   7           H        TRP   7  -5.129   2.778   0.765
   38    HA   TRP   7           HA       TRP   7  -4.365   3.629   3.453
   39   1HB   TRP   7          1HB       TRP   7  -2.764   1.747   3.663
   40   2HB   TRP   7          2HB       TRP   7  -4.444   1.248   3.691
   41    HD1  TRP   7           HD1      TRP   7  -5.355   0.013   1.370
   42    HE1  TRP   7           HE1      TRP   7  -4.063  -1.502  -0.280
   43    HE3  TRP   7           HE3      TRP   7  -0.573   1.352   2.605
   44    HZ2  TRP   7           HZ2      TRP   7  -1.388  -2.058  -0.940
   45    HZ3  TRP   7           HZ3      TRP   7   1.295   0.284   1.411
   46    HH2  TRP   7           HH2      TRP   7   0.901  -1.379  -0.334
   47    H    ALA   8           H        ALA   8  -2.086   4.063   3.698
   48    HA   ALA   8           HA       ALA   8  -0.917   5.059   1.180
   49   1HB   ALA   8          1HB       ALA   8  -0.474   6.082   3.985
   50   2HB   ALA   8          2HB       ALA   8  -1.532   6.818   2.781
   51   3HB   ALA   8          3HB       ALA   8   0.210   6.759   2.508
   52    H    CYS   9           H        CYS   9   0.764   3.929   0.489
   53    HA   CYS   9           HA       CYS   9   2.059   1.957   2.030
   54   1HB   CYS   9          1HB       CYS   9   1.813   2.038  -0.498
   55   2HB   CYS   9          2HB       CYS   9   3.141   3.194  -0.493
   56    H    GLN  10           H        GLN  10   4.400   1.840   2.420
   57    HA   GLN  10           HA       GLN  10   5.490   4.469   3.157
   58   1HB   GLN  10          1HB       GLN  10   6.667   3.303   5.018
   59   2HB   GLN  10          2HB       GLN  10   4.916   3.271   5.168
   60   1HG   GLN  10          1HG       GLN  10   6.343   0.986   3.885
   61   2HG   GLN  10          2HG       GLN  10   6.298   1.131   5.642
   62   1HE2  GLN  10          1HE2      GLN  10   4.855  -0.324   3.138
   63   2HE2  GLN  10          2HE2      GLN  10   3.262  -0.534   3.772
   64    H    HIS  11           H        HIS  11   5.866   3.125   0.639
   65    HA   HIS  11           HA       HIS  11   8.786   2.872   0.713
   66   1HB   HIS  11          1HB       HIS  11   7.617   0.585   0.627
   67   2HB   HIS  11          2HB       HIS  11   7.093   1.043  -0.991
   68    HD1  HIS  11           HD1      HIS  11   8.896   1.129  -2.842
   69    HD2  HIS  11           HD2      HIS  11  10.326  -0.064   0.872
   70    HE1  HIS  11           HE1      HIS  11  11.180   0.192  -3.275
   71    HE2  HIS  11           HE2      HIS  11  12.061  -0.443  -1.001
   72    H    CYS  12           H        CYS  12   6.032   2.786  -1.537
   73    HA   CYS  12           HA       CYS  12   7.455   4.413  -3.450
   74   1HB   CYS  12          1HB       CYS  12   5.314   4.164  -4.725
   75   2HB   CYS  12          2HB       CYS  12   6.122   2.653  -4.372
   76    H    THR  13           H        THR  13   5.050   4.670  -0.991
   77    HA   THR  13           HA       THR  13   4.139   6.430   0.075
   78    HB   THR  13           HB       THR  13   5.153   8.472   0.026
   79    HG1  THR  13           HG1      THR  13   5.341   9.568  -1.741
   80   1HG2  THR  13          1HG2      THR  13   7.454   7.441  -1.452
   81   2HG2  THR  13          2HG2      THR  13   6.897   6.425  -0.121
   82   3HG2  THR  13          3HG2      THR  13   7.347   8.104   0.179
   83    H    PHE  14           H        PHE  14   2.733   5.181  -1.927
   84    HA   PHE  14           HA       PHE  14   1.187   7.405  -3.067
   85   1HB   PHE  14          1HB       PHE  14   2.330   6.062  -4.794
   86   2HB   PHE  14          2HB       PHE  14   1.510   4.626  -4.206
   87    HD1  PHE  14           HD1      PHE  14   0.623   8.089  -5.285
   88    HD2  PHE  14           HD2      PHE  14  -0.311   3.939  -5.409
   89    HE1  PHE  14           HE1      PHE  14  -1.264   8.563  -6.791
   90    HE2  PHE  14           HE2      PHE  14  -2.200   4.405  -6.915
   91    HZ   PHE  14           HZ       PHE  14  -2.678   6.718  -7.608
   92    H    MET  15           H        MET  15  -1.105   6.817  -3.451
   93    HA   MET  15           HA       MET  15  -2.184   5.560  -1.062
   94   1HB   MET  15          1HB       MET  15  -2.981   7.754  -2.424
   95   2HB   MET  15          2HB       MET  15  -4.007   6.549  -3.189
   96   1HG   MET  15          1HG       MET  15  -4.412   5.912  -0.619
   97   2HG   MET  15          2HG       MET  15  -4.067   7.631  -0.450
   98   1HE   MET  15          1HE       MET  15  -7.187   9.347  -1.375
   99   2HE   MET  15          2HE       MET  15  -5.516   9.545  -1.905
  100   3HE   MET  15          3HE       MET  15  -5.868   9.148  -0.222
  101    H    ASN  16           H        ASN  16  -3.605   3.833  -1.055
  102    HA   ASN  16           HA       ASN  16  -3.816   2.306  -3.546
  103   1HB   ASN  16          1HB       ASN  16  -1.859   1.744  -1.840
  104   2HB   ASN  16          2HB       ASN  16  -3.147   0.857  -1.049
  105   1HD2  ASN  16          1HD2      ASN  16  -1.255   1.187  -3.949
  106   2HD2  ASN  16          2HD2      ASN  16  -1.584  -0.385  -4.584
  107    H    GLN  17           H        GLN  17  -5.574   0.907  -3.678
  108    HA   GLN  17           HA       GLN  17  -7.873   1.624  -2.223
  109   1HB   GLN  17          1HB       GLN  17  -7.193  -0.370  -4.270
  110   2HB   GLN  17          2HB       GLN  17  -8.648  -0.675  -3.341
  111   1HG   GLN  17          1HG       GLN  17  -8.137   1.951  -4.696
  112   2HG   GLN  17          2HG       GLN  17  -8.878   0.591  -5.538
  113   1HE2  GLN  17          1HE2      GLN  17  -9.409   3.268  -3.594
  114   2HE2  GLN  17          2HE2      GLN  17 -11.054   2.956  -3.166
  115    HA   PRO  18           HA       PRO  18  -7.868  -1.117   1.232
  116   1HB   PRO  18          1HB       PRO  18 -10.441  -1.875   1.479
  117   2HB   PRO  18          2HB       PRO  18  -9.917  -0.213   1.772
  118   1HG   PRO  18          1HG       PRO  18 -11.220  -1.388  -0.649
  119   2HG   PRO  18          2HG       PRO  18 -11.539   0.160   0.153
  120   1HD   PRO  18          1HD       PRO  18 -10.014  -0.088  -2.097
  121   2HD   PRO  18          2HD       PRO  18  -9.792   1.206  -0.904
  122    H    GLY  19           H        GLY  19  -8.443  -2.385  -1.837
  123   1HA   GLY  19          1HA       GLY  19  -8.649  -5.136  -0.794
  124   2HA   GLY  19          2HA       GLY  19  -9.094  -4.638  -2.420
  125    H    THR  20           H        THR  20  -6.533  -2.938  -2.349
  126    HA   THR  20           HA       THR  20  -4.802  -5.060  -3.366
  127    HB   THR  20           HB       THR  20  -3.459  -2.798  -3.926
  128    HG1  THR  20           HG1      THR  20  -6.178  -2.020  -4.051
  129   1HG2  THR  20          1HG2      THR  20  -5.826  -3.702  -5.529
  130   2HG2  THR  20          2HG2      THR  20  -4.231  -4.454  -5.561
  131   3HG2  THR  20          3HG2      THR  20  -4.434  -2.788  -6.106
  132    H    GLY  21           H        GLY  21  -4.569  -5.646  -0.942
  133   1HA   GLY  21          1HA       GLY  21  -3.183  -4.107   0.886
  134   2HA   GLY  21          2HA       GLY  21  -3.050  -5.852   0.779
  135    H    HIS  22           H        HIS  22  -1.987  -5.730  -1.964
  136    HA   HIS  22           HA       HIS  22   0.768  -5.506  -1.267
  137   1HB   HIS  22          1HB       HIS  22  -0.679  -6.074  -3.851
  138   2HB   HIS  22          2HB       HIS  22   1.071  -5.898  -3.797
  139    HD1  HIS  22           HD1      HIS  22  -1.520  -7.929  -1.870
  140    HD2  HIS  22           HD2      HIS  22   2.273  -8.292  -3.527
  141    HE1  HIS  22           HE1      HIS  22  -0.825 -10.309  -1.445
  142    HE2  HIS  22           HE2      HIS  22   1.436 -10.528  -2.533
  143    H    CYS  23           H        CYS  23   0.278  -4.192  -4.387
  144    HA   CYS  23           HA       CYS  23  -0.222  -1.539  -3.934
  145   1HB   CYS  23          1HB       CYS  23   2.214  -2.193  -2.746
  146   2HB   CYS  23          2HB       CYS  23   2.645  -1.402  -4.242
  147    H    GLU  24           H        GLU  24  -0.005  -0.263  -5.755
  148    HA   GLU  24           HA       GLU  24   0.702  -1.739  -8.186
  149   1HB   GLU  24          1HB       GLU  24  -1.384   0.160  -7.493
  150   2HB   GLU  24          2HB       GLU  24  -0.513   0.661  -8.934
  151   1HG   GLU  24          1HG       GLU  24  -1.371  -0.987 -10.183
  152   2HG   GLU  24          2HG       GLU  24  -1.264  -2.170  -8.881
  153    H    MET  25           H        MET  25   2.610  -0.426  -6.330
  154    HA   MET  25           HA       MET  25   3.912   1.293  -8.317
  155   1HB   MET  25          1HB       MET  25   3.146   1.972  -5.545
  156   2HB   MET  25          2HB       MET  25   4.784   2.414  -6.007
  157   1HG   MET  25          1HG       MET  25   3.389   4.284  -6.416
  158   2HG   MET  25          2HG       MET  25   3.832   3.599  -7.978
  159   1HE   MET  25          1HE       MET  25   1.805   2.926  -9.841
  160   2HE   MET  25          2HE       MET  25   2.303   4.551  -9.373
  161   3HE   MET  25          3HE       MET  25   0.589   4.163  -9.521
  162    H    CYS  26           H        CYS  26   4.531  -0.095  -5.064
  163    HA   CYS  26           HA       CYS  26   7.238  -0.702  -5.836
  164   1HB   CYS  26          1HB       CYS  26   7.261  -1.747  -3.526
  165   2HB   CYS  26          2HB       CYS  26   7.019  -0.015  -3.596
  166    H    SER  27           H        SER  27   4.362  -2.572  -4.884
  167    HA   SER  27           HA       SER  27   3.632  -4.569  -5.865
  168   1HB   SER  27          1HB       SER  27   5.490  -4.302  -7.628
  169   2HB   SER  27          2HB       SER  27   6.470  -5.294  -6.548
  170    HG   SER  27           HG       SER  27   3.982  -6.004  -7.717
  171    H    LEU  28           H        LEU  28   4.388  -3.821  -3.292
  172    HA   LEU  28           HA       LEU  28   5.363  -6.340  -2.151
  173   1HB   LEU  28          1HB       LEU  28   5.941  -3.507  -1.631
  174   2HB   LEU  28          2HB       LEU  28   5.730  -4.488  -0.221
  175    HG   LEU  28           HG       LEU  28   7.701  -5.043  -2.424
  176   1HD1  LEU  28          1HD1      LEU  28   7.881  -3.484   0.090
  177   2HD1  LEU  28          2HD1      LEU  28   8.696  -3.245  -1.456
  178   3HD1  LEU  28          3HD1      LEU  28   9.257  -4.495  -0.348
  179   1HD2  LEU  28          1HD2      LEU  28   7.595  -6.284   0.315
  180   2HD2  LEU  28          2HD2      LEU  28   8.584  -6.762  -1.061
  181   3HD2  LEU  28          3HD2      LEU  28   6.844  -7.015  -1.103
  182    HA   PRO  29           HA       PRO  29   1.636  -6.513   0.223
  183   1HB   PRO  29          1HB       PRO  29   2.424  -7.443   2.615
  184   2HB   PRO  29          2HB       PRO  29   2.549  -8.422   1.149
  185   1HG   PRO  29          1HG       PRO  29   4.671  -6.887   2.590
  186   2HG   PRO  29          2HG       PRO  29   4.763  -8.489   1.838
  187   1HD   PRO  29          1HD       PRO  29   5.673  -6.163   0.667
  188   2HD   PRO  29          2HD       PRO  29   5.202  -7.616  -0.231
  189    H    ARG  30           H        ARG  30   0.391  -5.657   2.007
  190    HA   ARG  30           HA       ARG  30   1.045  -2.961   2.621
  191   1HB   ARG  30          1HB       ARG  30  -1.274  -4.408   2.492
  192   2HB   ARG  30          2HB       ARG  30  -1.074  -4.203   4.220
  193   1HG   ARG  30          1HG       ARG  30  -1.011  -1.810   3.986
  194   2HG   ARG  30          2HG       ARG  30  -1.057  -1.952   2.228
  195   1HD   ARG  30          1HD       ARG  30  -3.277  -2.272   2.197
  196   2HD   ARG  30          2HD       ARG  30  -3.233  -3.357   3.586
  197    HE   ARG  30           HE       ARG  30  -2.836  -0.588   4.258
  198   1HH1  ARG  30          1HH1      ARG  30  -5.205  -3.091   3.708
  199   2HH1  ARG  30          2HH1      ARG  30  -6.425  -2.319   4.663
  200   1HH2  ARG  30          1HH2      ARG  30  -4.440   0.428   5.515
  201   2HH2  ARG  30          2HH2      ARG  30  -5.992  -0.321   5.688
  202    H    THR  31           H        THR  31   1.976  -5.825   3.978
  203    HA   THR  31           HA       THR  31   2.994  -4.452   6.326
  204    HB   THR  31           HB       THR  31   1.205  -6.878   6.408
  205    HG1  THR  31           HG1      THR  31   1.140  -4.407   7.796
  206   1HG2  THR  31          1HG2      THR  31   2.816  -5.803   8.712
  207   2HG2  THR  31          2HG2      THR  31   3.149  -7.310   7.859
  208   3HG2  THR  31          3HG2      THR  31   1.645  -7.121   8.760
  Start of MODEL    4
    1   1H    GLY   1          1H        GLY   1 -16.972  -0.381  -7.710
    2   2H    GLY   1          2H        GLY   1 -15.747   0.690  -7.248
    3   3H    GLY   1          3H        GLY   1 -16.366   0.742  -8.822
    4   1HA   GLY   1          1HA       GLY   1 -17.452   2.512  -7.888
    5   2HA   GLY   1          2HA       GLY   1 -18.611   1.210  -7.670
    6    H    SER   2           H        SER   2 -17.757  -0.158  -5.545
    7    HA   SER   2           HA       SER   2 -18.058   1.791  -3.393
    8   1HB   SER   2          1HB       SER   2 -18.578  -1.134  -3.687
    9   2HB   SER   2          2HB       SER   2 -18.243  -0.508  -2.073
   10    HG   SER   2           HG       SER   2 -20.188   0.256  -2.041
   11    H    THR   3           H        THR   3 -16.712   1.827  -1.558
   12    HA   THR   3           HA       THR   3 -14.314   0.228  -1.482
   13    HB   THR   3           HB       THR   3 -14.039   3.221  -1.802
   14    HG1  THR   3           HG1      THR   3 -14.406   2.649  -3.819
   15   1HG2  THR   3          1HG2      THR   3 -11.715   2.898  -1.916
   16   2HG2  THR   3          2HG2      THR   3 -11.884   1.145  -2.002
   17   3HG2  THR   3          3HG2      THR   3 -12.261   1.995  -0.503
   18    H    SER   4           H        SER   4 -13.463   0.096   0.545
   19    HA   SER   4           HA       SER   4 -15.030   1.256   2.680
   20   1HB   SER   4          1HB       SER   4 -12.750  -0.720   2.610
   21   2HB   SER   4          2HB       SER   4 -13.401  -0.093   4.124
   22    HG   SER   4           HG       SER   4 -14.343  -2.068   2.625
   23    H    ALA   5           H        ALA   5 -11.496   0.926   2.498
   24    HA   ALA   5           HA       ALA   5 -11.082   3.768   2.708
   25   1HB   ALA   5          1HB       ALA   5  -9.920   3.680   4.875
   26   2HB   ALA   5          2HB       ALA   5 -10.425   2.000   5.060
   27   3HB   ALA   5          3HB       ALA   5 -11.633   3.285   5.016
   28    H    MET   6           H        MET   6  -9.315   4.200   1.572
   29    HA   MET   6           HA       MET   6  -7.547   2.140   0.701
   30   1HB   MET   6          1HB       MET   6  -7.578   5.130   0.387
   31   2HB   MET   6          2HB       MET   6  -6.273   4.150  -0.245
   32   1HG   MET   6          1HG       MET   6  -7.478   3.984  -2.100
   33   2HG   MET   6          2HG       MET   6  -8.509   2.875  -1.198
   34   1HE   MET   6          1HE       MET   6  -7.947   6.559  -2.348
   35   2HE   MET   6          2HE       MET   6  -8.136   6.773  -0.607
   36   3HE   MET   6          3HE       MET   6  -9.373   7.379  -1.710
   37    H    TRP   7           H        TRP   7  -5.062   2.804   0.774
   38    HA   TRP   7           HA       TRP   7  -4.358   3.693   3.466
   39   1HB   TRP   7          1HB       TRP   7  -2.731   1.816   3.700
   40   2HB   TRP   7          2HB       TRP   7  -4.414   1.326   3.756
   41    HD1  TRP   7           HD1      TRP   7  -5.361   0.041   1.494
   42    HE1  TRP   7           HE1      TRP   7  -4.107  -1.491  -0.163
   43    HE3  TRP   7           HE3      TRP   7  -0.554   1.422   2.582
   44    HZ2  TRP   7           HZ2      TRP   7  -1.445  -2.046  -0.887
   45    HZ3  TRP   7           HZ3      TRP   7   1.286   0.344   1.354
   46    HH2  TRP   7           HH2      TRP   7   0.855  -1.348  -0.354
   47    H    ALA   8           H        ALA   8  -2.077   4.141   3.744
   48    HA   ALA   8           HA       ALA   8  -0.886   5.133   1.236
   49   1HB   ALA   8          1HB       ALA   8   0.228   6.825   2.548
   50   2HB   ALA   8          2HB       ALA   8  -0.368   6.108   4.045
   51   3HB   ALA   8          3HB       ALA   8  -1.497   6.853   2.915
   52    H    CYS   9           H        CYS   9   0.771   3.973   0.527
   53    HA   CYS   9           HA       CYS   9   2.040   1.971   2.047
   54   1HB   CYS   9          1HB       CYS   9   1.780   2.089  -0.485
   55   2HB   CYS   9          2HB       CYS   9   3.147   3.200  -0.466
   56    H    GLN  10           H        GLN  10   4.379   1.814   2.432
   57    HA   GLN  10           HA       GLN  10   5.510   4.420   3.188
   58   1HB   GLN  10          1HB       GLN  10   6.190   1.854   4.601
   59   2HB   GLN  10          2HB       GLN  10   6.409   3.506   5.161
   60   1HG   GLN  10          1HG       GLN  10   4.561   3.178   6.349
   61   2HG   GLN  10          2HG       GLN  10   3.696   3.349   4.821
   62   1HE2  GLN  10          1HE2      GLN  10   2.926   1.515   3.775
   63   2HE2  GLN  10          2HE2      GLN  10   2.784  -0.009   4.575
   64    H    HIS  11           H        HIS  11   5.862   3.086   0.663
   65    HA   HIS  11           HA       HIS  11   8.778   2.784   0.734
   66   1HB   HIS  11          1HB       HIS  11   7.568   0.521   0.630
   67   2HB   HIS  11          2HB       HIS  11   7.052   1.000  -0.984
   68    HD1  HIS  11           HD1      HIS  11  10.240   0.404   0.967
   69    HD2  HIS  11           HD2      HIS  11   8.869   0.488  -2.950
   70    HE1  HIS  11           HE1      HIS  11  12.168  -0.405  -0.439
   71    HE2  HIS  11           HE2      HIS  11  11.334  -0.261  -2.815
   72    H    CYS  12           H        CYS  12   6.007   2.801  -1.499
   73    HA   CYS  12           HA       CYS  12   7.478   4.382  -3.416
   74   1HB   CYS  12          1HB       CYS  12   5.297   4.228  -4.666
   75   2HB   CYS  12          2HB       CYS  12   6.085   2.695  -4.362
   76    H    THR  13           H        THR  13   4.930   4.671  -1.068
   77    HA   THR  13           HA       THR  13   4.149   6.475   0.073
   78    HB   THR  13           HB       THR  13   6.464   7.487  -0.680
   79    HG1  THR  13           HG1      THR  13   6.002   8.984   0.735
   80   1HG2  THR  13          1HG2      THR  13   5.040   9.767  -1.756
   81   2HG2  THR  13          2HG2      THR  13   4.996   8.376  -2.840
   82   3HG2  THR  13          3HG2      THR  13   6.544   9.015  -2.287
   83    H    PHE  14           H        PHE  14   2.755   5.228  -2.003
   84    HA   PHE  14           HA       PHE  14   1.137   7.462  -3.015
   85   1HB   PHE  14          1HB       PHE  14   2.280   6.241  -4.819
   86   2HB   PHE  14          2HB       PHE  14   1.537   4.746  -4.278
   87    HD1  PHE  14           HD1      PHE  14   0.489   8.205  -5.215
   88    HD2  PHE  14           HD2      PHE  14  -0.287   4.028  -5.456
   89    HE1  PHE  14           HE1      PHE  14  -1.445   8.652  -6.669
   90    HE2  PHE  14           HE2      PHE  14  -2.222   4.467  -6.912
   91    HZ   PHE  14           HZ       PHE  14  -2.802   6.782  -7.520
   92    H    MET  15           H        MET  15  -1.151   6.829  -3.394
   93    HA   MET  15           HA       MET  15  -2.156   5.460  -1.038
   94   1HB   MET  15          1HB       MET  15  -3.037   7.670  -2.327
   95   2HB   MET  15          2HB       MET  15  -4.048   6.454  -3.098
   96   1HG   MET  15          1HG       MET  15  -4.821   5.721  -0.887
   97   2HG   MET  15          2HG       MET  15  -3.845   6.986  -0.143
   98   1HE   MET  15          1HE       MET  15  -5.865  10.081  -0.333
   99   2HE   MET  15          2HE       MET  15  -4.256   9.696  -0.943
  100   3HE   MET  15          3HE       MET  15  -4.792   9.042   0.604
  101    H    ASN  16           H        ASN  16  -3.616   3.744  -1.087
  102    HA   ASN  16           HA       ASN  16  -3.746   2.244  -3.599
  103   1HB   ASN  16          1HB       ASN  16  -1.858   1.692  -1.786
  104   2HB   ASN  16          2HB       ASN  16  -3.172   0.748  -1.118
  105   1HD2  ASN  16          1HD2      ASN  16  -1.301   1.327  -4.027
  106   2HD2  ASN  16          2HD2      ASN  16  -1.474  -0.262  -4.683
  107    H    GLN  17           H        GLN  17  -5.445   0.718  -3.723
  108    HA   GLN  17           HA       GLN  17  -7.828   1.466  -2.430
  109   1HB   GLN  17          1HB       GLN  17  -7.010  -0.678  -4.278
  110   2HB   GLN  17          2HB       GLN  17  -8.524  -0.896  -3.421
  111   1HG   GLN  17          1HG       GLN  17  -7.890   1.586  -4.984
  112   2HG   GLN  17          2HG       GLN  17  -8.635   0.166  -5.716
  113   1HE2  GLN  17          1HE2      GLN  17  -9.178   3.048  -4.116
  114   2HE2  GLN  17          2HE2      GLN  17 -10.843   2.818  -3.713
  115    HA   PRO  18           HA       PRO  18  -7.940  -0.986   1.232
  116   1HB   PRO  18          1HB       PRO  18 -10.519  -1.777   1.385
  117   2HB   PRO  18          2HB       PRO  18 -10.027  -0.097   1.619
  118   1HG   PRO  18          1HG       PRO  18 -11.170  -1.413  -0.814
  119   2HG   PRO  18          2HG       PRO  18 -11.569   0.162  -0.103
  120   1HD   PRO  18          1HD       PRO  18  -9.924  -0.117  -2.247
  121   2HD   PRO  18          2HD       PRO  18  -9.752   1.195  -1.065
  122    H    GLY  19           H        GLY  19  -8.488  -2.477  -1.779
  123   1HA   GLY  19          1HA       GLY  19  -8.534  -5.151  -0.529
  124   2HA   GLY  19          2HA       GLY  19  -9.108  -4.797  -2.151
  125    H    THR  20           H        THR  20  -6.562  -2.971  -2.203
  126    HA   THR  20           HA       THR  20  -4.849  -5.036  -3.348
  127    HB   THR  20           HB       THR  20  -3.539  -2.850  -3.986
  128    HG1  THR  20           HG1      THR  20  -4.593  -1.043  -3.728
  129   1HG2  THR  20          1HG2      THR  20  -6.164  -3.053  -5.356
  130   2HG2  THR  20          2HG2      THR  20  -5.029  -4.398  -5.447
  131   3HG2  THR  20          3HG2      THR  20  -4.554  -2.802  -6.028
  132    H    GLY  21           H        GLY  21  -4.657  -5.575  -0.835
  133   1HA   GLY  21          1HA       GLY  21  -3.176  -4.129   0.949
  134   2HA   GLY  21          2HA       GLY  21  -3.054  -5.872   0.802
  135    H    HIS  22           H        HIS  22  -2.024  -5.707  -1.950
  136    HA   HIS  22           HA       HIS  22   0.739  -5.480  -1.278
  137   1HB   HIS  22          1HB       HIS  22  -0.729  -6.046  -3.853
  138   2HB   HIS  22          2HB       HIS  22   1.023  -5.873  -3.806
  139    HD1  HIS  22           HD1      HIS  22  -1.571  -7.906  -1.884
  140    HD2  HIS  22           HD2      HIS  22   2.227  -8.266  -3.532
  141    HE1  HIS  22           HE1      HIS  22  -0.879 -10.287  -1.463
  142    HE2  HIS  22           HE2      HIS  22   1.386 -10.505  -2.544
  143    H    CYS  23           H        CYS  23   0.230  -4.169  -4.392
  144    HA   CYS  23           HA       CYS  23  -0.282  -1.513  -3.921
  145   1HB   CYS  23          1HB       CYS  23   2.160  -2.154  -2.761
  146   2HB   CYS  23          2HB       CYS  23   2.591  -1.395  -4.273
  147    H    GLU  24           H        GLU  24   0.130  -0.141  -5.718
  148    HA   GLU  24           HA       GLU  24   0.694  -1.643  -8.181
  149   1HB   GLU  24          1HB       GLU  24  -1.348   0.290  -7.445
  150   2HB   GLU  24          2HB       GLU  24  -0.488   0.782  -8.897
  151   1HG   GLU  24          1HG       GLU  24  -1.370  -2.032  -8.769
  152   2HG   GLU  24          2HG       GLU  24  -2.629  -0.807  -8.928
  153    H    MET  25           H        MET  25   2.614  -0.316  -6.308
  154    HA   MET  25           HA       MET  25   3.940   1.364  -8.317
  155   1HB   MET  25          1HB       MET  25   3.210   2.051  -5.534
  156   2HB   MET  25          2HB       MET  25   4.845   2.477  -6.018
  157   1HG   MET  25          1HG       MET  25   2.661   3.214  -7.869
  158   2HG   MET  25          2HG       MET  25   2.763   4.099  -6.347
  159   1HE   MET  25          1HE       MET  25   3.768   4.955  -9.925
  160   2HE   MET  25          2HE       MET  25   4.017   3.234  -9.644
  161   3HE   MET  25          3HE       MET  25   5.394   4.275  -9.983
  162    H    CYS  26           H        CYS  26   4.507  -0.122  -5.099
  163    HA   CYS  26           HA       CYS  26   7.222  -0.737  -5.868
  164   1HB   CYS  26          1HB       CYS  26   7.209  -1.815  -3.555
  165   2HB   CYS  26          2HB       CYS  26   7.055  -0.073  -3.627
  166    H    SER  27           H        SER  27   4.322  -2.564  -4.902
  167    HA   SER  27           HA       SER  27   3.550  -4.542  -5.888
  168   1HB   SER  27          1HB       SER  27   5.391  -4.293  -7.671
  169   2HB   SER  27          2HB       SER  27   6.368  -5.308  -6.609
  170    HG   SER  27           HG       SER  27   3.790  -6.028  -7.547
  171    H    LEU  28           H        LEU  28   4.350  -3.824  -3.320
  172    HA   LEU  28           HA       LEU  28   5.290  -6.368  -2.206
  173   1HB   LEU  28          1HB       LEU  28   5.934  -3.550  -1.680
  174   2HB   LEU  28          2HB       LEU  28   5.722  -4.535  -0.272
  175    HG   LEU  28           HG       LEU  28   7.652  -5.118  -2.506
  176   1HD1  LEU  28          1HD1      LEU  28   7.975  -3.733   0.129
  177   2HD1  LEU  28          2HD1      LEU  28   8.535  -3.234  -1.468
  178   3HD1  LEU  28          3HD1      LEU  28   9.324  -4.569  -0.640
  179   1HD2  LEU  28          1HD2      LEU  28   8.517  -6.863  -1.168
  180   2HD2  LEU  28          2HD2      LEU  28   6.770  -7.078  -1.183
  181   3HD2  LEU  28          3HD2      LEU  28   7.557  -6.372   0.226
  182    HA   PRO  29           HA       PRO  29   1.595  -6.483   0.219
  183   1HB   PRO  29          1HB       PRO  29   2.402  -7.422   2.603
  184   2HB   PRO  29          2HB       PRO  29   2.484  -8.406   1.136
  185   1HG   PRO  29          1HG       PRO  29   4.658  -6.911   2.543
  186   2HG   PRO  29          2HG       PRO  29   4.706  -8.516   1.790
  187   1HD   PRO  29          1HD       PRO  29   5.645  -6.209   0.605
  188   2HD   PRO  29          2HD       PRO  29   5.131  -7.651  -0.286
  189    H    ARG  30           H        ARG  30   0.396  -5.617   2.034
  190    HA   ARG  30           HA       ARG  30   1.087  -2.924   2.623
  191   1HB   ARG  30          1HB       ARG  30  -1.244  -4.356   2.554
  192   2HB   ARG  30          2HB       ARG  30  -1.005  -4.140   4.275
  193   1HG   ARG  30          1HG       ARG  30  -0.943  -1.753   4.028
  194   2HG   ARG  30          2HG       ARG  30  -1.003  -1.898   2.271
  195   1HD   ARG  30          1HD       ARG  30  -3.181  -1.328   3.452
  196   2HD   ARG  30          2HD       ARG  30  -3.224  -2.663   2.301
  197    HE   ARG  30           HE       ARG  30  -2.740  -3.485   5.013
  198   1HH1  ARG  30          1HH1      ARG  30  -5.189  -2.729   2.646
  199   2HH1  ARG  30          2HH1      ARG  30  -6.412  -3.677   3.424
  200   1HH2  ARG  30          1HH2      ARG  30  -4.346  -4.731   6.039
  201   2HH2  ARG  30          2HH2      ARG  30  -5.934  -4.813   5.351
  202    H    THR  31           H        THR  31   2.027  -5.790   3.970
  203    HA   THR  31           HA       THR  31   3.105  -4.416   6.291
  204    HB   THR  31           HB       THR  31   1.300  -6.829   6.420
  205    HG1  THR  31           HG1      THR  31  -0.031  -5.438   7.213
  206   1HG2  THR  31          1HG2      THR  31   1.789  -7.059   8.767
  207   2HG2  THR  31          2HG2      THR  31   2.979  -5.760   8.680
  208   3HG2  THR  31          3HG2      THR  31   3.266  -7.279   7.829
  Start of MODEL    5
    1   1H    GLY   1          1H        GLY   1 -15.763  -2.690  -5.667
    2   2H    GLY   1          2H        GLY   1 -16.685  -1.981  -6.895
    3   3H    GLY   1          3H        GLY   1 -16.631  -3.665  -6.743
    4   1HA   GLY   1          1HA       GLY   1 -18.721  -2.731  -5.900
    5   2HA   GLY   1          2HA       GLY   1 -17.808  -3.604  -4.679
    6    H    SER   2           H        SER   2 -18.049  -2.624  -2.788
    7    HA   SER   2           HA       SER   2 -18.198   0.303  -2.706
    8   1HB   SER   2          1HB       SER   2 -19.985  -1.117  -1.606
    9   2HB   SER   2          2HB       SER   2 -18.760  -1.613  -0.438
   10    HG   SER   2           HG       SER   2 -19.721   1.010  -0.925
   11    H    THR   3           H        THR   3 -16.262   1.228  -2.501
   12    HA   THR   3           HA       THR   3 -14.016  -0.045  -1.313
   13    HB   THR   3           HB       THR   3 -14.341   2.911  -1.837
   14    HG1  THR   3           HG1      THR   3 -14.052   2.549  -3.904
   15   1HG2  THR   3          1HG2      THR   3 -12.012   3.007  -2.099
   16   2HG2  THR   3          2HG2      THR   3 -11.861   1.249  -2.107
   17   3HG2  THR   3          3HG2      THR   3 -12.290   2.091  -0.618
   18    H    SER   4           H        SER   4 -13.407  -0.138   0.747
   19    HA   SER   4           HA       SER   4 -15.017   1.154   2.767
   20   1HB   SER   4          1HB       SER   4 -12.917  -0.956   2.724
   21   2HB   SER   4          2HB       SER   4 -13.119  -0.049   4.223
   22    HG   SER   4           HG       SER   4 -14.958  -1.021   4.556
   23    H    ALA   5           H        ALA   5 -11.475   0.869   2.606
   24    HA   ALA   5           HA       ALA   5 -11.114   3.726   2.679
   25   1HB   ALA   5          1HB       ALA   5 -10.308   2.111   5.094
   26   2HB   ALA   5          2HB       ALA   5 -11.660   3.241   5.027
   27   3HB   ALA   5          3HB       ALA   5 -10.009   3.829   4.835
   28    H    MET   6           H        MET   6  -9.324   4.180   1.581
   29    HA   MET   6           HA       MET   6  -7.551   2.117   0.723
   30   1HB   MET   6          1HB       MET   6  -7.612   5.101   0.380
   31   2HB   MET   6          2HB       MET   6  -6.275   4.143  -0.217
   32   1HG   MET   6          1HG       MET   6  -7.448   3.339  -1.948
   33   2HG   MET   6          2HG       MET   6  -8.923   3.168  -1.000
   34   1HE   MET   6          1HE       MET   6 -11.124   5.649  -2.124
   35   2HE   MET   6          2HE       MET   6 -10.487   5.996  -0.517
   36   3HE   MET   6          3HE       MET   6 -10.700   4.325  -1.039
   37    H    TRP   7           H        TRP   7  -5.066   2.812   0.785
   38    HA   TRP   7           HA       TRP   7  -4.361   3.706   3.475
   39   1HB   TRP   7          1HB       TRP   7  -2.726   1.835   3.709
   40   2HB   TRP   7          2HB       TRP   7  -4.408   1.340   3.773
   41    HD1  TRP   7           HD1      TRP   7  -5.360   0.046   1.523
   42    HE1  TRP   7           HE1      TRP   7  -4.112  -1.483  -0.140
   43    HE3  TRP   7           HE3      TRP   7  -0.552   1.445   2.577
   44    HZ2  TRP   7           HZ2      TRP   7  -1.453  -2.030  -0.881
   45    HZ3  TRP   7           HZ3      TRP   7   1.285   0.371   1.338
   46    HH2  TRP   7           HH2      TRP   7   0.847  -1.324  -0.364
   47    H    ALA   8           H        ALA   8  -2.068   4.146   3.743
   48    HA   ALA   8           HA       ALA   8  -0.892   5.136   1.228
   49   1HB   ALA   8          1HB       ALA   8  -1.472   6.887   2.850
   50   2HB   ALA   8          2HB       ALA   8   0.268   6.804   2.572
   51   3HB   ALA   8          3HB       ALA   8  -0.423   6.120   4.044
   52    H    CYS   9           H        CYS   9   0.762   3.974   0.516
   53    HA   CYS   9           HA       CYS   9   2.035   1.973   2.032
   54   1HB   CYS   9          1HB       CYS   9   1.776   2.060  -0.491
   55   2HB   CYS   9          2HB       CYS   9   3.108   3.213  -0.495
   56    H    GLN  10           H        GLN  10   4.348   1.809   2.454
   57    HA   GLN  10           HA       GLN  10   5.497   4.413   3.189
   58   1HB   GLN  10          1HB       GLN  10   6.605   3.284   5.072
   59   2HB   GLN  10          2HB       GLN  10   4.855   3.149   5.175
   60   1HG   GLN  10          1HG       GLN  10   6.321   0.951   3.837
   61   2HG   GLN  10          2HG       GLN  10   6.469   1.092   5.588
   62   1HE2  GLN  10          1HE2      GLN  10   4.673  -0.174   3.096
   63   2HE2  GLN  10          2HE2      GLN  10   3.231  -0.556   3.966
   64    H    HIS  11           H        HIS  11   5.850   3.095   0.667
   65    HA   HIS  11           HA       HIS  11   8.762   2.756   0.746
   66   1HB   HIS  11          1HB       HIS  11   7.212   0.561   0.492
   67   2HB   HIS  11          2HB       HIS  11   7.288   1.056  -1.196
   68    HD1  HIS  11           HD1      HIS  11   9.811   1.340  -2.157
   69    HD2  HIS  11           HD2      HIS  11   9.365  -0.849   1.346
   70    HE1  HIS  11           HE1      HIS  11  11.938   0.013  -1.920
   71    HE2  HIS  11           HE2      HIS  11  11.608  -1.368   0.162
   72    H    CYS  12           H        CYS  12   6.002   2.820  -1.502
   73    HA   CYS  12           HA       CYS  12   7.499   4.415  -3.388
   74   1HB   CYS  12          1HB       CYS  12   5.328   4.280  -4.660
   75   2HB   CYS  12          2HB       CYS  12   6.122   2.746  -4.378
   76    H    THR  13           H        THR  13   4.922   4.682  -1.068
   77    HA   THR  13           HA       THR  13   4.139   6.481   0.083
   78    HB   THR  13           HB       THR  13   6.453   7.504  -0.659
   79    HG1  THR  13           HG1      THR  13   5.979   9.057   0.716
   80   1HG2  THR  13          1HG2      THR  13   6.528   9.052  -2.250
   81   2HG2  THR  13          2HG2      THR  13   5.009   9.779  -1.728
   82   3HG2  THR  13          3HG2      THR  13   4.994   8.395  -2.819
   83    H    PHE  14           H        PHE  14   2.761   5.236  -2.010
   84    HA   PHE  14           HA       PHE  14   1.138   7.468  -3.019
