*HEADER    TOXIN                                   25-MAR-07   2JOT              
*TITLE     NUCLEAR MAGNETIC RESONANCE STUDIES ON HUWENTOXIN-XI FROM              
*TITLE    2 THE CHINESE BIRD SPIDER ORNITHOCTONUS HUWENA                         
*COMPND    MOL_ID: 1;                                                            
*COMPND   2 MOLECULE: HUWENTOXIN-11;                                             
*COMPND   3 CHAIN: A;                                                            
*COMPND   4 SYNONYM: HUWENTOXIN-XI, HWTX-XI;                                     
*COMPND   5 ENGINEERED: YES                                                      
*SOURCE    MOL_ID: 1;                                                            
*SOURCE   2 ORGANISM_SCIENTIFIC: ORNITHOCTONUS HUWENA;                           
*SOURCE   3 ORGANISM_COMMON: CHINESE BIRD SPIDER;                                
*SOURCE   4 EXPRESSION_SYSTEM: SACCHAROMYCES CEREVISIAE;                         
*SOURCE   5 EXPRESSION_SYSTEM_COMMON: YEAST;                                     
*SOURCE   6 EXPRESSION_SYSTEM_STRAIN: S-78;                                      
*SOURCE   7 EXPRESSION_SYSTEM_VECTOR_TYPE: VECTOR;                               
*SOURCE   8 EXPRESSION_SYSTEM_VECTOR: PVT102U                                    
*KEYWDS    PROTEINASE INHIBITOR                                                  
*EXPDTA    NMR, 20 STRUCTURES                                                    
*AUTHOR    K.PENG, S.LIANG                                                       
*REVDAT   1   10-APR-07 2JOT    0                                                


assign (residue 17 and name HE#) (residue 17 and name HA) 5.0 3.2 2.4
assign (residue 17 and name HE#) (residue 34 and name HA#) 4.0 2.2 3.4
assign (residue 17 and name HE#) (residue 17 and name HB#) 5.0 3.2 2.4
assign (residue 17 and name HE#) (residue 15 and name HA) 5.0 3.2 3.4
assign (residue 17 and name HE#) (residue 15 and name HB#) 4.0 2.2 3.4
assign (residue 17 and name HD#) (residue 17 and name HA) 3.0 1.2 2.4
assign (residue 17 and name HD#) (residue 34 and name HA#) 4.0 2.2 3.4
assign (residue 17 and name HD#) (residue 16 and name HA) 5.0 3.2 2.4
assign (residue 17 and name HD#) (residue 17 and name HB#) 2.5 0.7 2.4
assign (residue 17 and name HD#) (residue 32 and name HB#) 4.0 2.2 3.4
assign (residue 17 and name HD#) (residue 15 and name HB#) 4.0 2.2 3.4

assign (residue 20 and name HE1) (residue 45 and name HN) 6.0 4.2 0.0
assign (residue 20 and name HE1) (residue 20 and name HZ2) 5.0 3.2 0.0
assign (residue 20 and name HE1) (residue 44 and name HA) 5.0 3.2 0.0

assign (residue 20 and name HD1) (residue 44 and name HA) 4.0 2.2 0.0
assign (residue 20 and name HD1) (residue 44 and name HB) 6.0 4.2 0.0
assign (residue 20 and name HD1) (residue 43 and name HD#) 6.0 4.2 1.0
assign (residue 20 and name HD1) (residue 19 and name HD#) 5.0 3.2 1.0
assign (residue 20 and name HD1) (residue 20 and name HB#) 5.0 3.2 1.0
assign (residue 20 and name HD1) (residue 42 and name HB#) 5.0 3.2 1.0
assign (residue 20 and name HD1) (residue 45 and name HA) 5.0 3.2 0.0
assign (residue 20 and name HD1) (residue 19 and name HB#) 5.0 3.2 1.0
assign (residue 20 and name HD1) (residue 47 and name HB#) 6.0 4.2 1.0
assign (residue 20 and name HD1) (residue 44 and name HG2#) 5.0 3.2 1.0
assign (residue 20 and name HD1) (residue 45 and name HB#) 6.0 4.2 1.0

assign (residue 20 and name HZ2) (residue 45 and name HN) 6.0 4.2 0.0
assign (residue 20 and name HZ2) (residue 20 and name HD1) 5.0 3.2 0.0
assign (residue 20 and name HZ2) (residue 44 and name HA) 6.0 4.2 0.0
assign (residue 20 and name HZ2) (residue 29 and name HE#) 5.0 3.2 1.0
assign (residue 20 and name HZ2) (residue 45 and name HG#) 6.0 4.2 1.0
assign (residue 20 and name HZ2) (residue 29 and name HD#) 4.0 2.2 1.0
assign (residue 20 and name HZ2) (residue 45 and name HB#) 5.0 3.2 1.0
assign (residue 20 and name HZ2) (residue 29 and name HG#) 5.0 3.2 1.0

assign (residue 20 and name HH2) (residue 29 and name HE#) 5.0 3.2 1.0
assign (residue 20 and name HH2) (residue 45 and name HG#) 6.0 4.2 1.0
assign (residue 20 and name HH2) (residue 29 and name HD#) 5.0 3.2 1.0
assign (residue 20 and name HH2) (residue 29 and name HB#) 5.0 3.2 1.0
assign (residue 20 and name HH2) (residue 29 and name HG#) 5.0 3.2 1.0

assign (residue 20 and name HZ3) (residue 28 and name HN) 5.0 3.2 0.0
assign (residue 20 and name HZ3) (residue 27 and name HN) 6.0 4.2 0.0
assign (residue 20 and name HZ3) (residue 29 and name HN) 5.0 3.2 0.0
assign (residue 20 and name HZ3) (residue 28 and name HA) 4.0 2.2 0.0
assign (residue 20 and name HZ3) (residue 27 and name HB#) 5.0 3.2 1.0
assign (residue 20 and name HZ3) (residue 48 and name HB#) 6.0 4.2 1.0
assign (residue 20 and name HZ3) (residue 20 and name HB#) 5.0 3.2 1.0
assign (residue 20 and name HZ3) (residue 45 and name HA) 6.0 4.2 0.0
assign (residue 20 and name HZ3) (residue 45 and name HG#) 5.0 3.2 1.0
assign (residue 20 and name HZ3) (residue 45 and name HB#) 6.0 4.2 1.0
assign (residue 20 and name HZ3) (residue 28 and name HB#) 5.0 3.2 1.0