   85   1HB   PHE  14          1HB       PHE  14   2.291   6.254  -4.822
   86   2HB   PHE  14          2HB       PHE  14   1.551   4.755  -4.286
   87    HD1  PHE  14           HD1      PHE  14  -0.268   4.032  -5.468
   88    HD2  PHE  14           HD2      PHE  14   0.494   8.211  -5.221
   89    HE1  PHE  14           HE1      PHE  14  -2.199   4.466  -6.928
   90    HE2  PHE  14           HE2      PHE  14  -1.436   8.653  -6.681
   91    HZ   PHE  14           HZ       PHE  14  -2.786   6.779  -7.537
   92    H    MET  15           H        MET  15  -1.148   6.825  -3.409
   93    HA   MET  15           HA       MET  15  -2.154   5.449  -1.055
   94   1HB   MET  15          1HB       MET  15  -3.144   7.611  -1.811
   95   2HB   MET  15          2HB       MET  15  -3.685   6.816  -3.283
   96   1HG   MET  15          1HG       MET  15  -5.158   5.391  -2.050
   97   2HG   MET  15          2HG       MET  15  -4.514   5.977  -0.517
   98   1HE   MET  15          1HE       MET  15  -6.284   9.035   0.325
   99   2HE   MET  15          2HE       MET  15  -4.712   9.251  -0.445
  100   3HE   MET  15          3HE       MET  15  -4.991   7.873   0.620
  101    H    ASN  16           H        ASN  16  -3.617   3.736  -1.112
  102    HA   ASN  16           HA       ASN  16  -3.728   2.231  -3.621
  103   1HB   ASN  16          1HB       ASN  16  -1.857   1.685  -1.783
  104   2HB   ASN  16          2HB       ASN  16  -3.177   0.736  -1.136
  105   1HD2  ASN  16          1HD2      ASN  16  -1.323   1.350  -4.056
  106   2HD2  ASN  16          2HD2      ASN  16  -1.461  -0.245  -4.704
  107    H    GLN  17           H        GLN  17  -5.418   0.675  -3.734
  108    HA   GLN  17           HA       GLN  17  -7.813   1.446  -2.469
  109   1HB   GLN  17          1HB       GLN  17  -6.988  -0.722  -4.287
  110   2HB   GLN  17          2HB       GLN  17  -8.510  -0.922  -3.441
  111   1HG   GLN  17          1HG       GLN  17  -7.852   1.541  -5.024
  112   2HG   GLN  17          2HG       GLN  17  -8.591   0.116  -5.752
  113   1HE2  GLN  17          1HE2      GLN  17  -9.140   3.004  -4.144
  114   2HE2  GLN  17          2HE2      GLN  17 -10.812   2.782  -3.775
  115    HA   PRO  18           HA       PRO  18  -7.951  -0.955   1.224
  116   1HB   PRO  18          1HB       PRO  18 -10.531  -1.756   1.357
  117   2HB   PRO  18          2HB       PRO  18 -10.044  -0.073   1.589
  118   1HG   PRO  18          1HG       PRO  18 -11.161  -1.401  -0.850
  119   2HG   PRO  18          2HG       PRO  18 -11.569   0.177  -0.149
  120   1HD   PRO  18          1HD       PRO  18  -9.907  -0.100  -2.274
  121   2HD   PRO  18          2HD       PRO  18  -9.738   1.208  -1.088
  122    H    GLY  19           H        GLY  19  -8.489  -2.477  -1.776
  123   1HA   GLY  19          1HA       GLY  19  -8.505  -5.140  -0.497
  124   2HA   GLY  19          2HA       GLY  19  -9.103  -4.808  -2.116
  125    H    THR  20           H        THR  20  -6.559  -2.958  -2.179
  126    HA   THR  20           HA       THR  20  -4.852  -5.009  -3.357
  127    HB   THR  20           HB       THR  20  -3.549  -2.838  -4.007
  128    HG1  THR  20           HG1      THR  20  -4.607  -1.335  -2.803
  129   1HG2  THR  20          1HG2      THR  20  -6.123  -2.747  -5.385
  130   2HG2  THR  20          2HG2      THR  20  -5.347  -4.330  -5.350
  131   3HG2  THR  20          3HG2      THR  20  -4.492  -2.942  -6.024
  132    H    GLY  21           H        GLY  21  -4.680  -5.533  -0.817
  133   1HA   GLY  21          1HA       GLY  21  -3.177  -4.116   0.958
  134   2HA   GLY  21          2HA       GLY  21  -3.060  -5.857   0.800
  135    H    HIS  22           H        HIS  22  -2.028  -5.681  -1.951
  136    HA   HIS  22           HA       HIS  22   0.735  -5.459  -1.274
  137   1HB   HIS  22          1HB       HIS  22  -0.724  -6.013  -3.856
  138   2HB   HIS  22          2HB       HIS  22   1.028  -5.857  -3.796
  139    HD1  HIS  22           HD1      HIS  22  -1.592  -7.864  -1.883
  140    HD2  HIS  22           HD2      HIS  22   2.200  -8.268  -3.535
  141    HE1  HIS  22           HE1      HIS  22  -0.927 -10.254  -1.465
  142    HE2  HIS  22           HE2      HIS  22   1.406 -10.450  -2.398
  143    H    CYS  23           H        CYS  23   0.229  -4.145  -4.386
  144    HA   CYS  23           HA       CYS  23  -0.274  -1.488  -3.911
  145   1HB   CYS  23          1HB       CYS  23   2.173  -2.137  -2.763
  146   2HB   CYS  23          2HB       CYS  23   2.599  -1.381  -4.278
  147    H    GLU  24           H        GLU  24   0.141  -0.116  -5.711
  148    HA   GLU  24           HA       GLU  24   0.675  -1.623  -8.176
  149   1HB   GLU  24          1HB       GLU  24  -1.338   0.334  -7.429
  150   2HB   GLU  24          2HB       GLU  24  -0.483   0.815  -8.886
  151   1HG   GLU  24          1HG       GLU  24  -1.415  -0.802 -10.124
  152   2HG   GLU  24          2HG       GLU  24  -1.320  -1.993  -8.827
  153    H    MET  25           H        MET  25   2.621  -0.321  -6.315
  154    HA   MET  25           HA       MET  25   3.956   1.343  -8.331
  155   1HB   MET  25          1HB       MET  25   2.949   2.259  -5.849
  156   2HB   MET  25          2HB       MET  25   4.698   2.186  -5.687
  157   1HG   MET  25          1HG       MET  25   3.458   3.490  -8.069
  158   2HG   MET  25          2HG       MET  25   3.585   4.354  -6.538
  159   1HE   MET  25          1HE       MET  25   6.874   3.259  -9.468
  160   2HE   MET  25          2HE       MET  25   5.422   4.176  -9.871
  161   3HE   MET  25          3HE       MET  25   5.287   2.505  -9.334
  162    H    CYS  26           H        CYS  26   4.537  -0.117  -5.103
  163    HA   CYS  26           HA       CYS  26   7.237  -0.770  -5.885
  164   1HB   CYS  26          1HB       CYS  26   7.206  -1.863  -3.569
  165   2HB   CYS  26          2HB       CYS  26   7.103  -0.116  -3.644
  166    H    SER  27           H        SER  27   4.331  -2.575  -4.897
  167    HA   SER  27           HA       SER  27   3.534  -4.544  -5.886
  168   1HB   SER  27          1HB       SER  27   5.367  -4.313  -7.677
  169   2HB   SER  27          2HB       SER  27   6.343  -5.333  -6.619
  170    HG   SER  27           HG       SER  27   3.989  -5.952  -8.022
  171    H    LEU  28           H        LEU  28   4.353  -3.835  -3.319
  172    HA   LEU  28           HA       LEU  28   5.277  -6.388  -2.213
  173   1HB   LEU  28          1HB       LEU  28   5.941  -3.576  -1.681
  174   2HB   LEU  28          2HB       LEU  28   5.724  -4.563  -0.275
  175    HG   LEU  28           HG       LEU  28   7.642  -5.152  -2.515
  176   1HD1  LEU  28          1HD1      LEU  28   8.717  -3.401  -1.553
  177   2HD1  LEU  28          2HD1      LEU  28   9.239  -4.667  -0.445
  178   3HD1  LEU  28          3HD1      LEU  28   7.899  -3.608  -0.002
  179   1HD2  LEU  28          1HD2      LEU  28   7.550  -6.413   0.217
  180   2HD2  LEU  28          2HD2      LEU  28   8.504  -6.908  -1.180
  181   3HD2  LEU  28          3HD2      LEU  28   6.755  -7.112  -1.193
  182    HA   PRO  29           HA       PRO  29   1.584  -6.483   0.218
  183   1HB   PRO  29          1HB       PRO  29   2.389  -7.429   2.602
  184   2HB   PRO  29          2HB       PRO  29   2.463  -8.413   1.135
  185   1HG   PRO  29          1HG       PRO  29   4.649  -6.934   2.536
  186   2HG   PRO  29          2HG       PRO  29   4.684  -8.538   1.782
  187   1HD   PRO  29          1HD       PRO  29   5.638  -6.236   0.599
  188   2HD   PRO  29          2HD       PRO  29   5.110  -7.674  -0.293
  189    H    ARG  30           H        ARG  30   0.394  -5.615   2.039
  190    HA   ARG  30           HA       ARG  30   1.097  -2.927   2.626
  191   1HB   ARG  30          1HB       ARG  30  -1.239  -4.354   2.565
  192   2HB   ARG  30          2HB       ARG  30  -0.993  -4.132   4.286
  193   1HG   ARG  30          1HG       ARG  30  -0.912  -1.741   4.021
  194   2HG   ARG  30          2HG       ARG  30  -1.007  -1.903   2.267
  195   1HD   ARG  30          1HD       ARG  30  -3.161  -1.312   3.470
  196   2HD   ARG  30          2HD       ARG  30  -3.229  -2.675   2.353
  197    HE   ARG  30           HE       ARG  30  -2.691  -3.434   5.073
  198   1HH1  ARG  30          1HH1      ARG  30  -5.190  -2.719   2.744
  199   2HH1  ARG  30          2HH1      ARG  30  -6.399  -3.642   3.572
  200   1HH2  ARG  30          1HH2      ARG  30  -4.279  -4.647   6.163
  201   2HH2  ARG  30          2HH2      ARG  30  -5.883  -4.736   5.514
  202    H    THR  31           H        THR  31   2.034  -5.794   3.970
  203    HA   THR  31           HA       THR  31   3.122  -4.424   6.288
  204    HB   THR  31           HB       THR  31   1.312  -6.832   6.421
  205    HG1  THR  31           HG1      THR  31   1.294  -4.414   7.895
  206   1HG2  THR  31          1HG2      THR  31   3.236  -7.333   7.829
  207   2HG2  THR  31          2HG2      THR  31   1.798  -7.010   8.797
  208   3HG2  THR  31          3HG2      THR  31   3.051  -5.780   8.642
  Start of MODEL    6
    1   1H    GLY   1          1H        GLY   1 -18.225  -1.792  -6.884
    2   2H    GLY   1          2H        GLY   1 -16.575  -1.424  -6.842
    3   3H    GLY   1          3H        GLY   1 -17.497  -1.021  -8.201
    4   1HA   GLY   1          1HA       GLY   1 -17.077   0.946  -6.889
    5   2HA   GLY   1          2HA       GLY   1 -18.789   0.552  -6.905
    6    H    SER   2           H        SER   2 -18.158   2.161  -4.960
    7    HA   SER   2           HA       SER   2 -18.223   2.478  -2.709
    8   1HB   SER   2          1HB       SER   2 -19.935   0.439  -3.169
    9   2HB   SER   2          2HB       SER   2 -18.795  -0.363  -2.090
   10    HG   SER   2           HG       SER   2 -20.394   1.911  -1.602
   11    H    THR   3           H        THR   3 -16.205   2.902  -2.034
   12    HA   THR   3           HA       THR   3 -14.389   0.642  -1.546
   13    HB   THR   3           HB       THR   3 -13.702   3.581  -1.710
   14    HG1  THR   3           HG1      THR   3 -13.092   3.188  -3.792
   15   1HG2  THR   3          1HG2      THR   3 -12.093   2.096  -0.490
   16   2HG2  THR   3          2HG2      THR   3 -11.440   2.936  -1.896
   17   3HG2  THR   3          3HG2      THR   3 -11.864   1.228  -2.008
   18    H    SER   4           H        SER   4 -13.735   0.153   0.466
   19    HA   SER   4           HA       SER   4 -15.068   1.295   2.696
   20   1HB   SER   4          1HB       SER   4 -12.766  -0.653   2.491
   21   2HB   SER   4          2HB       SER   4 -13.491  -0.174   4.026
   22    HG   SER   4           HG       SER   4 -14.487  -2.046   3.320
   23    H    ALA   5           H        ALA   5 -11.544   0.931   2.477
   24    HA   ALA   5           HA       ALA   5 -11.083   3.754   2.815
   25   1HB   ALA   5          1HB       ALA   5 -10.440   1.879   5.087
   26   2HB   ALA   5          2HB       ALA   5 -11.658   3.154   5.100
   27   3HB   ALA   5          3HB       ALA   5  -9.947   3.569   4.980
   28    H    MET   6           H        MET   6  -9.346   4.169   1.633
   29    HA   MET   6           HA       MET   6  -7.580   2.110   0.751
   30   1HB   MET   6          1HB       MET   6  -7.646   5.096   0.423
   31   2HB   MET   6          2HB       MET   6  -6.306   4.144  -0.180
   32   1HG   MET   6          1HG       MET   6  -7.471   3.361  -1.920
   33   2HG   MET   6          2HG       MET   6  -8.939   3.147  -0.970
   34   1HE   MET   6          1HE       MET   6  -9.645   5.893   0.204
   35   2HE   MET   6          2HE       MET   6 -10.810   4.917  -0.688
   36   3HE   MET   6          3HE       MET   6 -10.612   6.625  -1.076
   37    H    TRP   7           H        TRP   7  -5.099   2.799   0.808
   38    HA   TRP   7           HA       TRP   7  -4.377   3.681   3.496
   39   1HB   TRP   7          1HB       TRP   7  -2.749   1.807   3.721
   40   2HB   TRP   7          2HB       TRP   7  -4.430   1.308   3.773
   41    HD1  TRP   7           HD1      TRP   7  -5.371   0.040   1.499
   42    HE1  TRP   7           HE1      TRP   7  -4.110  -1.472  -0.172
   43    HE3  TRP   7           HE3      TRP   7  -0.572   1.423   2.610
   44    HZ2  TRP   7           HZ2      TRP   7  -1.443  -2.013  -0.895
   45    HZ3  TRP   7           HZ3      TRP   7   1.276   0.362   1.376
   46    HH2  TRP   7           HH2      TRP   7   0.853  -1.312  -0.349
   47    H    ALA   8           H        ALA   8  -2.074   4.105   3.750
   48    HA   ALA   8           HA       ALA   8  -0.913   5.103   1.230
   49   1HB   ALA   8          1HB       ALA   8  -0.417   6.097   4.038
   50   2HB   ALA   8          2HB       ALA   8  -1.503   6.847   2.868
   51   3HB   ALA   8          3HB       ALA   8   0.231   6.789   2.550
   52    H    CYS   9           H        CYS   9   0.765   3.973   0.517
   53    HA   CYS   9           HA       CYS   9   2.039   1.967   2.028
   54   1HB   CYS   9          1HB       CYS   9   1.785   2.087  -0.502
   55   2HB   CYS   9          2HB       CYS   9   3.137   3.217  -0.481
   56    H    GLN  10           H        GLN  10   4.367   1.816   2.429
   57    HA   GLN  10           HA       GLN  10   5.497   4.421   3.189
   58   1HB   GLN  10          1HB       GLN  10   6.172   1.859   4.610
   59   2HB   GLN  10          2HB       GLN  10   6.381   3.513   5.169
   60   1HG   GLN  10          1HG       GLN  10   4.525   3.176   6.344
   61   2HG   GLN  10          2HG       GLN  10   3.671   3.346   4.812
   62   1HE2  GLN  10          1HE2      GLN  10   2.910   1.513   3.762
   63   2HE2  GLN  10          2HE2      GLN  10   2.769  -0.014   4.558
   64    H    HIS  11           H        HIS  11   5.859   3.084   0.667
   65    HA   HIS  11           HA       HIS  11   8.773   2.768   0.754
   66   1HB   HIS  11          1HB       HIS  11   7.347   0.541   0.565
   67   2HB   HIS  11          2HB       HIS  11   7.210   1.036  -1.118
   68    HD1  HIS  11           HD1      HIS  11   9.204  -1.028   0.917
   69    HD2  HIS  11           HD2      HIS  11  10.032   1.678  -2.126
   70    HE1  HIS  11           HE1      HIS  11  11.490  -1.645   0.075
   71    HE2  HIS  11           HE2      HIS  11  11.934  -0.049  -1.823
   72    H    CYS  12           H        CYS  12   6.017   2.806  -1.496
   73    HA   CYS  12           HA       CYS  12   7.509   4.396  -3.391
   74   1HB   CYS  12          1HB       CYS  12   5.343   4.250  -4.666
   75   2HB   CYS  12          2HB       CYS  12   6.133   2.717  -4.367
   76    H    THR  13           H        THR  13   4.938   4.671  -1.067
   77    HA   THR  13           HA       THR  13   4.148   6.470   0.076
   78    HB   THR  13           HB       THR  13   6.465   7.490  -0.661
   79    HG1  THR  13           HG1      THR  13   5.941   9.220   0.577
   80   1HG2  THR  13          1HG2      THR  13   5.039   9.768  -1.739
   81   2HG2  THR  13          2HG2      THR  13   5.011   8.381  -2.827
   82   3HG2  THR  13          3HG2      THR  13   6.551   9.026  -2.260
   83    H    PHE  14           H        PHE  14   2.771   5.225  -2.012
   84    HA   PHE  14           HA       PHE  14   1.159   7.457  -3.037
   85   1HB   PHE  14          1HB       PHE  14   2.306   6.222  -4.830
   86   2HB   PHE  14          2HB       PHE  14   1.553   4.733  -4.284
   87    HD1  PHE  14           HD1      PHE  14   0.522   8.193  -5.237
   88    HD2  PHE  14           HD2      PHE  14  -0.265   4.017  -5.471
   89    HE1  PHE  14           HE1      PHE  14  -1.403   8.641  -6.701
   90    HE2  PHE  14           HE2      PHE  14  -2.192   4.457  -6.936
   91    HZ   PHE  14           HZ       PHE  14  -2.763   6.772  -7.553
   92    H    MET  15           H        MET  15  -1.128   6.829  -3.419
   93    HA   MET  15           HA       MET  15  -2.145   5.472  -1.061
   94   1HB   MET  15          1HB       MET  15  -3.139   7.622  -1.787
   95   2HB   MET  15          2HB       MET  15  -3.635   6.872  -3.297
   96   1HG   MET  15          1HG       MET  15  -5.304   5.652  -2.307
   97   2HG   MET  15          2HG       MET  15  -4.525   5.668  -0.726
   98   1HE   MET  15          1HE       MET  15  -5.111   8.820  -3.064
   99   2HE   MET  15          2HE       MET  15  -6.737   9.278  -2.559
  100   3HE   MET  15          3HE       MET  15  -6.470   7.742  -3.385
  101    H    ASN  16           H        ASN  16  -3.614   3.762  -1.110
  102    HA   ASN  16           HA       ASN  16  -3.733   2.252  -3.617
  103   1HB   ASN  16          1HB       ASN  16  -1.856   1.701  -1.795
  104   2HB   ASN  16          2HB       ASN  16  -3.177   0.766  -1.126
  105   1HD2  ASN  16          1HD2      ASN  16  -1.304   1.325  -4.039
  106   2HD2  ASN  16          2HD2      ASN  16  -1.477  -0.268  -4.683
  107    H    GLN  17           H        GLN  17  -5.422   0.697  -3.726
  108    HA   GLN  17           HA       GLN  17  -7.817   1.473  -2.462
  109   1HB   GLN  17          1HB       GLN  17  -6.996  -0.689  -4.287
  110   2HB   GLN  17          2HB       GLN  17  -8.516  -0.893  -3.439
  111   1HG   GLN  17          1HG       GLN  17  -7.864   1.578  -5.010
  112   2HG   GLN  17          2HG       GLN  17  -8.596   0.155  -5.748
  113   1HE2  GLN  17          1HE2      GLN  17  -9.176   3.046  -4.192
  114   2HE2  GLN  17          2HE2      GLN  17 -10.843   2.809  -3.801
  115    HA   PRO  18           HA       PRO  18  -7.959  -0.944   1.221
  116   1HB   PRO  18          1HB       PRO  18 -10.539  -1.737   1.358
  117   2HB   PRO  18          2HB       PRO  18 -10.049  -0.055   1.588
  118   1HG   PRO  18          1HG       PRO  18 -11.171  -1.383  -0.849
  119   2HG   PRO  18          2HG       PRO  18 -11.577   0.195  -0.149
  120   1HD   PRO  18          1HD       PRO  18  -9.916  -0.088  -2.275
  121   2HD   PRO  18          2HD       PRO  18  -9.748   1.225  -1.093
  122    H    GLY  19           H        GLY  19  -8.476  -2.456  -1.782
  123   1HA   GLY  19          1HA       GLY  19  -8.525  -5.121  -0.512
  124   2HA   GLY  19          2HA       GLY  19  -9.099  -4.780  -2.138
  125    H    THR  20           H        THR  20  -6.558  -2.951  -2.208
  126    HA   THR  20           HA       THR  20  -4.841  -5.025  -3.334
  127    HB   THR  20           HB       THR  20  -3.530  -2.847  -3.987
  128    HG1  THR  20           HG1      THR  20  -4.696  -1.370  -2.807
  129   1HG2  THR  20          1HG2      THR  20  -4.403  -3.023  -6.029
  130   2HG2  THR  20          2HG2      THR  20  -6.059  -2.837  -5.450
  131   3HG2  THR  20          3HG2      THR  20  -5.258  -4.406  -5.348
  132    H    GLY  21           H        GLY  21  -4.675  -5.517  -0.795
  133   1HA   GLY  21          1HA       GLY  21  -3.189  -4.064   0.968
  134   2HA   GLY  21          2HA       GLY  21  -3.068  -5.807   0.841
  135    H    HIS  22           H        HIS  22  -2.021  -5.685  -1.905
  136    HA   HIS  22           HA       HIS  22   0.738  -5.450  -1.221
  137   1HB   HIS  22          1HB       HIS  22  -0.719  -6.050  -3.791
  138   2HB   HIS  22          2HB       HIS  22   1.032  -5.865  -3.748
  139    HD1  HIS  22           HD1      HIS  22  -1.471  -7.843  -1.653
  140    HD2  HIS  22           HD2      HIS  22   2.175  -8.296  -3.595
  141    HE1  HIS  22           HE1      HIS  22  -0.781 -10.226  -1.240
  142    HE2  HIS  22           HE2      HIS  22   1.385 -10.502  -2.498
  143    H    CYS  23           H        CYS  23   0.242  -4.171  -4.352
  144    HA   CYS  23           HA       CYS  23  -0.263  -1.511  -3.915
  145   1HB   CYS  23          1HB       CYS  23   2.172  -2.139  -2.737
  146   2HB   CYS  23          2HB       CYS  23   2.612  -1.404  -4.259
  147    H    GLU  24           H        GLU  24   0.102  -0.181  -5.734
  148    HA   GLU  24           HA       GLU  24   0.702  -1.707  -8.172
  149   1HB   GLU  24          1HB       GLU  24  -1.361   0.215  -7.468
  150   2HB   GLU  24          2HB       GLU  24  -0.503   0.698  -8.924
  151   1HG   GLU  24          1HG       GLU  24  -1.673  -2.042  -8.542
  152   2HG   GLU  24          2HG       GLU  24  -2.557  -0.702  -9.269
  153    H    MET  25           H        MET  25   2.608  -0.350  -6.317
  154    HA   MET  25           HA       MET  25   3.918   1.329  -8.334
  155   1HB   MET  25          1HB       MET  25   2.900   2.218  -5.837
  156   2HB   MET  25          2HB       MET  25   4.653   2.210  -5.711
  157   1HG   MET  25          1HG       MET  25   4.438   4.272  -6.568
  158   2HG   MET  25          2HG       MET  25   4.393   3.393  -8.095
  159   1HE   MET  25          1HE       MET  25   2.271   6.589  -7.871
  160   2HE   MET  25          2HE       MET  25   2.284   5.689  -9.387
  161   3HE   MET  25          3HE       MET  25   3.759   5.826  -8.429
  162    H    CYS  26           H        CYS  26   4.509  -0.120  -5.106
  163    HA   CYS  26           HA       CYS  26   7.223  -0.726  -5.877
  164   1HB   CYS  26          1HB       CYS  26   7.226  -1.787  -3.559
  165   2HB   CYS  26          2HB       CYS  26   7.044  -0.048  -3.639
  166    H    SER  27           H        SER  27   4.327  -2.564  -4.926
  167    HA   SER  27           HA       SER  27   3.576  -4.558  -5.885
  168   1HB   SER  27          1HB       SER  27   5.409  -4.292  -7.678
  169   2HB   SER  27          2HB       SER  27   6.396  -5.300  -6.621
  170    HG   SER  27           HG       SER  27   4.040  -5.948  -8.012
  171    H    LEU  28           H        LEU  28   4.372  -3.824  -3.329
  172    HA   LEU  28           HA       LEU  28   5.378  -6.340  -2.204
  173   1HB   LEU  28          1HB       LEU  28   5.927  -3.501  -1.689
  174   2HB   LEU  28          2HB       LEU  28   5.730  -4.477  -0.273
  175    HG   LEU  28           HG       LEU  28   7.703  -5.004  -2.481
  176   1HD1  LEU  28          1HD1      LEU  28   8.696  -3.224  -1.494
  177   2HD1  LEU  28          2HD1      LEU  28   9.245  -4.475  -0.371
  178   3HD1  LEU  28          3HD1      LEU  28   7.856  -3.460   0.039
  179   1HD2  LEU  28          1HD2      LEU  28   8.588  -6.747  -1.165
  180   2HD2  LEU  28          2HD2      LEU  28   6.840  -6.992  -1.163
  181   3HD2  LEU  28          3HD2      LEU  28   7.637  -6.279   0.242
  182    HA   PRO  29           HA       PRO  29   1.688  -6.599   0.216
  183   1HB   PRO  29          1HB       PRO  29   2.522  -7.334   2.671
  184   2HB   PRO  29          2HB       PRO  29   2.666  -8.403   1.270
  185   1HG   PRO  29          1HG       PRO  29   4.748  -6.707   2.582
  186   2HG   PRO  29          2HG       PRO  29   4.885  -8.351   1.934
  187   1HD   PRO  29          1HD       PRO  29   5.720  -6.095   0.606
  188   2HD   PRO  29          2HD       PRO  29   5.253  -7.602  -0.200
  189    H    ARG  30           H        ARG  30   0.437  -5.760   2.049
  190    HA   ARG  30           HA       ARG  30   0.878  -2.981   2.430
  191   1HB   ARG  30          1HB       ARG  30  -1.296  -4.665   2.541
  192   2HB   ARG  30          2HB       ARG  30  -1.056  -4.230   4.222
  193   1HG   ARG  30          1HG       ARG  30  -0.837  -1.820   2.890
  194   2HG   ARG  30          2HG       ARG  30  -2.129  -2.665   2.036
  195   1HD   ARG  30          1HD       ARG  30  -2.638  -3.125   4.736
  196   2HD   ARG  30          2HD       ARG  30  -2.139  -1.435   4.654
  197    HE   ARG  30           HE       ARG  30  -4.082  -2.146   2.665
  198   1HH1  ARG  30          1HH1      ARG  30  -3.633  -1.123   5.971
  199   2HH1  ARG  30          2HH1      ARG  30  -5.211  -0.421   6.099
  200   1HH2  ARG  30          1HH2      ARG  30  -6.158  -1.224   2.832
  201   2HH2  ARG  30          2HH2      ARG  30  -6.645  -0.478   4.317
  202    H    THR  31           H        THR  31   2.149  -5.625   3.937
  203    HA   THR  31           HA       THR  31   3.100  -3.992   6.143
  204    HB   THR  31           HB       THR  31   1.589  -6.582   6.467
  205    HG1  THR  31           HG1      THR  31   0.131  -5.346   7.326
  206   1HG2  THR  31          1HG2      THR  31   2.113  -6.514   8.849
  207   2HG2  THR  31          2HG2      THR  31   3.230  -5.179   8.567
  208   3HG2  THR  31          3HG2      THR  31   3.560  -6.767   7.873
  Start of MODEL    7
    1   1H    GLY   1          1H        GLY   1 -17.340   6.504  -7.644
    2   2H    GLY   1          2H        GLY   1 -16.325   6.722  -6.308
    3   3H    GLY   1          3H        GLY   1 -17.988   6.989  -6.158
    4   1HA   GLY   1          1HA       GLY   1 -18.355   4.600  -6.708
    5   2HA   GLY   1          2HA       GLY   1 -16.615   4.396  -6.583
    6    H    SER   2           H        SER   2 -16.157   6.138  -4.404
    7    HA   SER   2           HA       SER   2 -16.072   6.114  -2.131
    8   1HB   SER   2          1HB       SER   2 -18.685   6.456  -2.720
    9   2HB   SER   2          2HB       SER   2 -18.778   4.948  -1.810
   10    HG   SER   2           HG       SER   2 -17.440   6.126  -0.202
   11    H    THR   3           H        THR   3 -14.539   4.511  -1.882
   12    HA   THR   3           HA       THR   3 -15.413   1.736  -1.714
   13    HB   THR   3           HB       THR   3 -13.330   2.310  -2.930
   14    HG1  THR   3           HG1      THR   3 -13.521   0.251  -1.995
   15   1HG2  THR   3          1HG2      THR   3 -12.372   3.175  -0.221
   16   2HG2  THR   3          2HG2      THR   3 -12.401   4.111  -1.716
   17   3HG2  THR   3          3HG2      THR   3 -11.291   2.751  -1.547
   18    H    SER   4           H        SER   4 -13.693   0.696   0.149
   19    HA   SER   4           HA       SER   4 -15.034   1.367   2.586
   20   1HB   SER   4          1HB       SER   4 -13.090  -0.690   1.698
   21   2HB   SER   4          2HB       SER   4 -13.080  -0.296   3.417
   22    HG   SER   4           HG       SER   4 -15.290  -1.174   1.868
   23    H    ALA   5           H        ALA   5 -11.526   0.961   2.265
   24    HA   ALA   5           HA       ALA   5 -10.979   3.664   3.092
   25   1HB   ALA   5          1HB       ALA   5 -11.297   3.135   5.280
   26   2HB   ALA   5          2HB       ALA   5  -9.620   2.613   5.116
   27   3HB   ALA   5          3HB       ALA   5 -10.924   1.428   5.038
   28    H    MET   6           H        MET   6  -9.373   4.116   1.728
   29    HA   MET   6           HA       MET   6  -7.570   2.151   0.729
   30   1HB   MET   6          1HB       MET   6  -7.580   5.161   0.564
   31   2HB   MET   6          2HB       MET   6  -6.431   4.147  -0.277
   32   1HG   MET   6          1HG       MET   6  -7.890   4.285  -1.963
   33   2HG   MET   6          2HG       MET   6  -8.748   3.024  -1.079
   34   1HE   MET   6          1HE       MET   6  -9.736   7.501  -0.691
   35   2HE   MET   6          2HE       MET   6  -8.849   6.924  -2.102
   36   3HE   MET   6          3HE       MET   6  -8.148   6.761  -0.492
   37    H    TRP   7           H        TRP   7  -5.120   2.749   0.785
   38    HA   TRP   7           HA       TRP   7  -4.349   3.648   3.458
   39   1HB   TRP   7          1HB       TRP   7  -2.738   1.772   3.673
   40   2HB   TRP   7          2HB       TRP   7  -4.417   1.270   3.717
   41    HD1  TRP   7           HD1      TRP   7  -5.344   0.031   1.400
   42    HE1  TRP   7           HE1      TRP   7  -4.063  -1.498  -0.245
   43    HE3  TRP   7           HE3      TRP   7  -0.554   1.356   2.616
   44    HZ2  TRP   7           HZ2      TRP   7  -1.391  -2.069  -0.908
   45    HZ3  TRP   7           HZ3      TRP   7   1.307   0.275   1.422
   46    HH2  TRP   7           HH2      TRP   7   0.902  -1.396  -0.313
   47    H    ALA   8           H        ALA   8  -2.072   4.089   3.696
   48    HA   ALA   8           HA       ALA   8  -0.906   5.070   1.172
   49   1HB   ALA   8          1HB       ALA   8  -1.539   6.818   2.808
   50   2HB   ALA   8          2HB       ALA   8   0.188   6.800   2.452
   51   3HB   ALA   8          3HB       ALA   8  -0.408   6.109   3.961
   52    H    CYS   9           H        CYS   9   0.776   3.937   0.486
   53    HA   CYS   9           HA       CYS   9   2.069   1.971   2.036
   54   1HB   CYS   9          1HB       CYS   9   1.821   2.056  -0.496
   55   2HB   CYS   9          2HB       CYS   9   3.165   3.195  -0.486
   56    H    GLN  10           H        GLN  10   4.421   1.857   2.411
   57    HA   GLN  10           HA       GLN  10   5.502   4.487   3.154
   58   1HB   GLN  10          1HB       GLN  10   6.225   1.942   4.585
   59   2HB   GLN  10          2HB       GLN  10   6.420   3.601   5.133
   60   1HG   GLN  10          1HG       GLN  10   4.576   3.257   6.323
   61   2HG   GLN  10          2HG       GLN  10   3.709   3.402   4.795
   62   1HE2  GLN  10          1HE2      GLN  10   2.968   1.546   3.765
   63   2HE2  GLN  10          2HE2      GLN  10   2.849   0.027   4.578
   64    H    HIS  11           H        HIS  11   5.878   3.126   0.637
   65    HA   HIS  11           HA       HIS  11   8.800   2.891   0.709
   66   1HB   HIS  11          1HB       HIS  11   7.659   0.598   0.639
   67   2HB   HIS  11          2HB       HIS  11   7.105   1.041  -0.972
   68    HD1  HIS  11           HD1      HIS  11   8.918   1.227  -2.836
   69    HD2  HIS  11           HD2      HIS  11  10.332  -0.115   0.829
   70    HE1  HIS  11           HE1      HIS  11  11.194   0.289  -3.306
   71    HE2  HIS  11           HE2      HIS  11  12.070  -0.440  -1.058
   72    H    CYS  12           H        CYS  12   6.039   2.788  -1.530
   73    HA   CYS  12           HA       CYS  12   7.452   4.404  -3.460
   74   1HB   CYS  12          1HB       CYS  12   5.308   4.147  -4.725
   75   2HB   CYS  12          2HB       CYS  12   6.116   2.637  -4.364
   76    H    THR  13           H        THR  13   5.058   4.675  -0.991
   77    HA   THR  13           HA       THR  13   4.151   6.439   0.067
   78    HB   THR  13           HB       THR  13   5.169   8.480   0.009
   79    HG1  THR  13           HG1      THR  13   5.514   9.574  -1.756
   80   1HG2  THR  13          1HG2      THR  13   6.903   6.517   0.041
   81   2HG2  THR  13          2HG2      THR  13   7.421   8.202   0.003
   82   3HG2  THR  13          3HG2      THR  13   7.411   7.249  -1.481
   83    H    PHE  14           H        PHE  14   2.736   5.187  -1.924
   84    HA   PHE  14           HA       PHE  14   1.194   7.411  -3.070
   85   1HB   PHE  14          1HB       PHE  14   2.335   6.056  -4.793
   86   2HB   PHE  14          2HB       PHE  14   1.500   4.629  -4.205
   87    HD1  PHE  14           HD1      PHE  14  -0.333   3.960  -5.400
   88    HD2  PHE  14           HD2      PHE  14   0.658   8.097  -5.298
   89    HE1  PHE  14           HE1      PHE  14  -2.213   4.443  -6.912
   90    HE2  PHE  14           HE2      PHE  14  -1.222   8.588  -6.809
   91    HZ   PHE  14           HZ       PHE  14  -2.660   6.760  -7.618
   92    H    MET  15           H        MET  15  -1.100   6.822  -3.454
   93    HA   MET  15           HA       MET  15  -2.181   5.582  -1.060
   94   1HB   MET  15          1HB       MET  15  -3.065   7.756  -1.979
   95   2HB   MET  15          2HB       MET  15  -3.683   6.857  -3.358
   96   1HG   MET  15          1HG       MET  15  -4.808   5.420  -1.439
   97   2HG   MET  15          2HG       MET  15  -4.638   6.936  -0.556
   98   1HE   MET  15          1HE       MET  15  -6.297   4.851  -3.031
   99   2HE   MET  15          2HE       MET  15  -5.970   5.922  -4.393
  100   3HE   MET  15          3HE       MET  15  -7.603   5.806  -3.735
  101    H    ASN  16           H        ASN  16  -3.617   3.861  -1.048
  102    HA   ASN  16           HA       ASN  16  -3.808   2.312  -3.528
  103   1HB   ASN  16          1HB       ASN  16  -1.871   1.760  -1.797
  104   2HB   ASN  16          2HB       ASN  16  -3.169   0.882  -1.013
  105   1HD2  ASN  16          1HD2      ASN  16  -1.281   1.205  -3.925
  106   2HD2  ASN  16          2HD2      ASN  16  -1.595  -0.378  -4.541
  107    H    GLN  17           H        GLN  17  -5.568   0.927  -3.674
  108    HA   GLN  17           HA       GLN  17  -7.880   1.653  -2.242
  109   1HB   GLN  17          1HB       GLN  17  -7.192  -0.358  -4.276
  110   2HB   GLN  17          2HB       GLN  17  -8.672  -0.621  -3.376
  111   1HG   GLN  17          1HG       GLN  17  -8.134   2.029  -4.639
  112   2HG   GLN  17          2HG       GLN  17  -8.716   0.685  -5.619
  113   1HE2  GLN  17          1HE2      GLN  17  -9.661   3.312  -3.931
  114   2HE2  GLN  17          2HE2      GLN  17 -11.288   2.863  -3.563
  115    HA   PRO  18           HA       PRO  18  -7.925  -1.077   1.219
  116   1HB   PRO  18          1HB       PRO  18 -10.506  -1.837   1.419
  117   2HB   PRO  18          2HB       PRO  18  -9.979  -0.182   1.741
  118   1HG   PRO  18          1HG       PRO  18 -11.242  -1.322  -0.719
  119   2HG   PRO  18          2HG       PRO  18 -11.578   0.213   0.102
  120   1HD   PRO  18          1HD       PRO  18 -10.022   0.021  -2.123
  121   2HD   PRO  18          2HD       PRO  18  -9.796   1.273  -0.888
  122    H    GLY  19           H        GLY  19  -8.453  -2.345  -1.858
  123   1HA   GLY  19          1HA       GLY  19  -8.674  -5.094  -0.813
  124   2HA   GLY  19          2HA       GLY  19  -9.110  -4.600  -2.441
  125    H    THR  20           H        THR  20  -6.534  -2.905  -2.338
  126    HA   THR  20           HA       THR  20  -4.814  -5.033  -3.361
  127    HB   THR  20           HB       THR  20  -3.449  -2.775  -3.893
  128    HG1  THR  20           HG1      THR  20  -6.164  -1.984  -4.032
  129   1HG2  THR  20          1HG2      THR  20  -4.433  -4.519  -5.473
  130   2HG2  THR  20          2HG2      THR  20  -4.190  -2.879  -6.074
  131   3HG2  THR  20          3HG2      THR  20  -5.803  -3.417  -5.604