assign (residue 20 and name HE3) (residue 21 and name HN) 5.0 3.2 0.0
assign (residue 20 and name HE3) (residue 28 and name HN) 5.0 3.2 0.0
assign (residue 20 and name HE3) (residue 20 and name HN) 6.0 4.2 0.0
assign (residue 20 and name HE3) (residue 29 and name HN) 5.0 3.2 0.0
assign (residue 20 and name HE3) (residue 45 and name HN) 7.0 5.2 0.0
assign (residue 20 and name HE3) (residue 28 and name HA) 4.0 2.2 0.0
assign (residue 20 and name HE3) (residue 20 and name HA) 4.0 2.2 0.0
assign (residue 20 and name HE3) (residue 27 and name HB#) 4.0 2.2 1.0
assign (residue 20 and name HE3) (residue 48 and name HB#) 6.0 4.2 1.0
assign (residue 20 and name HE3) (residue 20 and name HB#) 3.0 1.2 1.0
assign (residue 20 and name HE3) (residue 45 and name HA) 5.0 3.2 0.0
assign (residue 20 and name HE3) (residue 45 and name HG#) 5.0 3.2 1.0
assign (residue 20 and name HE3) (residue 45 and name HB#) 6.0 4.2 1.0
assign (residue 20 and name HE3) (residue 28 and name HB#) 5.0 3.2 1.0

assign (residue 21 and name HD#) (residue 21 and name HN) 4.0 2.2 2.4
assign (residue 21 and name HD#) (residue 22 and name HN) 5.0 3.2 2.4
assign (residue 21 and name HD#) (residue 28 and name HN) 5.0 3.2 2.4
assign (residue 21 and name HD#) (residue 30 and name HN) 5.0 3.2 2.4
assign (residue 21 and name HD#) (residue 23 and name HN) 5.0 3.2 3.4
assign (residue 21 and name HD#) (residue 40 and name HD#) 4.0 2.2 3.4
assign (residue 21 and name HD#) (residue 8 and name HN) 5.0 3.2 2.4
assign (residue 21 and name HD#) (residue 20 and name HA) 4.0 2.2 2.4
assign (residue 21 and name HD#) (residue 21 and name HA) 5.0 3.2 2.4
assign (residue 21 and name HD#) (residue 30 and name HA) 5.0 3.2 2.4
assign (residue 21 and name HD#) (residue 7 and name HA) 5.0 3.2 2.4
assign (residue 21 and name HD#) (residue 23 and name HA) 4.0 2.2 2.4
assign (residue 21 and name HD#) (residue 8 and name HA) 5.0 3.2 2.4
assign (residue 21 and name HD#) (residue 30 and name HB#) 5.0 3.2 3.4
assign (residue 21 and name HD#) (residue 21 and name HB#) 3.0 1.2 3.4
assign (residue 21 and name HD#) (residue 23 and name HB#) 5.0 3.2 3.4
assign (residue 21 and name HD#) (residue 8 and name HB#) 5.0 3.2 3.4
assign (residue 21 and name HD#) (residue 28 and name HB#) 4.0 2.2 3.4
assign (residue 21 and name HE#) (residue 21 and name HN) 5.0 3.2 2.4
assign (residue 21 and name HE#) (residue 22 and name HN) 6.0 4.2 2.4
assign (residue 21 and name HE#) (residue 28 and name HN) 6.0 4.2 2.4
assign (residue 21 and name HE#) (residue 30 and name HN) 6.0 4.2 2.4
assign (residue 21 and name HE#) (residue 23 and name HN) 5.0 3.2 2.4
assign (residue 21 and name HE#) (residue 40 and name HD#) 5.0 3.2 3.4
assign (residue 21 and name HE#) (residue 29 and name HN) 5.0 3.2 2.4
assign (residue 21 and name HE#) (residue 31 and name HN) 6.0 4.2 2.4
assign (residue 21 and name HE#) (residue 8 and name HN) 4.0 2.2 2.4
assign (residue 21 and name HE#) (residue 23 and name HD#) 5.0 3.2 3.4
assign (residue 21 and name HE#) (residue 20 and name HA) 6.0 4.2 2.4
assign (residue 21 and name HE#) (residue 21 and name HA) 6.0 4.2 2.4
assign (residue 21 and name HE#) (residue 30 and name HA) 5.0 3.2 2.4
assign (residue 21 and name HE#) (residue 7 and name HA) 5.0 3.2 2.4
assign (residue 21 and name HE#) (residue 23 and name HA) 4.0 2.2 2.4
assign (residue 21 and name HE#) (residue 8 and name HA) 6.0 4.2 2.4
assign (residue 21 and name HE#) (residue 23 and name HB#) 4.0 2.2 3.4
assign (residue 21 and name HE#) (residue 30 and name HB#) 4.0 2.2 3.4
assign (residue 21 and name HE#) (residue 21 and name HB#) 5.0 3.2 3.4
assign (residue 21 and name HE#) (residue 8 and name HB#) 5.0 3.2 3.4
assign (residue 21 and name HE#) (residue 28 and name HB#) 3.0 1.2 3.4

assign (residue 22 and name HD#) (residue 23 and name HA) 5.0 3.2 2.4
assign (residue 22 and name HD#) (residue 4 and name HA) 5.0 3.2 2.4
assign (residue 22 and name HD#) (residue 22 and name HB#) 4.0 2.2 3.4
assign (residue 22 and name HD#) (residue 21 and name HB#) 3.0 1.2 3.4
assign (residue 22 and name HD#) (residue 23 and name HB#) 6.0 4.2 3.4
assign (residue 22 and name HD#) (residue 52 and name HB#) 5.0 3.2 3.4
assign (residue 22 and name HD#) (residue 53 and name HB#) 5.0 3.2 3.4
assign (residue 22 and name HE#) (residue 40 and name HA) 5.0 3.2 2.4
assign (residue 22 and name HE#) (residue 4 and name HA) 6.0 4.2 2.4
assign (residue 22 and name HE#) (residue 51 and name HA) 6.0 4.2 2.4
assign (residue 22 and name HE#) (residue 3 and name HB) 6.0 4.2 2.4
assign (residue 22 and name HE#) (residue 51 and name HD#) 5.0 3.2 3.4
assign (residue 22 and name HE#) (residue 48 and name HA) 5.0 3.2 2.4
assign (residue 22 and name HE#) (residue 51 and name HB#) 3.0 1.2 3.4
assign (residue 22 and name HE#) (residue 51 and name HG#) 4.0 2.2 3.4
assign (residue 22 and name HE#) (residue 47 and name HB#) 6.0 4.2 3.4
assign (residue 22 and name HE#) (residue 3 and name HG2#) 4.0 2.2 3.4

assign (residue 30 and name HD#) (residue 21 and name HN) 5.0 3.2 2.4
assign (residue 30 and name HD#) (residue 30 and name HN) 4.0 2.2 2.4
assign (residue 30 and name HD#) (residue 32 and name HN) 5.0 3.2 2.4
assign (residue 30 and name HD#) (residue 20 and name HN) 5.0 3.2 2.4
assign (residue 30 and name HD#) (residue 33 and name HN) 6.0 4.2 2.4
assign (residue 30 and name HD#) (residue 19 and name HN) 5.0 3.2 2.4
assign (residue 30 and name HD#) (residue 31 and name HN) 4.0 2.2 2.4
assign (residue 30 and name HD#) (residue 32 and name HE#) 5.0 3.2 4.8
assign (residue 30 and name HD#) (residue 20 and name HA) 4.0 2.2 2.4
assign (residue 30 and name HD#) (residue 30 and name HA) 5.0 3.2 2.4
assign (residue 30 and name HD#) (residue 10 and name HA) 5.0 3.2 2.4
assign (residue 30 and name HD#) (residue 31 and name HA) 5.0 3.2 2.4
assign (residue 30 and name HD#) (residue 8 and name HA) 5.0 3.2 2.4
assign (residue 30 and name HD#) (residue 10 and name HD#) 5.0 3.2 3.4
assign (residue 30 and name HD#) (residue 30 and name HB#) 3.0 1.2 3.4
assign (residue 30 and name HD#) (residue 21 and name HB#) 5.0 3.2 3.4
assign (residue 30 and name HD#) (residue 32 and name HB#) 5.0 3.2 3.4
assign (residue 30 and name HD#) (residue 10 and name HB#) 5.0 3.2 3.4
assign (residue 30 and name HD#) (residue 8 and name HB#) 5.0 3.2 3.4
assign (residue 30 and name HD#) (residue 10 and name HG#) 5.0 3.2 3.4
assign (residue 30 and name HD#) (residue 19 and name HB#) 5.0 3.2 3.4
assign (residue 30 and name HD#) (residue 31 and name HG2#) 5.0 3.2 3.4
assign (residue 30 and name HD#) (residue 31 and name HD#) 5.0 3.2 3.4

assign (residue 30 and name HE#) (residue 21 and name HN) 5.0 3.2 2.4
assign (residue 30 and name HE#) (residue 42 and name HN) 6.0 4.2 2.4
assign (residue 30 and name HE#) (residue 30 and name HN) 5.0 3.2 2.4
assign (residue 30 and name HE#) (residue 32 and name HN) 5.0 3.2 2.4
assign (residue 30 and name HE#) (residue 20 and name HN) 5.0 3.2 2.4
assign (residue 30 and name HE#) (residue 33 and name HN) 5.0 3.2 2.4
assign (residue 30 and name HE#) (residue 19 and name HN) 5.0 3.2 2.4
assign (residue 30 and name HE#) (residue 38 and name HD#) 6.0 4.2 3.4
assign (residue 30 and name HE#) (residue 31 and name HN) 6.0 4.2 2.4
assign (residue 30 and name HE#) (residue 32 and name HE#) 5.0 3.2 4.8
assign (residue 30 and name HE#) (residue 21 and name HE#) 4.0 2.2 4.8
assign (residue 30 and name HE#) (residue 32 and name HD#) 4.0 2.2 4.8
assign (residue 30 and name HE#) (residue 20 and name HA) 5.0 3.2 2.4
assign (residue 30 and name HE#) (residue 21 and name HA) 5.0 3.2 2.4
assign (residue 30 and name HE#) (residue 30 and name HA) 6.0 4.2 2.4
assign (residue 30 and name HE#) (residue 10 and name HA) 4.0 2.2 2.4
assign (residue 30 and name HE#) (residue 31 and name HA) 6.0 4.2 2.4
assign (residue 30 and name HE#) (residue 10 and name HD#) 5.0 3.2 3.4
assign (residue 30 and name HE#) (residue 30 and name HB#) 5.0 3.2 3.4
assign (residue 30 and name HE#) (residue 21 and name HB#) 4.0 2.2 3.4
assign (residue 30 and name HE#) (residue 32 and name HB#) 5.0 3.2 3.4
assign (residue 30 and name HE#) (residue 10 and name HB#) 5.0 3.2 3.4
assign (residue 30 and name HE#) (residue 8 and name HB#) 3.0 1.2 3.4
assign (residue 30 and name HE#) (residue 10 and name HG#) 4.0 2.2 3.4
assign (residue 30 and name HE#) (residue 19 and name HB#) 5.0 3.2 3.4
assign (residue 30 and name HE#) (residue 31 and name HG2#) 5.0 3.2 3.4
assign (residue 30 and name HE#) (residue 31 and name HD#) 5.0 3.2 3.4

assign (residue 30 and name HE#) (residue 41 and name HB#) 5.0 3.2 2.4
assign (residue 30 and name HE#) (residue 41 and name HD#) 5.0 3.2 2.4
assign (residue 30 and name HE#) (residue 41 and name HG#) 5.0 3.2 3.4

assign (residue 30 and name HZ) (residue 10 and name HN) 7.0 5.2 0.0
assign (residue 30 and name HZ) (residue 41 and name HA) 5.0 3.2 0.0
assign (residue 30 and name HZ) (residue 10 and name HA) 6.0 4.2 0.0
assign (residue 30 and name HZ) (residue 8 and name HA) 7.0 5.2 0.0
assign (residue 30 and name HZ) (residue 41 and name HE#) 6.0 4.2 1.0
assign (residue 30 and name HZ) (residue 41 and name HB#)  4.0 2.2 1.0
assign (residue 30 and name HZ) (residue 41 and name HD#)  5.0 3.2 1.0
assign (residue 30 and name HZ) (residue 41 and name HG#)  5.0 3.2 1.0