  132    H    GLY  21           H        GLY  21  -4.573  -5.660  -0.961
  133   1HA   GLY  21          1HA       GLY  21  -3.196  -4.142   0.897
  134   2HA   GLY  21          2HA       GLY  21  -3.066  -5.886   0.769
  135    H    HIS  22           H        HIS  22  -1.994  -5.739  -1.967
  136    HA   HIS  22           HA       HIS  22   0.759  -5.516  -1.259
  137   1HB   HIS  22          1HB       HIS  22  -0.678  -6.082  -3.847
  138   2HB   HIS  22          2HB       HIS  22   1.072  -5.903  -3.787
  139    HD1  HIS  22           HD1      HIS  22  -1.528  -7.946  -1.885
  140    HD2  HIS  22           HD2      HIS  22   2.283  -8.291  -3.505
  141    HE1  HIS  22           HE1      HIS  22  -0.829 -10.324  -1.458
  142    HE2  HIS  22           HE2      HIS  22   1.444 -10.533  -2.524
  143    H    CYS  23           H        CYS  23   0.272  -4.199  -4.377
  144    HA   CYS  23           HA       CYS  23  -0.231  -1.546  -3.921
  145   1HB   CYS  23          1HB       CYS  23   2.203  -2.197  -2.729
  146   2HB   CYS  23          2HB       CYS  23   2.638  -1.411  -4.226
  147    H    GLU  24           H        GLU  24  -0.032  -0.276  -5.742
  148    HA   GLU  24           HA       GLU  24   0.683  -1.747  -8.175
  149   1HB   GLU  24          1HB       GLU  24  -1.403   0.153  -7.479
  150   2HB   GLU  24          2HB       GLU  24  -0.531   0.655  -8.920
  151   1HG   GLU  24          1HG       GLU  24  -1.270  -2.175  -8.884
  152   2HG   GLU  24          2HG       GLU  24  -2.636  -1.060  -8.877
  153    H    MET  25           H        MET  25   2.593  -0.436  -6.317
  154    HA   MET  25           HA       MET  25   3.893   1.285  -8.305
  155   1HB   MET  25          1HB       MET  25   3.135   1.959  -5.527
  156   2HB   MET  25          2HB       MET  25   4.770   2.404  -5.996
  157   1HG   MET  25          1HG       MET  25   3.367   4.272  -6.395
  158   2HG   MET  25          2HG       MET  25   3.809   3.592  -7.960
  159   1HE   MET  25          1HE       MET  25   0.308   4.932  -8.724
  160   2HE   MET  25          2HE       MET  25   1.629   4.236  -9.663
  161   3HE   MET  25          3HE       MET  25   1.971   5.426  -8.407
  162    H    CYS  26           H        CYS  26   4.522  -0.101  -5.052
  163    HA   CYS  26           HA       CYS  26   7.226  -0.709  -5.830
  164   1HB   CYS  26          1HB       CYS  26   7.247  -1.764  -3.522
  165   2HB   CYS  26          2HB       CYS  26   7.015  -0.031  -3.587
  166    H    SER  27           H        SER  27   4.354  -2.582  -4.875
  167    HA   SER  27           HA       SER  27   3.622  -4.575  -5.865
  168   1HB   SER  27          1HB       SER  27   5.480  -4.309  -7.625
  169   2HB   SER  27          2HB       SER  27   6.462  -5.300  -6.546
  170    HG   SER  27           HG       SER  27   4.624  -6.825  -6.654
  171    H    LEU  28           H        LEU  28   4.384  -3.832  -3.287
  172    HA   LEU  28           HA       LEU  28   5.344  -6.359  -2.151
  173   1HB   LEU  28          1HB       LEU  28   5.949  -3.531  -1.632
  174   2HB   LEU  28          2HB       LEU  28   5.733  -4.511  -0.222
  175    HG   LEU  28           HG       LEU  28   7.693  -5.082  -2.433
  176   1HD1  LEU  28          1HD1      LEU  28   8.714  -3.302  -1.475
  177   2HD1  LEU  28          2HD1      LEU  28   9.248  -4.549  -0.347
  178   3HD1  LEU  28          3HD1      LEU  28   7.888  -3.511   0.067
  179   1HD2  LEU  28          1HD2      LEU  28   7.579  -6.320   0.304
  180   2HD2  LEU  28          2HD2      LEU  28   8.562  -6.808  -1.076
  181   3HD2  LEU  28          3HD2      LEU  28   6.818  -7.045  -1.110
  182    HA   PRO  29           HA       PRO  29   1.624  -6.501   0.238
  183   1HB   PRO  29          1HB       PRO  29   2.415  -7.429   2.630
  184   2HB   PRO  29          2HB       PRO  29   2.526  -8.414   1.166
  185   1HG   PRO  29          1HG       PRO  29   4.667  -6.891   2.593
  186   2HG   PRO  29          2HG       PRO  29   4.741  -8.497   1.847
  187   1HD   PRO  29          1HD       PRO  29   5.666  -6.182   0.665
  188   2HD   PRO  29          2HD       PRO  29   5.178  -7.633  -0.227
  189    H    ARG  30           H        ARG  30   0.393  -5.634   2.027
  190    HA   ARG  30           HA       ARG  30   1.065  -2.938   2.627
  191   1HB   ARG  30          1HB       ARG  30  -1.261  -4.371   2.522
  192   2HB   ARG  30          2HB       ARG  30  -1.045  -4.168   4.247
  193   1HG   ARG  30          1HG       ARG  30  -1.000  -1.784   4.032
  194   2HG   ARG  30          2HG       ARG  30  -1.006  -1.903   2.272
  195   1HD   ARG  30          1HD       ARG  30  -3.220  -1.360   3.413
  196   2HD   ARG  30          2HD       ARG  30  -3.225  -2.655   2.217
  197    HE   ARG  30           HE       ARG  30  -2.822  -3.564   4.917
  198   1HH1  ARG  30          1HH1      ARG  30  -5.198  -2.741   2.496
  199   2HH1  ARG  30          2HH1      ARG  30  -6.440  -3.718   3.204
  200   1HH2  ARG  30          1HH2      ARG  30  -4.456  -4.849   5.849
  201   2HH2  ARG  30          2HH2      ARG  30  -6.020  -4.914   5.108
  202    H    THR  31           H        THR  31   1.989  -5.803   3.990
  203    HA   THR  31           HA       THR  31   3.036  -4.426   6.324
  204    HB   THR  31           HB       THR  31   1.230  -6.837   6.430
  205    HG1  THR  31           HG1      THR  31  -0.111  -5.452   7.218
  206   1HG2  THR  31          1HG2      THR  31   2.948  -5.784   8.667
  207   2HG2  THR  31          2HG2      THR  31   3.116  -7.349   7.871
  208   3HG2  THR  31          3HG2      THR  31   1.675  -6.993   8.824
  Start of MODEL    8
    1   1H    GLY   1          1H        GLY   1 -19.136   5.714  -2.103
    2   2H    GLY   1          2H        GLY   1 -19.083   5.442  -0.434
    3   3H    GLY   1          3H        GLY   1 -20.314   6.393  -1.096
    4   1HA   GLY   1          1HA       GLY   1 -21.261   4.291  -0.604
    5   2HA   GLY   1          2HA       GLY   1 -21.110   4.431  -2.349
    6    H    SER   2           H        SER   2 -18.603   3.792  -2.929
    7    HA   SER   2           HA       SER   2 -18.369   1.035  -1.940
    8   1HB   SER   2          1HB       SER   2 -17.723   2.351  -4.550
    9   2HB   SER   2          2HB       SER   2 -16.834   0.903  -4.077
   10    HG   SER   2           HG       SER   2 -19.650   1.161  -4.325
   11    H    THR   3           H        THR   3 -15.987   0.212  -2.193
   12    HA   THR   3           HA       THR   3 -13.871   0.227  -1.359
   13    HB   THR   3           HB       THR   3 -14.008   3.187  -1.968
   14    HG1  THR   3           HG1      THR   3 -13.578   2.675  -3.968
   15   1HG2  THR   3          1HG2      THR   3 -12.058   2.091  -0.532
   16   2HG2  THR   3          2HG2      THR   3 -11.775   3.369  -1.713
   17   3HG2  THR   3          3HG2      THR   3 -11.473   1.686  -2.145
   18    H    SER   4           H        SER   4 -13.730  -0.214   0.738
   19    HA   SER   4           HA       SER   4 -15.033   1.186   2.789
   20   1HB   SER   4          1HB       SER   4 -13.490  -0.109   4.313
   21   2HB   SER   4          2HB       SER   4 -14.390  -1.096   3.161
   22    HG   SER   4           HG       SER   4 -12.346  -1.809   2.978
   23    H    ALA   5           H        ALA   5 -11.496   0.883   2.598
   24    HA   ALA   5           HA       ALA   5 -11.112   3.735   2.721
   25   1HB   ALA   5          1HB       ALA   5  -9.944   3.740   4.877
   26   2HB   ALA   5          2HB       ALA   5 -10.384   2.048   5.114
   27   3HB   ALA   5          3HB       ALA   5 -11.640   3.285   5.052
   28    H    MET   6           H        MET   6  -9.334   4.180   1.601
   29    HA   MET   6           HA       MET   6  -7.574   2.116   0.722
   30   1HB   MET   6          1HB       MET   6  -7.636   5.101   0.396
   31   2HB   MET   6          2HB       MET   6  -6.289   4.154  -0.197
   32   1HG   MET   6          1HG       MET   6  -7.435   3.379  -1.951
   33   2HG   MET   6          2HG       MET   6  -8.906   3.140  -1.009
   34   1HE   MET   6          1HE       MET   6  -8.578   5.091  -4.339
   35   2HE   MET   6          2HE       MET   6  -7.083   4.706  -3.488
   36   3HE   MET   6          3HE       MET   6  -7.572   6.387  -3.695
   37    H    TRP   7           H        TRP   7  -5.086   2.808   0.777
   38    HA   TRP   7           HA       TRP   7  -4.367   3.675   3.470
   39   1HB   TRP   7          1HB       TRP   7  -2.741   1.800   3.692
   40   2HB   TRP   7          2HB       TRP   7  -4.422   1.303   3.742
   41    HD1  TRP   7           HD1      TRP   7  -5.361   0.035   1.466
   42    HE1  TRP   7           HE1      TRP   7  -4.099  -1.484  -0.199
   43    HE3  TRP   7           HE3      TRP   7  -0.562   1.414   2.582
   44    HZ2  TRP   7           HZ2      TRP   7  -1.433  -2.028  -0.917
   45    HZ3  TRP   7           HZ3      TRP   7   1.286   0.348   1.352
   46    HH2  TRP   7           HH2      TRP   7   0.864  -1.331  -0.369
   47    H    ALA   8           H        ALA   8  -2.077   4.112   3.735
   48    HA   ALA   8           HA       ALA   8  -0.902   5.116   1.224
   49   1HB   ALA   8          1HB       ALA   8   0.167   6.839   2.490
   50   2HB   ALA   8          2HB       ALA   8  -0.310   6.092   4.015
   51   3HB   ALA   8          3HB       ALA   8  -1.533   6.806   2.963
   52    H    CYS   9           H        CYS   9   0.759   3.965   0.510
   53    HA   CYS   9           HA       CYS   9   2.036   1.962   2.023
   54   1HB   CYS   9          1HB       CYS   9   1.780   2.049  -0.496
   55   2HB   CYS   9          2HB       CYS   9   3.103   3.213  -0.500
   56    H    GLN  10           H        GLN  10   4.347   1.804   2.450
   57    HA   GLN  10           HA       GLN  10   5.491   4.409   3.188
   58   1HB   GLN  10          1HB       GLN  10   6.565   3.322   5.089
   59   2HB   GLN  10          2HB       GLN  10   4.824   3.095   5.157
   60   1HG   GLN  10          1HG       GLN  10   6.258   0.957   3.772
   61   2HG   GLN  10          2HG       GLN  10   6.678   1.134   5.475
   62   1HE2  GLN  10          1HE2      GLN  10   4.418  -0.034   3.246
   63   2HE2  GLN  10          2HE2      GLN  10   3.204  -0.538   4.368
   64    H    HIS  11           H        HIS  11   5.849   3.094   0.665
   65    HA   HIS  11           HA       HIS  11   8.760   2.757   0.746
   66   1HB   HIS  11          1HB       HIS  11   7.519   0.510   0.614
   67   2HB   HIS  11          2HB       HIS  11   7.025   1.011  -1.001
   68    HD1  HIS  11           HD1      HIS  11   8.775   0.910  -2.855
   69    HD2  HIS  11           HD2      HIS  11  10.274  -0.062   0.894
   70    HE1  HIS  11           HE1      HIS  11  11.061  -0.051  -3.276
   71    HE2  HIS  11           HE2      HIS  11  11.986  -0.552  -0.988
   72    H    CYS  12           H        CYS  12   6.005   2.817  -1.506
   73    HA   CYS  12           HA       CYS  12   7.503   4.417  -3.387
   74   1HB   CYS  12          1HB       CYS  12   5.337   4.280  -4.666
   75   2HB   CYS  12          2HB       CYS  12   6.132   2.748  -4.383
   76    H    THR  13           H        THR  13   4.926   4.679  -1.070
   77    HA   THR  13           HA       THR  13   4.135   6.472   0.081
   78    HB   THR  13           HB       THR  13   6.450   7.500  -0.652
   79    HG1  THR  13           HG1      THR  13   4.249   9.001   0.302
   80   1HG2  THR  13          1HG2      THR  13   4.994   8.395  -2.816
   81   2HG2  THR  13          2HG2      THR  13   6.530   9.045  -2.245
   82   3HG2  THR  13          3HG2      THR  13   5.014   9.778  -1.723
   83    H    PHE  14           H        PHE  14   2.761   5.230  -2.011
   84    HA   PHE  14           HA       PHE  14   1.147   7.462  -3.034
   85   1HB   PHE  14          1HB       PHE  14   2.291   6.226  -4.828
   86   2HB   PHE  14          2HB       PHE  14   1.542   4.737  -4.278
   87    HD1  PHE  14           HD1      PHE  14  -0.277   4.016  -5.462
   88    HD2  PHE  14           HD2      PHE  14   0.504   8.193  -5.234
   89    HE1  PHE  14           HE1      PHE  14  -2.206   4.452  -6.927
   90    HE2  PHE  14           HE2      PHE  14  -1.425   8.638  -6.697
   91    HZ   PHE  14           HZ       PHE  14  -2.782   6.766  -7.544
   92    H    MET  15           H        MET  15  -1.141   6.838  -3.413
   93    HA   MET  15           HA       MET  15  -2.155   5.479  -1.054
   94   1HB   MET  15          1HB       MET  15  -3.026   7.693  -2.327
   95   2HB   MET  15          2HB       MET  15  -4.027   6.490  -3.130
   96   1HG   MET  15          1HG       MET  15  -5.251   6.069  -1.280
   97   2HG   MET  15          2HG       MET  15  -3.899   6.349  -0.185
   98   1HE   MET  15          1HE       MET  15  -6.912   7.330  -1.762
   99   2HE   MET  15          2HE       MET  15  -6.427   8.810  -2.587
  100   3HE   MET  15          3HE       MET  15  -7.343   8.899  -1.083
  101    H    ASN  16           H        ASN  16  -3.614   3.764  -1.099
  102    HA   ASN  16           HA       ASN  16  -3.753   2.266  -3.612
  103   1HB   ASN  16          1HB       ASN  16  -1.858   1.707  -1.815
  104   2HB   ASN  16          2HB       ASN  16  -3.171   0.771  -1.130
  105   1HD2  ASN  16          1HD2      ASN  16  -1.296   1.317  -4.040
  106   2HD2  ASN  16          2HD2      ASN  16  -1.494  -0.269  -4.693
  107    H    GLN  17           H        GLN  17  -5.450   0.734  -3.728
  108    HA   GLN  17           HA       GLN  17  -7.831   1.486  -2.434
  109   1HB   GLN  17          1HB       GLN  17  -7.017  -0.652  -4.287
  110   2HB   GLN  17          2HB       GLN  17  -8.528  -0.878  -3.426
  111   1HG   GLN  17          1HG       GLN  17  -7.909   1.614  -4.979
  112   2HG   GLN  17          2HG       GLN  17  -8.644   0.195  -5.720
  113   1HE2  GLN  17          1HE2      GLN  17  -9.207   3.061  -4.098
  114   2HE2  GLN  17          2HE2      GLN  17 -10.870   2.818  -3.699
  115    HA   PRO  18           HA       PRO  18  -7.941  -0.977   1.221
  116   1HB   PRO  18          1HB       PRO  18 -10.517  -1.771   1.378
  117   2HB   PRO  18          2HB       PRO  18 -10.028  -0.089   1.609
  118   1HG   PRO  18          1HG       PRO  18 -11.173  -1.411  -0.820
  119   2HG   PRO  18          2HG       PRO  18 -11.573   0.165  -0.111
  120   1HD   PRO  18          1HD       PRO  18  -9.930  -0.119  -2.256
  121   2HD   PRO  18          2HD       PRO  18  -9.762   1.200  -1.082
  122    H    GLY  19           H        GLY  19  -8.482  -2.465  -1.790
  123   1HA   GLY  19          1HA       GLY  19  -8.533  -5.140  -0.544
  124   2HA   GLY  19          2HA       GLY  19  -9.099  -4.784  -2.169
  125    H    THR  20           H        THR  20  -6.559  -2.962  -2.228
  126    HA   THR  20           HA       THR  20  -4.839  -5.035  -3.349
  127    HB   THR  20           HB       THR  20  -3.533  -2.837  -3.991
  128    HG1  THR  20           HG1      THR  20  -5.034  -1.114  -4.260
  129   1HG2  THR  20          1HG2      THR  20  -4.879  -2.563  -5.996
  130   2HG2  THR  20          2HG2      THR  20  -6.149  -3.555  -5.276
  131   3HG2  THR  20          3HG2      THR  20  -4.574  -4.263  -5.640
  132    H    GLY  21           H        GLY  21  -4.641  -5.560  -0.841
  133   1HA   GLY  21          1HA       GLY  21  -3.166  -4.092   0.934
  134   2HA   GLY  21          2HA       GLY  21  -3.043  -5.835   0.804
  135    H    HIS  22           H        HIS  22  -2.015  -5.687  -1.953
  136    HA   HIS  22           HA       HIS  22   0.748  -5.465  -1.285
  137   1HB   HIS  22          1HB       HIS  22  -0.718  -6.017  -3.862
  138   2HB   HIS  22          2HB       HIS  22   1.034  -5.863  -3.809
  139    HD1  HIS  22           HD1      HIS  22  -1.608  -7.884  -1.943
  140    HD2  HIS  22           HD2      HIS  22   2.230  -8.258  -3.491
  141    HE1  HIS  22           HE1      HIS  22  -0.938 -10.269  -1.512
  142    HE2  HIS  22           HE2      HIS  22   1.352 -10.495  -2.535
  143    H    CYS  23           H        CYS  23   0.237  -4.148  -4.396
  144    HA   CYS  23           HA       CYS  23  -0.259  -1.491  -3.921
  145   1HB   CYS  23          1HB       CYS  23   2.184  -2.143  -2.767
  146   2HB   CYS  23          2HB       CYS  23   2.614  -1.386  -4.280
  147    H    GLU  24           H        GLU  24   0.116  -0.132  -5.722
  148    HA   GLU  24           HA       GLU  24   0.675  -1.629  -8.185
  149   1HB   GLU  24          1HB       GLU  24  -1.342   0.324  -7.439
  150   2HB   GLU  24          2HB       GLU  24  -0.483   0.811  -8.893
  151   1HG   GLU  24          1HG       GLU  24  -1.336  -1.998  -8.826
  152   2HG   GLU  24          2HG       GLU  24  -2.638  -0.810  -8.859
  153    H    MET  25           H        MET  25   2.620  -0.337  -6.321
  154    HA   MET  25           HA       MET  25   3.956   1.338  -8.326
  155   1HB   MET  25          1HB       MET  25   2.962   2.225  -5.819
  156   2HB   MET  25          2HB       MET  25   4.715   2.179  -5.697
  157   1HG   MET  25          1HG       MET  25   3.880   4.363  -6.417
  158   2HG   MET  25          2HG       MET  25   4.931   3.614  -7.620
  159   1HE   MET  25          1HE       MET  25   4.444   5.066  -9.237
  160   2HE   MET  25          2HE       MET  25   2.929   5.966  -9.153
  161   3HE   MET  25          3HE       MET  25   3.184   4.787 -10.445
  162    H    CYS  26           H        CYS  26   4.547  -0.122  -5.103
  163    HA   CYS  26           HA       CYS  26   7.240  -0.785  -5.895
  164   1HB   CYS  26          1HB       CYS  26   7.209  -1.886  -3.580
  165   2HB   CYS  26          2HB       CYS  26   7.126  -0.138  -3.655
  166    H    SER  27           H        SER  27   4.343  -2.588  -4.884
  167    HA   SER  27           HA       SER  27   3.534  -4.550  -5.883
  168   1HB   SER  27          1HB       SER  27   5.368  -4.330  -7.672
  169   2HB   SER  27          2HB       SER  27   6.342  -5.349  -6.611
  170    HG   SER  27           HG       SER  27   3.743  -6.081  -7.452
  171    H    LEU  28           H        LEU  28   4.358  -3.844  -3.313
  172    HA   LEU  28           HA       LEU  28   5.252  -6.410  -2.209
  173   1HB   LEU  28          1HB       LEU  28   5.962  -3.607  -1.677
  174   2HB   LEU  28          2HB       LEU  28   5.739  -4.596  -0.273
  175    HG   LEU  28           HG       LEU  28   7.630  -5.210  -2.526
  176   1HD1  LEU  28          1HD1      LEU  28   7.934  -3.667  -0.018
  177   2HD1  LEU  28          2HD1      LEU  28   8.735  -3.473  -1.576
  178   3HD1  LEU  28          3HD1      LEU  28   9.258  -4.748  -0.470
  179   1HD2  LEU  28          1HD2      LEU  28   7.530  -6.466   0.207
  180   2HD2  LEU  28          2HD2      LEU  28   8.479  -6.975  -1.190
  181   3HD2  LEU  28          3HD2      LEU  28   6.724  -7.155  -1.202
  182    HA   PRO  29           HA       PRO  29   1.566  -6.438   0.235
  183   1HB   PRO  29          1HB       PRO  29   2.361  -7.446   2.594
  184   2HB   PRO  29          2HB       PRO  29   2.407  -8.404   1.109
  185   1HG   PRO  29          1HG       PRO  29   4.631  -7.001   2.529
  186   2HG   PRO  29          2HG       PRO  29   4.628  -8.590   1.745
  187   1HD   PRO  29          1HD       PRO  29   5.624  -6.284   0.600
  188   2HD   PRO  29          2HD       PRO  29   5.072  -7.698  -0.314
  189    H    ARG  30           H        ARG  30   0.394  -5.529   2.026
  190    HA   ARG  30           HA       ARG  30   1.213  -2.890   2.687
  191   1HB   ARG  30          1HB       ARG  30  -1.188  -4.192   2.546
  192   2HB   ARG  30          2HB       ARG  30  -0.966  -4.035   4.277
  193   1HG   ARG  30          1HG       ARG  30  -0.657  -1.614   4.008
  194   2HG   ARG  30          2HG       ARG  30  -0.944  -1.790   2.276
  195   1HD   ARG  30          1HD       ARG  30  -2.918  -1.064   3.714
  196   2HD   ARG  30          2HD       ARG  30  -3.186  -2.402   2.598
  197    HE   ARG  30           HE       ARG  30  -3.525  -3.788   4.391
  198   1HH1  ARG  30          1HH1      ARG  30  -2.072  -0.820   5.509
  199   2HH1  ARG  30          2HH1      ARG  30  -2.287  -1.199   7.184
  200   1HH2  ARG  30          1HH2      ARG  30  -3.809  -4.289   6.594
  201   2HH2  ARG  30          2HH2      ARG  30  -3.273  -3.168   7.801
  202    H    THR  31           H        THR  31   1.977  -5.831   3.984
  203    HA   THR  31           HA       THR  31   3.090  -4.566   6.350
  204    HB   THR  31           HB       THR  31   1.157  -6.880   6.400
  205    HG1  THR  31           HG1      THR  31   1.245  -4.467   7.883
  206   1HG2  THR  31          1HG2      THR  31   3.026  -7.510   7.830
  207   2HG2  THR  31          2HG2      THR  31   1.589  -7.128   8.780
  208   3HG2  THR  31          3HG2      THR  31   2.908  -5.964   8.671
  Start of MODEL    9
    1   1H    GLY   1          1H        GLY   1 -16.233   0.835  -7.575
    2   2H    GLY   1          2H        GLY   1 -16.508   0.195  -6.034
    3   3H    GLY   1          3H        GLY   1 -15.636   1.633  -6.208
    4   1HA   GLY   1          1HA       GLY   1 -17.747   2.539  -7.319
    5   2HA   GLY   1          2HA       GLY   1 -18.530   1.172  -6.542
    6    H    SER   2           H        SER   2 -17.892   0.954  -4.129
    7    HA   SER   2           HA       SER   2 -18.320   3.589  -2.924
    8   1HB   SER   2          1HB       SER   2 -19.698   1.300  -2.529
    9   2HB   SER   2          2HB       SER   2 -18.498   1.154  -1.246
   10    HG   SER   2           HG       SER   2 -19.152   3.402  -0.719
   11    H    THR   3           H        THR   3 -16.369   0.654  -2.446
   12    HA   THR   3           HA       THR   3 -14.312   0.326  -1.534
   13    HB   THR   3           HB       THR   3 -13.961   3.316  -1.811
   14    HG1  THR   3           HG1      THR   3 -13.502   3.001  -3.868
   15   1HG2  THR   3          1HG2      THR   3 -11.828   1.225  -2.032
   16   2HG2  THR   3          2HG2      THR   3 -12.240   1.985  -0.495
   17   3HG2  THR   3          3HG2      THR   3 -11.655   2.969  -1.837
   18    H    SER   4           H        SER   4 -13.480   0.140   0.496
   19    HA   SER   4           HA       SER   4 -15.041   1.283   2.640
   20   1HB   SER   4          1HB       SER   4 -13.501  -1.064   2.284
   21   2HB   SER   4          2HB       SER   4 -12.738  -0.157   3.589
   22    HG   SER   4           HG       SER   4 -14.679  -0.155   4.692
   23    H    ALA   5           H        ALA   5 -11.508   0.934   2.461
   24    HA   ALA   5           HA       ALA   5 -11.078   3.770   2.732
   25   1HB   ALA   5          1HB       ALA   5 -11.646   3.200   5.032
   26   2HB   ALA   5          2HB       ALA   5  -9.947   3.658   4.898
   27   3HB   ALA   5          3HB       ALA   5 -10.394   1.958   5.045
   28    H    MET   6           H        MET   6  -9.324   4.201   1.579
   29    HA   MET   6           HA       MET   6  -7.555   2.148   0.692
   30   1HB   MET   6          1HB       MET   6  -7.584   5.141   0.399
   31   2HB   MET   6          2HB       MET   6  -6.286   4.161  -0.248
   32   1HG   MET   6          1HG       MET   6  -7.506   4.023  -2.096
   33   2HG   MET   6          2HG       MET   6  -8.524   2.898  -1.201
   34   1HE   MET   6          1HE       MET   6  -7.949   5.826  -2.986
   35   2HE   MET   6          2HE       MET   6  -8.875   7.150  -2.280
   36   3HE   MET   6          3HE       MET   6  -9.602   6.127  -3.519
   37    H    TRP   7           H        TRP   7  -5.073   2.805   0.767
   38    HA   TRP   7           HA       TRP   7  -4.361   3.684   3.460
   39   1HB   TRP   7          1HB       TRP   7  -2.740   1.805   3.690
   40   2HB   TRP   7          2HB       TRP   7  -4.423   1.314   3.738
   41    HD1  TRP   7           HD1      TRP   7  -5.361   0.034   1.470
   42    HE1  TRP   7           HE1      TRP   7  -4.098  -1.490  -0.190
   43    HE3  TRP   7           HE3      TRP   7  -0.559   1.421   2.576
   44    HZ2  TRP   7           HZ2      TRP   7  -1.433  -2.036  -0.908
   45    HZ3  TRP   7           HZ3      TRP   7   1.287   0.351   1.349
   46    HH2  TRP   7           HH2      TRP   7   0.864  -1.336  -0.365
   47    H    ALA   8           H        ALA   8  -2.079   4.126   3.735
   48    HA   ALA   8           HA       ALA   8  -0.892   5.125   1.228
   49   1HB   ALA   8          1HB       ALA   8   0.318   6.743   2.655
   50   2HB   ALA   8          2HB       ALA   8  -0.529   6.102   4.062
   51   3HB   ALA   8          3HB       ALA   8  -1.434   6.904   2.779
   52    H    CYS   9           H        CYS   9   0.761   3.963   0.515
   53    HA   CYS   9           HA       CYS   9   2.034   1.960   2.029
   54   1HB   CYS   9          1HB       CYS   9   1.778   2.036  -0.489
   55   2HB   CYS   9          2HB       CYS   9   3.094   3.207  -0.502
   56    H    GLN  10           H        GLN  10   4.345   1.796   2.456
   57    HA   GLN  10           HA       GLN  10   5.493   4.402   3.190
   58   1HB   GLN  10          1HB       GLN  10   6.624   3.241   5.059
   59   2HB   GLN  10          2HB       GLN  10   4.872   3.165   5.184
   60   1HG   GLN  10          1HG       GLN  10   6.073   0.905   3.770
   61   2HG   GLN  10          2HG       GLN  10   6.561   1.053   5.458
   62   1HE2  GLN  10          1HE2      GLN  10   4.192  -0.022   3.335
   63   2HE2  GLN  10          2HE2      GLN  10   2.956  -0.378   4.489
   64    H    HIS  11           H        HIS  11   5.846   3.093   0.666
   65    HA   HIS  11           HA       HIS  11   8.757   2.753   0.741
   66   1HB   HIS  11          1HB       HIS  11   7.426   0.519   0.582
   67   2HB   HIS  11          2HB       HIS  11   7.085   1.027  -1.069
   68    HD1  HIS  11           HD1      HIS  11   8.984   0.876  -2.766
   69    HD2  HIS  11           HD2      HIS  11  10.133  -0.132   1.097
   70    HE1  HIS  11           HE1      HIS  11  11.268  -0.146  -2.990
   71    HE2  HIS  11           HE2      HIS  11  11.979  -0.669  -0.631
   72    H    CYS  12           H        CYS  12   5.997   2.821  -1.506
   73    HA   CYS  12           HA       CYS  12   7.496   4.422  -3.387
   74   1HB   CYS  12          1HB       CYS  12   5.326   4.289  -4.662
   75   2HB   CYS  12          2HB       CYS  12   6.124   2.756  -4.386
   76    H    THR  13           H        THR  13   4.919   4.682  -1.067
   77    HA   THR  13           HA       THR  13   4.130   6.476   0.086
   78    HB   THR  13           HB       THR  13   6.444   7.505  -0.653
   79    HG1  THR  13           HG1      THR  13   4.241   8.992   0.313
   80   1HG2  THR  13          1HG2      THR  13   5.003   9.781  -1.719
   81   2HG2  THR  13          2HG2      THR  13   4.985   8.398  -2.813
   82   3HG2  THR  13          3HG2      THR  13   6.520   9.051  -2.243
   83    H    PHE  14           H        PHE  14   2.754   5.233  -2.004
   84    HA   PHE  14           HA       PHE  14   1.136   7.463  -3.024
   85   1HB   PHE  14          1HB       PHE  14   2.280   6.229  -4.820
   86   2HB   PHE  14          2HB       PHE  14   1.532   4.739  -4.270
   87    HD1  PHE  14           HD1      PHE  14   0.490   8.195  -5.224
   88    HD2  PHE  14           HD2      PHE  14  -0.288   4.018  -5.453
   89    HE1  PHE  14           HE1      PHE  14  -1.440   8.639  -6.684
   90    HE2  PHE  14           HE2      PHE  14  -2.219   4.453  -6.913
   91    HZ   PHE  14           HZ       PHE  14  -2.797   6.766  -7.530
   92    H    MET  15           H        MET  15  -1.151   6.837  -3.401
   93    HA   MET  15           HA       MET  15  -2.162   5.478  -1.041
   94   1HB   MET  15          1HB       MET  15  -3.036   7.692  -2.304
   95   2HB   MET  15          2HB       MET  15  -4.031   6.493  -3.119
   96   1HG   MET  15          1HG       MET  15  -5.277   6.079  -1.288
   97   2HG   MET  15          2HG       MET  15  -3.925   6.306  -0.181
   98   1HE   MET  15          1HE       MET  15  -7.384   8.741  -0.767
   99   2HE   MET  15          2HE       MET  15  -6.909   7.310  -1.680
  100   3HE   MET  15          3HE       MET  15  -6.611   8.917  -2.343
  101    H    ASN  16           H        ASN  16  -3.619   3.760  -1.085
  102    HA   ASN  16           HA       ASN  16  -3.760   2.263  -3.599
  103   1HB   ASN  16          1HB       ASN  16  -1.861   1.704  -1.807
  104   2HB   ASN  16          2HB       ASN  16  -3.171   0.768  -1.118
  105   1HD2  ASN  16          1HD2      ASN  16  -1.304   1.316  -4.033
  106   2HD2  ASN  16          2HD2      ASN  16  -1.501  -0.271  -4.686
  107    H    GLN  17           H        GLN  17  -5.454   0.731  -3.717
  108    HA   GLN  17           HA       GLN  17  -7.835   1.477  -2.415
  109   1HB   GLN  17          1HB       GLN  17  -7.022  -0.655  -4.276
  110   2HB   GLN  17          2HB       GLN  17  -8.530  -0.884  -3.413
  111   1HG   GLN  17          1HG       GLN  17  -7.917   1.612  -4.959
  112   2HG   GLN  17          2HG       GLN  17  -8.652   0.194  -5.704
  113   1HE2  GLN  17          1HE2      GLN  17  -9.218   3.055  -4.074
  114   2HE2  GLN  17          2HE2      GLN  17 -10.879   2.806  -3.673
  115    HA   PRO  18           HA       PRO  18  -7.934  -0.996   1.233
  116   1HB   PRO  18          1HB       PRO  18 -10.509  -1.793   1.393
  117   2HB   PRO  18          2HB       PRO  18 -10.022  -0.110   1.628
  118   1HG   PRO  18          1HG       PRO  18 -11.171  -1.427  -0.802
  119   2HG   PRO  18          2HG       PRO  18 -11.570   0.147  -0.088
  120   1HD   PRO  18          1HD       PRO  18  -9.932  -0.131  -2.237
  121   2HD   PRO  18          2HD       PRO  18  -9.763   1.185  -1.060
  122    H    GLY  19           H        GLY  19  -8.485  -2.476  -1.781
  123   1HA   GLY  19          1HA       GLY  19  -8.530  -5.154  -0.541
  124   2HA   GLY  19          2HA       GLY  19  -9.099  -4.795  -2.165
  125    H    THR  20           H        THR  20  -6.559  -2.969  -2.220
  126    HA   THR  20           HA       THR  20  -4.838  -5.039  -3.349
  127    HB   THR  20           HB       THR  20  -3.535  -2.837  -3.984
  128    HG1  THR  20           HG1      THR  20  -5.039  -1.116  -4.248
  129   1HG2  THR  20          1HG2      THR  20  -4.859  -2.570  -5.993
  130   2HG2  THR  20          2HG2      THR  20  -6.154  -3.529  -5.277
  131   3HG2  THR  20          3HG2      THR  20  -4.594  -4.274  -5.626
  132    H    GLY  21           H        GLY  21  -4.638  -5.571  -0.843
  133   1HA   GLY  21          1HA       GLY  21  -3.164  -4.106   0.937
  134   2HA   GLY  21          2HA       GLY  21  -3.039  -5.850   0.801
  135    H    HIS  22           H        HIS  22  -2.013  -5.691  -1.956
  136    HA   HIS  22           HA       HIS  22   0.750  -5.469  -1.289
  137   1HB   HIS  22          1HB       HIS  22  -0.716  -6.016  -3.867
  138   2HB   HIS  22          2HB       HIS  22   1.037  -5.862  -3.812
  139    HD1  HIS  22           HD1      HIS  22  -1.609  -7.890  -1.960
  140    HD2  HIS  22           HD2      HIS  22   2.237  -8.253  -3.490
  141    HE1  HIS  22           HE1      HIS  22  -0.937 -10.275  -1.531
  142    HE2  HIS  22           HE2      HIS  22   1.359 -10.495  -2.543
  143    H    CYS  23           H        CYS  23   0.235  -4.146  -4.396
  144    HA   CYS  23           HA       CYS  23  -0.262  -1.489  -3.914
  145   1HB   CYS  23          1HB       CYS  23   2.184  -2.145  -2.767
  146   2HB   CYS  23          2HB       CYS  23   2.610  -1.382  -4.280
  147    H    GLU  24           H        GLU  24   0.110  -0.126  -5.712
  148    HA   GLU  24           HA       GLU  24   0.663  -1.619  -8.181
  149   1HB   GLU  24          1HB       GLU  24  -1.350   0.335  -7.427
  150   2HB   GLU  24          2HB       GLU  24  -0.494   0.824  -8.882
  151   1HG   GLU  24          1HG       GLU  24  -1.318  -1.984  -8.851
  152   2HG   GLU  24          2HG       GLU  24  -2.647  -0.826  -8.813
  153    H    MET  25           H        MET  25   2.613  -0.332  -6.318
  154    HA   MET  25           HA       MET  25   3.947   1.345  -8.323
  155   1HB   MET  25          1HB       MET  25   2.961   2.225  -5.807
  156   2HB   MET  25          2HB       MET  25   4.714   2.184  -5.696
  157   1HG   MET  25          1HG       MET  25   4.250   4.334  -6.427
  158   2HG   MET  25          2HG       MET  25   4.701   3.477  -7.899
  159   1HE   MET  25          1HE       MET  25   1.828   3.775 -10.167
  160   2HE   MET  25          2HE       MET  25   3.242   2.818  -9.734
  161   3HE   MET  25          3HE       MET  25   3.395   4.559  -9.957
  162    H    CYS  26           H        CYS  26   4.543  -0.118  -5.101
  163    HA   CYS  26           HA       CYS  26   7.235  -0.782  -5.899
  164   1HB   CYS  26          1HB       CYS  26   7.205  -1.889  -3.586
  165   2HB   CYS  26          2HB       CYS  26   7.127  -0.141  -3.657
  166    H    SER  27           H        SER  27   4.340  -2.587  -4.882
  167    HA   SER  27           HA       SER  27   3.527  -4.546  -5.887
  168   1HB   SER  27          1HB       SER  27   5.358  -4.325  -7.678
  169   2HB   SER  27          2HB       SER  27   6.333  -5.345  -6.619
  170    HG   SER  27           HG       SER  27   5.154  -6.547  -8.194
  171    H    LEU  28           H        LEU  28   4.357  -3.845  -3.315
  172    HA   LEU  28           HA       LEU  28   5.245  -6.414  -2.219
  173   1HB   LEU  28          1HB       LEU  28   5.965  -3.616  -1.682
  174   2HB   LEU  28          2HB       LEU  28   5.745  -4.608  -0.280
  175    HG   LEU  28           HG       LEU  28   7.628  -5.226  -2.540
  176   1HD1  LEU  28          1HD1      LEU  28   8.740  -3.493  -1.595
  177   2HD1  LEU  28          2HD1      LEU  28   9.259  -4.769  -0.488
  178   3HD1  LEU  28          3HD1      LEU  28   7.948  -3.685  -0.033
  179   1HD2  LEU  28          1HD2      LEU  28   8.479  -6.993  -1.207