assign (residue 32 and name HE#) (residue 19 and name HE) 6.0 4.2 2.4
assign (residue 32 and name HE#) (residue 42 and name HD#) 5.0 3.2 4.8
assign (residue 32 and name HE#) (residue 42 and name HE#) 5.0 3.2 4.8
assign (residue 32 and name HE#) (residue 32 and name HA) 4.0 2.2 2.4
assign (residue 32 and name HE#) (residue 43 and name HA) 5.0 3.2 2.4
assign (residue 32 and name HE#) (residue 10 and name HA) 5.0 2.2 2.4
assign (residue 32 and name HE#) (residue 17 and name HB#) 5.0 3.2 3.4
assign (residue 32 and name HE#) (residue 32 and name HB#) 4.0 2.2 3.4
assign (residue 32 and name HE#) (residue 10 and name HG#) 6.0 4.2 3.4
assign (residue 32 and name HE#) (residue 41 and name HB#) 6.0 4.2 3.4
assign (residue 32 and name HE#) (residue 19 and name HG#) 5.0 3.2 3.4
assign (residue 32 and name HE#) (residue 41 and name HD#) 5.0 3.2 3.4
assign (residue 32 and name HE#) (residue 19 and name HB#) 5.0 3.2 3.4
assign (residue 32 and name HD#) (residue 17 and name HE#) 5.0 3.2 4.8
assign (residue 32 and name HD#) (residue 17 and name HD#) 4.0 2.2 4.8
assign (residue 32 and name HD#) (residue 42 and name HD#) 4.0 2.2 4.8
assign (residue 32 and name HD#) (residue 35 and name HA) 6.0 4.2 2.4
assign (residue 32 and name HD#) (residue 43 and name HA) 5.0 3.2 2.4
assign (residue 32 and name HD#) (residue 32 and name HA) 5.0 3.2 2.4
assign (residue 32 and name HD#) (residue 10 and name HA) 4.0 2.2 2.4
assign (residue 32 and name HD#) (residue 37 and name HA#) 5.0 3.2 3.4
assign (residue 32 and name HD#) (residue 34 and name HA#) 4.0 1.2 3.4
assign (residue 32 and name HD#) (residue 11 and name HA#) 6.0 4.2 3.4
assign (residue 32 and name HD#) (residue 17 and name HB#) 5.0 3.2 3.4
assign (residue 32 and name HD#) (residue 41 and name HD#) 4.0 2.2 3.4
assign (residue 32 and name HD#) (residue 32 and name HB#) 3.0 1.2 3.4
assign (residue 32 and name HD#) (residue 10 and name HB#) 6.0 4.2 3.4
assign (residue 32 and name HD#) (residue 10 and name HG#) 5.0 3.2 3.4
assign (residue 32 and name HD#) (residue 15 and name HB#) 5.0 3.2 3.4
assign (residue 32 and name HD#) (residue 31 and name HG2#) 5.0 3.2 3.4
assign (residue 32 and name HD#) (residue 41 and name HD#) 5.0 3.2 3.4

assign (residue 42 and name HD#) (residue 22 and name HN) 5.0 3.2 2.4
assign (residue 42 and name HD#) (residue 42 and name HN) 5.0 3.2 2.4
assign (residue 42 and name HD#) (residue 41 and name HN) 5.0 3.2 2.4
assign (residue 42 and name HD#) (residue 21 and name HA) 5.0 3.2 2.4
assign (residue 42 and name HD#) (residue 42 and name HA) 5.0 3.2 2.4
assign (residue 42 and name HD#) (residue 41 and name HA) 5.0 2.2 2.4
assign (residue 42 and name HD#) (residue 40 and name HA) 5.0 3.2 2.4
assign (residue 42 and name HD#) (residue 43 and name HD#) 5.0 3.2 3.4
assign (residue 42 and name HD#) (residue 51 and name HD#) 5.0 3.2 3.4
assign (residue 42 and name HD#) (residue 42 and name HB#) 3.0 1.2 3.4
assign (residue 42 and name HD#) (residue 20 and name HB#) 6.0 4.2 2.4
assign (residue 42 and name HD#) (residue 48 and name HB#) 4.0 2.2 2.4
assign (residue 42 and name HD#) (residue 48 and name HA) 5.0 3.2 2.4
assign (residue 42 and name HD#) (residue 51 and name HB#) 5.0 3.2 2.4
assign (residue 42 and name HD#) (residue 51 and name HG#) 5.0 3.2 2.4
assign (residue 42 and name HD#) (residue 47 and name HB#) 4.0 2.2 3.4

assign (residue 42 and name HE#) (residue 51 and name HB#) 5.0 3.2 3.4
assign (residue 42 and name HE#) (residue 50 and name HB#) 5.0 3.2 3.4
assign (residue 42 and name HE#) (residue 47 and name HB#) 5.0 3.2 3.4

assign (residue 1 and name HA) (residue 2 and name HA) 6.0 4.2 0.0
assign (residue 1 and name HA) (residue 2 and name HB#) 5.0 3.2 1.0
assign (residue 1 and name HA) (residue 1 and name HB) 4.0 2.2 0.0
assign (residue 1 and name HA) (residue 1 and name HG1#) 5.0 3.2 1.0
assign (residue 1 and name HA) (residue 1 and name HD#) 4.0 2.2 1.0
assign (residue 1 and name HA) (residue 1 and name HG2#) 5.0 3.2 1.0
assign (residue 1 and name HB) (residue 2 and name HB#) 6.0 4.2 1.0
assign (residue 1 and name HB) (residue 1 and name HG1#) 5.0 3.2 1.0
assign (residue 1 and name HB) (residue 1 and name HD#) 4.0 2.2 1.0
assign (residue 1 and name HB) (residue 1 and name HG2#) 4.0 2.2 1.0
assign (residue 1 and name HG1#) (residue 3 and name HA) 7.0 5.2 1.0
assign (residue 1 and name HG1#) (residue 1 and name HD#) 5.0 3.2 2.0
assign (residue 1 and name HG1#) (residue 1 and name HG2#) 4.0 2.2 2.0
assign (residue 1 and name HG2#) (residue 5 and name HB#) 6.0 4.2 2.0
assign (residue 1 and name HD#) (residue 3 and name HA) 6.0 4.2 1.0

assign (residue 2 and name HN) (residue 3 and name HN) 5.0 3.2 0.0
assign (residue 2 and name HN) (residue 4 and name HN) 6.0 4.2 0.0
assign (residue 2 and name HN) (residue 5 and name HN) 6.0 4.2 0.0
assign (residue 2 and name HN) (residue 2 and name HA) 4.0 2.2 0.0
assign (residue 2 and name HN) (residue 1 and name HA) 4.0 2.2 0.0
assign (residue 2 and name HN) (residue 3 and name HA) 6.0 4.2 0.0
assign (residue 2 and name HN) (residue 5 and name HD#) 5.0 3.2 1.0
assign (residue 2 and name HN) (residue 2 and name HB#) 3.0 1.2 1.0
assign (residue 2 and name HN) (residue 5 and name HB#) 6.0 4.2 1.0
assign (residue 2 and name HN) (residue 1 and name HB) 5.0 3.2 0.0
assign (residue 2 and name HN) (residue 5 and name HG#) 5.0 3.2 1.0
assign (residue 2 and name HN) (residue 1 and name HG1#) 5.0 3.2 1.0
assign (residue 2 and name HN) (residue 3 and name HG2#) 6.0 4.2 1.0
assign (residue 2 and name HN) (residue 1 and name HD#) 5.0 3.2 1.0
assign (residue 2 and name HN) (residue 1 and name HG2#) 5.0 3.2 1.0
assign (residue 2 and name HA) (residue 3 and name HA) 5.0 3.2 0.0
assign (residue 2 and name HA) (residue 3 and name HB) 6.0 4.2 0.0
assign (residue 2 and name HA) (residue 5 and name HD#) 6.0 4.2 1.0
assign (residue 2 and name HA) (residue 2 and name HB#) 3.0 1.2 1.0
assign (residue 2 and name HA) (residue 5 and name HG#) 6.0 4.2 1.0
assign (residue 2 and name HB#) (residue 4 and name HA) 7.0 5.2 1.0
assign (residue 2 and name HB#) (residue 3 and name HB) 6.0 4.2 1.0
assign (residue 2 and name HB#) (residue 3 and name HA) 5.0 3.2 1.0
assign (residue 2 and name HB#) (residue 5 and name HD#) 4.0 2.2 1.0
assign (residue 2 and name HB#) (residue 5 and name HB#) 5.0 3.2 2.0
assign (residue 2 and name HB#) (residue 5 and name HG#) 4.0 2.2 1.0

assign (residue 3 and name HN) (residue 4 and name HN) 3.0 1.2 0.0
assign (residue 3 and name HN) (residue 5 and name HN) 5.0 3.2 0.0
assign (residue 3 and name HN) (residue 5 and name HE) 6.0 4.2 0.0
assign (residue 3 and name HN) (residue 6 and name HN) 6.0 4.2 0.0
assign (residue 3 and name HN) (residue 2 and name HA) 4.0 2.2 0.0
assign (residue 3 and name HN) (residue 4 and name HA) 6.0 4.2 0.0
assign (residue 3 and name HN) (residue 3 and name HB) 4.0 2.2 0.0
assign (residue 3 and name HN) (residue 1 and name HA) 6.0 4.2 0.0
assign (residue 3 and name HN) (residue 3 and name HA) 5.0 3.2 0.0
assign (residue 3 and name HN) (residue 4 and name HB#) 5.0 3.2 1.0
assign (residue 3 and name HN) (residue 2 and name HB#) 4.0 2.2 1.0
assign (residue 3 and name HN) (residue 6 and name HG) 6.0 4.2 0.0
assign (residue 3 and name HN) (residue 1 and name HG1#) 6.0 4.2 1.0
assign (residue 3 and name HN) (residue 3 and name HG2#) 4.0 2.2 1.0
assign (residue 3 and name HN) (residue 6 and name HD#) 5.0 3.2 2.4
assign (residue 3 and name HN) (residue 1 and name HD#) 5.0 3.2 1.0
assign (residue 3 and name HN) (residue 1 and name HG2#) 6.0 4.2 1.0
assign (residue 3 and name HA) (residue 3 and name HB) 4.0 2.2 0.0
assign (residue 3 and name HA) (residue 40 and name HB#) 5.0 3.2 1.0
assign (residue 3 and name HA) (residue 4 and name HB#) 5.0 3.2 1.0
assign (residue 3 and name HA) (residue 5 and name HB#) 6.0 4.2 1.0
assign (residue 3 and name HA) (residue 6 and name HG) 2.5 0.7 0.0
assign (residue 3 and name HA) (residue 6 and name HB#) 5.0 3.2 1.0
assign (residue 3 and name HA) (residue 3 and name HG2#) 3.0 1.2 1.0
assign (residue 3 and name HA) (residue 6 and name HD#) 2.5 0.7 2.4
assign (residue 3 and name HB) (residue 4 and name HA) 6.0 4.2 0.0
assign (residue 3 and name HB) (residue 40 and name HB#) 5.0 3.2 1.0
assign (residue 3 and name HB) (residue 4 and name HB#) 6.0 4.2 1.0
assign (residue 3 and name HB) (residue 6 and name HG) 5.0 3.2 0.0
assign (residue 3 and name HB) (residue 3 and name HG2#) 2.5 0.7 1.0
assign (residue 3 and name HB) (residue 6 and name HD#) 5.0 3.2 1.0
assign (residue 3 and name HG2#) (residue 40 and name HA) 5.0 3.2 1.0
assign (residue 3 and name HG2#) (residue 4 and name HA) 5.0 3.2 1.0
assign (residue 3 and name HG2#) (residue 39 and name HA#) 4.0 2.2 2.0
assign (residue 3 and name HG2#) (residue 51 and name HD#) 6.0 4.2 2.0
assign (residue 3 and name HG2#) (residue 40 and name HB#) 5.0 3.2 2.0
assign (residue 3 and name HG2#) (residue 38 and name HB#) 5.0 3.2 2.0
assign (residue 3 and name HG2#) (residue 4 and name HB#) 5.0 3.2 2.0
assign (residue 3 and name HG2#) (residue 6 and name HG) 5.0 3.2 1.0
assign (residue 3 and name HG2#) (residue 6 and name HD#) 4.0 2.2 3.4

assign (residue 4 and name HN) (residue 5 and name HN) 3.0 1.2 0.0
assign (residue 4 and name HN) (residue 6 and name HN) 5.0 3.2 0.0
assign (residue 4 and name HN) (residue 2 and name HA) 5.0 3.2 0.0
assign (residue 4 and name HN) (residue 5 and name HA) 6.0 4.2 0.0
assign (residue 4 and name HN) (residue 4 and name HA) 4.0 2.2 0.0
assign (residue 4 and name HN) (residue 3 and name HB) 4.0 2.2 0.0
assign (residue 4 and name HN) (residue 3 and name HA) 4.0 2.2 0.0
assign (residue 4 and name HN) (residue 5 and name HD#) 6.0 4.2 1.0
assign (residue 4 and name HN) (residue 4 and name HB#) 2.5 0.7 1.0
assign (residue 4 and name HN) (residue 2 and name HB#) 5.0 3.2 1.0
assign (residue 4 and name HN) (residue 5 and name HB#) 5.0 3.2 1.0
assign (residue 4 and name HN) (residue 52 and name HB#) 7.0 5.2 1.0
assign (residue 4 and name HN) (residue 6 and name HG) 5.0 3.2 0.0
assign (residue 4 and name HN) (residue 5 and name HG#) 5.0 3.2 1.0
assign (residue 4 and name HN) (residue 3 and name HG2#) 5.0 3.2 1.0
assign (residue 4 and name HN) (residue 6 and name HD#) 5.0 3.2 2.4
assign (residue 4 and name HA) (residue 22 and name HB#) 5.0 3.2 1.0
assign (residue 4 and name HA) (residue 23 and name HB#) 7.0 5.2 1.0
assign (residue 4 and name HA) (residue 40 and name HB#) 4.0 2.2 1.0
assign (residue 4 and name HA) (residue 4 and name HB#) 2.5 0.7 1.0
assign (residue 4 and name HB#) (residue 52 and name HA) 6.0 4.2 1.0
assign (residue 4 and name HB#) (residue 5 and name HA) 5.0 3.2 1.0
assign (residue 4 and name HB#) (residue 5 and name HD#) 6.0 4.2 2.0
assign (residue 4 and name HB#) (residue 22 and name HB#) 4.0 2.2 2.0
assign (residue 4 and name HB#) (residue 52 and name HB#) 4.0 2.2 2.0
assign (residue 4 and name HB#) (residue 5 and name HB#) 6.0 4.2 2.0