  180   2HD2  LEU  28          2HD2      LEU  28   6.723  -7.170  -1.217
  181   3HD2  LEU  28          3HD2      LEU  28   7.526  -6.481   0.191
  182    HA   PRO  29           HA       PRO  29   1.565  -6.432   0.235
  183   1HB   PRO  29          1HB       PRO  29   2.361  -7.462   2.583
  184   2HB   PRO  29          2HB       PRO  29   2.397  -8.411   1.092
  185   1HG   PRO  29          1HG       PRO  29   4.632  -7.029   2.516
  186   2HG   PRO  29          2HG       PRO  29   4.619  -8.614   1.721
  187   1HD   PRO  29          1HD       PRO  29   5.624  -6.303   0.590
  188   2HD   PRO  29          2HD       PRO  29   5.065  -7.708  -0.333
  189    H    ARG  30           H        ARG  30   0.401  -5.519   2.024
  190    HA   ARG  30           HA       ARG  30   1.248  -2.895   2.707
  191   1HB   ARG  30          1HB       ARG  30  -1.168  -4.166   2.549
  192   2HB   ARG  30          2HB       ARG  30  -0.949  -4.028   4.283
  193   1HG   ARG  30          1HG       ARG  30  -0.572  -1.598   4.000
  194   2HG   ARG  30          2HG       ARG  30  -0.940  -1.781   2.285
  195   1HD   ARG  30          1HD       ARG  30  -2.849  -1.010   3.745
  196   2HD   ARG  30          2HD       ARG  30  -3.173  -2.418   2.733
  197    HE   ARG  30           HE       ARG  30  -2.278  -3.062   5.392
  198   1HH1  ARG  30          1HH1      ARG  30  -5.045  -2.348   3.388
  199   2HH1  ARG  30          2HH1      ARG  30  -6.165  -3.157   4.431
  200   1HH2  ARG  30          1HH2      ARG  30  -3.751  -4.127   6.765
  201   2HH2  ARG  30          2HH2      ARG  30  -5.431  -4.166   6.347
  202    H    THR  31           H        THR  31   1.974  -5.854   3.982
  203    HA   THR  31           HA       THR  31   3.097  -4.621   6.362
  204    HB   THR  31           HB       THR  31   1.135  -6.912   6.389
  205    HG1  THR  31           HG1      THR  31  -0.115  -5.439   7.158
  206   1HG2  THR  31          1HG2      THR  31   2.829  -6.020   8.711
  207   2HG2  THR  31          2HG2      THR  31   3.048  -7.524   7.817
  208   3HG2  THR  31          3HG2      THR  31   1.565  -7.249   8.731
  Start of MODEL   10
    1   1H    GLY   1          1H        GLY   1 -18.825  -3.442  -7.310
    2   2H    GLY   1          2H        GLY   1 -19.249  -3.591  -5.679
    3   3H    GLY   1          3H        GLY   1 -17.640  -3.806  -6.158
    4   1HA   GLY   1          1HA       GLY   1 -17.351  -1.540  -6.655
    5   2HA   GLY   1          2HA       GLY   1 -19.081  -1.252  -6.556
    6    H    SER   2           H        SER   2 -17.450  -3.277  -4.239
    7    HA   SER   2           HA       SER   2 -18.184  -1.406  -2.131
    8   1HB   SER   2          1HB       SER   2 -17.787  -3.226  -0.596
    9   2HB   SER   2          2HB       SER   2 -18.725  -3.849  -1.953
   10    HG   SER   2           HG       SER   2 -15.924  -4.109  -1.567
   11    H    THR   3           H        THR   3 -16.749  -0.505  -0.671
   12    HA   THR   3           HA       THR   3 -13.945  -1.070  -0.732
   13    HB   THR   3           HB       THR   3 -14.847   1.610  -1.804
   14    HG1  THR   3           HG1      THR   3 -14.582   0.813  -3.723
   15   1HG2  THR   3          1HG2      THR   3 -12.612   2.185  -2.114
   16   2HG2  THR   3          2HG2      THR   3 -12.054   0.537  -1.829
   17   3HG2  THR   3          3HG2      THR   3 -12.670   1.504  -0.489
   18    H    SER   4           H        SER   4 -13.135  -0.651   1.221
   19    HA   SER   4           HA       SER   4 -14.771   0.788   3.135
   20   1HB   SER   4          1HB       SER   4 -13.117  -0.020   4.796
   21   2HB   SER   4          2HB       SER   4 -13.780  -1.334   3.824
   22    HG   SER   4           HG       SER   4 -11.383  -1.195   4.166
   23    H    ALA   5           H        ALA   5 -11.236   0.827   2.799
   24    HA   ALA   5           HA       ALA   5 -11.178   3.656   2.256
   25   1HB   ALA   5          1HB       ALA   5 -10.206   2.651   4.929
   26   2HB   ALA   5          2HB       ALA   5 -11.593   3.706   4.650
   27   3HB   ALA   5          3HB       ALA   5  -9.963   4.279   4.295
   28    H    MET   6           H        MET   6  -9.261   4.295   1.371
   29    HA   MET   6           HA       MET   6  -7.459   2.266   0.508
   30   1HB   MET   6          1HB       MET   6  -7.353   5.273   0.301
   31   2HB   MET   6          2HB       MET   6  -6.223   4.197  -0.486
   32   1HG   MET   6          1HG       MET   6  -7.589   4.210  -2.228
   33   2HG   MET   6          2HG       MET   6  -8.684   3.225  -1.261
   34   1HE   MET   6          1HE       MET   6  -9.089   7.114  -3.084
   35   2HE   MET   6          2HE       MET   6 -10.128   5.794  -3.619
   36   3HE   MET   6          3HE       MET   6  -8.384   5.559  -3.521
   37    H    TRP   7           H        TRP   7  -4.998   2.789   0.684
   38    HA   TRP   7           HA       TRP   7  -4.345   3.705   3.384
   39   1HB   TRP   7          1HB       TRP   7  -2.745   1.810   3.653
   40   2HB   TRP   7          2HB       TRP   7  -4.434   1.344   3.676
   41    HD1  TRP   7           HD1      TRP   7  -5.348   0.040   1.409
   42    HE1  TRP   7           HE1      TRP   7  -4.071  -1.518  -0.213
   43    HE3  TRP   7           HE3      TRP   7  -0.553   1.403   2.573
   44    HZ2  TRP   7           HZ2      TRP   7  -1.401  -2.096  -0.878
   45    HZ3  TRP   7           HZ3      TRP   7   1.303   0.302   1.390
   46    HH2  TRP   7           HH2      TRP   7   0.894  -1.403  -0.308
   47    H    ALA   8           H        ALA   8  -2.103   4.181   3.723
   48    HA   ALA   8           HA       ALA   8  -0.842   5.171   1.253
   49   1HB   ALA   8          1HB       ALA   8   0.296   6.807   2.647
   50   2HB   ALA   8          2HB       ALA   8  -0.413   6.093   4.096
   51   3HB   ALA   8          3HB       ALA   8  -1.447   6.886   2.907
   52    H    CYS   9           H        CYS   9   0.772   3.959   0.542
   53    HA   CYS   9           HA       CYS   9   2.038   1.959   2.070
   54   1HB   CYS   9          1HB       CYS   9   1.769   2.009  -0.443
   55   2HB   CYS   9          2HB       CYS   9   3.084   3.180  -0.480
   56    H    GLN  10           H        GLN  10   4.361   1.789   2.475
   57    HA   GLN  10           HA       GLN  10   5.517   4.396   3.190
   58   1HB   GLN  10          1HB       GLN  10   6.703   3.182   5.026
   59   2HB   GLN  10          2HB       GLN  10   4.954   3.217   5.208
   60   1HG   GLN  10          1HG       GLN  10   6.096   0.879   3.811
   61   2HG   GLN  10          2HG       GLN  10   6.420   1.013   5.538
   62   1HE2  GLN  10          1HE2      GLN  10   4.274  -0.063   3.235
   63   2HE2  GLN  10          2HE2      GLN  10   2.892  -0.303   4.243
   64    H    HIS  11           H        HIS  11   5.849   3.094   0.661
   65    HA   HIS  11           HA       HIS  11   8.761   2.760   0.708
   66   1HB   HIS  11          1HB       HIS  11   7.232   0.553   0.488
   67   2HB   HIS  11          2HB       HIS  11   7.263   1.043  -1.203
   68    HD1  HIS  11           HD1      HIS  11   9.542  -0.068   1.578
   69    HD2  HIS  11           HD2      HIS  11   9.644   0.583  -2.524
   70    HE1  HIS  11           HE1      HIS  11  11.736  -1.016   0.803
   71    HE2  HIS  11           HE2      HIS  11  11.808  -0.532  -1.670
   72    H    CYS  12           H        CYS  12   5.973   2.807  -1.505
   73    HA   CYS  12           HA       CYS  12   7.445   4.392  -3.422
   74   1HB   CYS  12          1HB       CYS  12   5.259   4.245  -4.666
   75   2HB   CYS  12          2HB       CYS  12   6.057   2.714  -4.381
   76    H    THR  13           H        THR  13   4.903   4.677  -1.068
   77    HA   THR  13           HA       THR  13   4.124   6.483   0.073
   78    HB   THR  13           HB       THR  13   6.432   7.501  -0.696
   79    HG1  THR  13           HG1      THR  13   4.269   9.074   0.229
   80   1HG2  THR  13          1HG2      THR  13   4.991   9.770  -1.772
   81   2HG2  THR  13          2HG2      THR  13   4.952   8.376  -2.852
   82   3HG2  THR  13          3HG2      THR  13   6.498   9.027  -2.306
   83    H    PHE  14           H        PHE  14   2.720   5.219  -1.980
   84    HA   PHE  14           HA       PHE  14   1.106   7.440  -3.027
   85   1HB   PHE  14          1HB       PHE  14   2.221   6.157  -4.807
   86   2HB   PHE  14          2HB       PHE  14   1.464   4.687  -4.219
   87    HD1  PHE  14           HD1      PHE  14   0.443   8.132  -5.229
   88    HD2  PHE  14           HD2      PHE  14  -0.371   3.959  -5.371
   89    HE1  PHE  14           HE1      PHE  14  -1.499   8.564  -6.679
   90    HE2  PHE  14           HE2      PHE  14  -2.313   4.381  -6.821
   91    HZ   PHE  14           HZ       PHE  14  -2.879   6.688  -7.477
   92    H    MET  15           H        MET  15  -1.186   6.833  -3.362
   93    HA   MET  15           HA       MET  15  -2.187   5.522  -0.972
   94   1HB   MET  15          1HB       MET  15  -3.048   7.727  -2.275
   95   2HB   MET  15          2HB       MET  15  -4.079   6.522  -3.032
   96   1HG   MET  15          1HG       MET  15  -5.078   5.936  -0.991
   97   2HG   MET  15          2HG       MET  15  -3.836   6.766  -0.054
   98   1HE   MET  15          1HE       MET  15  -7.113   6.823  -1.787
   99   2HE   MET  15          2HE       MET  15  -6.404   7.823  -3.056
  100   3HE   MET  15          3HE       MET  15  -7.585   8.516  -1.943
  101    H    ASN  16           H        ASN  16  -3.611   3.791  -0.961
  102    HA   ASN  16           HA       ASN  16  -3.846   2.286  -3.464
  103   1HB   ASN  16          1HB       ASN  16  -1.868   1.731  -1.774
  104   2HB   ASN  16          2HB       ASN  16  -3.141   0.816  -0.996
  105   1HD2  ASN  16          1HD2      ASN  16  -1.308   1.238  -3.931
  106   2HD2  ASN  16          2HD2      ASN  16  -1.599  -0.338  -4.573
  107    H    GLN  17           H        GLN  17  -5.620   0.918  -3.604
  108    HA   GLN  17           HA       GLN  17  -7.888   1.592  -2.083
  109   1HB   GLN  17          1HB       GLN  17  -7.252  -0.363  -4.186
  110   2HB   GLN  17          2HB       GLN  17  -8.699  -0.664  -3.243
  111   1HG   GLN  17          1HG       GLN  17  -8.158   1.969  -4.576
  112   2HG   GLN  17          2HG       GLN  17  -8.960   0.638  -5.405
  113   1HE2  GLN  17          1HE2      GLN  17  -9.334   3.280  -3.345
  114   2HE2  GLN  17          2HE2      GLN  17 -10.984   3.023  -2.904
  115    HA   PRO  18           HA       PRO  18  -7.828  -1.213   1.318
  116   1HB   PRO  18          1HB       PRO  18 -10.401  -1.984   1.572
  117   2HB   PRO  18          2HB       PRO  18  -9.869  -0.337   1.919
  118   1HG   PRO  18          1HG       PRO  18 -11.204  -1.419  -0.528
  119   2HG   PRO  18          2HG       PRO  18 -11.510   0.099   0.335
  120   1HD   PRO  18          1HD       PRO  18 -10.022  -0.056  -1.941
  121   2HD   PRO  18          2HD       PRO  18  -9.763   1.177  -0.692
  122    H    GLY  19           H        GLY  19  -8.447  -2.415  -1.770
  123   1HA   GLY  19          1HA       GLY  19  -8.644  -5.187  -0.784
  124   2HA   GLY  19          2HA       GLY  19  -9.100  -4.655  -2.395
  125    H    THR  20           H        THR  20  -6.535  -2.958  -2.288
  126    HA   THR  20           HA       THR  20  -4.812  -5.052  -3.374
  127    HB   THR  20           HB       THR  20  -3.470  -2.793  -3.901
  128    HG1  THR  20           HG1      THR  20  -6.177  -1.965  -3.940
  129   1HG2  THR  20          1HG2      THR  20  -4.482  -4.471  -5.505
  130   2HG2  THR  20          2HG2      THR  20  -4.324  -2.803  -6.059
  131   3HG2  THR  20          3HG2      THR  20  -5.892  -3.413  -5.531
  132    H    GLY  21           H        GLY  21  -4.590  -5.674  -0.942
  133   1HA   GLY  21          1HA       GLY  21  -3.188  -4.189   0.908
  134   2HA   GLY  21          2HA       GLY  21  -3.054  -5.931   0.759
  135    H    HIS  22           H        HIS  22  -1.992  -5.745  -1.980
  136    HA   HIS  22           HA       HIS  22   0.763  -5.518  -1.275
  137   1HB   HIS  22          1HB       HIS  22  -0.676  -6.072  -3.867
  138   2HB   HIS  22          2HB       HIS  22   1.075  -5.895  -3.802
  139    HD1  HIS  22           HD1      HIS  22  -1.544  -7.953  -1.942
  140    HD2  HIS  22           HD2      HIS  22   2.291  -8.281  -3.507
  141    HE1  HIS  22           HE1      HIS  22  -0.848 -10.332  -1.522
  142    HE2  HIS  22           HE2      HIS  22   1.509 -10.484  -2.400
  143    H    CYS  23           H        CYS  23   0.265  -4.185  -4.386
  144    HA   CYS  23           HA       CYS  23  -0.247  -1.535  -3.910
  145   1HB   CYS  23          1HB       CYS  23   2.187  -2.184  -2.727
  146   2HB   CYS  23          2HB       CYS  23   2.626  -1.404  -4.226
  147    H    GLU  24           H        GLU  24  -0.021  -0.235  -5.721
  148    HA   GLU  24           HA       GLU  24   0.666  -1.697  -8.169
  149   1HB   GLU  24          1HB       GLU  24  -1.419   0.194  -7.450
  150   2HB   GLU  24          2HB       GLU  24  -0.558   0.704  -8.896
  151   1HG   GLU  24          1HG       GLU  24  -1.339  -2.130  -8.817
  152   2HG   GLU  24          2HG       GLU  24  -2.664  -0.969  -8.897
  153    H    MET  25           H        MET  25   2.576  -0.382  -6.312
  154    HA   MET  25           HA       MET  25   3.860   1.356  -8.295
  155   1HB   MET  25          1HB       MET  25   3.129   1.993  -5.502
  156   2HB   MET  25          2HB       MET  25   4.758   2.449  -5.981
  157   1HG   MET  25          1HG       MET  25   3.326   4.314  -6.335
  158   2HG   MET  25          2HG       MET  25   3.787   3.669  -7.910
  159   1HE   MET  25          1HE       MET  25   0.840   5.013  -9.009
  160   2HE   MET  25          2HE       MET  25   1.064   3.450  -9.796
  161   3HE   MET  25          3HE       MET  25   2.468   4.410  -9.327
  162    H    CYS  26           H        CYS  26   4.490  -0.127  -5.088
  163    HA   CYS  26           HA       CYS  26   7.200  -0.709  -5.897
  164   1HB   CYS  26          1HB       CYS  26   7.225  -1.798  -3.586
  165   2HB   CYS  26          2HB       CYS  26   7.070  -0.057  -3.654
  166    H    SER  27           H        SER  27   4.348  -2.578  -4.880
  167    HA   SER  27           HA       SER  27   3.585  -4.559  -5.881
  168   1HB   SER  27          1HB       SER  27   5.424  -4.310  -7.659
  169   2HB   SER  27          2HB       SER  27   6.415  -5.298  -6.587
  170    HG   SER  27           HG       SER  27   4.731  -6.889  -6.699
  171    H    LEU  28           H        LEU  28   4.381  -3.825  -3.306
  172    HA   LEU  28           HA       LEU  28   5.321  -6.366  -2.187
  173   1HB   LEU  28          1HB       LEU  28   5.959  -3.546  -1.658
  174   2HB   LEU  28          2HB       LEU  28   5.747  -4.534  -0.251
  175    HG   LEU  28           HG       LEU  28   7.681  -5.114  -2.483
  176   1HD1  LEU  28          1HD1      LEU  28   7.917  -3.555   0.022
  177   2HD1  LEU  28          2HD1      LEU  28   8.729  -3.347  -1.528
  178   3HD1  LEU  28          3HD1      LEU  28   9.261  -4.604  -0.411
  179   1HD2  LEU  28          1HD2      LEU  28   7.586  -6.362   0.252
  180   2HD2  LEU  28          2HD2      LEU  28   8.545  -6.853  -1.139
  181   3HD2  LEU  28          3HD2      LEU  28   6.804  -7.073  -1.158
  182    HA   PRO  29           HA       PRO  29   1.619  -6.482   0.228
  183   1HB   PRO  29          1HB       PRO  29   2.419  -7.428   2.612
  184   2HB   PRO  29          2HB       PRO  29   2.507  -8.408   1.143
  185   1HG   PRO  29          1HG       PRO  29   4.675  -6.917   2.559
  186   2HG   PRO  29          2HG       PRO  29   4.726  -8.519   1.803
  187   1HD   PRO  29          1HD       PRO  29   5.667  -6.209   0.627
  188   2HD   PRO  29          2HD       PRO  29   5.157  -7.648  -0.270
  189    H    ARG  30           H        ARG  30   0.411  -5.611   2.031
  190    HA   ARG  30           HA       ARG  30   1.113  -2.925   2.636
  191   1HB   ARG  30          1HB       ARG  30  -1.227  -4.339   2.543
  192   2HB   ARG  30          2HB       ARG  30  -0.998  -4.136   4.268
  193   1HG   ARG  30          1HG       ARG  30  -0.923  -1.749   4.039
  194   2HG   ARG  30          2HG       ARG  30  -0.966  -1.880   2.280
  195   1HD   ARG  30          1HD       ARG  30  -3.153  -1.306   3.438
  196   2HD   ARG  30          2HD       ARG  30  -3.192  -2.640   2.286
  197    HE   ARG  30           HE       ARG  30  -3.780  -4.024   3.998
  198   1HH1  ARG  30          1HH1      ARG  30  -2.309  -1.168   5.358
  199   2HH1  ARG  30          2HH1      ARG  30  -2.639  -1.624   6.995
  200   1HH2  ARG  30          1HH2      ARG  30  -4.216  -4.627   6.151
  201   2HH2  ARG  30          2HH2      ARG  30  -3.722  -3.588   7.446
  202    H    THR  31           H        THR  31   2.023  -5.801   3.980
  203    HA   THR  31           HA       THR  31   3.096  -4.441   6.312
  204    HB   THR  31           HB       THR  31   1.269  -6.837   6.423
  205    HG1  THR  31           HG1      THR  31  -0.051  -5.462   7.271
  206   1HG2  THR  31          1HG2      THR  31   1.738  -7.059   8.784
  207   2HG2  THR  31          2HG2      THR  31   2.965  -5.797   8.683
  208   3HG2  THR  31          3HG2      THR  31   3.205  -7.330   7.844
  Start of MODEL   11
    1   1H    GLY   1          1H        GLY   1 -18.602   4.344  -5.220
    2   2H    GLY   1          2H        GLY   1 -17.797   2.864  -5.368
    3   3H    GLY   1          3H        GLY   1 -17.433   3.899  -4.081
    4   1HA   GLY   1          1HA       GLY   1 -19.753   3.645  -3.282
    5   2HA   GLY   1          2HA       GLY   1 -19.966   2.422  -4.525
    6    H    SER   2           H        SER   2 -19.552   0.381  -3.985
    7    HA   SER   2           HA       SER   2 -18.862  -0.364  -1.376
    8   1HB   SER   2          1HB       SER   2 -18.775  -1.980  -3.934
    9   2HB   SER   2          2HB       SER   2 -18.643  -2.663  -2.313
   10    HG   SER   2           HG       SER   2 -20.731  -2.626  -2.236
   11    H    THR   3           H        THR   3 -16.939   0.660  -0.784
   12    HA   THR   3           HA       THR   3 -14.561  -0.808  -1.389
   13    HB   THR   3           HB       THR   3 -14.718   2.073  -2.299
   14    HG1  THR   3           HG1      THR   3 -14.643   1.281  -4.319
   15   1HG2  THR   3          1HG2      THR   3 -12.508   1.420  -1.355
   16   2HG2  THR   3          2HG2      THR   3 -12.477   1.876  -3.059
   17   3HG2  THR   3          3HG2      THR   3 -12.409   0.174  -2.600
   18    H    SER   4           H        SER   4 -13.681  -1.005   0.552
   19    HA   SER   4           HA       SER   4 -14.290   0.598   2.767
   20   1HB   SER   4          1HB       SER   4 -11.674  -0.777   2.828
   21   2HB   SER   4          2HB       SER   4 -13.033  -0.885   3.946
   22    HG   SER   4           HG       SER   4 -14.061  -2.271   2.488
   23    H    ALA   5           H        ALA   5 -11.905   1.204   4.019
   24    HA   ALA   5           HA       ALA   5 -11.231   3.680   2.702
   25   1HB   ALA   5          1HB       ALA   5 -10.264   2.505   5.307
   26   2HB   ALA   5          2HB       ALA   5 -11.573   3.669   5.101
   27   3HB   ALA   5          3HB       ALA   5  -9.912   4.134   4.730
   28    H    MET   6           H        MET   6  -9.357   4.209   1.703
   29    HA   MET   6           HA       MET   6  -7.660   2.105   0.791
   30   1HB   MET   6          1HB       MET   6  -7.690   5.087   0.455
   31   2HB   MET   6          2HB       MET   6  -6.337   4.139  -0.126
   32   1HG   MET   6          1HG       MET   6  -7.444   3.519  -1.940
   33   2HG   MET   6          2HG       MET   6  -8.830   2.991  -0.989
   34   1HE   MET   6          1HE       MET   6 -11.410   5.181  -1.215
   35   2HE   MET   6          2HE       MET   6 -10.465   6.086  -0.034
   36   3HE   MET   6          3HE       MET   6 -10.432   4.322  -0.025
   37    H    TRP   7           H        TRP   7  -5.152   2.774   0.796
   38    HA   TRP   7           HA       TRP   7  -4.381   3.597   3.489
   39   1HB   TRP   7          1HB       TRP   7  -2.784   1.712   3.688
   40   2HB   TRP   7          2HB       TRP   7  -4.464   1.212   3.705
   41    HD1  TRP   7           HD1      TRP   7  -5.366  -0.013   1.379
   42    HE1  TRP   7           HE1      TRP   7  -4.067  -1.505  -0.287
   43    HE3  TRP   7           HE3      TRP   7  -0.594   1.347   2.623
   44    HZ2  TRP   7           HZ2      TRP   7  -1.385  -2.035  -0.953
   45    HZ3  TRP   7           HZ3      TRP   7   1.281   0.304   1.418
   46    HH2  TRP   7           HH2      TRP   7   0.898  -1.344  -0.340
   47    H    ALA   8           H        ALA   8  -2.087   4.011   3.725
   48    HA   ALA   8           HA       ALA   8  -0.934   5.029   1.207
   49   1HB   ALA   8          1HB       ALA   8  -1.527   6.792   2.796
   50   2HB   ALA   8          2HB       ALA   8   0.219   6.708   2.561
   51   3HB   ALA   8          3HB       ALA   8  -0.507   6.037   4.022
   52    H    CYS   9           H        CYS   9   0.774   3.944   0.503
   53    HA   CYS   9           HA       CYS   9   2.063   1.946   2.021
   54   1HB   CYS   9          1HB       CYS   9   1.818   2.070  -0.512
   55   2HB   CYS   9          2HB       CYS   9   3.165   3.204  -0.481
   56    H    GLN  10           H        GLN  10   4.405   1.826   2.405
   57    HA   GLN  10           HA       GLN  10   5.499   4.445   3.171
   58   1HB   GLN  10          1HB       GLN  10   6.195   1.894   4.603
   59   2HB   GLN  10          2HB       GLN  10   6.388   3.551   5.157
   60   1HG   GLN  10          1HG       GLN  10   4.533   3.209   6.328
   61   2HG   GLN  10          2HG       GLN  10   3.680   3.358   4.793
   62   1HE2  GLN  10          1HE2      GLN  10   2.949   1.504   3.750
   63   2HE2  GLN  10          2HE2      GLN  10   2.819  -0.016   4.560
   64    H    HIS  11           H        HIS  11   5.877   3.095   0.654
   65    HA   HIS  11           HA       HIS  11   8.794   2.816   0.746
   66   1HB   HIS  11          1HB       HIS  11   7.315   0.582   0.535
   67   2HB   HIS  11          2HB       HIS  11   7.338   1.057  -1.160
   68    HD1  HIS  11           HD1      HIS  11   9.097  -1.020   1.050
   69    HD2  HIS  11           HD2      HIS  11  10.260   1.671  -1.894
   70    HE1  HIS  11           HE1      HIS  11  11.448  -1.671   0.431
   71    HE2  HIS  11           HE2      HIS  11  12.099  -0.083  -1.414
   72    H    CYS  12           H        CYS  12   6.047   2.784  -1.516
   73    HA   CYS  12           HA       CYS  12   7.516   4.375  -3.424
   74   1HB   CYS  12          1HB       CYS  12   5.356   4.194  -4.696
   75   2HB   CYS  12          2HB       CYS  12   6.145   2.667  -4.370
   76    H    THR  13           H        THR  13   4.965   4.652  -1.083
   77    HA   THR  13           HA       THR  13   4.152   6.448   0.039
   78    HB   THR  13           HB       THR  13   6.468   7.474  -0.684
   79    HG1  THR  13           HG1      THR  13   5.913   8.690   0.900
   80   1HG2  THR  13          1HG2      THR  13   5.056   9.746  -1.783
   81   2HG2  THR  13          2HG2      THR  13   5.015   8.354  -2.865
   82   3HG2  THR  13          3HG2      THR  13   6.561   8.989  -2.301
   83    H    PHE  14           H        PHE  14   2.772   5.189  -2.025
   84    HA   PHE  14           HA       PHE  14   1.177   7.414  -3.093
   85   1HB   PHE  14          1HB       PHE  14   2.304   6.110  -4.858
   86   2HB   PHE  14          2HB       PHE  14   1.517   4.653  -4.275
   87    HD1  PHE  14           HD1      PHE  14   0.549   8.116  -5.281
   88    HD2  PHE  14           HD2      PHE  14  -0.301   3.951  -5.470
   89    HE1  PHE  14           HE1      PHE  14  -1.368   8.579  -6.752
   90    HE2  PHE  14           HE2      PHE  14  -2.220   4.405  -6.941
   91    HZ   PHE  14           HZ       PHE  14  -2.755   6.721  -7.585
   92    H    MET  15           H        MET  15  -1.109   6.829  -3.440
   93    HA   MET  15           HA       MET  15  -2.144   5.521  -1.064
   94   1HB   MET  15          1HB       MET  15  -3.112   7.672  -1.765
   95   2HB   MET  15          2HB       MET  15  -3.582   6.966  -3.305
   96   1HG   MET  15          1HG       MET  15  -4.560   5.692  -0.806
   97   2HG   MET  15          2HG       MET  15  -5.287   7.212  -1.322
   98   1HE   MET  15          1HE       MET  15  -7.088   7.425  -3.002
   99   2HE   MET  15          2HE       MET  15  -7.257   6.405  -4.431
  100   3HE   MET  15          3HE       MET  15  -5.801   7.374  -4.207
  101    H    ASN  16           H        ASN  16  -3.612   3.813  -1.085
  102    HA   ASN  16           HA       ASN  16  -3.803   2.316  -3.595
  103   1HB   ASN  16          1HB       ASN  16  -1.874   1.726  -1.865
  104   2HB   ASN  16          2HB       ASN  16  -3.177   0.831  -1.107
  105   1HD2  ASN  16          1HD2      ASN  16  -1.217   1.186  -3.955
  106   2HD2  ASN  16          2HD2      ASN  16  -1.548  -0.372  -4.625
  107    H    GLN  17           H        GLN  17  -5.547   0.882  -3.742
  108    HA   GLN  17           HA       GLN  17  -7.881   1.623  -2.358
  109   1HB   GLN  17          1HB       GLN  17  -7.146  -0.432  -4.331
  110   2HB   GLN  17          2HB       GLN  17  -8.637  -0.686  -3.446
  111   1HG   GLN  17          1HG       GLN  17  -8.014   1.867  -4.897
  112   2HG   GLN  17          2HG       GLN  17  -8.811   0.499  -5.671
  113   1HE2  GLN  17          1HE2      GLN  17  -9.112   3.087  -3.403
  114   2HE2  GLN  17          2HE2      GLN  17 -10.816   2.953  -3.151
  115    HA   PRO  18           HA       PRO  18  -7.958  -1.032   1.161
  116   1HB   PRO  18          1HB       PRO  18 -10.540  -1.774   1.361
  117   2HB   PRO  18          2HB       PRO  18 -10.014  -0.109   1.634
  118   1HG   PRO  18          1HG       PRO  18 -11.255  -1.329  -0.802
  119   2HG   PRO  18          2HG       PRO  18 -11.601   0.232  -0.032
  120   1HD   PRO  18          1HD       PRO  18 -10.019  -0.033  -2.234
  121   2HD   PRO  18          2HD       PRO  18  -9.815   1.263  -1.041
  122    H    GLY  19           H        GLY  19  -8.473  -2.359  -1.895
  123   1HA   GLY  19          1HA       GLY  19  -8.716  -5.088  -0.805
  124   2HA   GLY  19          2HA       GLY  19  -9.114  -4.620  -2.451
  125    H    THR  20           H        THR  20  -6.564  -2.934  -2.393
  126    HA   THR  20           HA       THR  20  -4.806  -5.090  -3.285
  127    HB   THR  20           HB       THR  20  -3.456  -2.836  -3.885
  128    HG1  THR  20           HG1      THR  20  -6.180  -2.105  -4.135
  129   1HG2  THR  20          1HG2      THR  20  -5.719  -3.472  -5.683
  130   2HG2  THR  20          2HG2      THR  20  -4.504  -4.711  -5.368
  131   3HG2  THR  20          3HG2      THR  20  -4.024  -3.159  -6.054
  132    H    GLY  21           H        GLY  21  -4.491  -5.692  -0.945
  133   1HA   GLY  21          1HA       GLY  21  -3.195  -4.052   0.899
  134   2HA   GLY  21          2HA       GLY  21  -3.042  -5.799   0.840
  135    H    HIS  22           H        HIS  22  -1.956  -5.744  -1.893
  136    HA   HIS  22           HA       HIS  22   0.787  -5.484  -1.185
  137   1HB   HIS  22          1HB       HIS  22  -0.644  -6.110  -3.763
  138   2HB   HIS  22          2HB       HIS  22   1.104  -5.906  -3.713
  139    HD1  HIS  22           HD1      HIS  22  -1.386  -7.895  -1.615
  140    HD2  HIS  22           HD2      HIS  22   2.272  -8.324  -3.539
  141    HE1  HIS  22           HE1      HIS  22  -0.675 -10.268  -1.183
  142    HE2  HIS  22           HE2      HIS  22   1.582 -10.478  -2.283
  143    H    CYS  23           H        CYS  23   0.281  -4.216  -4.330
  144    HA   CYS  23           HA       CYS  23  -0.218  -1.557  -3.906
  145   1HB   CYS  23          1HB       CYS  23   2.214  -2.179  -2.716
  146   2HB   CYS  23          2HB       CYS  23   2.656  -1.444  -4.238
  147    H    GLU  24           H        GLU  24   0.060  -0.265  -5.730
  148    HA   GLU  24           HA       GLU  24   0.729  -1.772  -8.159
  149   1HB   GLU  24          1HB       GLU  24  -1.378   0.106  -7.470
  150   2HB   GLU  24          2HB       GLU  24  -0.521   0.606  -8.921
  151   1HG   GLU  24          1HG       GLU  24  -0.870  -1.910  -9.595
  152   2HG   GLU  24          2HG       GLU  24  -2.194  -1.800  -8.436
  153    H    MET  25           H        MET  25   2.615  -0.402  -6.312
  154    HA   MET  25           HA       MET  25   3.887   1.324  -8.315
  155   1HB   MET  25          1HB       MET  25   3.146   1.980  -5.527
  156   2HB   MET  25          2HB       MET  25   4.770   2.448  -6.010
  157   1HG   MET  25          1HG       MET  25   3.304   4.291  -6.375
  158   2HG   MET  25          2HG       MET  25   3.800   3.652  -7.942
  159   1HE   MET  25          1HE       MET  25   0.092   4.980  -8.402
  160   2HE   MET  25          2HE       MET  25   1.682   4.976  -9.166
  161   3HE   MET  25          3HE       MET  25   1.483   5.646  -7.547
  162    H    CYS  26           H        CYS  26   4.505  -0.147  -5.102
  163    HA   CYS  26           HA       CYS  26   7.226  -0.709  -5.893
  164   1HB   CYS  26          1HB       CYS  26   7.282  -1.732  -3.571
  165   2HB   CYS  26          2HB       CYS  26   7.038  -0.001  -3.658
  166    H    SER  27           H        SER  27   4.353  -2.568  -4.914
  167    HA   SER  27           HA       SER  27   3.624  -4.583  -5.848
  168   1HB   SER  27          1HB       SER  27   5.455  -4.316  -7.644
  169   2HB   SER  27          2HB       SER  27   6.451  -5.304  -6.576
  170    HG   SER  27           HG       SER  27   3.996  -6.001  -7.803
  171    H    LEU  28           H        LEU  28   4.407  -3.811  -3.302
  172    HA   LEU  28           HA       LEU  28   5.453  -6.294  -2.144
  173   1HB   LEU  28          1HB       LEU  28   5.943  -3.441  -1.659
  174   2HB   LEU  28          2HB       LEU  28   5.756  -4.403  -0.231
  175    HG   LEU  28           HG       LEU  28   7.751  -4.919  -2.422
  176   1HD1  LEU  28          1HD1      LEU  28   8.695  -3.099  -1.452
  177   2HD1  LEU  28          2HD1      LEU  28   9.275  -4.326  -0.328
  178   3HD1  LEU  28          3HD1      LEU  28   7.867  -3.347   0.085
  179   1HD2  LEU  28          1HD2      LEU  28   8.661  -6.624  -1.077
  180   2HD2  LEU  28          2HD2      LEU  28   6.922  -6.905  -1.078
  181   3HD2  LEU  28          3HD2      LEU  28   7.694  -6.154   0.318
  182    HA   PRO  29           HA       PRO  29   1.756  -6.605   0.259
  183   1HB   PRO  29          1HB       PRO  29   2.589  -7.274   2.734
  184   2HB   PRO  29          2HB       PRO  29   2.763  -8.364   1.354
  185   1HG   PRO  29          1HG       PRO  29   4.801  -6.600   2.648
  186   2HG   PRO  29          2HG       PRO  29   4.977  -8.252   2.030
  187   1HD   PRO  29          1HD       PRO  29   5.774  -6.006   0.666
  188   2HD   PRO  29          2HD       PRO  29   5.341  -7.534  -0.115
  189    H    ARG  30           H        ARG  30   0.465  -5.762   2.061
  190    HA   ARG  30           HA       ARG  30   0.837  -2.967   2.400
  191   1HB   ARG  30          1HB       ARG  30  -1.297  -4.703   2.519
  192   2HB   ARG  30          2HB       ARG  30  -1.089  -4.226   4.192
  193   1HG   ARG  30          1HG       ARG  30  -0.916  -1.834   2.856
  194   2HG   ARG  30          2HG       ARG  30  -2.134  -2.720   1.936
  195   1HD   ARG  30          1HD       ARG  30  -3.312  -1.548   3.612
  196   2HD   ARG  30          2HD       ARG  30  -3.249  -3.227   4.147
  197    HE   ARG  30           HE       ARG  30  -1.088  -1.694   5.197
  198   1HH1  ARG  30          1HH1      ARG  30  -4.481  -2.392   5.618
  199   2HH1  ARG  30          2HH1      ARG  30  -4.477  -2.015   7.308
  200   1HH2  ARG  30          1HH2      ARG  30  -1.080  -1.199   7.420
  201   2HH2  ARG  30          2HH2      ARG  30  -2.547  -1.337   8.331
  202    H    THR  31           H        THR  31   2.154  -5.554   3.965
  203    HA   THR  31           HA       THR  31   3.039  -3.862   6.153
  204    HB   THR  31           HB       THR  31   1.587  -6.481   6.504
  205    HG1  THR  31           HG1      THR  31   1.218  -3.970   7.761
  206   1HG2  THR  31          1HG2      THR  31   3.548  -6.595   7.934
  207   2HG2  THR  31          2HG2      THR  31   2.082  -6.366   8.889
  208   3HG2  THR  31          3HG2      THR  31   3.167  -5.005   8.599
  Start of MODEL   12
    1   1H    GLY   1          1H        GLY   1 -18.641   3.367  -0.552
    2   2H    GLY   1          2H        GLY   1 -19.771   4.500  -1.099
    3   3H    GLY   1          3H        GLY   1 -18.916   3.555  -2.210
    4   1HA   GLY   1          1HA       GLY   1 -21.051   2.708  -0.348
    5   2HA   GLY   1          2HA       GLY   1 -21.044   2.598  -2.101
    6    H    SER   2           H        SER   2 -18.707   1.441  -2.714
    7    HA   SER   2           HA       SER   2 -18.978  -1.204  -1.478
    8   1HB   SER   2          1HB       SER   2 -18.016  -0.251  -4.156
    9   2HB   SER   2          2HB       SER   2 -17.508  -1.827  -3.549
   10    HG   SER   2           HG       SER   2 -19.630  -1.463  -4.844
   11    H    THR   3           H        THR   3 -16.677   1.356  -2.108
   12    HA   THR   3           HA       THR   3 -14.433  -0.175  -1.113
   13    HB   THR   3           HB       THR   3 -14.643   2.757  -1.827
   14    HG1  THR   3           HG1      THR   3 -14.349   2.143  -3.800
   15   1HG2  THR   3          1HG2      THR   3 -12.059   1.353  -1.962
   16   2HG2  THR   3          2HG2      THR   3 -12.661   1.738  -0.350
   17   3HG2  THR   3          3HG2      THR   3 -12.431   3.023  -1.535
   18    H    SER   4           H        SER   4 -13.420   0.063   0.844