assign (residue 5 and name HN) (residue 6 and name HN) 3.0 1.2 0.0
assign (residue 5 and name HN) (residue 5 and name HA) 4.0 2.2 0.0
assign (residue 5 and name HN) (residue 6 and name HA) 5.0 3.2 0.0
assign (residue 5 and name HN) (residue 4 and name HA) 4.0 2.2 0.0
assign (residue 5 and name HN) (residue 3 and name HB) 5.0 3.2 0.0
assign (residue 5 and name HN) (residue 3 and name HA) 4.0 2.2 0.0
assign (residue 5 and name HN) (residue 5 and name HD#) 5.0 3.2 1.0
assign (residue 5 and name HN) (residue 40 and name HB#) 6.0 4.2 1.0
assign (residue 5 and name HN) (residue 4 and name HB#) 4.0 2.2 1.0
assign (residue 5 and name HN) (residue 2 and name HB#) 4.0 2.2 1.0
assign (residue 5 and name HN) (residue 5 and name HB#) 2.5 0.7 1.0
assign (residue 5 and name HN) (residue 6 and name HG) 4.0 2.2 0.0
assign (residue 5 and name HN) (residue 5 and name HG#) 3.0 1.2 1.0
assign (residue 5 and name HN) (residue 3 and name HG2#) 5.0 3.2 1.0
assign (residue 5 and name HN) (residue 6 and name HD#) 5.0 3.2 2.4
assign (residue 5 and name HN) (residue 1 and name HD#) 6.0 4.2 1.0
assign (residue 5 and name HN) (residue 1 and name HG2#) 6.0 4.2 1.0
assign (residue 5 and name HE) (residue 3 and name HB) 7.0 5.2 0.0
assign (residue 5 and name HE) (residue 5 and name HD#) 3.0 1.2 1.0
assign (residue 5 and name HE) (residue 2 and name HB#) 6.0 4.2 1.0
assign (residue 5 and name HE) (residue 5 and name HB#) 5.0 3.2 1.0
assign (residue 5 and name HE) (residue 5 and name HG#) 5.0 3.2 1.0
assign (residue 5 and name HE) (residue 1 and name HD#) 6.0 4.2 1.0
assign (residue 5 and name HE) (residue 1 and name HG2#) 5.0 3.2 1.0
assign (residue 5 and name HA) (residue 24 and name HA#) 6.0 4.2 1.0
assign (residue 5 and name HA) (residue 5 and name HD#) 4.0 2.2 1.0
assign (residue 5 and name HA) (residue 5 and name HB#) 3.0 1.2 1.0
assign (residue 5 and name HA) (residue 6 and name HG) 6.0 4.2 0.0
assign (residue 5 and name HA) (residue 6 and name HB#) 5.0 3.2 1.0
assign (residue 5 and name HA) (residue 6 and name HD#) 6.0 4.2 2.4
assign (residue 5 and name HA) (residue 5 and name HG#) 4.0 2.2 1.0
assign (residue 5 and name HB#) (residue 6 and name HA) 6.0 4.2 1.0
assign (residue 5 and name HB#) (residue 5 and name HD#) 2.5 0.7 2.0
assign (residue 5 and name HB#) (residue 5 and name HG#) 2.5 0.7 2.0
assign (residue 5 and name HG#) (residue 5 and name HD#) 3.0 1.2 2.0

assign (residue 6 and name HN) (residue 38 and name HD#) 6.0 4.2 1.0
assign (residue 6 and name HN) (residue 40 and name HD#) 5.0 3.2 1.0
assign (residue 6 and name HN) (residue 40 and name HA) 7.0 5.2 0.0
assign (residue 6 and name HN) (residue 5 and name HA) 4.0 2.2 0.0
assign (residue 6 and name HN) (residue 6 and name HA) 4.0 2.2 0.0
assign (residue 6 and name HN) (residue 4 and name HA) 5.0 3.2 0.0
assign (residue 6 and name HN) (residue 3 and name HB) 6.0 4.2 0.0
assign (residue 6 and name HN) (residue 7 and name HD#) 5.0 3.2 1.0
assign (residue 6 and name HN) (residue 3 and name HA) 5.0 3.2 0.0
assign (residue 6 and name HN) (residue 40 and name HB#) 5.0 3.2 1.0
assign (residue 6 and name HN) (residue 4 and name HB#) 5.0 3.2 1.0
assign (residue 6 and name HN) (residue 2 and name HB#) 6.0 4.2 1.0
assign (residue 6 and name HN) (residue 5 and name HB#) 5.0 3.2 1.0
assign (residue 6 and name HN) (residue 6 and name HG) 4.0 2.2 0.0
assign (residue 6 and name HN) (residue 6 and name HB#) 4.0 2.2 1.0
assign (residue 6 and name HN) (residue 3 and name HG2#) 5.0 3.2 1.0
assign (residue 6 and name HN) (residue 6 and name HD#) 4.0 2.2 2.4
assign (residue 6 and name HN) (residue 1 and name HD#) 6.0 4.2 1.0
assign (residue 6 and name HA) (residue 7 and name HD#) 2.5 0.7 1.0
assign (residue 6 and name HA) (residue 40 and name HB#) 7.0 5.2 1.0
assign (residue 6 and name HA) (residue 7 and name HG#) 5.0 3.2 1.0
assign (residue 6 and name HA) (residue 6 and name HG) 4.0 2.2 0.0
assign (residue 6 and name HA) (residue 6 and name HB#) 3.0 1.2 1.0
assign (residue 6 and name HA) (residue 6 and name HD#) 3.0 1.2 2.4
assign (residue 6 and name HB#) (residue 7 and name HD#) 3.0 1.2 2.0
assign (residue 6 and name HB#) (residue 38 and name HB#) 6.0 4.2 2.0
assign (residue 6 and name HB#) (residue 6 and name HG) 2.5 0.7 1.0
assign (residue 6 and name HB#) (residue 6 and name HD#) 2.5 0.7 2.4
assign (residue 6 and name HG) (residue 40 and name HB#) 4.0 2.2 1.0
assign (residue 6 and name HG) (residue 6 and name HD#) 2.5 0.7 2.4
assign (residue 6 and name HD#) (residue 7 and name HD#) 5.0 3.2 3.4
assign (residue 6 and name HD#) (residue 39 and name HA#) 5.0 3.2 3.4
assign (residue 6 and name HD#) (residue 38 and name HA) 4.0 2.2 2.4
assign (residue 6 and name HD#) (residue 38 and name HB#) 3.0 1.2 3.4
assign (residue 6 and name HD#) (residue 40 and name HB#) 4.0 2.2 3.4

assign (residue 7 and name HA) (residue 7 and name HD#) 5.0 3.2 1.0
assign (residue 7 and name HA) (residue 8 and name HA) 6.0 4.2 0.0
assign (residue 7 and name HA) (residue 7 and name HB#) 3.0 1.2 1.0
assign (residue 7 and name HA) (residue 7 and name HG#) 5.0 3.2 1.0
assign (residue 7 and name HA) (residue 8 and name HB#) 6.0 4.2 1.0
assign (residue 7 and name HB#) (residue 7 and name HD#) 4.0 2.2 2.0
assign (residue 7 and name HB#) (residue 7 and name HG#) 2.5 0.7 2.0
assign (residue 7 and name HG#) (residue 7 and name HD#) 3.0 1.2 2.0
assign (residue 7 and name HG#) (residue 8 and name HA) 6.0 4.2 1.0

assign (residue 8 and name HN) (residue 9 and name HN) 5.0 3.2 0.0
assign (residue 8 and name HN) (residue 7 and name HA) 4.0 2.2 0.0
assign (residue 8 and name HN) (residue 8 and name HA) 4.0 2.2 0.0
assign (residue 8 and name HN) (residue 7 and name HB#) 4.0 2.2 1.0
assign (residue 8 and name HN) (residue 7 and name HG#) 5.0 3.2 1.0
assign (residue 8 and name HN) (residue 8 and name HB#) 4.0 2.2 1.0
assign (residue 8 and name HA) (residue 40 and name HB#) 6.0 4.2 1.0
assign (residue 8 and name HA) (residue 21 and name HB#) 6.0 4.2 1.0
assign (residue 8 and name HA) (residue 9 and name HA) 5.0 3.2 0.0
assign (residue 8 and name HA) (residue 9 and name HB#) 5.0 3.2 1.0
assign (residue 8 and name HA) (residue 8 and name HB#) 3.0 1.2 1.0
assign (residue 8 and name HB#) (residue 9 and name HA) 6.0 4.2 1.0
assign (residue 8 and name HB#) (residue 8 and name HG) 5.0 3.2 1.0
assign (residue 8 and name HB#) (residue 30 and name HB#) 5.0 3.2 2.0
assign (residue 8 and name HB#) (residue 21 and name HB#) 5.0 3.2 2.0

assign (residue 9 and name HN) (residue 10 and name HN) 5.0 3.2 0.0
assign (residue 9 and name HN) (residue 38 and name HD#) 5.0 3.2 1.0
assign (residue 9 and name HN) (residue 9 and name HA) 4.0 2.2 0.0
assign (residue 9 and name HN) (residue 8 and name HG) 4.0 2.2 0.0
assign (residue 9 and name HN) (residue 8 and name HA) 3.0 1.2 0.0
assign (residue 9 and name HN) (residue 9 and name HB#) 4.0 2.2 1.0
assign (residue 9 and name HN) (residue 8 and name HB#) 4.0 2.2 1.0
assign (residue 9 and name HA) (residue 10 and name HB#) 5.0 3.2 1.0
assign (residue 9 and name HA) (residue 9 and name HB#) 4.0 2.2 1.0
assign (residue 9 and name HB#) (residue 10 and name HA) 6.0 4.2 1.0
assign (residue 9 and name HB#) (residue 37 and name HA#) 4.0 2.2 2.0

assign (residue 10 and name HN) (residue 11 and name HN) 4.0 2.2 0.0
assign (residue 10 and name HN) (residue 10 and name HE) 5.0 3.2 0.0
assign (residue 10 and name HN) (residue 9 and name HA) 4.0 2.2 0.0
assign (residue 10 and name HN) (residue 10 and name HA) 4.0 2.2 0.0
assign (residue 10 and name HN) (residue 10 and name HD#) 5.0 3.2 1.0
assign (residue 10 and name HN) (residue 9 and name HB#) 5.0 3.2 1.0
assign (residue 10 and name HN) (residue 10 and name HB#) 4.0 2.2 1.0
assign (residue 10 and name HN) (residue 10 and name HG#) 5.0 3.2 1.0
assign (residue 10 and name HE) (residue 33 and name HA#) 6.0 4.2 1.0
assign (residue 10 and name HE) (residue 10 and name HD#) 3.0 1.2 1.0
assign (residue 10 and name HE) (residue 10 and name HB#) 5.0 3.2 1.0
assign (residue 10 and name HE) (residue 10 and name HG#) 3.0 1.2 1.0
assign (residue 10 and name HE) (residue 31 and name HG2#) 5.0 3.2 1.0
assign (residue 10 and name HE) (residue 31 and name HG2#) 5.0 3.2 1.0
assign (residue 10 and name HA) (residue 32 and name HA) 6.0 4.2 0.0
assign (residue 10 and name HA) (residue 10 and name HD#) 4.0 2.2 1.0
assign (residue 10 and name HA) (residue 10 and name HB#) 4.0 2.2 1.0
assign (residue 10 and name HA) (residue 10 and name HG#) 3.0 1.2 1.0
assign (residue 10 and name HA) (residue 31 and name HG2#) 6.0 4.2 1.0
assign (residue 10 and name HB#) (residue 10 and name HD#) 3.0 1.2 2.0
assign (residue 10 and name HB#) (residue 10 and name HG#) 2.5 0.7 2.0
assign (residue 10 and name HB#) (residue 31 and name HG2#) 5.0 3.2 2.0
assign (residue 10 and name HG#) (residue 10 and name HD#) 2.5 0.7 2.0
assign (residue 10 and name HG#) (residue 31 and name HG2#) 4.0 2.2 2.0
assign (residue 10 and name HG#) (residue 32 and name HA) 4.0 2.2 1.0
assign (residue 10 and name HG#) (residue 33 and name HA#) 5.0 3.2 2.0
assign (residue 10 and name HD#) (residue 31 and name HG2#) 5.0 3.2 2.0

assign (residue 11 and name HN) (residue 12 and name HN) 5.0 3.2 0.0
assign (residue 11 and name HN) (residue 32 and name HD#) 6.0 4.2 2.4
assign (residue 11 and name HN) (residue 9 and name HA) 5.0 3.2 0.0
assign (residue 11 and name HN) (residue 10 and name HA) 5.0 3.2 0.0
assign (residue 11 and name HN) (residue 37 and name HA#) 6.0 4.2 1.0
assign (residue 11 and name HN) (residue 12 and name HA) 6.0 4.2 0.0
assign (residue 11 and name HN) (residue 11 and name HA#) 2.5 0.7 1.0
assign (residue 11 and name HN) (residue 10 and name HD#) 6.0 4.2 1.0
assign (residue 11 and name HN) (residue 9 and name HB#) 6.0 4.2 1.0
assign (residue 11 and name HN) (residue 10 and name HB#) 4.0 2.2 1.0
assign (residue 11 and name HN) (residue 10 and name HG#) 5.0 3.2 1.0
assign (residue 11 and name HN) (residue 12 and name HB#) 6.0 4.2 1.0
assign (residue 11 and name HN) (residue 12 and name HG#) 6.0 4.2 1.0
assign (residue 11 and name HA#) (residue 37 and name HA#) 5.0 3.2 2.0
assign (residue 11 and name HA#) (residue 36 and name HA#) 6.0 4.2 2.0
assign (residue 11 and name HA#) (residue 12 and name HA) 6.0 4.2 1.0
assign (residue 11 and name HA#) (residue 12 and name HB#) 7.0 5.2 2.0