   19    HA   SER   4           HA       SER   4 -15.013   1.318   2.938
   20   1HB   SER   4          1HB       SER   4 -12.847  -0.742   2.873
   21   2HB   SER   4          2HB       SER   4 -13.097   0.173   4.359
   22    HG   SER   4           HG       SER   4 -15.188  -0.586   4.455
   23    H    ALA   5           H        ALA   5 -11.483   1.027   2.664
   24    HA   ALA   5           HA       ALA   5 -11.115   3.881   2.545
   25   1HB   ALA   5          1HB       ALA   5 -11.618   3.535   4.935
   26   2HB   ALA   5          2HB       ALA   5  -9.983   4.136   4.665
   27   3HB   ALA   5          3HB       ALA   5 -10.245   2.433   5.043
   28    H    MET   6           H        MET   6  -9.280   4.314   1.491
   29    HA   MET   6           HA       MET   6  -7.571   2.200   0.636
   30   1HB   MET   6          1HB       MET   6  -7.515   5.189   0.309
   31   2HB   MET   6          2HB       MET   6  -6.238   4.170  -0.319
   32   1HG   MET   6          1HG       MET   6  -7.449   3.537  -2.073
   33   2HG   MET   6          2HG       MET   6  -8.879   3.243  -1.086
   34   1HE   MET   6          1HE       MET   6 -11.169   5.888  -1.632
   35   2HE   MET   6          2HE       MET   6 -10.232   6.171  -0.165
   36   3HE   MET   6          3HE       MET   6 -10.612   4.523  -0.664
   37    H    TRP   7           H        TRP   7  -5.064   2.794   0.712
   38    HA   TRP   7           HA       TRP   7  -4.358   3.662   3.412
   39   1HB   TRP   7          1HB       TRP   7  -2.763   1.771   3.655
   40   2HB   TRP   7          2HB       TRP   7  -4.448   1.292   3.675
   41    HD1  TRP   7           HD1      TRP   7  -5.354   0.016   1.384
   42    HE1  TRP   7           HE1      TRP   7  -4.066  -1.522  -0.247
   43    HE3  TRP   7           HE3      TRP   7  -0.567   1.371   2.588
   44    HZ2  TRP   7           HZ2      TRP   7  -1.392  -2.090  -0.905
   45    HZ3  TRP   7           HZ3      TRP   7   1.297   0.286   1.404
   46    HH2  TRP   7           HH2      TRP   7   0.898  -1.402  -0.316
   47    H    ALA   8           H        ALA   8  -2.107   4.124   3.714
   48    HA   ALA   8           HA       ALA   8  -0.880   5.122   1.228
   49   1HB   ALA   8          1HB       ALA   8   0.182   6.826   2.529
   50   2HB   ALA   8          2HB       ALA   8  -0.337   6.073   4.038
   51   3HB   ALA   8          3HB       ALA   8  -1.527   6.803   2.961
   52    H    CYS   9           H        CYS   9   0.767   3.952   0.522
   53    HA   CYS   9           HA       CYS   9   2.040   1.955   2.050
   54   1HB   CYS   9          1HB       CYS   9   1.783   2.033  -0.472
   55   2HB   CYS   9          2HB       CYS   9   3.114   3.188  -0.480
   56    H    GLN  10           H        GLN  10   4.375   1.805   2.446
   57    HA   GLN  10           HA       GLN  10   5.500   4.418   3.188
   58   1HB   GLN  10          1HB       GLN  10   6.200   1.859   4.603
   59   2HB   GLN  10          2HB       GLN  10   6.404   3.514   5.161
   60   1HG   GLN  10          1HG       GLN  10   4.562   3.163   6.354
   61   2HG   GLN  10          2HG       GLN  10   3.695   3.340   4.829
   62   1HE2  GLN  10          1HE2      GLN  10   2.917   1.516   3.782
   63   2HE2  GLN  10          2HE2      GLN  10   2.789  -0.017   4.568
   64    H    HIS  11           H        HIS  11   5.854   3.095   0.661
   65    HA   HIS  11           HA       HIS  11   8.771   2.798   0.728
   66   1HB   HIS  11          1HB       HIS  11   7.255   0.576   0.503
   67   2HB   HIS  11          2HB       HIS  11   7.316   1.057  -1.189
   68    HD1  HIS  11           HD1      HIS  11   9.498   0.709  -2.432
   69    HD2  HIS  11           HD2      HIS  11   9.772  -0.125   1.629
   70    HE1  HIS  11           HE1      HIS  11  11.730  -0.413  -2.125
   71    HE2  HIS  11           HE2      HIS  11  11.829  -0.985   0.325
   72    H    CYS  12           H        CYS  12   5.995   2.808  -1.501
   73    HA   CYS  12           HA       CYS  12   7.464   4.393  -3.418
   74   1HB   CYS  12          1HB       CYS  12   5.290   4.227  -4.674
   75   2HB   CYS  12          2HB       CYS  12   6.085   2.699  -4.367
   76    H    THR  13           H        THR  13   4.914   4.674  -1.072
   77    HA   THR  13           HA       THR  13   4.121   6.478   0.059
   78    HB   THR  13           HB       THR  13   6.431   7.501  -0.694
   79    HG1  THR  13           HG1      THR  13   4.217   8.966   0.276
   80   1HG2  THR  13          1HG2      THR  13   4.962   8.372  -2.862
   81   2HG2  THR  13          2HG2      THR  13   6.504   9.021  -2.309
   82   3HG2  THR  13          3HG2      THR  13   4.996   9.767  -1.784
   83    H    PHE  14           H        PHE  14   2.729   5.210  -1.997
   84    HA   PHE  14           HA       PHE  14   1.121   7.429  -3.058
   85   1HB   PHE  14          1HB       PHE  14   2.240   6.133  -4.829
   86   2HB   PHE  14          2HB       PHE  14   1.475   4.669  -4.238
   87    HD1  PHE  14           HD1      PHE  14   0.474   8.117  -5.265
   88    HD2  PHE  14           HD2      PHE  14  -0.361   3.946  -5.395
   89    HE1  PHE  14           HE1      PHE  14  -1.460   8.553  -6.723
   90    HE2  PHE  14           HE2      PHE  14  -2.295   4.374  -6.853
   91    HZ   PHE  14           HZ       PHE  14  -2.848   6.680  -7.518
   92    H    MET  15           H        MET  15  -1.170   6.825  -3.398
   93    HA   MET  15           HA       MET  15  -2.183   5.527  -1.007
   94   1HB   MET  15          1HB       MET  15  -3.034   7.728  -2.317
   95   2HB   MET  15          2HB       MET  15  -4.059   6.524  -3.084
   96   1HG   MET  15          1HG       MET  15  -5.267   6.150  -1.211
   97   2HG   MET  15          2HG       MET  15  -3.901   6.446  -0.137
   98   1HE   MET  15          1HE       MET  15  -6.127   7.152   0.985
   99   2HE   MET  15          2HE       MET  15  -6.822   8.769   0.870
  100   3HE   MET  15          3HE       MET  15  -5.275   8.529   1.684
  101    H    ASN  16           H        ASN  16  -3.599   3.794  -0.990
  102    HA   ASN  16           HA       ASN  16  -3.838   2.281  -3.487
  103   1HB   ASN  16          1HB       ASN  16  -1.857   1.728  -1.801
  104   2HB   ASN  16          2HB       ASN  16  -3.129   0.817  -1.014
  105   1HD2  ASN  16          1HD2      ASN  16  -1.285   1.216  -3.942
  106   2HD2  ASN  16          2HD2      ASN  16  -1.589  -0.358  -4.584
  107    H    GLN  17           H        GLN  17  -5.608   0.912  -3.620
  108    HA   GLN  17           HA       GLN  17  -7.878   1.591  -2.104
  109   1HB   GLN  17          1HB       GLN  17  -7.237  -0.369  -4.200
  110   2HB   GLN  17          2HB       GLN  17  -8.679  -0.680  -3.253
  111   1HG   GLN  17          1HG       GLN  17  -8.171   1.962  -4.579
  112   2HG   GLN  17          2HG       GLN  17  -8.940   0.621  -5.425
  113   1HE2  GLN  17          1HE2      GLN  17  -9.404   3.270  -3.420
  114   2HE2  GLN  17          2HE2      GLN  17 -11.045   2.969  -2.971
  115    HA   PRO  18           HA       PRO  18  -7.806  -1.212   1.302
  116   1HB   PRO  18          1HB       PRO  18 -10.376  -1.974   1.577
  117   2HB   PRO  18          2HB       PRO  18  -9.840  -0.322   1.906
  118   1HG   PRO  18          1HG       PRO  18 -11.193  -1.427  -0.522
  119   2HG   PRO  18          2HG       PRO  18 -11.491   0.099   0.327
  120   1HD   PRO  18          1HD       PRO  18 -10.014  -0.085  -1.957
  121   2HD   PRO  18          2HD       PRO  18  -9.756   1.167  -0.728
  122    H    GLY  19           H        GLY  19  -8.427  -2.414  -1.780
  123   1HA   GLY  19          1HA       GLY  19  -8.634  -5.186  -0.794
  124   2HA   GLY  19          2HA       GLY  19  -9.087  -4.653  -2.407
  125    H    THR  20           H        THR  20  -6.526  -2.961  -2.319
  126    HA   THR  20           HA       THR  20  -4.800  -5.063  -3.387
  127    HB   THR  20           HB       THR  20  -3.460  -2.802  -3.925
  128    HG1  THR  20           HG1      THR  20  -6.170  -1.987  -3.984
  129   1HG2  THR  20          1HG2      THR  20  -4.453  -2.740  -6.085
  130   2HG2  THR  20          2HG2      THR  20  -5.872  -3.614  -5.509
  131   3HG2  THR  20          3HG2      THR  20  -4.305  -4.422  -5.576
  132    H    GLY  21           H        GLY  21  -4.585  -5.667  -0.951
  133   1HA   GLY  21          1HA       GLY  21  -3.183  -4.172   0.891
  134   2HA   GLY  21          2HA       GLY  21  -3.050  -5.915   0.753
  135    H    HIS  22           H        HIS  22  -1.985  -5.747  -1.986
  136    HA   HIS  22           HA       HIS  22   0.769  -5.520  -1.281
  137   1HB   HIS  22          1HB       HIS  22  -0.668  -6.075  -3.872
  138   2HB   HIS  22          2HB       HIS  22   1.082  -5.900  -3.808
  139    HD1  HIS  22           HD1      HIS  22  -1.532  -7.949  -1.932
  140    HD2  HIS  22           HD2      HIS  22   2.292  -8.290  -3.521
  141    HE1  HIS  22           HE1      HIS  22  -0.838 -10.329  -1.511
  142    HE2  HIS  22           HE2      HIS  22   1.443 -10.535  -2.559
  143    H    CYS  23           H        CYS  23   0.279  -4.191  -4.393
  144    HA   CYS  23           HA       CYS  23  -0.233  -1.541  -3.926
  145   1HB   CYS  23          1HB       CYS  23   2.192  -2.183  -2.727
  146   2HB   CYS  23          2HB       CYS  23   2.643  -1.415  -4.229
  147    H    GLU  24           H        GLU  24  -0.013  -0.250  -5.741
  148    HA   GLU  24           HA       GLU  24   0.697  -1.713  -8.182
  149   1HB   GLU  24          1HB       GLU  24  -1.401   0.170  -7.477
  150   2HB   GLU  24          2HB       GLU  24  -0.534   0.683  -8.918
  151   1HG   GLU  24          1HG       GLU  24  -0.897  -1.830  -9.616
  152   2HG   GLU  24          2HG       GLU  24  -2.234  -1.710  -8.471
  153    H    MET  25           H        MET  25   2.594  -0.395  -6.321
  154    HA   MET  25           HA       MET  25   3.880   1.352  -8.296
  155   1HB   MET  25          1HB       MET  25   3.141   1.979  -5.500
  156   2HB   MET  25          2HB       MET  25   4.766   2.449  -5.984
  157   1HG   MET  25          1HG       MET  25   2.612   3.169  -7.856
  158   2HG   MET  25          2HG       MET  25   2.594   3.996  -6.299
  159   1HE   MET  25          1HE       MET  25   5.407   2.615  -8.573
  160   2HE   MET  25          2HE       MET  25   6.144   4.071  -9.231
  161   3HE   MET  25          3HE       MET  25   4.527   3.588  -9.746
  162    H    CYS  26           H        CYS  26   4.501  -0.133  -5.089
  163    HA   CYS  26           HA       CYS  26   7.216  -0.706  -5.889
  164   1HB   CYS  26          1HB       CYS  26   7.241  -1.789  -3.577
  165   2HB   CYS  26          2HB       CYS  26   7.070  -0.049  -3.646
  166    H    SER  27           H        SER  27   4.362  -2.581  -4.883
  167    HA   SER  27           HA       SER  27   3.610  -4.566  -5.881
  168   1HB   SER  27          1HB       SER  27   5.457  -4.312  -7.653
  169   2HB   SER  27          2HB       SER  27   6.444  -5.300  -6.576
  170    HG   SER  27           HG       SER  27   4.603  -6.822  -6.665
  171    H    LEU  28           H        LEU  28   4.391  -3.826  -3.305
  172    HA   LEU  28           HA       LEU  28   5.342  -6.360  -2.177
  173   1HB   LEU  28          1HB       LEU  28   5.959  -3.537  -1.650
  174   2HB   LEU  28          2HB       LEU  28   5.745  -4.521  -0.243
  175    HG   LEU  28           HG       LEU  28   7.691  -5.091  -2.463
  176   1HD1  LEU  28          1HD1      LEU  28   8.499  -3.167  -1.390
  177   2HD1  LEU  28          2HD1      LEU  28   9.375  -4.506  -0.648
  178   3HD1  LEU  28          3HD1      LEU  28   8.021  -3.753   0.204
  179   1HD2  LEU  28          1HD2      LEU  28   8.563  -6.828  -1.114
  180   2HD2  LEU  28          2HD2      LEU  28   6.813  -7.055  -1.142
  181   3HD2  LEU  28          3HD2      LEU  28   7.593  -6.342   0.272
  182    HA   PRO  29           HA       PRO  29   1.628  -6.497   0.219
  183   1HB   PRO  29          1HB       PRO  29   2.423  -7.428   2.611
  184   2HB   PRO  29          2HB       PRO  29   2.525  -8.414   1.146
  185   1HG   PRO  29          1HG       PRO  29   4.675  -6.900   2.568
  186   2HG   PRO  29          2HG       PRO  29   4.742  -8.504   1.819
  187   1HD   PRO  29          1HD       PRO  29   5.673  -6.193   0.637
  188   2HD   PRO  29          2HD       PRO  29   5.177  -7.640  -0.256
  189    H    ARG  30           H        ARG  30   0.406  -5.633   2.018
  190    HA   ARG  30           HA       ARG  30   1.079  -2.938   2.615
  191   1HB   ARG  30          1HB       ARG  30  -1.247  -4.374   2.519
  192   2HB   ARG  30          2HB       ARG  30  -1.026  -4.164   4.244
  193   1HG   ARG  30          1HG       ARG  30  -0.993  -1.785   4.025
  194   2HG   ARG  30          2HG       ARG  30  -0.985  -1.903   2.264
  195   1HD   ARG  30          1HD       ARG  30  -3.210  -1.365   3.386
  196   2HD   ARG  30          2HD       ARG  30  -3.202  -2.664   2.195
  197    HE   ARG  30           HE       ARG  30  -2.816  -3.567   4.896
  198   1HH1  ARG  30          1HH1      ARG  30  -5.180  -2.745   2.465
  199   2HH1  ARG  30          2HH1      ARG  30  -6.427  -3.718   3.169
  200   1HH2  ARG  30          1HH2      ARG  30  -4.455  -4.849   5.824
  201   2HH2  ARG  30          2HH2      ARG  30  -6.016  -4.912   5.077
  202    H    THR  31           H        THR  31   2.013  -5.800   3.973
  203    HA   THR  31           HA       THR  31   3.065  -4.422   6.304
  204    HB   THR  31           HB       THR  31   1.264  -6.838   6.416
  205    HG1  THR  31           HG1      THR  31   1.217  -4.414   7.881
  206   1HG2  THR  31          1HG2      THR  31   3.208  -7.293   7.846
  207   2HG2  THR  31          2HG2      THR  31   1.728  -7.055   8.774
  208   3HG2  THR  31          3HG2      THR  31   2.928  -5.767   8.685
  Start of MODEL   13
    1   1H    GLY   1          1H        GLY   1 -10.736   7.965  -7.871
    2   2H    GLY   1          2H        GLY   1  -9.837   6.839  -6.984
    3   3H    GLY   1          3H        GLY   1 -10.547   8.159  -6.200
    4   1HA   GLY   1          1HA       GLY   1 -12.740   7.335  -6.615
    5   2HA   GLY   1          2HA       GLY   1 -12.078   6.031  -7.588
    6    H    SER   2           H        SER   2 -13.066   6.986  -4.504
    7    HA   SER   2           HA       SER   2 -11.563   4.905  -3.125
    8   1HB   SER   2          1HB       SER   2 -12.656   5.795  -1.085
    9   2HB   SER   2          2HB       SER   2 -11.803   7.048  -1.984
   10    HG   SER   2           HG       SER   2 -13.767   7.763  -2.792
   11    H    THR   3           H        THR   3 -12.475   3.104  -2.172
   12    HA   THR   3           HA       THR   3 -15.231   2.489  -3.013
   13    HB   THR   3           HB       THR   3 -13.537   1.102  -4.138
   14    HG1  THR   3           HG1      THR   3 -15.282  -0.097  -3.949
   15   1HG2  THR   3          1HG2      THR   3 -11.869   1.130  -2.267
   16   2HG2  THR   3          2HG2      THR   3 -12.153  -0.444  -3.011
   17   3HG2  THR   3          3HG2      THR   3 -12.881  -0.062  -1.451
   18    H    SER   4           H        SER   4 -12.825   2.096  -0.453
   19    HA   SER   4           HA       SER   4 -14.973   2.008   1.509
   20   1HB   SER   4          1HB       SER   4 -13.874  -0.373   0.676
   21   2HB   SER   4          2HB       SER   4 -12.907   0.009   2.100
   22    HG   SER   4           HG       SER   4 -14.650  -1.055   2.874
   23    H    ALA   5           H        ALA   5 -11.484   1.289   1.574
   24    HA   ALA   5           HA       ALA   5 -10.872   3.810   2.826
   25   1HB   ALA   5          1HB       ALA   5  -9.942   2.794   4.886
   26   2HB   ALA   5          2HB       ALA   5 -10.678   1.261   4.420
   27   3HB   ALA   5          3HB       ALA   5 -11.696   2.657   4.768
   28    H    MET   6           H        MET   6  -9.252   4.232   1.418
   29    HA   MET   6           HA       MET   6  -7.393   2.266   0.535
   30   1HB   MET   6          1HB       MET   6  -7.350   5.276   0.366
   31   2HB   MET   6          2HB       MET   6  -6.210   4.226  -0.442
   32   1HG   MET   6          1HG       MET   6  -7.596   4.327  -2.174
   33   2HG   MET   6          2HG       MET   6  -8.599   3.199  -1.264
   34   1HE   MET   6          1HE       MET   6  -9.645   7.266  -2.700
   35   2HE   MET   6          2HE       MET   6  -9.625   5.735  -3.576
   36   3HE   MET   6          3HE       MET   6  -8.129   6.390  -2.908
   37    H    TRP   7           H        TRP   7  -4.972   2.795   0.747
   38    HA   TRP   7           HA       TRP   7  -4.330   3.739   3.441
   39   1HB   TRP   7          1HB       TRP   7  -2.712   1.848   3.709
   40   2HB   TRP   7          2HB       TRP   7  -4.401   1.381   3.755
   41    HD1  TRP   7           HD1      TRP   7  -5.342   0.043   1.538
   42    HE1  TRP   7           HE1      TRP   7  -4.093  -1.502  -0.113
   43    HE3  TRP   7           HE3      TRP   7  -0.535   1.473   2.560
   44    HZ2  TRP   7           HZ2      TRP   7  -1.434  -2.045  -0.856
   45    HZ3  TRP   7           HZ3      TRP   7   1.301   0.392   1.328
   46    HH2  TRP   7           HH2      TRP   7   0.866  -1.324  -0.352
   47    H    ALA   8           H        ALA   8  -2.073   4.212   3.773
   48    HA   ALA   8           HA       ALA   8  -0.829   5.200   1.295
   49   1HB   ALA   8          1HB       ALA   8  -1.425   6.905   2.977
   50   2HB   ALA   8          2HB       ALA   8   0.309   6.841   2.666
   51   3HB   ALA   8          3HB       ALA   8  -0.350   6.115   4.132
   52    H    CYS   9           H        CYS   9   0.780   3.987   0.571
   53    HA   CYS   9           HA       CYS   9   2.048   1.976   2.077
   54   1HB   CYS   9          1HB       CYS   9   1.760   2.076  -0.445
   55   2HB   CYS   9          2HB       CYS   9   3.114   3.203  -0.458
   56    H    GLN  10           H        GLN  10   4.384   1.798   2.450
   57    HA   GLN  10           HA       GLN  10   5.543   4.395   3.193
   58   1HB   GLN  10          1HB       GLN  10   6.234   1.819   4.581
   59   2HB   GLN  10          2HB       GLN  10   6.464   3.466   5.148
   60   1HG   GLN  10          1HG       GLN  10   4.633   3.127   6.361
   61   2HG   GLN  10          2HG       GLN  10   3.749   3.325   4.849
   62   1HE2  GLN  10          1HE2      GLN  10   2.938   1.517   3.798
   63   2HE2  GLN  10          2HE2      GLN  10   2.804  -0.020   4.575
   64    H    HIS  11           H        HIS  11   5.860   3.092   0.653
   65    HA   HIS  11           HA       HIS  11   8.773   2.769   0.687
   66   1HB   HIS  11          1HB       HIS  11   7.445   0.527   0.551
   67   2HB   HIS  11          2HB       HIS  11   7.097   1.027  -1.101
   68    HD1  HIS  11           HD1      HIS  11   8.940   0.764  -2.814
   69    HD2  HIS  11           HD2      HIS  11  10.208   0.003   1.069
   70    HE1  HIS  11           HE1      HIS  11  11.237  -0.219  -3.041
   71    HE2  HIS  11           HE2      HIS  11  12.023  -0.592  -0.674
   72    H    CYS  12           H        CYS  12   5.970   2.833  -1.504
   73    HA   CYS  12           HA       CYS  12   7.433   4.417  -3.428
   74   1HB   CYS  12          1HB       CYS  12   5.234   4.282  -4.656
   75   2HB   CYS  12          2HB       CYS  12   6.031   2.747  -4.382
   76    H    THR  13           H        THR  13   4.893   4.698  -1.066
   77    HA   THR  13           HA       THR  13   4.136   6.504   0.094
   78    HB   THR  13           HB       THR  13   6.438   7.521  -0.695
   79    HG1  THR  13           HG1      THR  13   5.853   8.578   0.996
   80   1HG2  THR  13          1HG2      THR  13   6.488   9.065  -2.291
   81   2HG2  THR  13          2HG2      THR  13   4.976   9.792  -1.748
   82   3HG2  THR  13          3HG2      THR  13   4.947   8.403  -2.833
   83    H    PHE  14           H        PHE  14   2.723   5.252  -1.972
   84    HA   PHE  14           HA       PHE  14   1.083   7.479  -2.963
   85   1HB   PHE  14          1HB       PHE  14   2.210   6.269  -4.780
   86   2HB   PHE  14          2HB       PHE  14   1.492   4.766  -4.229
   87    HD1  PHE  14           HD1      PHE  14   0.386   8.210  -5.154
   88    HD2  PHE  14           HD2      PHE  14  -0.332   4.023  -5.387
   89    HE1  PHE  14           HE1      PHE  14  -1.569   8.630  -6.588
   90    HE2  PHE  14           HE2      PHE  14  -2.288   4.433  -6.822
   91    HZ   PHE  14           HZ       PHE  14  -2.909   6.740  -7.425
   92    H    MET  15           H        MET  15  -1.207   6.844  -3.313
   93    HA   MET  15           HA       MET  15  -2.179   5.460  -0.948
   94   1HB   MET  15          1HB       MET  15  -3.083   7.682  -2.129
   95   2HB   MET  15          2HB       MET  15  -4.047   6.514  -3.023
   96   1HG   MET  15          1HG       MET  15  -5.320   5.983  -1.236
   97   2HG   MET  15          2HG       MET  15  -4.000   6.208  -0.089
   98   1HE   MET  15          1HE       MET  15  -4.554   8.520   1.773
   99   2HE   MET  15          2HE       MET  15  -5.410   7.001   1.501
  100   3HE   MET  15          3HE       MET  15  -6.304   8.520   1.556
  101    H    ASN  16           H        ASN  16  -3.636   3.737  -0.992
  102    HA   ASN  16           HA       ASN  16  -3.791   2.257  -3.515
  103   1HB   ASN  16          1HB       ASN  16  -1.876   1.697  -1.741
  104   2HB   ASN  16          2HB       ASN  16  -3.174   0.748  -1.052
  105   1HD2  ASN  16          1HD2      ASN  16  -1.330   1.331  -3.974
  106   2HD2  ASN  16          2HD2      ASN  16  -1.520  -0.252  -4.637
  107    H    GLN  17           H        GLN  17  -5.482   0.729  -3.641
  108    HA   GLN  17           HA       GLN  17  -7.859   1.441  -2.317
  109   1HB   GLN  17          1HB       GLN  17  -7.042  -0.685  -4.188
  110   2HB   GLN  17          2HB       GLN  17  -8.557  -0.902  -3.333
  111   1HG   GLN  17          1HG       GLN  17  -7.921   1.598  -4.863
  112   2HG   GLN  17          2HG       GLN  17  -8.643   0.184  -5.628
  113   1HE2  GLN  17          1HE2      GLN  17  -9.096   2.698  -3.243
  114   2HE2  GLN  17          2HE2      GLN  17 -10.817   2.575  -3.155
  115    HA   PRO  18           HA       PRO  18  -7.928  -1.051   1.318
  116   1HB   PRO  18          1HB       PRO  18 -10.499  -1.864   1.476
  117   2HB   PRO  18          2HB       PRO  18 -10.019  -0.183   1.728
  118   1HG   PRO  18          1HG       PRO  18 -11.161  -1.478  -0.718
  119   2HG   PRO  18          2HG       PRO  18 -11.574   0.082   0.018
  120   1HD   PRO  18          1HD       PRO  18  -9.939  -0.140  -2.136
  121   2HD   PRO  18          2HD       PRO  18  -9.766   1.149  -0.928
  122    H    GLY  19           H        GLY  19  -8.494  -2.513  -1.706
  123   1HA   GLY  19          1HA       GLY  19  -8.522  -5.199  -0.485
  124   2HA   GLY  19          2HA       GLY  19  -9.095  -4.830  -2.104
  125    H    THR  20           H        THR  20  -6.565  -2.995  -2.150
  126    HA   THR  20           HA       THR  20  -4.838  -5.047  -3.297
  127    HB   THR  20           HB       THR  20  -3.545  -2.847  -3.930
  128    HG1  THR  20           HG1      THR  20  -5.041  -1.116  -4.160
  129   1HG2  THR  20          1HG2      THR  20  -6.193  -3.399  -5.225
  130   2HG2  THR  20          2HG2      THR  20  -4.721  -4.323  -5.524
  131   3HG2  THR  20          3HG2      THR  20  -4.788  -2.613  -5.944
  132    H    GLY  21           H        GLY  21  -4.635  -5.583  -0.784
  133   1HA   GLY  21          1HA       GLY  21  -3.159  -4.117   0.991
  134   2HA   GLY  21          2HA       GLY  21  -3.028  -5.860   0.852
  135    H    HIS  22           H        HIS  22  -2.010  -5.703  -1.904
  136    HA   HIS  22           HA       HIS  22   0.754  -5.461  -1.247
  137   1HB   HIS  22          1HB       HIS  22  -0.719  -6.039  -3.815
  138   2HB   HIS  22          2HB       HIS  22   1.033  -5.867  -3.771
  139    HD1  HIS  22           HD1      HIS  22  -1.481  -7.844  -1.687
  140    HD2  HIS  22           HD2      HIS  22   2.157  -8.308  -3.641
  141    HE1  HIS  22           HE1      HIS  22  -0.809 -10.235  -1.295
  142    HE2  HIS  22           HE2      HIS  22   1.438 -10.469  -2.414
  143    H    CYS  23           H        CYS  23   0.226  -4.165  -4.364
  144    HA   CYS  23           HA       CYS  23  -0.290  -1.509  -3.906
  145   1HB   CYS  23          1HB       CYS  23   2.167  -2.141  -2.760
  146   2HB   CYS  23          2HB       CYS  23   2.576  -1.372  -4.275
  147    H    GLU  24           H        GLU  24   0.058  -0.165  -5.719
  148    HA   GLU  24           HA       GLU  24   0.637  -1.675  -8.171
  149   1HB   GLU  24          1HB       GLU  24  -1.413   0.248  -7.438
  150   2HB   GLU  24          2HB       GLU  24  -0.566   0.737  -8.899
  151   1HG   GLU  24          1HG       GLU  24  -1.017  -1.898  -9.390
  152   2HG   GLU  24          2HG       GLU  24  -2.444  -1.459  -8.451
  153    H    MET  25           H        MET  25   2.562  -0.326  -6.321
  154    HA   MET  25           HA       MET  25   3.861   1.352  -8.349
  155   1HB   MET  25          1HB       MET  25   2.808   2.312  -5.940
  156   2HB   MET  25          2HB       MET  25   4.536   2.173  -5.652
  157   1HG   MET  25          1HG       MET  25   3.907   4.392  -6.455
  158   2HG   MET  25          2HG       MET  25   5.006   3.571  -7.563
  159   1HE   MET  25          1HE       MET  25   4.775   4.733  -9.520
  160   2HE   MET  25          2HE       MET  25   3.417   4.663 -10.642
  161   3HE   MET  25          3HE       MET  25   4.312   3.195 -10.248
  162    H    CYS  26           H        CYS  26   4.478  -0.084  -5.117
  163    HA   CYS  26           HA       CYS  26   7.185  -0.691  -5.907
  164   1HB   CYS  26          1HB       CYS  26   7.203  -1.750  -3.589
  165   2HB   CYS  26          2HB       CYS  26   7.022  -0.011  -3.668
  166    H    SER  27           H        SER  27   4.306  -2.540  -4.918
  167    HA   SER  27           HA       SER  27   3.553  -4.536  -5.876
  168   1HB   SER  27          1HB       SER  27   5.373  -4.266  -7.681
  169   2HB   SER  27          2HB       SER  27   6.368  -5.272  -6.629
  170    HG   SER  27           HG       SER  27   3.862  -5.950  -7.775
  171    H    LEU  28           H        LEU  28   4.352  -3.801  -3.325
  172    HA   LEU  28           HA       LEU  28   5.394  -6.306  -2.208
  173   1HB   LEU  28          1HB       LEU  28   5.886  -3.460  -1.671
  174   2HB   LEU  28          2HB       LEU  28   5.704  -4.451  -0.264
  175    HG   LEU  28           HG       LEU  28   7.692  -4.924  -2.471
  176   1HD1  LEU  28          1HD1      LEU  28   8.657  -3.134  -1.481
  177   2HD1  LEU  28          2HD1      LEU  28   9.211  -4.371  -0.347
  178   3HD1  LEU  28          3HD1      LEU  28   7.805  -3.375   0.044
  179   1HD2  LEU  28          1HD2      LEU  28   7.628  -6.210   0.248
  180   2HD2  LEU  28          2HD2      LEU  28   8.622  -6.646  -1.144
  181   3HD2  LEU  28          3HD2      LEU  28   6.885  -6.940  -1.173
  182    HA   PRO  29           HA       PRO  29   1.690  -6.635   0.184
  183   1HB   PRO  29          1HB       PRO  29   2.523  -7.493   2.591
  184   2HB   PRO  29          2HB       PRO  29   2.683  -8.488   1.139
  185   1HG   PRO  29          1HG       PRO  29   4.744  -6.843   2.547
  186   2HG   PRO  29          2HG       PRO  29   4.900  -8.451   1.820
  187   1HD   PRO  29          1HD       PRO  29   5.714  -6.115   0.609
  188   2HD   PRO  29          2HD       PRO  29   5.286  -7.594  -0.267
  189    H    ARG  30           H        ARG  30   0.424  -5.850   2.005
  190    HA   ARG  30           HA       ARG  30   0.910  -3.105   2.554
  191   1HB   ARG  30          1HB       ARG  30  -1.305  -4.721   2.508
  192   2HB   ARG  30          2HB       ARG  30  -1.089  -4.437   4.222
  193   1HG   ARG  30          1HG       ARG  30  -1.195  -2.055   3.899
  194   2HG   ARG  30          2HG       ARG  30  -1.267  -2.268   2.149
  195   1HD   ARG  30          1HD       ARG  30  -3.488  -2.142   2.447
  196   2HD   ARG  30          2HD       ARG  30  -3.341  -3.823   2.957
  197    HE   ARG  30           HE       ARG  30  -2.950  -1.986   5.111
  198   1HH1  ARG  30          1HH1      ARG  30  -5.375  -3.611   3.199
  199   2HH1  ARG  30          2HH1      ARG  30  -6.583  -3.534   4.437
  200   1HH2  ARG  30          1HH2      ARG  30  -4.538  -1.882   6.741
  201   2HH2  ARG  30          2HH2      ARG  30  -6.109  -2.551   6.448
  202    H    THR  31           H        THR  31   2.070  -5.869   3.939
  203    HA   THR  31           HA       THR  31   3.027  -4.384   6.246
  204    HB   THR  31           HB       THR  31   1.425  -6.935   6.402
  205    HG1  THR  31           HG1      THR  31   1.190  -4.504   7.837
  206   1HG2  THR  31          1HG2      THR  31   3.133  -5.720   8.562
  207   2HG2  THR  31          2HG2      THR  31   3.308  -7.320   7.841
  208   3HG2  THR  31          3HG2      THR  31   1.893  -6.947   8.825
  Start of MODEL   14
    1   1H    GLY   1          1H        GLY   1 -19.362   4.949  -5.927
    2   2H    GLY   1          2H        GLY   1 -19.729   3.455  -6.632
    3   3H    GLY   1          3H        GLY   1 -19.000   4.670  -7.556
    4   1HA   GLY   1          1HA       GLY   1 -17.397   2.965  -6.935
    5   2HA   GLY   1          2HA       GLY   1 -16.991   4.537  -6.263
    6    H    SER   2           H        SER   2 -17.959   1.289  -5.582
    7    HA   SER   2           HA       SER   2 -18.395   1.719  -2.770
    8   1HB   SER   2          1HB       SER   2 -18.377  -0.638  -4.600
    9   2HB   SER   2          2HB       SER   2 -18.143  -0.928  -2.877
   10    HG   SER   2           HG       SER   2 -20.271   0.645  -3.876
   11    H    THR   3           H        THR   3 -16.872   1.900  -1.275
   12    HA   THR   3           HA       THR   3 -14.506   0.293  -1.286
   13    HB   THR   3           HB       THR   3 -14.190   3.272  -1.700
   14    HG1  THR   3           HG1      THR   3 -13.613   2.809  -3.702
   15   1HG2  THR   3          1HG2      THR   3 -12.486   1.886  -0.247
   16   2HG2  THR   3          2HG2      THR   3 -11.946   3.100  -1.406
   17   3HG2  THR   3          3HG2      THR   3 -11.905   1.391  -1.836
   18    H    SER   4           H        SER   4 -13.540   0.200   0.716
   19    HA   SER   4           HA       SER   4 -15.066   1.358   2.888
   20   1HB   SER   4          1HB       SER   4 -12.767  -0.604   2.816
   21   2HB   SER   4          2HB       SER   4 -13.496  -0.023   4.313
   22    HG   SER   4           HG       SER   4 -15.538  -0.806   3.361
   23    H    ALA   5           H        ALA   5 -11.542   0.984   2.631
   24    HA   ALA   5           HA       ALA   5 -11.087   3.822   2.825
   25   1HB   ALA   5          1HB       ALA   5  -9.808   3.632   4.972
   26   2HB   ALA   5          2HB       ALA   5 -10.522   2.033   5.181
   27   3HB   ALA   5          3HB       ALA   5 -11.556   3.460   5.132
   28    H    MET   6           H        MET   6  -9.337   4.226   1.652
   29    HA   MET   6           HA       MET   6  -7.615   2.142   0.751
   30   1HB   MET   6          1HB       MET   6  -7.627   5.129   0.432
   31   2HB   MET   6          2HB       MET   6  -6.323   4.151  -0.202
   32   1HG   MET   6          1HG       MET   6  -7.499   3.734  -2.021
   33   2HG   MET   6          2HG       MET   6  -8.755   2.977  -1.043
   34   1HE   MET   6          1HE       MET   6  -9.435   5.294  -3.979
   35   2HE   MET   6          2HE       MET   6  -7.766   5.213  -3.416
   36   3HE   MET   6          3HE       MET   6  -8.655   6.734  -3.323
   37    H    TRP   7           H        TRP   7  -5.119   2.783   0.776
   38    HA   TRP   7           HA       TRP   7  -4.363   3.641   3.464
   39   1HB   TRP   7          1HB       TRP   7  -2.757   1.761   3.677
   40   2HB   TRP   7          2HB       TRP   7  -4.437   1.262   3.707
   41    HD1  TRP   7           HD1      TRP   7  -5.348   0.008   1.401
   42    HE1  TRP   7           HE1      TRP   7  -4.056  -1.504  -0.252
   43    HE3  TRP   7           HE3      TRP   7  -0.568   1.385   2.602
   44    HZ2  TRP   7           HZ2      TRP   7  -1.380  -2.040  -0.928
   45    HZ3  TRP   7           HZ3      TRP   7   1.300   0.327   1.399
   46    HH2  TRP   7           HH2      TRP   7   0.906  -1.344  -0.338
   47    H    ALA   8           H        ALA   8  -2.089   4.086   3.715
   48    HA   ALA   8           HA       ALA   8  -0.917   5.090   1.202
   49   1HB   ALA   8          1HB       ALA   8  -1.538   6.823   2.846
   50   2HB   ALA   8          2HB       ALA   8   0.195   6.791   2.519
   51   3HB   ALA   8          3HB       ALA   8  -0.434   6.089   4.009
   52    H    CYS   9           H        CYS   9   0.770   3.974   0.498
   53    HA   CYS   9           HA       CYS   9   2.060   1.986   2.026
   54   1HB   CYS   9          1HB       CYS   9   1.808   2.085  -0.504
   55   2HB   CYS   9          2HB       CYS   9   3.149   3.226  -0.491
   56    H    GLN  10           H        GLN  10   4.399   1.862   2.414
   57    HA   GLN  10           HA       GLN  10   5.501   4.483   3.159
   58   1HB   GLN  10          1HB       GLN  10   6.203   1.937   4.594
   59   2HB   GLN  10          2HB       GLN  10   6.398   3.596   5.142
   60   1HG   GLN  10          1HG       GLN  10   4.550   3.252   6.325
   61   2HG   GLN  10          2HG       GLN  10   3.689   3.403   4.793
   62   1HE2  GLN  10          1HE2      GLN  10   2.945   1.553   3.758
   63   2HE2  GLN  10          2HE2      GLN  10   2.820   0.032   4.567
   64    H    HIS  11           H        HIS  11   5.870   3.131   0.644
   65    HA   HIS  11           HA       HIS  11   8.788   2.854   0.726
   66   1HB   HIS  11          1HB       HIS  11   7.598   0.580   0.637
   67   2HB   HIS  11          2HB       HIS  11   7.083   1.042  -0.982
   68    HD1  HIS  11           HD1      HIS  11   8.773   0.829  -2.852
   69    HD2  HIS  11           HD2      HIS  11  10.414   0.188   0.908
   70    HE1  HIS  11           HE1      HIS  11  11.087  -0.059  -3.273
   71    HE2  HIS  11           HE2      HIS  11  12.087  -0.357  -0.985
   72    H    CYS  12           H        CYS  12   6.030   2.822  -1.522
   73    HA   CYS  12           HA       CYS  12   7.492   4.406  -3.441
   74   1HB   CYS  12          1HB       CYS  12   5.326   4.221  -4.704
   75   2HB   CYS  12          2HB       CYS  12   6.121   2.696  -4.381
   76    H    THR  13           H        THR  13   4.943   4.688  -1.098
   77    HA   THR  13           HA       THR  13   4.134   6.489   0.022
   78    HB   THR  13           HB       THR  13   6.445   7.516  -0.718
   79    HG1  THR  13           HG1      THR  13   5.957   8.961   0.723
   80   1HG2  THR  13          1HG2      THR  13   6.528   9.027  -2.340
   81   2HG2  THR  13          2HG2      THR  13   5.020   9.780  -1.821
   82   3HG2  THR  13          3HG2      THR  13   4.984   8.382  -2.895
   83    H    PHE  14           H        PHE  14   2.753   5.218  -2.035
   84    HA   PHE  14           HA       PHE  14   1.146   7.434  -3.106
   85   1HB   PHE  14          1HB       PHE  14   2.271   6.134  -4.870
   86   2HB   PHE  14          2HB       PHE  14   1.503   4.671  -4.278
   87    HD1  PHE  14           HD1      PHE  14  -0.326   3.946  -5.443
   88    HD2  PHE  14           HD2      PHE  14   0.504   8.118  -5.310
   89    HE1  PHE  14           HE1      PHE  14  -2.256   4.372  -6.908
   90    HE2  PHE  14           HE2      PHE  14  -1.426   8.552  -6.775
   91    HZ   PHE  14           HZ       PHE  14  -2.808   6.678  -7.575
   92    H    MET  15           H        MET  15  -1.142   6.835  -3.447
   93    HA   MET  15           HA       MET  15  -2.162   5.540  -1.058
   94   1HB   MET  15          1HB       MET  15  -3.005   7.738  -2.395
   95   2HB   MET  15          2HB       MET  15  -4.047   6.525  -3.125
   96   1HG   MET  15          1HG       MET  15  -5.036   5.980  -1.067
   97   2HG   MET  15          2HG       MET  15  -3.787   6.823  -0.153
   98   1HE   MET  15          1HE       MET  15  -6.948   6.716  -1.849
   99   2HE   MET  15          2HE       MET  15  -6.668   7.994  -3.031
  100   3HE   MET  15          3HE       MET  15  -7.702   8.295  -1.634
  101    H    ASN  16           H        ASN  16  -3.605   3.822  -1.050
  102    HA   ASN  16           HA       ASN  16  -3.820   2.301  -3.545
  103   1HB   ASN  16          1HB       ASN  16  -1.867   1.743  -1.826
  104   2HB   ASN  16          2HB       ASN  16  -3.157   0.839  -1.057
  105   1HD2  ASN  16          1HD2      ASN  16  -1.258   1.223  -3.952
  106   2HD2  ASN  16          2HD2      ASN  16  -1.563  -0.349  -4.600
  107    H    GLN  17           H        GLN  17  -5.581   0.902  -3.676
  108    HA   GLN  17           HA       GLN  17  -7.878   1.623  -2.222
  109   1HB   GLN  17          1HB       GLN  17  -7.200  -0.381  -4.262
  110   2HB   GLN  17          2HB       GLN  17  -8.658  -0.675  -3.335
  111   1HG   GLN  17          1HG       GLN  17  -8.130   1.941  -4.705
  112   2HG   GLN  17          2HG       GLN  17  -8.884   0.582  -5.536
  113   1HE2  GLN  17          1HE2      GLN  17  -9.392   3.276  -3.615
  114   2HE2  GLN  17          2HE2      GLN  17 -11.037   2.980  -3.181
  115    HA   PRO  18           HA       PRO  18  -7.880  -1.104   1.244
  116   1HB   PRO  18          1HB       PRO  18 -10.454  -1.864   1.485
  117   2HB   PRO  18          2HB       PRO  18  -9.932  -0.202   1.777
  118   1HG   PRO  18          1HG       PRO  18 -11.224  -1.382  -0.649
  119   2HG   PRO  18          2HG       PRO  18 -11.550   0.167   0.153
  120   1HD   PRO  18          1HD       PRO  18 -10.018  -0.072  -2.091
  121   2HD   PRO  18          2HD       PRO  18  -9.796   1.215  -0.891
  122    H    GLY  19           H        GLY  19  -8.439  -2.384  -1.821
  123   1HA   GLY  19          1HA       GLY  19  -8.644  -5.131  -0.766
  124   2HA   GLY  19          2HA       GLY  19  -9.090  -4.642  -2.394
  125    H    THR  20           H        THR  20  -6.533  -2.936  -2.328
  126    HA   THR  20           HA       THR  20  -4.796  -5.058  -3.335
  127    HB   THR  20           HB       THR  20  -3.458  -2.806  -3.916
  128    HG1  THR  20           HG1      THR  20  -6.171  -2.008  -4.017
  129   1HG2  THR  20          1HG2      THR  20  -4.314  -4.492  -5.519
  130   2HG2  THR  20          2HG2      THR  20  -4.394  -2.824  -6.088
  131   3HG2  THR  20          3HG2      THR  20  -5.853  -3.632  -5.514
  132    H    GLY  21           H        GLY  21  -4.563  -5.627  -0.906
  133   1HA   GLY  21          1HA       GLY  21  -3.180  -4.072   0.911
  134   2HA   GLY  21          2HA       GLY  21  -3.042  -5.819   0.816
  135    H    HIS  22           H        HIS  22  -1.979  -5.717  -1.926
  136    HA   HIS  22           HA       HIS  22   0.773  -5.482  -1.233
  137   1HB   HIS  22          1HB       HIS  22  -0.670  -6.061  -3.818
  138   2HB   HIS  22          2HB       HIS  22   1.082  -5.895  -3.756
  139    HD1  HIS  22           HD1      HIS  22  -1.449  -7.850  -1.674
  140    HD2  HIS  22           HD2      HIS  22   2.187  -8.344  -3.623
  141    HE1  HIS  22           HE1      HIS  22  -0.790 -10.244  -1.272
  142    HE2  HIS  22           HE2      HIS  22   1.455 -10.495  -2.389
  143    H    CYS  23           H        CYS  23   0.285  -4.190  -4.362
  144    HA   CYS  23           HA       CYS  23  -0.214  -1.532  -3.926
  145   1HB   CYS  23          1HB       CYS  23   2.209  -2.168  -2.722
  146   2HB   CYS  23          2HB       CYS  23   2.661  -1.418  -4.234
  147    H    GLU  24           H        GLU  24   0.024  -0.258  -5.752
  148    HA   GLU  24           HA       GLU  24   0.731  -1.750  -8.178
  149   1HB   GLU  24          1HB       GLU  24  -1.375   0.133  -7.497
  150   2HB   GLU  24          2HB       GLU  24  -0.507   0.635  -8.941
  151   1HG   GLU  24          1HG       GLU  24  -1.266  -2.204  -8.836
  152   2HG   GLU  24          2HG       GLU  24  -2.599  -1.055  -8.940
  153    H    MET  25           H        MET  25   2.618  -0.401  -6.323
  154    HA   MET  25           HA       MET  25   3.902   1.330  -8.313
  155   1HB   MET  25          1HB       MET  25   3.158   1.978  -5.523
  156   2HB   MET  25          2HB       MET  25   4.780   2.452  -6.011
  157   1HG   MET  25          1HG       MET  25   3.320   4.295  -6.374
  158   2HG   MET  25          2HG       MET  25   3.790   3.647  -7.945
  159   1HE   MET  25          1HE       MET  25   0.563   4.221  -9.467
  160   2HE   MET  25          2HE       MET  25   1.703   2.926  -9.833
  161   3HE   MET  25          3HE       MET  25   2.298   4.514  -9.347
  162    H    CYS  26           H        CYS  26   4.515  -0.133  -5.095
  163    HA   CYS  26           HA       CYS  26   7.233  -0.704  -5.883
  164   1HB   CYS  26          1HB       CYS  26   7.271  -1.744  -3.560
  165   2HB   CYS  26          2HB       CYS  26   7.063  -0.008  -3.647
  166    H    SER  27           H        SER  27   4.371  -2.570  -4.880
  167    HA   SER  27           HA       SER  27   3.637  -4.578  -5.836
  168   1HB   SER  27          1HB       SER  27   5.476  -4.317  -7.621
  169   2HB   SER  27          2HB       SER  27   6.466  -5.304  -6.547
  170    HG   SER  27           HG       SER  27   4.946  -6.265  -8.306
  171    H    LEU  28           H        LEU  28   4.398  -3.817  -3.280
  172    HA   LEU  28           HA       LEU  28   5.447  -6.303  -2.129
  173   1HB   LEU  28          1HB       LEU  28   5.891  -3.448  -1.599
  174   2HB   LEU  28          2HB       LEU  28   5.699  -4.435  -0.190
  175    HG   LEU  28           HG       LEU  28   7.731  -4.893  -2.358
  176   1HD1  LEU  28          1HD1      LEU  28   7.786  -3.338   0.159
  177   2HD1  LEU  28          2HD1      LEU  28   8.644  -3.074  -1.361
  178   3HD1  LEU  28          3HD1      LEU  28   9.214  -4.300  -0.231
  179   1HD2  LEU  28          1HD2      LEU  28   7.638  -6.161   0.369
  180   2HD2  LEU  28          2HD2      LEU  28   8.659  -6.589  -1.000
  181   3HD2  LEU  28          3HD2      LEU  28   6.927  -6.910  -1.062
  182    HA   PRO  29           HA       PRO  29   1.705  -6.668   0.198
  183   1HB   PRO  29          1HB       PRO  29   2.506  -7.521   2.616
  184   2HB   PRO  29          2HB       PRO  29   2.706  -8.510   1.165
  185   1HG   PRO  29          1HG       PRO  29   4.719  -6.840   2.613
  186   2HG   PRO  29          2HG       PRO  29   4.909  -8.446   1.890
  187   1HD   PRO  29          1HD       PRO  29   5.713  -6.098   0.693
  188   2HD   PRO  29          2HD       PRO  29   5.323  -7.582  -0.190
  189    H    ARG  30           H        ARG  30   0.391  -5.884   1.974
  190    HA   ARG  30           HA       ARG  30   0.857  -3.141   2.549
  191   1HB   ARG  30          1HB       ARG  30  -1.355  -4.756   2.435
  192   2HB   ARG  30          2HB       ARG  30  -1.186  -4.483   4.156
  193   1HG   ARG  30          1HG       ARG  30  -1.278  -2.096   3.840
  194   2HG   ARG  30          2HG       ARG  30  -1.314  -2.305   2.089
  195   1HD   ARG  30          1HD       ARG  30  -3.540  -2.206   2.315
  196   2HD   ARG  30          2HD       ARG  30  -3.404  -3.868   2.885
  197    HE   ARG  30           HE       ARG  30  -3.084  -1.907   4.961
  198   1HH1  ARG  30          1HH1      ARG  30  -5.389  -3.792   3.139
  199   2HH1  ARG  30          2HH1      ARG  30  -6.609  -3.717   4.366
  200   1HH2  ARG  30          1HH2      ARG  30  -4.687  -1.809   6.576
  201   2HH2  ARG  30          2HH2      ARG  30  -6.211  -2.592   6.318
  202    H    THR  31           H        THR  31   1.979  -5.910   3.955
  203    HA   THR  31           HA       THR  31   2.874  -4.435   6.291
  204    HB   THR  31           HB       THR  31   1.263  -6.982   6.396
  205    HG1  THR  31           HG1      THR  31  -0.165  -5.773   7.383
  206   1HG2  THR  31          1HG2      THR  31   1.684  -7.100   8.785
  207   2HG2  THR  31          2HG2      THR  31   2.827  -5.762   8.662
  208   3HG2  THR  31          3HG2      THR  31   3.180  -7.299   7.872
  Start of MODEL   15
    1   1H    GLY   1          1H        GLY   1 -11.376   5.463  -7.212
    2   2H    GLY   1          2H        GLY   1 -11.586   5.075  -5.579
    3   3H    GLY   1          3H        GLY   1 -12.858   5.767  -6.454
    4   1HA   GLY   1          1HA       GLY   1 -12.723   3.736  -7.953
    5   2HA   GLY   1          2HA       GLY   1 -11.752   3.034  -6.668
    6    H    SER   2           H        SER   2 -13.307   4.519  -4.609
    7    HA   SER   2           HA       SER   2 -15.073   4.141  -3.227
    8   1HB   SER   2          1HB       SER   2 -16.365   3.716  -5.916
    9   2HB   SER   2          2HB       SER   2 -17.280   3.553  -4.418
   10    HG   SER   2           HG       SER   2 -16.410   5.739  -3.941
   11    H    THR   3           H        THR   3 -14.775   2.462  -1.915
   12    HA   THR   3           HA       THR   3 -15.986  -0.029  -2.364
   13    HB   THR   3           HB       THR   3 -14.293  -0.626  -3.885
   14    HG1  THR   3           HG1      THR   3 -14.597  -2.134  -2.120
   15   1HG2  THR   3          1HG2      THR   3 -12.683   1.101  -3.613
   16   2HG2  THR   3          2HG2      THR   3 -11.871  -0.441  -3.347
   17   3HG2  THR   3          3HG2      THR   3 -12.311   0.572  -1.973
   18    H    SER   4           H        SER   4 -13.375   1.681  -0.712
   19    HA   SER   4           HA       SER   4 -14.439   1.346   1.844
   20   1HB   SER   4          1HB       SER   4 -13.108  -0.990   0.908
   21   2HB   SER   4          2HB       SER   4 -12.102  -0.271   2.164
   22    HG   SER   4           HG       SER   4 -14.063  -0.201   3.459
   23    H    ALA   5           H        ALA   5 -12.148   1.275   3.419
   24    HA   ALA   5           HA       ALA   5 -11.066   3.891   2.863
   25   1HB   ALA   5          1HB       ALA   5 -10.503   1.973   5.121
   26   2HB   ALA   5          2HB       ALA   5 -11.660   3.304   5.142
   27   3HB   ALA   5          3HB       ALA   5  -9.932   3.638   5.026
   28    H    MET   6           H        MET   6  -9.334   4.236   1.655
   29    HA   MET   6           HA       MET   6  -7.626   2.119   0.794
   30   1HB   MET   6          1HB       MET   6  -7.640   5.097   0.411
   31   2HB   MET   6          2HB       MET   6  -6.301   4.122  -0.157
   32   1HG   MET   6          1HG       MET   6  -7.459   3.930  -2.044
   33   2HG   MET   6          2HG       MET   6  -8.450   2.771  -1.160
   34   1HE   MET   6          1HE       MET   6  -8.063   5.517  -3.156
   35   2HE   MET   6          2HE       MET   6  -9.068   6.862  -2.616
   36   3HE   MET   6          3HE       MET   6  -9.746   5.624  -3.673
   37    H    TRP   7           H        TRP   7  -5.128   2.772   0.823
   38    HA   TRP   7           HA       TRP   7  -4.380   3.639   3.512
   39   1HB   TRP   7          1HB       TRP   7  -2.766   1.758   3.716
   40   2HB   TRP   7          2HB       TRP   7  -4.447   1.259   3.755
   41    HD1  TRP   7           HD1      TRP   7  -5.376   0.017   1.457
   42    HE1  TRP   7           HE1      TRP   7  -4.103  -1.478  -0.223
   43    HE3  TRP   7           HE3      TRP   7  -0.585   1.388   2.616
   44    HZ2  TRP   7           HZ2      TRP   7  -1.431  -2.006  -0.934
   45    HZ3  TRP   7           HZ3      TRP   7   1.271   0.343   1.383
   46    HH2  TRP   7           HH2      TRP   7   0.861  -1.312  -0.363
   47    H    ALA   8           H        ALA   8  -2.080   4.057   3.754
   48    HA   ALA   8           HA       ALA   8  -0.928   5.069   1.233
   49   1HB   ALA   8          1HB       ALA   8  -1.504   6.825   2.837
   50   2HB   ALA   8          2HB       ALA   8   0.240   6.736   2.585
   51   3HB   ALA   8          3HB       ALA   8  -0.475   6.062   4.049
   52    H    CYS   9           H        CYS   9   0.757   3.953   0.517
   53    HA   CYS   9           HA       CYS   9   2.040   1.948   2.026
   54   1HB   CYS   9          1HB       CYS   9   1.783   2.050  -0.499
   55   2HB   CYS   9          2HB       CYS   9   3.113   3.205  -0.492
   56    H    GLN  10           H        GLN  10   4.361   1.800   2.433
   57    HA   GLN  10           HA       GLN  10   5.493   4.409   3.179
   58   1HB   GLN  10          1HB       GLN  10   6.710   3.090   4.988
   59   2HB   GLN  10          2HB       GLN  10   4.984   3.331   5.218
   60   1HG   GLN  10          1HG       GLN  10   5.485   1.089   5.805
   61   2HG   GLN  10          2HG       GLN  10   4.612   1.056   4.273
   62   1HE2  GLN  10          1HE2      GLN  10   5.568   0.204   2.508
   63   2HE2  GLN  10          2HE2      GLN  10   7.156  -0.479   2.494
   64    H    HIS  11           H        HIS  11   5.849   3.085   0.658
   65    HA   HIS  11           HA       HIS  11   8.763   2.759   0.737
   66   1HB   HIS  11          1HB       HIS  11   7.357   0.531   0.558
   67   2HB   HIS  11          2HB       HIS  11   7.167   1.031  -1.119
   68    HD1  HIS  11           HD1      HIS  11   9.664  -0.289   1.298
   69    HD2  HIS  11           HD2      HIS  11   9.527   0.950  -2.664
   70    HE1  HIS  11           HE1      HIS  11  11.823  -1.079   0.271
   71    HE2  HIS  11           HE2      HIS  11  11.672  -0.393  -2.151
   72    H    CYS  12           H        CYS  12   6.009   2.795  -1.518
   73    HA   CYS  12           HA       CYS  12   7.497   4.397  -3.405
   74   1HB   CYS  12          1HB       CYS  12   5.329   4.251  -4.679
   75   2HB   CYS  12          2HB       CYS  12   6.122   2.720  -4.389
   76    H    THR  13           H        THR  13   4.937   4.661  -1.070
   77    HA   THR  13           HA       THR  13   4.140   6.452   0.076
   78    HB   THR  13           HB       THR  13   6.456   7.478  -0.652
   79    HG1  THR  13           HG1      THR  13   5.865   9.314   0.496
   80   1HG2  THR  13          1HG2      THR  13   6.544   9.012  -2.252
   81   2HG2  THR  13          2HG2      THR  13   5.039   9.762  -1.723
   82   3HG2  THR  13          3HG2      THR  13   4.998   8.379  -2.816
   83    H    PHE  14           H        PHE  14   2.760   5.215  -2.009
   84    HA   PHE  14           HA       PHE  14   1.149   7.451  -3.029
   85   1HB   PHE  14          1HB       PHE  14   2.294   6.216  -4.824
   86   2HB   PHE  14          2HB       PHE  14   1.537   4.728  -4.281
   87    HD1  PHE  14           HD1      PHE  14   0.509   8.193  -5.217
   88    HD2  PHE  14           HD2      PHE  14  -0.277   4.019  -5.480
   89    HE1  PHE  14           HE1      PHE  14  -1.416   8.651  -6.681
   90    HE2  PHE  14           HE2      PHE  14  -2.203   4.470  -6.943
   91    HZ   PHE  14           HZ       PHE  14  -2.774   6.789  -7.546
   92    H    MET  15           H        MET  15  -1.138   6.833  -3.406
   93    HA   MET  15           HA       MET  15  -2.155   5.465  -1.055
   94   1HB   MET  15          1HB       MET  15  -3.029   7.692  -2.221
   95   2HB   MET  15          2HB       MET  15  -3.962   6.548  -3.176
   96   1HG   MET  15          1HG       MET  15  -5.301   5.980  -1.448
   97   2HG   MET  15          2HG       MET  15  -4.026   6.186  -0.248
   98   1HE   MET  15          1HE       MET  15  -7.518   8.592  -0.771
   99   2HE   MET  15          2HE       MET  15  -7.058   7.092  -1.577
  100   3HE   MET  15          3HE       MET  15  -6.787   8.642  -2.375
  101    H    ASN  16           H        ASN  16  -3.626   3.752  -1.118
  102    HA   ASN  16           HA       ASN  16  -3.748   2.270  -3.642
  103   1HB   ASN  16          1HB       ASN  16  -1.861   1.694  -1.848
  104   2HB   ASN  16          2HB       ASN  16  -3.177   0.763  -1.161
  105   1HD2  ASN  16          1HD2      ASN  16  -1.263   1.287  -4.043
  106   2HD2  ASN  16          2HD2      ASN  16  -1.480  -0.293  -4.708
  107    H    GLN  17           H        GLN  17  -5.411   0.683  -3.748
  108    HA   GLN  17           HA       GLN  17  -7.825   1.433  -2.493
  109   1HB   GLN  17          1HB       GLN  17  -7.670  -1.266  -3.637
  110   2HB   GLN  17          2HB       GLN  17  -8.860  -0.013  -3.892
  111   1HG   GLN  17          1HG       GLN  17  -6.189  -0.325  -5.219
  112   2HG   GLN  17          2HG       GLN  17  -7.789  -0.344  -5.958
  113   1HE2  GLN  17          1HE2      GLN  17  -8.949   1.851  -4.820
  114   2HE2  GLN  17          2HE2      GLN  17  -8.121   3.279  -5.326
  115    HA   PRO  18           HA       PRO  18  -7.911  -0.949   1.205
  116   1HB   PRO  18          1HB       PRO  18 -10.495  -1.732   1.375
  117   2HB   PRO  18          2HB       PRO  18  -9.992  -0.053   1.601
  118   1HG   PRO  18          1HG       PRO  18 -11.152  -1.371  -0.823
  119   2HG   PRO  18          2HG       PRO  18 -11.540   0.208  -0.115
  120   1HD   PRO  18          1HD       PRO  18  -9.911  -0.074  -2.264
  121   2HD   PRO  18          2HD       PRO  18  -9.714   1.229  -1.076
  122    H    GLY  19           H        GLY  19  -8.475  -2.468  -1.785
  123   1HA   GLY  19          1HA       GLY  19  -8.542  -5.130  -0.511
  124   2HA   GLY  19          2HA       GLY  19  -9.092  -4.787  -2.145
  125    H    THR  20           H        THR  20  -6.561  -2.980  -2.242
  126    HA   THR  20           HA       THR  20  -4.829  -5.079  -3.299
  127    HB   THR  20           HB       THR  20  -3.527  -2.885  -3.980
  128    HG1  THR  20           HG1      THR  20  -4.762  -1.111  -4.062
  129   1HG2  THR  20          1HG2      THR  20  -6.084  -3.199  -5.439
  130   2HG2  THR  20          2HG2      THR  20  -4.948  -4.547  -5.406
  131   3HG2  THR  20          3HG2      THR  20  -4.446  -2.985  -6.054
  132    H    GLY  21           H        GLY  21  -4.622  -5.555  -0.792
  133   1HA   GLY  21          1HA       GLY  21  -3.168  -4.028   0.956
  134   2HA   GLY  21          2HA       GLY  21  -3.034  -5.774   0.868
  135    H    HIS  22           H        HIS  22  -2.001  -5.700  -1.885
  136    HA   HIS  22           HA       HIS  22   0.758  -5.456  -1.225
  137   1HB   HIS  22          1HB       HIS  22  -0.717  -6.057  -3.784
  138   2HB   HIS  22          2HB       HIS  22   1.034  -5.872  -3.756
  139    HD1  HIS  22           HD1      HIS  22  -1.457  -7.852  -1.649
  140    HD2  HIS  22           HD2      HIS  22   2.185  -8.297  -3.599
  141    HE1  HIS  22           HE1      HIS  22  -0.761 -10.234  -1.238
  142    HE2  HIS  22           HE2      HIS  22   1.403 -10.504  -2.501
  143    H    CYS  23           H        CYS  23   0.249  -4.178  -4.355
  144    HA   CYS  23           HA       CYS  23  -0.253  -1.517  -3.914
  145   1HB   CYS  23          1HB       CYS  23   2.190  -2.153  -2.749
  146   2HB   CYS  23          2HB       CYS  23   2.618  -1.403  -4.268
  147    H    GLU  24           H        GLU  24   0.140  -0.173  -5.725
  148    HA   GLU  24           HA       GLU  24   0.718  -1.694  -8.172
  149   1HB   GLU  24          1HB       GLU  24  -1.538  -0.313  -7.584
  150   2HB   GLU  24          2HB       GLU  24  -0.603   0.947  -8.377
  151   1HG   GLU  24          1HG       GLU  24  -0.254  -0.715 -10.265
  152   2HG   GLU  24          2HG       GLU  24  -1.513  -1.681  -9.498
  153    H    MET  25           H        MET  25   2.621  -0.323  -6.306
  154    HA   MET  25           HA       MET  25   3.931   1.350  -8.330
  155   1HB   MET  25          1HB       MET  25   3.166   2.063  -5.574
  156   2HB   MET  25          2HB       MET  25   4.827   2.453  -6.000
  157   1HG   MET  25          1HG       MET  25   3.429   4.352  -6.421
  158   2HG   MET  25          2HG       MET  25   4.007   3.703  -7.954
  159   1HE   MET  25          1HE       MET  25   2.855   4.225  -9.570
  160   2HE   MET  25          2HE       MET  25   1.308   5.044  -9.358
  161   3HE   MET  25          3HE       MET  25   1.359   3.423 -10.049
  162    H    CYS  26           H        CYS  26   4.513  -0.124  -5.112
  163    HA   CYS  26           HA       CYS  26   7.232  -0.721  -5.884
  164   1HB   CYS  26          1HB       CYS  26   7.244  -1.771  -3.566
  165   2HB   CYS  26          2HB       CYS  26   7.048  -0.034  -3.645
  166    H    SER  27           H        SER  27   4.332  -2.555  -4.928
  167    HA   SER  27           HA       SER  27   3.582  -4.553  -5.880
  168   1HB   SER  27          1HB       SER  27   5.411  -4.287  -7.677
  169   2HB   SER  27          2HB       SER  27   6.399  -5.297  -6.621
  170    HG   SER  27           HG       SER  27   4.099  -5.943  -8.075
  171    H    LEU  28           H        LEU  28   4.379  -3.815  -3.327
  172    HA   LEU  28           HA       LEU  28   5.396  -6.324  -2.200
  173   1HB   LEU  28          1HB       LEU  28   5.928  -3.482  -1.687
  174   2HB   LEU  28          2HB       LEU  28   5.732  -4.458  -0.270
  175    HG   LEU  28           HG       LEU  28   7.712  -4.971  -2.474
  176   1HD1  LEU  28          1HD1      LEU  28   7.881  -3.498   0.107
  177   2HD1  LEU  28          2HD1      LEU  28   8.626  -3.139  -1.453
  178   3HD1  LEU  28          3HD1      LEU  28   9.281  -4.422  -0.440
  179   1HD2  LEU  28          1HD2      LEU  28   7.650  -6.253   0.247
  180   2HD2  LEU  28          2HD2      LEU  28   8.610  -6.714  -1.158
  181   3HD2  LEU  28          3HD2      LEU  28   6.864  -6.969  -1.160
  182    HA   PRO  29           HA       PRO  29   1.704  -6.606   0.216
  183   1HB   PRO  29          1HB       PRO  29   2.539  -7.336   2.670
  184   2HB   PRO  29          2HB       PRO  29   2.691  -8.403   1.270
  185   1HG   PRO  29          1HG       PRO  29   4.760  -6.695   2.585
  186   2HG   PRO  29          2HG       PRO  29   4.909  -8.338   1.937
  187   1HD   PRO  29          1HD       PRO  29   5.732  -6.077   0.611
  188   2HD   PRO  29          2HD       PRO  29   5.276  -7.586  -0.196
  189    H    ARG  30           H        ARG  30   0.437  -5.767   2.031
  190    HA   ARG  30           HA       ARG  30   0.869  -2.988   2.422
  191   1HB   ARG  30          1HB       ARG  30  -1.301  -4.679   2.510
  192   2HB   ARG  30          2HB       ARG  30  -1.079  -4.243   4.193
  193   1HG   ARG  30          1HG       ARG  30  -0.855  -1.829   2.883
  194   2HG   ARG  30          2HG       ARG  30  -2.119  -2.675   1.987
  195   1HD   ARG  30          1HD       ARG  30  -3.137  -1.409   3.757
  196   2HD   ARG  30          2HD       ARG  30  -3.272  -3.127   4.133
  197    HE   ARG  30           HE       ARG  30  -0.969  -1.867   5.302
  198   1HH1  ARG  30          1HH1      ARG  30  -4.365  -2.556   5.708
  199   2HH1  ARG  30          2HH1      ARG  30  -4.314  -2.423   7.433
  200   1HH2  ARG  30          1HH2      ARG  30  -0.898  -1.694   7.571
  201   2HH2  ARG  30          2HH2      ARG  30  -2.346  -1.934   8.492
  202    H    THR  31           H        THR  31   2.133  -5.632   3.935
  203    HA   THR  31           HA       THR  31   3.058  -4.002   6.153
  204    HB   THR  31           HB       THR  31   1.553  -6.598   6.456
  205    HG1  THR  31           HG1      THR  31   1.238  -4.094   7.744
  206   1HG2  THR  31          1HG2      THR  31   3.451  -5.309   8.368
  207   2HG2  THR  31          2HG2      THR  31   3.242  -7.015   7.973
  208   3HG2  THR  31          3HG2      THR  31   2.039  -6.185   8.960
  Start of MODEL   16
    1   1H    GLY   1          1H        GLY   1 -21.466   0.402   2.267
    2   2H    GLY   1          2H        GLY   1 -19.873   0.692   1.778
    3   3H    GLY   1          3H        GLY   1 -20.298  -0.811   2.426
    4   1HA   GLY   1          1HA       GLY   1 -21.613  -1.371   0.551
    5   2HA   GLY   1          2HA       GLY   1 -21.463   0.262  -0.078
    6    H    SER   2           H        SER   2 -19.731   0.795  -1.318
    7    HA   SER   2           HA       SER   2 -17.858  -1.389  -1.919
    8   1HB   SER   2          1HB       SER   2 -17.503  -0.280  -4.081
    9   2HB   SER   2          2HB       SER   2 -19.215  -0.612  -3.821
   10    HG   SER   2           HG       SER   2 -19.417   1.588  -3.129
   11    H    THR   3           H        THR   3 -15.700  -1.127  -1.704
   12    HA   THR   3           HA       THR   3 -13.715  -0.247  -1.024
   13    HB   THR   3           HB       THR   3 -14.716   2.505  -1.677
   14    HG1  THR   3           HG1      THR   3 -14.172   0.409  -3.491
   15   1HG2  THR   3          1HG2      THR   3 -12.121   1.273  -2.504
   16   2HG2  THR   3          2HG2      THR   3 -12.333   1.987  -0.905
   17   3HG2  THR   3          3HG2      THR   3 -12.548   2.977  -2.348
   18    H    SER   4           H        SER   4 -13.378  -0.351   1.095
   19    HA   SER   4           HA       SER   4 -15.034   1.099   2.963
   20   1HB   SER   4          1HB       SER   4 -12.952  -1.013   3.132
   21   2HB   SER   4          2HB       SER   4 -13.138   0.030   4.542
   22    HG   SER   4           HG       SER   4 -14.707  -1.989   3.707
   23    H    ALA   5           H        ALA   5 -11.484   0.842   2.791
   24    HA   ALA   5           HA       ALA   5 -11.167   3.704   2.717
   25   1HB   ALA   5          1HB       ALA   5 -10.009   3.921   4.840
   26   2HB   ALA   5          2HB       ALA   5 -10.293   2.217   5.191
   27   3HB   ALA   5          3HB       ALA   5 -11.653   3.335   5.096
   28    H    MET   6           H        MET   6  -9.361   4.174   1.639
   29    HA   MET   6           HA       MET   6  -7.610   2.101   0.764
   30   1HB   MET   6          1HB       MET   6  -7.669   5.084   0.420
   31   2HB   MET   6          2HB       MET   6  -6.322   4.134  -0.168
   32   1HG   MET   6          1HG       MET   6  -7.464   3.865  -2.045
   33   2HG   MET   6          2HG       MET   6  -8.537   2.800  -1.138
   34   1HE   MET   6          1HE       MET   6 -11.738   4.243  -1.028
   35   2HE   MET   6          2HE       MET   6 -10.878   4.694   0.444
   36   3HE   MET   6          3HE       MET   6 -10.549   3.143  -0.329
   37    H    TRP   7           H        TRP   7  -5.118   2.796   0.802
   38    HA   TRP   7           HA       TRP   7  -4.385   3.665   3.492
   39   1HB   TRP   7          1HB       TRP   7  -2.761   1.790   3.708
   40   2HB   TRP   7          2HB       TRP   7  -4.441   1.288   3.754
   41    HD1  TRP   7           HD1      TRP   7  -5.377   0.043   1.457
   42    HE1  TRP   7           HE1      TRP   7  -4.108  -1.466  -0.212
   43    HE3  TRP   7           HE3      TRP   7  -0.580   1.397   2.618
   44    HZ2  TRP   7           HZ2      TRP   7  -1.438  -2.013  -0.915
   45    HZ3  TRP   7           HZ3      TRP   7   1.272   0.336   1.393
   46    HH2  TRP   7           HH2      TRP   7   0.857  -1.326  -0.346
   47    H    ALA   8           H        ALA   8  -2.081   4.084   3.740
   48    HA   ALA   8           HA       ALA   8  -0.924   5.088   1.218
   49   1HB   ALA   8          1HB       ALA   8   0.225   6.771   2.549
   50   2HB   ALA   8          2HB       ALA   8  -0.454   6.090   4.028
   51   3HB   ALA   8          3HB       ALA   8  -1.514   6.841   2.835
   52    H    CYS   9           H        CYS   9   0.764   3.971   0.510
   53    HA   CYS   9           HA       CYS   9   2.040   1.968   2.029
   54   1HB   CYS   9          1HB       CYS   9   1.791   2.092  -0.505
   55   2HB   CYS   9          2HB       CYS   9   3.151   3.211  -0.475
   56    H    GLN  10           H        GLN  10   4.376   1.824   2.421
   57    HA   GLN  10           HA       GLN  10   5.494   4.434   3.183
   58   1HB   GLN  10          1HB       GLN  10   6.171   1.875   4.610
   59   2HB   GLN  10          2HB       GLN  10   6.378   3.531   5.165
   60   1HG   GLN  10          1HG       GLN  10   4.522   3.200   6.338
   61   2HG   GLN  10          2HG       GLN  10   3.668   3.359   4.804
   62   1HE2  GLN  10          1HE2      GLN  10   2.920   1.514   3.760
   63   2HE2  GLN  10          2HE2      GLN  10   2.779  -0.006   4.567
   64    H    HIS  11           H        HIS  11   5.861   3.086   0.664
   65    HA   HIS  11           HA       HIS  11   8.778   2.784   0.755
   66   1HB   HIS  11          1HB       HIS  11   7.517   0.528   0.635
   67   2HB   HIS  11          2HB       HIS  11   7.096   1.007  -1.006
   68    HD1  HIS  11           HD1      HIS  11   8.868   0.761  -2.786
   69    HD2  HIS  11           HD2      HIS  11  10.303   0.075   1.052
   70    HE1  HIS  11           HE1      HIS  11  11.182  -0.179  -3.091
   71    HE2  HIS  11           HE2      HIS  11  12.071  -0.505  -0.752
   72    H    CYS  12           H        CYS  12   6.025   2.791  -1.501
   73    HA   CYS  12           HA       CYS  12   7.507   4.374  -3.407
   74   1HB   CYS  12          1HB       CYS  12   5.340   4.215  -4.676
   75   2HB   CYS  12          2HB       CYS  12   6.125   2.682  -4.362
   76    H    THR  13           H        THR  13   4.950   4.661  -1.071
   77    HA   THR  13           HA       THR  13   4.155   6.461   0.061
   78    HB   THR  13           HB       THR  13   6.475   7.475  -0.669
   79    HG1  THR  13           HG1      THR  13   5.995   8.913   0.782
   80   1HG2  THR  13          1HG2      THR  13   6.571   8.997  -2.279
   81   2HG2  THR  13          2HG2      THR  13   5.068   9.757  -1.757
   82   3HG2  THR  13          3HG2      THR  13   5.022   8.368  -2.841
   83    H    PHE  14           H        PHE  14   2.773   5.216  -2.018
   84    HA   PHE  14           HA       PHE  14   1.170   7.450  -3.052
   85   1HB   PHE  14          1HB       PHE  14   2.315   6.202  -4.840
   86   2HB   PHE  14          2HB       PHE  14   1.550   4.720  -4.290
   87    HD1  PHE  14           HD1      PHE  14  -0.269   4.013  -5.481
   88    HD2  PHE  14           HD2      PHE  14   0.541   8.185  -5.250
   89    HE1  PHE  14           HE1      PHE  14  -2.191   4.464  -6.950
   90    HE2  PHE  14           HE2      PHE  14  -1.379   8.643  -6.718
   91    HZ   PHE  14           HZ       PHE  14  -2.748   6.782  -7.570
   92    H    MET  15           H        MET  15  -1.118   6.833  -3.433
   93    HA   MET  15           HA       MET  15  -2.143   5.486  -1.072
   94   1HB   MET  15          1HB       MET  15  -3.004   7.699  -2.340
   95   2HB   MET  15          2HB       MET  15  -3.994   6.505  -3.167
   96   1HG   MET  15          1HG       MET  15  -4.749   5.703  -0.923
   97   2HG   MET  15          2HG       MET  15  -3.907   7.083  -0.220
   98   1HE   MET  15          1HE       MET  15  -7.670   7.219  -2.854
   99   2HE   MET  15          2HE       MET  15  -6.761   5.781  -2.390
  100   3HE   MET  15          3HE       MET  15  -6.110   6.883  -3.605
  101    H    ASN  16           H        ASN  16  -3.608   3.775  -1.117
  102    HA   ASN  16           HA       ASN  16  -3.741   2.269  -3.626
  103   1HB   ASN  16          1HB       ASN  16  -1.852   1.709  -1.824
  104   2HB   ASN  16          2HB       ASN  16  -3.169   0.783  -1.135
  105   1HD2  ASN  16          1HD2      ASN  16  -1.274   1.299  -4.034
  106   2HD2  ASN  16          2HD2      ASN  16  -1.482  -0.287  -4.683
  107    H    GLN  17           H        GLN  17  -5.435   0.727  -3.737
  108    HA   GLN  17           HA       GLN  17  -7.822   1.495  -2.458
  109   1HB   GLN  17          1HB       GLN  17  -7.007  -0.654  -4.299
  110   2HB   GLN  17          2HB       GLN  17  -8.520  -0.871  -3.444
  111   1HG   GLN  17          1HG       GLN  17  -7.891   1.616  -5.000
  112   2HG   GLN  17          2HG       GLN  17  -8.620   0.193  -5.744
  113   1HE2  GLN  17          1HE2      GLN  17  -9.156   3.016  -3.957
  114   2HE2  GLN  17          2HE2      GLN  17 -10.838   2.787  -3.638
  115    HA   PRO  18           HA       PRO  18  -7.947  -0.950   1.208
  116   1HB   PRO  18          1HB       PRO  18 -10.527  -1.732   1.363
  117   2HB   PRO  18          2HB       PRO  18 -10.032  -0.051   1.587
  118   1HG   PRO  18          1HG       PRO  18 -11.175  -1.381  -0.839
  119   2HG   PRO  18          2HG       PRO  18 -11.573   0.199  -0.138
  120   1HD   PRO  18          1HD       PRO  18  -9.925  -0.097  -2.277
  121   2HD   PRO  18          2HD       PRO  18  -9.755   1.225  -1.106
  122    H    GLY  19           H        GLY  19  -8.475  -2.444  -1.799
  123   1HA   GLY  19          1HA       GLY  19  -8.549  -5.116  -0.547
  124   2HA   GLY  19          2HA       GLY  19  -9.103  -4.762  -2.176
  125    H    THR  20           H        THR  20  -6.561  -2.952  -2.243
  126    HA   THR  20           HA       THR  20  -4.839  -5.042  -3.331
  127    HB   THR  20           HB       THR  20  -3.522  -2.851  -3.983
  128    HG1  THR  20           HG1      THR  20  -5.016  -1.130  -4.283
  129   1HG2  THR  20          1HG2      THR  20  -6.077  -3.067  -5.452
  130   2HG2  THR  20          2HG2      THR  20  -5.015  -4.475  -5.414
  131   3HG2  THR  20          3HG2      THR  20  -4.424  -2.941  -6.053
  132    H    GLY  21           H        GLY  21  -4.658  -5.535  -0.812
  133   1HA   GLY  21          1HA       GLY  21  -3.190  -4.050   0.952
  134   2HA   GLY  21          2HA       GLY  21  -3.069  -5.796   0.842
  135    H    HIS  22           H        HIS  22  -2.021  -5.693  -1.906
  136    HA   HIS  22           HA       HIS  22   0.738  -5.462  -1.227
  137   1HB   HIS  22          1HB       HIS  22  -0.726  -6.062  -3.793
  138   2HB   HIS  22          2HB       HIS  22   1.024  -5.874  -3.758
  139    HD1  HIS  22           HD1      HIS  22  -1.478  -7.865  -1.673
  140    HD2  HIS  22           HD2      HIS  22   2.187  -8.294  -3.585
  141    HE1  HIS  22           HE1      HIS  22  -0.777 -10.244  -1.257
  142    HE2  HIS  22           HE2      HIS  22   1.401 -10.506  -2.497
  143    H    CYS  23           H        CYS  23   0.245  -4.181  -4.358
  144    HA   CYS  23           HA       CYS  23  -0.259  -1.521  -3.921
  145   1HB   CYS  23          1HB       CYS  23   2.172  -2.153  -2.734
  146   2HB   CYS  23          2HB       CYS  23   2.617  -1.414  -4.253
  147    H    GLU  24           H        GLU  24   0.114  -0.188  -5.734
  148    HA   GLU  24           HA       GLU  24   0.729  -1.707  -8.173
  149   1HB   GLU  24          1HB       GLU  24  -1.347   0.204  -7.475
  150   2HB   GLU  24          2HB       GLU  24  -0.483   0.694  -8.925
  151   1HG   GLU  24          1HG       GLU  24  -1.121  -1.199 -10.101
  152   2HG   GLU  24          2HG       GLU  24  -1.504  -2.100  -8.635
  153    H    MET  25           H        MET  25   2.620  -0.344  -6.307
  154    HA   MET  25           HA       MET  25   3.931   1.347  -8.316
  155   1HB   MET  25          1HB       MET  25   3.185   2.028  -5.535
  156   2HB   MET  25          2HB       MET  25   4.819   2.470  -6.012
  157   1HG   MET  25          1HG       MET  25   2.703   3.187  -7.922
  158   2HG   MET  25          2HG       MET  25   2.657   4.030  -6.375
  159   1HE   MET  25          1HE       MET  25   4.866   3.518  -9.730
  160   2HE   MET  25          2HE       MET  25   5.524   2.551  -8.417
  161   3HE   MET  25          3HE       MET  25   6.420   3.947  -9.018
  162    H    CYS  26           H        CYS  26   4.505  -0.134  -5.098
  163    HA   CYS  26           HA       CYS  26   7.228  -0.722  -5.861
  164   1HB   CYS  26          1HB       CYS  26   7.233  -1.781  -3.546
  165   2HB   CYS  26          2HB       CYS  26   7.038  -0.043  -3.623
  166    H    SER  27           H        SER  27   4.330  -2.564  -4.920
  167    HA   SER  27           HA       SER  27   3.585  -4.559  -5.883
  168   1HB   SER  27          1HB       SER  27   5.424  -4.290  -7.669
  169   2HB   SER  27          2HB       SER  27   6.408  -5.299  -6.610
  170    HG   SER  27           HG       SER  27   5.307  -6.566  -8.137
  171    H    LEU  28           H        LEU  28   4.371  -3.827  -3.323
  172    HA   LEU  28           HA       LEU  28   5.372  -6.343  -2.198
  173   1HB   LEU  28          1HB       LEU  28   5.928  -3.505  -1.683
  174   2HB   LEU  28          2HB       LEU  28   5.729  -4.481  -0.267
  175    HG   LEU  28           HG       LEU  28   7.697  -5.014  -2.475
  176   1HD1  LEU  28          1HD1      LEU  28   9.239  -4.485  -0.361
  177   2HD1  LEU  28          2HD1      LEU  28   7.859  -3.460   0.035
  178   3HD1  LEU  28          3HD1      LEU  28   8.707  -3.240  -1.494
  179   1HD2  LEU  28          1HD2      LEU  28   6.842  -7.000  -1.153
  180   2HD2  LEU  28          2HD2      LEU  28   7.630  -6.282   0.251
  181   3HD2  LEU  28          3HD2      LEU  28   8.586  -6.756  -1.153
  182    HA   PRO  29           HA       PRO  29   1.679  -6.587   0.220
  183   1HB   PRO  29          1HB       PRO  29   2.509  -7.336   2.671
  184   2HB   PRO  29          2HB       PRO  29   2.649  -8.399   1.267
  185   1HG   PRO  29          1HG       PRO  29   4.737  -6.718   2.586
  186   2HG   PRO  29          2HG       PRO  29   4.868  -8.361   1.932
  187   1HD   PRO  29          1HD       PRO  29   5.713  -6.102   0.613
  188   2HD   PRO  29          2HD       PRO  29   5.242  -7.604  -0.198
  189    H    ARG  30           H        ARG  30   0.428  -5.741   2.047
  190    HA   ARG  30           HA       ARG  30   0.898  -2.969   2.446
  191   1HB   ARG  30          1HB       ARG  30  -1.290  -4.649   2.535
  192   2HB   ARG  30          2HB       ARG  30  -1.070  -4.189   4.212
  193   1HG   ARG  30          1HG       ARG  30  -0.815  -1.811   2.788
  194   2HG   ARG  30          2HG       ARG  30  -2.151  -2.669   2.018
  195   1HD   ARG  30          1HD       ARG  30  -2.158  -2.689   4.961
  196   2HD   ARG  30          2HD       ARG  30  -2.405  -1.111   4.215
  197    HE   ARG  30           HE       ARG  30  -4.074  -2.975   2.953
  198   1HH1  ARG  30          1HH1      ARG  30  -3.711  -1.386   6.039
  199   2HH1  ARG  30          2HH1      ARG  30  -5.400  -1.457   6.415
  200   1HH2  ARG  30          1HH2      ARG  30  -6.296  -3.070   3.446
  201   2HH2  ARG  30          2HH2      ARG  30  -6.868  -2.413   4.943
  202    H    THR  31           H        THR  31   2.160  -5.622   3.929
  203    HA   THR  31           HA       THR  31   3.039  -4.017   6.187
  204    HB   THR  31           HB       THR  31   0.939  -5.531   6.663
  205    HG1  THR  31           HG1      THR  31   1.662  -5.695   8.801
  206   1HG2  THR  31          1HG2      THR  31   2.989  -7.532   7.464
  207   2HG2  THR  31          2HG2      THR  31   2.308  -7.589   5.839
  208   3HG2  THR  31          3HG2      THR  31   1.250  -7.719   7.244
  Start of MODEL   17
    1   1H    GLY   1          1H        GLY   1 -18.510   4.006  -7.585
    2   2H    GLY   1          2H        GLY   1 -17.341   3.314  -6.577
    3   3H    GLY   1          3H        GLY   1 -17.844   4.908  -6.318
    4   1HA   GLY   1          1HA       GLY   1 -19.894   4.293  -5.472
    5   2HA   GLY   1          2HA       GLY   1 -19.786   2.697  -6.199
    6    H    SER   2           H        SER   2 -19.752   1.247  -4.614
    7    HA   SER   2           HA       SER   2 -18.916   1.719  -1.985
    8   1HB   SER   2          1HB       SER   2 -18.820  -0.860  -1.895
    9   2HB   SER   2          2HB       SER   2 -20.368  -0.108  -2.281
   10    HG   SER   2           HG       SER   2 -20.154  -0.698  -4.365
   11    H    THR   3           H        THR   3 -16.978   1.785  -1.055
   12    HA   THR   3           HA       THR   3 -14.765   0.214  -1.958
   13    HB   THR   3           HB       THR   3 -14.547   3.213  -2.269
   14    HG1  THR   3           HG1      THR   3 -14.561   1.232  -4.293
   15   1HG2  THR   3          1HG2      THR   3 -12.472   2.409  -3.608
   16   2HG2  THR   3          2HG2      THR   3 -12.596   0.987  -2.573
   17   3HG2  THR   3          3HG2      THR   3 -12.384   2.584  -1.856
   18    H    SER   4           H        SER   4 -13.816  -0.391  -0.138
   19    HA   SER   4           HA       SER   4 -14.299   0.761   2.365
   20   1HB   SER   4          1HB       SER   4 -12.666  -1.404   1.295
   21   2HB   SER   4          2HB       SER   4 -11.883  -0.591   2.649
   22    HG   SER   4           HG       SER   4 -13.468  -1.209   3.965
   23    H    ALA   5           H        ALA   5 -11.975   1.087   3.710
   24    HA   ALA   5           HA       ALA   5 -11.136   3.695   2.806
   25   1HB   ALA   5          1HB       ALA   5 -10.310   2.101   5.230
   26   2HB   ALA   5          2HB       ALA   5 -11.581   3.322   5.167
   27   3HB   ALA   5          3HB       ALA   5  -9.898   3.787   4.921
   28    H    MET   6           H        MET   6  -9.344   4.173   1.709
   29    HA   MET   6           HA       MET   6  -7.617   2.109   0.763
   30   1HB   MET   6          1HB       MET   6  -7.654   5.100   0.487
   31   2HB   MET   6          2HB       MET   6  -6.338   4.143  -0.158
   32   1HG   MET   6          1HG       MET   6  -7.519   3.853  -2.001
   33   2HG   MET   6          2HG       MET   6  -8.669   2.903  -1.064
   34   1HE   MET   6          1HE       MET   6  -8.269   6.767  -2.682
   35   2HE   MET   6          2HE       MET   6  -9.667   6.165  -3.573
   36   3HE   MET   6          3HE       MET   6  -8.201   5.190  -3.468
   37    H    TRP   7           H        TRP   7  -5.122   2.775   0.784
   38    HA   TRP   7           HA       TRP   7  -4.360   3.606   3.477
   39   1HB   TRP   7          1HB       TRP   7  -2.755   1.725   3.679
   40   2HB   TRP   7          2HB       TRP   7  -4.434   1.226   3.707
   41    HD1  TRP   7           HD1      TRP   7  -5.348  -0.022   1.400
   42    HE1  TRP   7           HE1      TRP   7  -4.056  -1.526  -0.260
   43    HE3  TRP   7           HE3      TRP   7  -0.569   1.361   2.596
   44    HZ2  TRP   7           HZ2      TRP   7  -1.380  -2.057  -0.942
   45    HZ3  TRP   7           HZ3      TRP   7   1.300   0.310   1.387
   46    HH2  TRP   7           HH2      TRP   7   0.906  -1.357  -0.353
   47    H    ALA   8           H        ALA   8  -2.079   4.040   3.724
   48    HA   ALA   8           HA       ALA   8  -0.913   5.054   1.211
   49   1HB   ALA   8          1HB       ALA   8  -1.514   6.808   2.811
   50   2HB   ALA   8          2HB       ALA   8   0.231   6.733   2.565
   51   3HB   ALA   8          3HB       ALA   8  -0.483   6.054   4.028
   52    H    CYS   9           H        CYS   9   0.779   3.947   0.506
   53    HA   CYS   9           HA       CYS   9   2.070   1.955   2.028
   54   1HB   CYS   9          1HB       CYS   9   1.819   2.065  -0.502
   55   2HB   CYS   9          2HB       CYS   9   3.161   3.205  -0.483
   56    H    GLN  10           H        GLN  10   4.405   1.830   2.420
   57    HA   GLN  10           HA       GLN  10   5.509   4.451   3.166
   58   1HB   GLN  10          1HB       GLN  10   6.686   3.251   5.022
   59   2HB   GLN  10          2HB       GLN  10   4.935   3.283   5.184
   60   1HG   GLN  10          1HG       GLN  10   6.086   0.939   3.809
   61   2HG   GLN  10          2HG       GLN  10   6.410   1.084   5.537
   62   1HE2  GLN  10          1HE2      GLN  10   4.275  -0.026   3.246
   63   2HE2  GLN  10          2HE2      GLN  10   2.889  -0.256   4.252
   64    H    HIS  11           H        HIS  11   5.879   3.110   0.652
   65    HA   HIS  11           HA       HIS  11   8.796   2.822   0.733
   66   1HB   HIS  11          1HB       HIS  11   7.422   0.572   0.579
   67   2HB   HIS  11          2HB       HIS  11   7.224   1.052  -1.103
   68    HD1  HIS  11           HD1      HIS  11   9.811  -0.061   1.362
   69    HD2  HIS  11           HD2      HIS  11   9.511   0.839  -2.684
   70    HE1  HIS  11           HE1      HIS  11  11.961  -0.868   0.332
   71    HE2  HIS  11           HE2      HIS  11  11.788  -0.235  -2.101
   72    H    CYS  12           H        CYS  12   6.043   2.794  -1.523
   73    HA   CYS  12           HA       CYS  12   7.505   4.386  -3.434
   74   1HB   CYS  12          1HB       CYS  12   5.338   4.207  -4.697
   75   2HB   CYS  12          2HB       CYS  12   6.128   2.679  -4.375
   76    H    THR  13           H        THR  13   4.959   4.662  -1.087
   77    HA   THR  13           HA       THR  13   4.150   6.456   0.041
   78    HB   THR  13           HB       THR  13   6.464   7.484  -0.690
   79    HG1  THR  13           HG1      THR  13   5.852   8.583   0.962
   80   1HG2  THR  13          1HG2      THR  13   6.552   9.002  -2.304
   81   2HG2  THR  13          2HG2      THR  13   5.046   9.756  -1.784
   82   3HG2  THR  13          3HG2      THR  13   5.007   8.364  -2.865
   83    H    PHE  14           H        PHE  14   2.766   5.199  -2.020
   84    HA   PHE  14           HA       PHE  14   1.165   7.422  -3.082
   85   1HB   PHE  14          1HB       PHE  14   2.292   6.124  -4.850
   86   2HB   PHE  14          2HB       PHE  14   1.509   4.665  -4.269
   87    HD1  PHE  14           HD1      PHE  14   0.531   8.128  -5.266
   88    HD2  PHE  14           HD2      PHE  14  -0.308   3.961  -5.462
   89    HE1  PHE  14           HE1      PHE  14  -1.391   8.588  -6.733
   90    HE2  PHE  14           HE2      PHE  14  -2.230   4.413  -6.930
   91    HZ   PHE  14           HZ       PHE  14  -2.774   6.729  -7.569
   92    H    MET  15           H        MET  15  -1.122   6.831  -3.427
   93    HA   MET  15           HA       MET  15  -2.148   5.517  -1.050
   94   1HB   MET  15          1HB       MET  15  -2.987   7.736  -2.315
   95   2HB   MET  15          2HB       MET  15  -3.996   6.555  -3.141
   96   1HG   MET  15          1HG       MET  15  -5.249   6.133  -1.310
   97   2HG   MET  15          2HG       MET  15  -3.908   6.388  -0.196
   98   1HE   MET  15          1HE       MET  15  -5.171   8.664   1.660
   99   2HE   MET  15          2HE       MET  15  -5.789   7.102   1.125
  100   3HE   MET  15          3HE       MET  15  -6.767   8.555   0.919
  101    H    ASN  16           H        ASN  16  -3.627   3.813  -1.075
  102    HA   ASN  16           HA       ASN  16  -3.804   2.313  -3.585
  103   1HB   ASN  16          1HB       ASN  16  -1.888   1.725  -1.839
  104   2HB   ASN  16          2HB       ASN  16  -3.196   0.827  -1.095
  105   1HD2  ASN  16          1HD2      ASN  16  -1.234   1.202  -3.945
  106   2HD2  ASN  16          2HD2      ASN  16  -1.551  -0.359  -4.613
  107    H    GLN  17           H        GLN  17  -5.552   0.892  -3.748
  108    HA   GLN  17           HA       GLN  17  -7.893   1.629  -2.380
  109   1HB   GLN  17          1HB       GLN  17  -7.143  -0.441  -4.335
  110   2HB   GLN  17          2HB       GLN  17  -8.651  -0.669  -3.472
  111   1HG   GLN  17          1HG       GLN  17  -7.949   1.839  -4.970
  112   2HG   GLN  17          2HG       GLN  17  -8.821   0.488  -5.687
  113   1HE2  GLN  17          1HE2      GLN  17  -8.973   3.182  -3.549
  114   2HE2  GLN  17          2HE2      GLN  17 -10.670   3.121  -3.242
  115    HA   PRO  18           HA       PRO  18  -8.006  -1.006   1.151
  116   1HB   PRO  18          1HB       PRO  18 -10.590  -1.753   1.318
  117   2HB   PRO  18          2HB       PRO  18 -10.069  -0.087   1.599
  118   1HG   PRO  18          1HG       PRO  18 -11.271  -1.306  -0.858
  119   2HG   PRO  18          2HG       PRO  18 -11.636   0.250  -0.087
  120   1HD   PRO  18          1HD       PRO  18 -10.026   0.016  -2.266
  121   2HD   PRO  18          2HD       PRO  18  -9.828   1.292  -1.050
  122    H    GLY  19           H        GLY  19  -8.491  -2.348  -1.907
  123   1HA   GLY  19          1HA       GLY  19  -8.732  -5.071  -0.802
  124   2HA   GLY  19          2HA       GLY  19  -9.130  -4.615  -2.451
  125    H    THR  20           H        THR  20  -6.572  -2.924  -2.378
  126    HA   THR  20           HA       THR  20  -4.816  -5.083  -3.274
  127    HB   THR  20           HB       THR  20  -3.461  -2.827  -3.860
  128    HG1  THR  20           HG1      THR  20  -6.184  -2.101  -4.121
  129   1HG2  THR  20          1HG2      THR  20  -3.879  -3.318  -5.984
  130   2HG2  THR  20          2HG2      THR  20  -5.627  -3.275  -5.758
  131   3HG2  THR  20          3HG2      THR  20  -4.715  -4.719  -5.314
  132    H    GLY  21           H        GLY  21  -4.453  -5.734  -0.981
  133   1HA   GLY  21          1HA       GLY  21  -3.175  -4.098   0.895
  134   2HA   GLY  21          2HA       GLY  21  -3.019  -5.844   0.817
  135    H    HIS  22           H        HIS  22  -1.948  -5.755  -1.920
  136    HA   HIS  22           HA       HIS  22   0.800  -5.497  -1.224
  137   1HB   HIS  22          1HB       HIS  22  -0.640  -6.090  -3.807
  138   2HB   HIS  22          2HB       HIS  22   1.109  -5.902  -3.752
  139    HD1  HIS  22           HD1      HIS  22  -1.510  -7.967  -1.905
  140    HD2  HIS  22           HD2      HIS  22   2.365  -8.259  -3.378
  141    HE1  HIS  22           HE1      HIS  22  -0.791 -10.332  -1.442
  142    HE2  HIS  22           HE2      HIS  22   1.524 -10.509  -2.419
  143    H    CYS  23           H        CYS  23   0.269  -4.202  -4.352
  144    HA   CYS  23           HA       CYS  23  -0.229  -1.546  -3.898
  145   1HB   CYS  23          1HB       CYS  23   2.215  -2.179  -2.738
  146   2HB   CYS  23          2HB       CYS  23   2.642  -1.429  -4.258
  147    H    GLU  24           H        GLU  24   0.067  -0.223  -5.709
  148    HA   GLU  24           HA       GLU  24   0.688  -1.714  -8.162
  149   1HB   GLU  24          1HB       GLU  24  -1.384   0.187  -7.431
  150   2HB   GLU  24          2HB       GLU  24  -0.534   0.691  -8.886
  151   1HG   GLU  24          1HG       GLU  24  -1.420  -0.948 -10.126
  152   2HG   GLU  24          2HG       GLU  24  -1.284  -2.140  -8.833
  153    H    MET  25           H        MET  25   2.609  -0.387  -6.315
  154    HA   MET  25           HA       MET  25   3.893   1.331  -8.316
  155   1HB   MET  25          1HB       MET  25   3.169   1.991  -5.527
  156   2HB   MET  25          2HB       MET  25   4.801   2.434  -6.009
  157   1HG   MET  25          1HG       MET  25   2.673   3.171  -7.901
  158   2HG   MET  25          2HG       MET  25   2.642   4.003  -6.346
  159   1HE   MET  25          1HE       MET  25   5.362   4.699  -9.856
  160   2HE   MET  25          2HE       MET  25   3.899   3.719  -9.723
  161   3HE   MET  25          3HE       MET  25   5.454   3.055  -9.224
  162    H    CYS  26           H        CYS  26   4.518  -0.140  -5.105
  163    HA   CYS  26           HA       CYS  26   7.224  -0.740  -5.914
  164   1HB   CYS  26          1HB       CYS  26   7.264  -1.790  -3.592
  165   2HB   CYS  26          2HB       CYS  26   7.084  -0.051  -3.677
  166    H    SER  27           H        SER  27   4.352  -2.578  -4.887
  167    HA   SER  27           HA       SER  27   3.584  -4.572  -5.843
  168   1HB   SER  27          1HB       SER  27   5.410  -4.334  -7.643
  169   2HB   SER  27          2HB       SER  27   6.399  -5.331  -6.577
  170    HG   SER  27           HG       SER  27   3.990  -5.994  -7.887
  171    H    LEU  28           H        LEU  28   4.391  -3.820  -3.291
  172    HA   LEU  28           HA       LEU  28   5.375  -6.336  -2.152
  173   1HB   LEU  28          1HB       LEU  28   5.962  -3.502  -1.651
  174   2HB   LEU  28          2HB       LEU  28   5.769  -4.477  -0.234
  175    HG   LEU  28           HG       LEU  28   7.708  -5.044  -2.461
  176   1HD1  LEU  28          1HD1      LEU  28   8.734  -3.253  -1.525
  177   2HD1  LEU  28          2HD1      LEU  28   9.290  -4.489  -0.394
  178   3HD1  LEU  28          3HD1      LEU  28   7.919  -3.456   0.027
  179   1HD2  LEU  28          1HD2      LEU  28   7.641  -6.268   0.287
  180   2HD2  LEU  28          2HD2      LEU  28   8.612  -6.757  -1.100
  181   3HD2  LEU  28          3HD2      LEU  28   6.869  -7.008  -1.116
  182    HA   PRO  29           HA       PRO  29   1.679  -6.502   0.268
  183   1HB   PRO  29          1HB       PRO  29   2.499  -7.405   2.662
  184   2HB   PRO  29          2HB       PRO  29   2.604  -8.400   1.204
  185   1HG   PRO  29          1HG       PRO  29   4.745  -6.851   2.601
  186   2HG   PRO  29          2HG       PRO  29   4.826  -8.460   1.862
  187   1HD   PRO  29          1HD       PRO  29   5.722  -6.146   0.660
  188   2HD   PRO  29          2HD       PRO  29   5.237  -7.605  -0.221
  189    H    ARG  30           H        ARG  30   0.443  -5.624   2.037
  190    HA   ARG  30           HA       ARG  30   1.101  -2.925   2.630
  191   1HB   ARG  30          1HB       ARG  30  -1.219  -4.365   2.519
  192   2HB   ARG  30          2HB       ARG  30  -1.011  -4.158   4.245
  193   1HG   ARG  30          1HG       ARG  30  -0.938  -1.762   4.001
  194   2HG   ARG  30          2HG       ARG  30  -1.010  -1.913   2.245
  195   1HD   ARG  30          1HD       ARG  30  -3.182  -1.350   3.447
  196   2HD   ARG  30          2HD       ARG  30  -3.228  -2.681   2.292
  197    HE   ARG  30           HE       ARG  30  -2.724  -3.499   5.005
  198   1HH1  ARG  30          1HH1      ARG  30  -5.183  -2.779   2.635
  199   2HH1  ARG  30          2HH1      ARG  30  -6.393  -3.741   3.416
  200   1HH2  ARG  30          1HH2      ARG  30  -4.314  -4.765   6.032
  201   2HH2  ARG  30          2HH2      ARG  30  -5.900  -4.869   5.344
  202    H    THR  31           H        THR  31   2.028  -5.780   4.009
  203    HA   THR  31           HA       THR  31   3.065  -4.388   6.338
  204    HB   THR  31           HB       THR  31   1.254  -6.797   6.453
  205    HG1  THR  31           HG1      THR  31   1.229  -4.309   7.812
  206   1HG2  THR  31          1HG2      THR  31   3.010  -5.749   8.664
  207   2HG2  THR  31          2HG2      THR  31   3.106  -7.337   7.903
  208   3HG2  THR  31          3HG2      THR  31   1.694  -6.905   8.867
  Start of MODEL   18
    1   1H    GLY   1          1H        GLY   1 -12.289   7.625  -6.991
    2   2H    GLY   1          2H        GLY   1 -12.285   6.554  -8.300
    3   3H    GLY   1          3H        GLY   1 -11.226   6.307  -7.004
    4   1HA   GLY   1          1HA       GLY   1 -14.186   6.179  -6.826
    5   2HA   GLY   1          2HA       GLY   1 -13.133   4.780  -6.956
    6    H    SER   2           H        SER   2 -14.586   4.528  -4.883
    7    HA   SER   2           HA       SER   2 -12.808   4.786  -2.663
    8   1HB   SER   2          1HB       SER   2 -14.033   7.070  -2.904
    9   2HB   SER   2          2HB       SER   2 -15.428   6.204  -2.261
   10    HG   SER   2           HG       SER   2 -13.740   7.319  -0.798
   11    H    THR   3           H        THR   3 -13.219   2.478  -3.002
   12    HA   THR   3           HA       THR   3 -15.736   1.285  -2.663
   13    HB   THR   3           HB       THR   3 -13.760   0.118  -3.583
   14    HG1  THR   3           HG1      THR   3 -15.369  -1.213  -2.864
   15   1HG2  THR   3          1HG2      THR   3 -12.141   0.999  -1.855
   16   2HG2  THR   3          2HG2      THR   3 -12.002  -0.710  -2.269
   17   3HG2  THR   3          3HG2      THR   3 -12.791  -0.227  -0.767
   18    H    SER   4           H        SER   4 -13.161   1.969  -0.319
   19    HA   SER   4           HA       SER   4 -15.111   2.154   1.804
   20   1HB   SER   4          1HB       SER   4 -13.188  -0.127   1.592
   21   2HB   SER   4          2HB       SER   4 -13.550   0.529   3.188
   22    HG   SER   4           HG       SER   4 -15.561  -0.182   3.047
   23    H    ALA   5           H        ALA   5 -11.621   1.474   1.835
   24    HA   ALA   5           HA       ALA   5 -10.955   4.225   2.367
   25   1HB   ALA   5          1HB       ALA   5 -11.081   2.216   4.558
   26   2HB   ALA   5          2HB       ALA   5 -11.468   3.937   4.578
   27   3HB   ALA   5          3HB       ALA   5  -9.784   3.411   4.579
   28    H    MET   6           H        MET   6  -9.167   4.512   1.223
   29    HA   MET   6           HA       MET   6  -7.483   2.353   0.427
   30   1HB   MET   6          1HB       MET   6  -7.235   5.344   0.142
   31   2HB   MET   6          2HB       MET   6  -6.101   4.210  -0.557
   32   1HG   MET   6          1HG       MET   6  -7.396   4.330  -2.365
   33   2HG   MET   6          2HG       MET   6  -8.459   3.237  -1.482
   34   1HE   MET   6          1HE       MET   6  -8.709   5.194  -3.816
   35   2HE   MET   6          2HE       MET   6  -9.591   6.698  -3.543
   36   3HE   MET   6          3HE       MET   6 -10.460   5.163  -3.598
   37    H    TRP   7           H        TRP   7  -4.986   2.789   0.634
   38    HA   TRP   7           HA       TRP   7  -4.370   3.661   3.362
   39   1HB   TRP   7          1HB       TRP   7  -2.800   1.741   3.620
   40   2HB   TRP   7          2HB       TRP   7  -4.495   1.294   3.592
   41    HD1  TRP   7           HD1      TRP   7  -5.367   0.000   1.328
   42    HE1  TRP   7           HE1      TRP   7  -4.070  -1.510  -0.321
   43    HE3  TRP   7           HE3      TRP   7  -0.591   1.415   2.504
   44    HZ2  TRP   7           HZ2      TRP   7  -1.394  -2.033  -1.004
   45    HZ3  TRP   7           HZ3      TRP   7   1.278   0.361   1.297
   46    HH2  TRP   7           HH2      TRP   7   0.888  -1.321  -0.427
   47    H    ALA   8           H        ALA   8  -2.121   4.092   3.754
   48    HA   ALA   8           HA       ALA   8  -0.815   5.139   1.333
   49   1HB   ALA   8          1HB       ALA   8  -1.460   6.771   3.100
   50   2HB   ALA   8          2HB       ALA   8   0.265   6.763   2.731
   51   3HB   ALA   8          3HB       ALA   8  -0.328   5.970   4.191
   52    H    CYS   9           H        CYS   9   0.766   3.900   0.601
   53    HA   CYS   9           HA       CYS   9   2.032   1.874   2.090
   54   1HB   CYS   9          1HB       CYS   9   1.748   1.955  -0.419
   55   2HB   CYS   9          2HB       CYS   9   3.054   3.135  -0.451
   56    H    GLN  10           H        GLN  10   4.367   1.693   2.467
   57    HA   GLN  10           HA       GLN  10   5.523   4.287   3.230
   58   1HB   GLN  10          1HB       GLN  10   6.242   1.699   4.580
   59   2HB   GLN  10          2HB       GLN  10   6.451   3.342   5.170
   60   1HG   GLN  10          1HG       GLN  10   4.631   2.950   6.385
   61   2HG   GLN  10          2HG       GLN  10   3.741   3.178   4.881
   62   1HE2  GLN  10          1HE2      GLN  10   2.918   1.400   3.804
   63   2HE2  GLN  10          2HE2      GLN  10   2.806  -0.160   4.536
   64    H    HIS  11           H        HIS  11   5.839   3.039   0.669
   65    HA   HIS  11           HA       HIS  11   8.751   2.716   0.688
   66   1HB   HIS  11          1HB       HIS  11   7.219   0.511   0.429
   67   2HB   HIS  11          2HB       HIS  11   7.257   1.033  -1.251
   68    HD1  HIS  11           HD1      HIS  11   9.151  -0.836   1.199
   69    HD2  HIS  11           HD2      HIS  11  10.011   1.311  -2.254
   70    HE1  HIS  11           HE1      HIS  11  11.446  -1.590   0.495
   71    HE2  HIS  11           HE2      HIS  11  11.983  -0.215  -1.547
   72    H    CYS  12           H        CYS  12   5.940   2.815  -1.492
   73    HA   CYS  12           HA       CYS  12   7.402   4.435  -3.390
   74   1HB   CYS  12          1HB       CYS  12   5.208   4.304  -4.627
   75   2HB   CYS  12          2HB       CYS  12   6.018   2.772  -4.379
   76    H    THR  13           H        THR  13   4.852   4.665  -1.033
   77    HA   THR  13           HA       THR  13   4.089   6.453   0.153
   78    HB   THR  13           HB       THR  13   6.373   7.504  -0.646
   79    HG1  THR  13           HG1      THR  13   5.628   8.362   1.141
   80   1HG2  THR  13          1HG2      THR  13   6.388   9.074  -2.220
   81   2HG2  THR  13          2HG2      THR  13   4.861   9.761  -1.669
   82   3HG2  THR  13          3HG2      THR  13   4.862   8.383  -2.767
   83    H    PHE  14           H        PHE  14   2.681   5.202  -1.939
   84    HA   PHE  14           HA       PHE  14   1.016   7.427  -2.891
   85   1HB   PHE  14          1HB       PHE  14   2.125   6.249  -4.730
   86   2HB   PHE  14          2HB       PHE  14   1.437   4.730  -4.184
   87    HD1  PHE  14           HD1      PHE  14  -0.396   3.973  -5.323
   88    HD2  PHE  14           HD2      PHE  14   0.271   8.167  -5.061
   89    HE1  PHE  14           HE1      PHE  14  -2.378   4.371  -6.726
   90    HE2  PHE  14           HE2      PHE  14  -1.710   8.574  -6.462
   91    HZ   PHE  14           HZ       PHE  14  -3.039   6.674  -7.295
   92    H    MET  15           H        MET  15  -1.259   6.853  -3.183
   93    HA   MET  15           HA       MET  15  -2.212   5.353  -0.876
   94   1HB   MET  15          1HB       MET  15  -3.065   7.689  -1.968
   95   2HB   MET  15          2HB       MET  15  -4.169   6.561  -2.742
   96   1HG   MET  15          1HG       MET  15  -4.768   5.699  -0.491
   97   2HG   MET  15          2HG       MET  15  -3.774   6.973   0.210
   98   1HE   MET  15          1HE       MET  15  -7.030   8.643   1.125
   99   2HE   MET  15          2HE       MET  15  -5.295   8.837   1.372
  100   3HE   MET  15          3HE       MET  15  -6.040   7.250   1.558
  101    H    ASN  16           H        ASN  16  -3.584   3.617  -0.957
  102    HA   ASN  16           HA       ASN  16  -4.025   2.395  -3.580
  103   1HB   ASN  16          1HB       ASN  16  -1.927   1.661  -2.104
  104   2HB   ASN  16          2HB       ASN  16  -3.149   0.646  -1.364
  105   1HD2  ASN  16          1HD2      ASN  16  -0.999   1.014  -3.898
  106   2HD2  ASN  16          2HD2      ASN  16  -1.528  -0.301  -4.884
  107    H    GLN  17           H        GLN  17  -5.687   0.800  -3.632
  108    HA   GLN  17           HA       GLN  17  -7.931   1.399  -2.049
  109   1HB   GLN  17          1HB       GLN  17  -7.276  -0.630  -4.087
  110   2HB   GLN  17          2HB       GLN  17  -8.708  -0.891  -3.110
  111   1HG   GLN  17          1HG       GLN  17  -8.264   1.724  -4.486
  112   2HG   GLN  17          2HG       GLN  17  -8.900   0.342  -5.377
  113   1HE2  GLN  17          1HE2      GLN  17  -9.556   2.807  -3.091
  114   2HE2  GLN  17          2HE2      GLN  17 -11.230   2.452  -2.854
  115    HA   PRO  18           HA       PRO  18  -7.589  -1.277   1.437
  116   1HB   PRO  18          1HB       PRO  18 -10.130  -2.096   1.841
  117   2HB   PRO  18          2HB       PRO  18  -9.616  -0.430   2.124
  118   1HG   PRO  18          1HG       PRO  18 -11.037  -1.597  -0.237
  119   2HG   PRO  18          2HG       PRO  18 -11.351  -0.074   0.615
  120   1HD   PRO  18          1HD       PRO  18  -9.971  -0.201  -1.721
  121   2HD   PRO  18          2HD       PRO  18  -9.663   1.035  -0.486
  122    H    GLY  19           H        GLY  19  -8.511  -2.560  -1.580
  123   1HA   GLY  19          1HA       GLY  19  -8.567  -5.312  -0.555
  124   2HA   GLY  19          2HA       GLY  19  -9.057  -4.805  -2.166
  125    H    THR  20           H        THR  20  -6.561  -3.088  -2.251
  126    HA   THR  20           HA       THR  20  -4.804  -5.194  -3.250
  127    HB   THR  20           HB       THR  20  -3.579  -2.812  -3.842
  128    HG1  THR  20           HG1      THR  20  -6.372  -2.398  -4.110
  129   1HG2  THR  20          1HG2      THR  20  -5.742  -3.874  -5.601
  130   2HG2  THR  20          2HG2      THR  20  -4.237  -4.758  -5.344
  131   3HG2  THR  20          3HG2      THR  20  -4.201  -3.139  -6.043
  132    H    GLY  21           H        GLY  21  -4.491  -5.692  -0.817
  133   1HA   GLY  21          1HA       GLY  21  -3.086  -4.063   0.917
  134   2HA   GLY  21          2HA       GLY  21  -2.922  -5.808   0.868
  135    H    HIS  22           H        HIS  22  -1.960  -5.706  -1.939
  136    HA   HIS  22           HA       HIS  22   0.809  -5.464  -1.335
  137   1HB   HIS  22          1HB       HIS  22  -0.720  -6.035  -3.866
  138   2HB   HIS  22          2HB       HIS  22   1.029  -5.837  -3.880
  139    HD1  HIS  22           HD1      HIS  22  -1.628  -8.049  -2.329
  140    HD2  HIS  22           HD2      HIS  22   2.436  -8.075  -3.195
  141    HE1  HIS  22           HE1      HIS  22  -0.848 -10.385  -1.821
  142    HE2  HIS  22           HE2      HIS  22   1.595 -10.400  -2.435
  143    H    CYS  23           H        CYS  23   0.197  -4.131  -4.429
  144    HA   CYS  23           HA       CYS  23  -0.289  -1.486  -3.928
  145   1HB   CYS  23          1HB       CYS  23   2.207  -2.157  -2.866
  146   2HB   CYS  23          2HB       CYS  23   2.556  -1.322  -4.362
  147    H    GLU  24           H        GLU  24   0.189  -0.067  -5.712
  148    HA   GLU  24           HA       GLU  24   0.624  -1.560  -8.208
  149   1HB   GLU  24          1HB       GLU  24  -1.565  -0.112  -7.534
  150   2HB   GLU  24          2HB       GLU  24  -0.602   1.130  -8.323
  151   1HG   GLU  24          1HG       GLU  24  -0.350  -0.760 -10.160
  152   2HG   GLU  24          2HG       GLU  24  -1.875  -1.293  -9.453
  153    H    MET  25           H        MET  25   2.611  -0.277  -6.349
  154    HA   MET  25           HA       MET  25   3.950   1.359  -8.385
  155   1HB   MET  25          1HB       MET  25   2.903   2.428  -6.073
  156   2HB   MET  25          2HB       MET  25   4.571   2.110  -5.621
  157   1HG   MET  25          1HG       MET  25   4.366   4.358  -6.440
  158   2HG   MET  25          2HG       MET  25   5.326   3.402  -7.569
  159   1HE   MET  25          1HE       MET  25   4.718   4.074 -10.344
  160   2HE   MET  25          2HE       MET  25   5.199   5.201  -9.073
  161   3HE   MET  25          3HE       MET  25   3.857   5.601 -10.147
  162    H    CYS  26           H        CYS  26   4.543  -0.069  -5.148
  163    HA   CYS  26           HA       CYS  26   7.226  -0.764  -5.935
  164   1HB   CYS  26          1HB       CYS  26   7.202  -1.835  -3.618
  165   2HB   CYS  26          2HB       CYS  26   7.084  -0.091  -3.696
  166    H    SER  27           H        SER  27   4.304  -2.544  -4.934
  167    HA   SER  27           HA       SER  27   3.490  -4.512  -5.905
  168   1HB   SER  27          1HB       SER  27   5.305  -4.277  -7.720
  169   2HB   SER  27          2HB       SER  27   6.281  -5.316  -6.681
  170    HG   SER  27           HG       SER  27   4.284  -5.986  -8.355
  171    H    LEU  28           H        LEU  28   4.329  -3.816  -3.352
  172    HA   LEU  28           HA       LEU  28   5.264  -6.372  -2.263
  173   1HB   LEU  28          1HB       LEU  28   5.958  -3.565  -1.738
  174   2HB   LEU  28          2HB       LEU  28   5.763  -4.555  -0.334
  175    HG   LEU  28           HG       LEU  28   7.630  -5.159  -2.611
  176   1HD1  LEU  28          1HD1      LEU  28   8.729  -3.406  -1.686
  177   2HD1  LEU  28          2HD1      LEU  28   9.277  -4.671  -0.585
  178   3HD1  LEU  28          3HD1      LEU  28   7.958  -3.603  -0.114
  179   1HD2  LEU  28          1HD2      LEU  28   7.577  -6.404   0.128
  180   2HD2  LEU  28          2HD2      LEU  28   8.511  -6.905  -1.276
  181   3HD2  LEU  28          3HD2      LEU  28   6.762  -7.106  -1.271
  182    HA   PRO  29           HA       PRO  29   1.604  -6.425   0.216
  183   1HB   PRO  29          1HB       PRO  29   2.428  -7.464   2.552
  184   2HB   PRO  29          2HB       PRO  29   2.454  -8.403   1.055
  185   1HG   PRO  29          1HG       PRO  29   4.697  -7.024   2.467
  186   2HG   PRO  29          2HG       PRO  29   4.683  -8.599   1.655
  187   1HD   PRO  29          1HD       PRO  29   5.663  -6.266   0.541
  188   2HD   PRO  29          2HD       PRO  29   5.111  -7.669  -0.390
  189    H    ARG  30           H        ARG  30   0.431  -5.496   1.969
  190    HA   ARG  30           HA       ARG  30   1.299  -2.890   2.696
  191   1HB   ARG  30          1HB       ARG  30  -1.131  -4.135   2.477
  192   2HB   ARG  30          2HB       ARG  30  -0.949  -3.996   4.212
  193   1HG   ARG  30          1HG       ARG  30  -0.472  -1.556   3.870
  194   2HG   ARG  30          2HG       ARG  30  -0.949  -1.782   2.187
  195   1HD   ARG  30          1HD       ARG  30  -2.759  -0.934   3.706
  196   2HD   ARG  30          2HD       ARG  30  -3.158  -2.398   2.808
  197    HE   ARG  30           HE       ARG  30  -2.091  -2.901   5.429
  198   1HH1  ARG  30          1HH1      ARG  30  -4.985  -2.227   3.600
  199   2HH1  ARG  30          2HH1      ARG  30  -6.042  -2.942   4.770
  200   1HH2  ARG  30          1HH2      ARG  30  -3.479  -3.842   6.970
  201   2HH2  ARG  30          2HH2      ARG  30  -5.187  -3.859   6.684
  202    H    THR  31           H        THR  31   1.962  -5.870   3.954
  203    HA   THR  31           HA       THR  31   3.042  -4.678   6.372
  204    HB   THR  31           HB       THR  31   1.056  -6.947   6.330
  205    HG1  THR  31           HG1      THR  31   1.172  -4.506   7.768
  206   1HG2  THR  31          1HG2      THR  31   2.811  -6.119   8.633
  207   2HG2  THR  31          2HG2      THR  31   2.828  -7.675   7.801
  208   3HG2  THR  31          3HG2      THR  31   1.417  -7.195   8.744
  Start of MODEL   19
    1   1H    GLY   1          1H        GLY   1 -17.756  10.073  -1.933
    2   2H    GLY   1          2H        GLY   1 -17.974   9.252  -3.395
    3   3H    GLY   1          3H        GLY   1 -16.780   8.744  -2.311
    4   1HA   GLY   1          1HA       GLY   1 -18.544   8.236  -0.668
    5   2HA   GLY   1          2HA       GLY   1 -19.718   8.601  -1.923
    6    H    SER   2           H        SER   2 -16.749   6.655  -1.557
    7    HA   SER   2           HA       SER   2 -18.107   4.225  -2.166
    8   1HB   SER   2          1HB       SER   2 -16.487   5.570  -4.318
    9   2HB   SER   2          2HB       SER   2 -16.659   3.816  -4.269
   10    HG   SER   2           HG       SER   2 -18.714   5.752  -4.505
   11    H    THR   3           H        THR   3 -16.421   2.416  -2.559
   12    HA   THR   3           HA       THR   3 -14.666   1.212  -1.760
   13    HB   THR   3           HB       THR   3 -13.311   3.914  -1.634
   14    HG1  THR   3           HG1      THR   3 -13.428   3.715  -3.713
   15   1HG2  THR   3          1HG2      THR   3 -11.984   1.232  -1.861
   16   2HG2  THR   3          2HG2      THR   3 -12.172   2.097  -0.336
   17   3HG2  THR   3          3HG2      THR   3 -11.225   2.809  -1.644
   18    H    SER   4           H        SER   4 -13.674   0.556   0.190
   19    HA   SER   4           HA       SER   4 -15.052   1.431   2.535
   20   1HB   SER   4          1HB       SER   4 -12.893  -0.600   2.008
   21   2HB   SER   4          2HB       SER   4 -13.389  -0.206   3.653
   22    HG   SER   4           HG       SER   4 -14.498  -1.982   2.270
   23    H    ALA   5           H        ALA   5 -11.538   0.997   2.271
   24    HA   ALA   5           HA       ALA   5 -10.999   3.744   2.945
   25   1HB   ALA   5          1HB       ALA   5 -10.572   1.574   4.987
   26   2HB   ALA   5          2HB       ALA   5 -11.541   3.039   5.149
   27   3HB   ALA   5          3HB       ALA   5  -9.783   3.150   5.059
   28    H    MET   6           H        MET   6  -9.335   4.178   1.659
   29    HA   MET   6           HA       MET   6  -7.562   2.173   0.682
   30   1HB   MET   6          1HB       MET   6  -7.538   5.181   0.503
   31   2HB   MET   6          2HB       MET   6  -6.365   4.161  -0.298
   32   1HG   MET   6          1HG       MET   6  -7.763   4.253  -2.030
   33   2HG   MET   6          2HG       MET   6  -8.690   3.047  -1.139
   34   1HE   MET   6          1HE       MET   6 -10.845   5.400  -3.133
   35   2HE   MET   6          2HE       MET   6  -9.113   5.145  -3.350
   36   3HE   MET   6          3HE       MET   6  -9.718   6.730  -2.866
   37    H    TRP   7           H        TRP   7  -5.094   2.759   0.759
   38    HA   TRP   7           HA       TRP   7  -4.350   3.632   3.446
   39   1HB   TRP   7          1HB       TRP   7  -2.749   1.747   3.668
   40   2HB   TRP   7          2HB       TRP   7  -4.431   1.258   3.697
   41    HD1  TRP   7           HD1      TRP   7  -5.345  -0.022   1.415
   42    HE1  TRP   7           HE1      TRP   7  -4.057  -1.541  -0.234
   43    HE3  TRP   7           HE3      TRP   7  -0.563   1.386   2.570
   44    HZ2  TRP   7           HZ2      TRP   7  -1.384  -2.076  -0.925
   45    HZ3  TRP   7           HZ3      TRP   7   1.302   0.326   1.363
   46    HH2  TRP   7           HH2      TRP   7   0.904  -1.362  -0.356
   47    H    ALA   8           H        ALA   8  -2.087   4.083   3.718
   48    HA   ALA   8           HA       ALA   8  -0.891   5.086   1.217
   49   1HB   ALA   8          1HB       ALA   8   0.191   6.795   2.520
   50   2HB   ALA   8          2HB       ALA   8  -0.377   6.067   4.023
   51   3HB   ALA   8          3HB       ALA   8  -1.531   6.794   2.905
   52    H    CYS   9           H        CYS   9   0.785   3.955   0.514
   53    HA   CYS   9           HA       CYS   9   2.068   1.963   2.040
   54   1HB   CYS   9          1HB       CYS   9   1.815   2.073  -0.491
   55   2HB   CYS   9          2HB       CYS   9   3.165   3.203  -0.472
   56    H    GLN  10           H        GLN  10   4.413   1.833   2.420
   57    HA   GLN  10           HA       GLN  10   5.513   4.451   3.179
   58   1HB   GLN  10          1HB       GLN  10   6.219   1.894   4.596
   59   2HB   GLN  10          2HB       GLN  10   6.420   3.549   5.154
   60   1HG   GLN  10          1HG       GLN  10   4.574   3.204   6.339
   61   2HG   GLN  10          2HG       GLN  10   3.709   3.363   4.811
   62   1HE2  GLN  10          1HE2      GLN  10   2.961   1.518   3.767
   63   2HE2  GLN  10          2HE2      GLN  10   2.836  -0.006   4.570
   64    H    HIS  11           H        HIS  11   5.881   3.114   0.654
   65    HA   HIS  11           HA       HIS  11   8.799   2.845   0.727
   66   1HB   HIS  11          1HB       HIS  11   7.298   0.610   0.505
   67   2HB   HIS  11          2HB       HIS  11   7.370   1.084  -1.189
   68    HD1  HIS  11           HD1      HIS  11   9.382  -0.375   1.539
   69    HD2  HIS  11           HD2      HIS  11   9.993   1.057  -2.313
   70    HE1  HIS  11           HE1      HIS  11  11.662  -1.194   0.866
   71    HE2  HIS  11           HE2      HIS  11  11.969  -0.388  -1.500
   72    H    CYS  12           H        CYS  12   6.032   2.813  -1.511
   73    HA   CYS  12           HA       CYS  12   7.484   4.402  -3.435
   74   1HB   CYS  12          1HB       CYS  12   5.310   4.219  -4.686
   75   2HB   CYS  12          2HB       CYS  12   6.103   2.692  -4.365
   76    H    THR  13           H        THR  13   4.942   4.680  -1.081
   77    HA   THR  13           HA       THR  13   4.142   6.479   0.047
   78    HB   THR  13           HB       THR  13   6.450   7.506  -0.699
   79    HG1  THR  13           HG1      THR  13   4.248   9.014   0.237
   80   1HG2  THR  13          1HG2      THR  13   4.983   8.379  -2.868
   81   2HG2  THR  13          2HG2      THR  13   6.529   9.021  -2.316
   82   3HG2  THR  13          3HG2      THR  13   5.023   9.773  -1.790
   83    H    PHE  14           H        PHE  14   2.750   5.214  -2.007
   84    HA   PHE  14           HA       PHE  14   1.140   7.435  -3.064
   85   1HB   PHE  14          1HB       PHE  14   2.265   6.141  -4.836
   86   2HB   PHE  14          2HB       PHE  14   1.488   4.679  -4.254
   87    HD1  PHE  14           HD1      PHE  14  -0.340   3.972  -5.434
   88    HD2  PHE  14           HD2      PHE  14   0.504   8.139  -5.254
   89    HE1  PHE  14           HE1      PHE  14  -2.267   4.421  -6.896
   90    HE2  PHE  14           HE2      PHE  14  -1.422   8.597  -6.715
   91    HZ   PHE  14           HZ       PHE  14  -2.811   6.735  -7.537
   92    H    MET  15           H        MET  15  -1.147   6.834  -3.406
   93    HA   MET  15           HA       MET  15  -2.165   5.522  -1.024
   94   1HB   MET  15          1HB       MET  15  -3.015   7.741  -2.232
   95   2HB   MET  15          2HB       MET  15  -3.982   6.589  -3.141
   96   1HG   MET  15          1HG       MET  15  -5.063   5.817  -1.173
   97   2HG   MET  15          2HG       MET  15  -3.944   6.704  -0.139
   98   1HE   MET  15          1HE       MET  15  -7.060   6.519  -2.031
   99   2HE   MET  15          2HE       MET  15  -6.512   7.679  -3.240
  100   3HE   MET  15          3HE       MET  15  -7.755   8.138  -2.076
  101    H    ASN  16           H        ASN  16  -3.636   3.815  -1.039
  102    HA   ASN  16           HA       ASN  16  -3.822   2.309  -3.544
  103   1HB   ASN  16          1HB       ASN  16  -1.898   1.730  -1.802
  104   2HB   ASN  16          2HB       ASN  16  -3.204   0.828  -1.057
  105   1HD2  ASN  16          1HD2      ASN  16  -1.261   1.219  -3.922
  106   2HD2  ASN  16          2HD2      ASN  16  -1.568  -0.345  -4.587
  107    H    GLN  17           H        GLN  17  -5.572   0.896  -3.701
  108    HA   GLN  17           HA       GLN  17  -7.899   1.626  -2.297
  109   1HB   GLN  17          1HB       GLN  17  -7.189  -0.410  -4.302
  110   2HB   GLN  17          2HB       GLN  17  -8.682  -0.654  -3.417
  111   1HG   GLN  17          1HG       GLN  17  -8.092   1.962  -4.738
  112   2HG   GLN  17          2HG       GLN  17  -8.724   0.607  -5.668
  113   1HE2  GLN  17          1HE2      GLN  17  -9.561   3.303  -4.011
  114   2HE2  GLN  17          2HE2      GLN  17 -11.200   2.916  -3.627
  115    HA   PRO  18           HA       PRO  18  -7.972  -1.066   1.194
  116   1HB   PRO  18          1HB       PRO  18 -10.555  -1.819   1.377
  117   2HB   PRO  18          2HB       PRO  18 -10.029  -0.162   1.690
  118   1HG   PRO  18          1HG       PRO  18 -11.267  -1.321  -0.775
  119   2HG   PRO  18          2HG       PRO  18 -11.614   0.219   0.032
  120   1HD   PRO  18          1HD       PRO  18 -10.036   0.021  -2.173
  121   2HD   PRO  18          2HD       PRO  18  -9.816   1.274  -0.937
  122    H    GLY  19           H        GLY  19  -8.500  -2.358  -1.879
  123   1HA   GLY  19          1HA       GLY  19  -8.735  -5.098  -0.817
  124   2HA   GLY  19          2HA       GLY  19  -9.135  -4.614  -2.458
  125    H    THR  20           H        THR  20  -6.576  -2.927  -2.359
  126    HA   THR  20           HA       THR  20  -4.824  -5.070  -3.296
  127    HB   THR  20           HB       THR  20  -3.471  -2.809  -3.853
  128    HG1  THR  20           HG1      THR  20  -6.191  -2.063  -4.085
  129   1HG2  THR  20          1HG2      THR  20  -4.340  -2.871  -6.065
  130   2HG2  THR  20          2HG2      THR  20  -5.773  -3.744  -5.527
  131   3HG2  THR  20          3HG2      THR  20  -4.191  -4.523  -5.468
  132    H    GLY  21           H        GLY  21  -4.455  -5.757  -1.013
  133   1HA   GLY  21          1HA       GLY  21  -3.178  -4.149   0.886
  134   2HA   GLY  21          2HA       GLY  21  -3.021  -5.893   0.781
  135    H    HIS  22           H        HIS  22  -1.947  -5.759  -1.956
  136    HA   HIS  22           HA       HIS  22   0.800  -5.500  -1.246
  137   1HB   HIS  22          1HB       HIS  22  -0.635  -6.100  -3.826
  138   2HB   HIS  22          2HB       HIS  22   1.111  -5.878  -3.784
  139    HD1  HIS  22           HD1      HIS  22  -1.531  -8.069  -2.148
  140    HD2  HIS  22           HD2      HIS  22   2.487  -8.144  -3.205
  141    HE1  HIS  22           HE1      HIS  22  -0.746 -10.403  -1.643
  142    HE2  HIS  22           HE2      HIS  22   1.709 -10.400  -2.210
  143    H    CYS  23           H        CYS  23   0.255  -4.186  -4.368
  144    HA   CYS  23           HA       CYS  23  -0.245  -1.534  -3.888
  145   1HB   CYS  23          1HB       CYS  23   2.207  -2.174  -2.749
  146   2HB   CYS  23          2HB       CYS  23   2.625  -1.413  -4.266
  147    H    GLU  24           H        GLU  24   0.057  -0.189  -5.687
  148    HA   GLU  24           HA       GLU  24   0.642  -1.661  -8.160
  149   1HB   GLU  24          1HB       GLU  24  -1.396   0.262  -7.394
  150   2HB   GLU  24          2HB       GLU  24  -0.549   0.768  -8.849
  151   1HG   GLU  24          1HG       GLU  24  -1.378  -2.051  -8.782
  152   2HG   GLU  24          2HG       GLU  24  -2.685  -0.868  -8.826
  153    H    MET  25           H        MET  25   2.591  -0.371  -6.308
  154    HA   MET  25           HA       MET  25   3.891   1.340  -8.306
  155   1HB   MET  25          1HB       MET  25   3.183   1.997  -5.513
  156   2HB   MET  25          2HB       MET  25   4.821   2.417  -5.995
  157   1HG   MET  25          1HG       MET  25   2.685   3.195  -7.867
  158   2HG   MET  25          2HG       MET  25   2.703   4.031  -6.315
  159   1HE   MET  25          1HE       MET  25   4.130   3.970  -9.866
  160   2HE   MET  25          2HE       MET  25   4.701   5.637  -9.736
  161   3HE   MET  25          3HE       MET  25   3.049   5.227  -9.266
  162    H    CYS  26           H        CYS  26   4.525  -0.129  -5.095
  163    HA   CYS  26           HA       CYS  26   7.215  -0.768  -5.922
  164   1HB   CYS  26          1HB       CYS  26   7.227  -1.860  -3.604
  165   2HB   CYS  26          2HB       CYS  26   7.121  -0.114  -3.680
  166    H    SER  27           H        SER  27   4.348  -2.593  -4.858
  167    HA   SER  27           HA       SER  27   3.540  -4.562  -5.848
  168   1HB   SER  27          1HB       SER  27   5.352  -4.337  -7.656
  169   2HB   SER  27          2HB       SER  27   6.344  -5.344  -6.603
  170    HG   SER  27           HG       SER  27   4.876  -6.991  -6.808
  171    H    LEU  28           H        LEU  28   4.376  -3.847  -3.287
  172    HA   LEU  28           HA       LEU  28   5.304  -6.402  -2.188
  173   1HB   LEU  28          1HB       LEU  28   5.992  -3.594  -1.661
  174   2HB   LEU  28          2HB       LEU  28   5.793  -4.587  -0.256
  175    HG   LEU  28           HG       LEU  28   7.666  -5.182  -2.529
  176   1HD1  LEU  28          1HD1      LEU  28   7.985  -3.629  -0.031
  177   2HD1  LEU  28          2HD1      LEU  28   8.773  -3.438  -1.597
  178   3HD1  LEU  28          3HD1      LEU  28   9.309  -4.700  -0.487
  179   1HD2  LEU  28          1HD2      LEU  28   7.605  -6.435   0.208
  180   2HD2  LEU  28          2HD2      LEU  28   8.556  -6.932  -1.190
  181   3HD2  LEU  28          3HD2      LEU  28   6.801  -7.136  -1.198
  182    HA   PRO  29           HA       PRO  29   1.637  -6.455   0.284
  183   1HB   PRO  29          1HB       PRO  29   2.452  -7.513   2.611
  184   2HB   PRO  29          2HB       PRO  29   2.490  -8.440   1.105
  185   1HG   PRO  29          1HG       PRO  29   4.721  -7.061   2.539
  186   2HG   PRO  29          2HG       PRO  29   4.717  -8.634   1.722
  187   1HD   PRO  29          1HD       PRO  29   5.695  -6.296   0.619
  188   2HD   PRO  29          2HD       PRO  29   5.151  -7.697  -0.318
  189    H    ARG  30           H        ARG  30   0.463  -5.524   2.033
  190    HA   ARG  30           HA       ARG  30   1.350  -2.930   2.783
  191   1HB   ARG  30          1HB       ARG  30  -1.088  -4.151   2.543
  192   2HB   ARG  30          2HB       ARG  30  -0.913  -4.030   4.281
  193   1HG   ARG  30          1HG       ARG  30  -0.381  -1.582   3.927
  194   2HG   ARG  30          2HG       ARG  30  -0.932  -1.811   2.267
  195   1HD   ARG  30          1HD       ARG  30  -2.688  -0.935   3.786
  196   2HD   ARG  30          2HD       ARG  30  -3.116  -2.463   3.019
  197    HE   ARG  30           HE       ARG  30  -1.913  -2.875   5.563
  198   1HH1  ARG  30          1HH1      ARG  30  -4.903  -1.951   4.020
  199   2HH1  ARG  30          2HH1      ARG  30  -5.894  -2.492   5.334
  200   1HH2  ARG  30          1HH2      ARG  30  -3.214  -3.586   7.292
  201   2HH2  ARG  30          2HH2      ARG  30  -4.935  -3.420   7.193
  202    H    THR  31           H        THR  31   1.984  -5.925   4.020
  203    HA   THR  31           HA       THR  31   3.060  -4.760   6.455
  204    HB   THR  31           HB       THR  31   1.065  -7.021   6.383
  205    HG1  THR  31           HG1      THR  31  -0.192  -5.621   7.302
  206   1HG2  THR  31          1HG2      THR  31   2.912  -7.691   7.858
  207   2HG2  THR  31          2HG2      THR  31   1.416  -7.383   8.740
  208   3HG2  THR  31          3HG2      THR  31   2.714  -6.189   8.760
  Start of MODEL   20
    1   1H    GLY   1          1H        GLY   1 -17.898   4.578  -8.298
    2   2H    GLY   1          2H        GLY   1 -17.895   5.742  -7.071
    3   3H    GLY   1          3H        GLY   1 -19.069   4.526  -7.078
    4   1HA   GLY   1          1HA       GLY   1 -17.437   2.840  -6.647
    5   2HA   GLY   1          2HA       GLY   1 -16.158   4.039  -6.772
    6    H    SER   2           H        SER   2 -17.502   2.207  -4.591
    7    HA   SER   2           HA       SER   2 -18.034   4.206  -2.545
    8   1HB   SER   2          1HB       SER   2 -18.213   1.193  -2.589
    9   2HB   SER   2          2HB       SER   2 -18.427   2.130  -1.111
   10    HG   SER   2           HG       SER   2 -20.069   3.317  -2.399
   11    H    THR   3           H        THR   3 -16.071   1.231  -2.522
   12    HA   THR   3           HA       THR   3 -14.026   0.761  -1.644
   13    HB   THR   3           HB       THR   3 -13.394   3.702  -1.716
   14    HG1  THR   3           HG1      THR   3 -13.362   1.903  -3.907
   15   1HG2  THR   3          1HG2      THR   3 -11.176   3.024  -2.246
   16   2HG2  THR   3          2HG2      THR   3 -11.669   1.338  -2.397
   17   3HG2  THR   3          3HG2      THR   3 -11.696   2.127  -0.820
   18    H    SER   4           H        SER   4 -13.801   0.162   0.398
   19    HA   SER   4           HA       SER   4 -15.066   1.407   2.564
   20   1HB   SER   4          1HB       SER   4 -12.900  -0.669   2.353
   21   2HB   SER   4          2HB       SER   4 -13.403  -0.052   3.925
   22    HG   SER   4           HG       SER   4 -15.609  -0.620   3.162
   23    H    ALA   5           H        ALA   5 -11.540   0.992   2.406
   24    HA   ALA   5           HA       ALA   5 -11.055   3.806   2.785
   25   1HB   ALA   5          1HB       ALA   5 -10.004   3.644   4.956
   26   2HB   ALA   5          2HB       ALA   5 -10.358   1.918   5.030
   27   3HB   ALA   5          3HB       ALA   5 -11.675   3.091   5.060
   28    H    MET   6           H        MET   6  -9.318   4.208   1.597
   29    HA   MET   6           HA       MET   6  -7.555   2.143   0.724
   30   1HB   MET   6          1HB       MET   6  -7.588   5.131   0.401
   31   2HB   MET   6          2HB       MET   6  -6.278   4.153  -0.222
   32   1HG   MET   6          1HG       MET   6  -7.500   3.352  -1.929
   33   2HG   MET   6          2HG       MET   6  -8.974   3.261  -0.967
   34   1HE   MET   6          1HE       MET   6 -10.468   5.083  -0.411
   35   2HE   MET   6          2HE       MET   6 -10.634   6.612  -1.272
   36   3HE   MET   6          3HE       MET   6  -9.430   6.446   0.006
   37    H    TRP   7           H        TRP   7  -5.075   2.802   0.794
   38    HA   TRP   7           HA       TRP   7  -4.362   3.691   3.484
   39   1HB   TRP   7          1HB       TRP   7  -2.737   1.813   3.712
   40   2HB   TRP   7          2HB       TRP   7  -4.419   1.321   3.764
   41    HD1  TRP   7           HD1      TRP   7  -5.360   0.028   1.509
   42    HE1  TRP   7           HE1      TRP   7  -4.101  -1.489  -0.160
   43    HE3  TRP   7           HE3      TRP   7  -0.562   1.448   2.576
   44    HZ2  TRP   7           HZ2      TRP   7  -1.438  -2.013  -0.901
   45    HZ3  TRP   7           HZ3      TRP   7   1.283   0.392   1.336
   46    HH2  TRP   7           HH2      TRP   7   0.857  -1.298  -0.375
   47    H    ALA   8           H        ALA   8  -2.072   4.129   3.752
   48    HA   ALA   8           HA       ALA   8  -0.895   5.127   1.240
   49   1HB   ALA   8          1HB       ALA   8  -0.412   6.111   4.052
   50   2HB   ALA   8          2HB       ALA   8  -1.493   6.864   2.881
   51   3HB   ALA   8          3HB       ALA   8   0.241   6.808   2.570
   52    H    CYS   9           H        CYS   9   0.773   3.986   0.528
   53    HA   CYS   9           HA       CYS   9   2.053   1.986   2.046
   54   1HB   CYS   9          1HB       CYS   9   1.787   2.115  -0.491
   55   2HB   CYS   9          2HB       CYS   9   3.160   3.219  -0.466
   56    H    GLN  10           H        GLN  10   4.397   1.840   2.417
   57    HA   GLN  10           HA       GLN  10   5.518   4.450   3.174
   58   1HB   GLN  10          1HB       GLN  10   6.206   1.888   4.591
   59   2HB   GLN  10          2HB       GLN  10   6.422   3.542   5.147
   60   1HG   GLN  10          1HG       GLN  10   4.574   3.215   6.335
   61   2HG   GLN  10          2HG       GLN  10   3.708   3.374   4.807
   62   1HE2  GLN  10          1HE2      GLN  10   2.951   1.529   3.768
   63   2HE2  GLN  10          2HE2      GLN  10   2.814   0.009   4.577
   64    H    HIS  11           H        HIS  11   5.869   3.109   0.651
   65    HA   HIS  11           HA       HIS  11   8.786   2.815   0.718
   66   1HB   HIS  11          1HB       HIS  11   7.523   0.555   0.604
   67   2HB   HIS  11          2HB       HIS  11   7.105   1.034  -1.038
   68    HD1  HIS  11           HD1      HIS  11  10.153   0.338   1.096
   69    HD2  HIS  11           HD2      HIS  11   9.044   0.554  -2.903
   70    HE1  HIS  11           HE1      HIS  11  12.139  -0.483  -0.201
   71    HE2  HIS  11           HE2      HIS  11  11.418  -0.431  -2.612
   72    H    CYS  12           H        CYS  12   6.013   2.818  -1.512
   73    HA   CYS  12           HA       CYS  12   7.474   4.402  -3.435
   74   1HB   CYS  12          1HB       CYS  12   5.290   4.240  -4.679
   75   2HB   CYS  12          2HB       CYS  12   6.083   2.709  -4.375
   76    H    THR  13           H        THR  13   4.936   4.688  -1.077
   77    HA   THR  13           HA       THR  13   4.150   6.488   0.063
   78    HB   THR  13           HB       THR  13   6.462   7.505  -0.690
   79    HG1  THR  13           HG1      THR  13   5.973   9.166   0.602
   80   1HG2  THR  13          1HG2      THR  13   6.539   9.026  -2.303
   81   2HG2  THR  13          2HG2      THR  13   5.041   9.783  -1.767
   82   3HG2  THR  13          3HG2      THR  13   4.987   8.393  -2.850
   83    H    PHE  14           H        PHE  14   2.753   5.239  -2.008
   84    HA   PHE  14           HA       PHE  14   1.130   7.471  -3.015
   85   1HB   PHE  14          1HB       PHE  14   2.277   6.257  -4.821
   86   2HB   PHE  14          2HB       PHE  14   1.535   4.758  -4.284
   87    HD1  PHE  14           HD1      PHE  14  -0.280   4.039  -5.473
   88    HD2  PHE  14           HD2      PHE  14   0.475   8.218  -5.205
   89    HE1  PHE  14           HE1      PHE  14  -2.214   4.477  -6.929
   90    HE2  PHE  14           HE2      PHE  14  -1.459   8.664  -6.659
   91    HZ   PHE  14           HZ       PHE  14  -2.806   6.793  -7.524
   92    H    MET  15           H        MET  15  -1.156   6.836  -3.392
   93    HA   MET  15           HA       MET  15  -2.158   5.454  -1.042
   94   1HB   MET  15          1HB       MET  15  -3.045   7.670  -2.302
   95   2HB   MET  15          2HB       MET  15  -4.040   6.464  -3.108
   96   1HG   MET  15          1HG       MET  15  -4.664   5.657  -0.780
   97   2HG   MET  15          2HG       MET  15  -3.940   7.154  -0.193
   98   1HE   MET  15          1HE       MET  15  -6.562   9.714  -0.564
   99   2HE   MET  15          2HE       MET  15  -4.811   9.514  -0.661
  100   3HE   MET  15          3HE       MET  15  -5.713   8.766   0.657
  101    H    ASN  16           H        ASN  16  -3.634   3.741  -1.108
  102    HA   ASN  16           HA       ASN  16  -3.738   2.253  -3.628
  103   1HB   ASN  16          1HB       ASN  16  -1.869   1.691  -1.801
  104   2HB   ASN  16          2HB       ASN  16  -3.190   0.747  -1.146
  105   1HD2  ASN  16          1HD2      ASN  16  -1.279   1.324  -4.027
  106   2HD2  ASN  16          2HD2      ASN  16  -1.454  -0.259  -4.693
  107    H    GLN  17           H        GLN  17  -5.405   0.671  -3.741
  108    HA   GLN  17           HA       GLN  17  -7.824   1.427  -2.501
  109   1HB   GLN  17          1HB       GLN  17  -7.675  -1.279  -3.626
  110   2HB   GLN  17          2HB       GLN  17  -8.853  -0.019  -3.902
  111   1HG   GLN  17          1HG       GLN  17  -6.170  -0.360  -5.201
  112   2HG   GLN  17          2HG       GLN  17  -7.762  -0.381  -5.955
  113   1HE2  GLN  17          1HE2      GLN  17  -8.911   1.838  -4.810
  114   2HE2  GLN  17          2HE2      GLN  17  -8.078   3.255  -5.340
  115    HA   PRO  18           HA       PRO  18  -7.951  -0.921   1.216
  116   1HB   PRO  18          1HB       PRO  18 -10.533  -1.722   1.350
  117   2HB   PRO  18          2HB       PRO  18 -10.042  -0.042   1.584
  118   1HG   PRO  18          1HG       PRO  18 -11.160  -1.364  -0.857
  119   2HG   PRO  18          2HG       PRO  18 -11.565   0.213  -0.154
  120   1HD   PRO  18          1HD       PRO  18  -9.909  -0.055  -2.280
  121   2HD   PRO  18          2HD       PRO  18  -9.722   1.240  -1.082
  122    H    GLY  19           H        GLY  19  -8.496  -2.476  -1.768
  123   1HA   GLY  19          1HA       GLY  19  -8.526  -5.123  -0.460
  124   2HA   GLY  19          2HA       GLY  19  -9.103  -4.807  -2.090
  125    H    THR  20           H        THR  20  -6.567  -2.972  -2.186
  126    HA   THR  20           HA       THR  20  -4.845  -5.054  -3.290
  127    HB   THR  20           HB       THR  20  -3.548  -2.873  -3.971
  128    HG1  THR  20           HG1      THR  20  -4.585  -1.078  -3.673
  129   1HG2  THR  20          1HG2      THR  20  -4.717  -4.358  -5.543
  130   2HG2  THR  20          2HG2      THR  20  -4.823  -2.651  -5.977
  131   3HG2  THR  20          3HG2      THR  20  -6.203  -3.460  -5.235
  132    H    GLY  21           H        GLY  21  -4.638  -5.548  -0.773
  133   1HA   GLY  21          1HA       GLY  21  -3.163  -4.054   0.978
  134   2HA   GLY  21          2HA       GLY  21  -3.034  -5.799   0.868
  135    H    HIS  22           H        HIS  22  -2.016  -5.689  -1.890
  136    HA   HIS  22           HA       HIS  22   0.747  -5.447  -1.239
  137   1HB   HIS  22          1HB       HIS  22  -0.731  -6.040  -3.800
  138   2HB   HIS  22          2HB       HIS  22   1.021  -5.867  -3.765
  139    HD1  HIS  22           HD1      HIS  22  -1.471  -7.823  -1.635
  140    HD2  HIS  22           HD2      HIS  22   2.132  -8.314  -3.648
  141    HE1  HIS  22           HE1      HIS  22  -0.800 -10.213  -1.238
  142    HE2  HIS  22           HE2      HIS  22   1.426 -10.463  -2.392
  143    H    CYS  23           H        CYS  23   0.229  -4.168  -4.364
  144    HA   CYS  23           HA       CYS  23  -0.277  -1.508  -3.916
  145   1HB   CYS  23          1HB       CYS  23   2.171  -2.142  -2.762
  146   2HB   CYS  23          2HB       CYS  23   2.592  -1.391  -4.283
  147    H    GLU  24           H        GLU  24   0.154  -0.143  -5.721
  148    HA   GLU  24           HA       GLU  24   0.704  -1.664  -8.176
  149   1HB   GLU  24          1HB       GLU  24  -1.344   0.265  -7.449
  150   2HB   GLU  24          2HB       GLU  24  -0.489   0.751  -8.907
  151   1HG   GLU  24          1HG       GLU  24  -1.296  -2.070  -8.819
  152   2HG   GLU  24          2HG       GLU  24  -2.620  -0.906  -8.854
  153    H    MET  25           H        MET  25   2.614  -0.304  -6.306
  154    HA   MET  25           HA       MET  25   3.932   1.365  -8.329
  155   1HB   MET  25          1HB       MET  25   3.208   2.063  -5.546
  156   2HB   MET  25          2HB       MET  25   4.835   2.503  -6.045
  157   1HG   MET  25          1HG       MET  25   2.694   3.207  -7.933
  158   2HG   MET  25          2HG       MET  25   2.669   4.060  -6.390
  159   1HE   MET  25          1HE       MET  25   6.288   4.059  -9.240
  160   2HE   MET  25          2HE       MET  25   4.864   3.040  -9.438
  161   3HE   MET  25          3HE       MET  25   5.993   2.744  -8.115
  162    H    CYS  26           H        CYS  26   4.502  -0.107  -5.106
  163    HA   CYS  26           HA       CYS  26   7.221  -0.712  -5.870
  164   1HB   CYS  26          1HB       CYS  26   7.226  -1.758  -3.552
  165   2HB   CYS  26          2HB       CYS  26   7.031  -0.020  -3.634
  166    H    SER  27           H        SER  27   4.319  -2.545  -4.907
  167    HA   SER  27           HA       SER  27   3.566  -4.542  -5.858
  168   1HB   SER  27          1HB       SER  27   5.393  -4.272  -7.660
  169   2HB   SER  27          2HB       SER  27   6.380  -5.287  -6.609
  170    HG   SER  27           HG       SER  27   3.788  -6.036  -7.460
  171    H    LEU  28           H        LEU  28   4.353  -3.813  -3.308
  172    HA   LEU  28           HA       LEU  28   5.399  -6.314  -2.188
  173   1HB   LEU  28          1HB       LEU  28   5.876  -3.468  -1.650
  174   2HB   LEU  28          2HB       LEU  28   5.691  -4.459  -0.243
  175    HG   LEU  28           HG       LEU  28   7.694  -4.921  -2.438
  176   1HD1  LEU  28          1HD1      LEU  28   7.789  -3.386   0.090
  177   2HD1  LEU  28          2HD1      LEU  28   8.639  -3.124  -1.434
  178   3HD1  LEU  28          3HD1      LEU  28   9.201  -4.366  -0.315
  179   1HD2  LEU  28          1HD2      LEU  28   7.625  -6.215   0.277
  180   2HD2  LEU  28          2HD2      LEU  28   8.616  -6.641  -1.112
  181   3HD2  LEU  28          3HD2      LEU  28   6.886  -6.943  -1.149
  182    HA   PRO  29           HA       PRO  29   1.686  -6.662   0.188
  183   1HB   PRO  29          1HB       PRO  29   2.512  -7.512   2.600
  184   2HB   PRO  29          2HB       PRO  29   2.685  -8.507   1.150
  185   1HG   PRO  29          1HG       PRO  29   4.729  -6.848   2.566
  186   2HG   PRO  29          2HG       PRO  29   4.897  -8.457   1.844
  187   1HD   PRO  29          1HD       PRO  29   5.704  -6.121   0.630
  188   2HD   PRO  29          2HD       PRO  29   5.288  -7.603  -0.245
  189    H    ARG  30           H        ARG  30   0.400  -5.870   1.985
  190    HA   ARG  30           HA       ARG  30   0.883  -3.127   2.542
  191   1HB   ARG  30          1HB       ARG  30  -1.334  -4.740   2.469
  192   2HB   ARG  30          2HB       ARG  30  -1.140  -4.453   4.185
  193   1HG   ARG  30          1HG       ARG  30  -1.220  -2.064   3.840
  194   2HG   ARG  30          2HG       ARG  30  -1.306  -2.300   2.095
  195   1HD   ARG  30          1HD       ARG  30  -3.525  -2.174   2.395
  196   2HD   ARG  30          2HD       ARG  30  -3.379  -3.839   2.954
  197    HE   ARG  30           HE       ARG  30  -2.976  -1.920   5.041
  198   1HH1  ARG  30          1HH1      ARG  30  -5.390  -3.668   3.227
  199   2HH1  ARG  30          2HH1      ARG  30  -6.584  -3.568   4.478
  200   1HH2  ARG  30          1HH2      ARG  30  -4.545  -1.786   6.688
  201   2HH2  ARG  30          2HH2      ARG  30  -6.104  -2.499   6.442
  202    H    THR  31           H        THR  31   2.022  -5.890   3.940
  203    HA   THR  31           HA       THR  31   2.951  -4.409   6.260
  204    HB   THR  31           HB       THR  31   1.347  -6.960   6.393
  205    HG1  THR  31           HG1      THR  31   1.092  -4.520   7.810
  206   1HG2  THR  31          1HG2      THR  31   2.883  -5.722   8.667
  207   2HG2  THR  31          2HG2      THR  31   3.320  -7.219   7.844
  208   3HG2  THR  31          3HG2      THR  31   1.811  -7.119   8.749