assign (residue 12 and name HN) (residue 13 and name HN) 5.0 3.2 0.0
assign (residue 12 and name HN) (residue 12 and name HA) 4.0 2.2 0.0
assign (residue 12 and name HN) (residue 11 and name HA#) 2.5 0.7 1.0
assign (residue 12 and name HN) (residue 12 and name HD#) 5.0 3.2 1.0
assign (residue 12 and name HN) (residue 12 and name HG#) 4.0 2.2 1.0
assign (residue 12 and name HN) (residue 12 and name HB#) 3.0 1.2 1.0
assign (residue 12 and name HE) (residue 12 and name HA) 6.0 4.2 0.0
assign (residue 12 and name HE) (residue 12 and name HD#) 3.0 1.2 1.0
assign (residue 12 and name HE) (residue 12 and name HG#) 5.0 3.2 1.0
assign (residue 12 and name HE) (residue 12 and name HB#) 5.0 3.2 1.0
assign (residue 12 and name HA) (residue 15 and name HA) 7.0 5.2 0.0
assign (residue 12 and name HA) (residue 33 and name HA#) 5.0 3.2 1.0
assign (residue 12 and name HA) (residue 12 and name HB#) 3.0 1.2 1.0
assign (residue 12 and name HA) (residue 12 and name HG#) 4.0 2.2 1.0
assign (residue 12 and name HA) (residue 12 and name HD#) 5.0 3.2 1.0
assign (residue 12 and name HB#) (residue 12 and name HD#) 2.5 0.7 2.0
assign (residue 12 and name HB#) (residue 12 and name HG#) 2.5 0.7 2.0
assign (residue 12 and name HG#) (residue 12 and name HD#) 2.5 0.7 2.0

assign (residue 13 and name HN) (residue 14 and name HN) 5.0 3.2 0.0
assign (residue 13 and name HN) (residue 15 and name HN) 6.0 4.2 0.0
assign (residue 13 and name HN) (residue 13 and name HA) 4.0 2.2 0.0
assign (residue 13 and name HN) (residue 12 and name HA) 5.0 3.2 0.0
assign (residue 13 and name HN) (residue 11 and name HA#) 6.0 4.2 1.0
assign (residue 13 and name HN) (residue 33 and name HA#) 6.0 4.2 1.0
assign (residue 13 and name HN) (residue 13 and name HB#) 5.0 3.2 1.0
assign (residue 13 and name HN) (residue 12 and name HG#) 5.0 3.2 1.0
assign (residue 13 and name HN) (residue 12 and name HB#) 5.0 3.2 1.0
assign (residue 13 and name HA) (residue 13 and name HB#) 4.0 2.2 1.0
assign (residue 13 and name HA) (residue 14 and name HG#) 5.0 3.2 1.0
assign (residue 13 and name HA) (residue 14 and name HD#) 5.0 3.2 1.0
assign (residue 13 and name HA) (residue 14 and name HE#) 6.0 4.2 1.0
assign (residue 13 and name HB#) (residue 33 and name HA#) 6.0 4.2 2.0
assign (residue 13 and name HB#) (residue 35 and name HB#) 6.0 4.2 2.0

assign (residue 14 and name HN) (residue 15 and name HN) 4.0 2.2 0.0
assign (residue 14 and name HN) (residue 13 and name HA) 4.0 2.2 0.0
assign (residue 14 and name HN) (residue 14 and name HA) 3.0 1.2 0.0
assign (residue 14 and name HN) (residue 15 and name HA) 6.0 4.2 0.0
assign (residue 14 and name HN) (residue 13 and name HB#) 3.0 1.2 1.0
assign (residue 14 and name HN) (residue 14 and name HB#) 3.0 1.2 1.0
assign (residue 14 and name HN) (residue 14 and name HG#) 4.0 2.2 1.0
assign (residue 14 and name HN) (residue 15 and name HB#) 5.0 3.2 1.0
assign (residue 14 and name HA) (residue 33 and name HA#) 5.0 3.2 1.0
assign (residue 14 and name HA) (residue 14 and name HB#) 3.0 1.2 1.0
assign (residue 14 and name HA) (residue 14 and name HD#) 5.0 3.2 1.0
assign (residue 14 and name HA) (residue 14 and name HG#) 4.0 2.2 1.0
assign (residue 14 and name HA) (residue 15 and name HB#) 5.0 3.2 1.0
assign (residue 14 and name HB#) (residue 14 and name HE#) 6.0 4.2 2.0
assign (residue 14 and name HB#) (residue 14 and name HG#) 4.0 2.2 2.0
assign (residue 14 and name HB#) (residue 15 and name HB#) 5.0 3.2 2.0
assign (residue 14 and name HG#) (residue 14 and name HD#) 4.0 2.2 2.0
assign (residue 14 and name HG#) (residue 14 and name HE#) 5.0 3.2 2.0

assign (residue 15 and name HN) (residue 16 and name HN) 5.0 3.2 0.0
assign (residue 15 and name HN) (residue 13 and name HA) 6.0 4.2 0.0
assign (residue 15 and name HN) (residue 14 and name HA) 4.0 2.2 0.0
assign (residue 15 and name HN) (residue 33 and name HA#) 5.0 3.2 1.0
assign (residue 15 and name HN) (residue 15 and name HA) 3.0 1.2 0.0
assign (residue 15 and name HN) (residue 13 and name HB#) 5.0 3.2 1.0
assign (residue 15 and name HN) (residue 14 and name HB#) 5.0 3.2 1.0
assign (residue 15 and name HN) (residue 14 and name HG#) 6.0 4.2 1.0
assign (residue 15 and name HN) (residue 15 and name HB#) 2.5 0.7 1.0
assign (residue 15 and name HA) (residue 33 and name HA#) 5.0 3.2 1.0
assign (residue 15 and name HA) (residue 16 and name HB#) 6.0 4.2 1.0
assign (residue 15 and name HA) (residue 14 and name HG#) 6.0 4.2 1.0
assign (residue 15 and name HA) (residue 15 and name HB#) 2.5 0.7 1.0
assign (residue 15 and name HB#) (residue 17 and name HA) 6.0 4.2 1.0
assign (residue 15 and name HB#) (residue 16 and name HA) 5.0 3.2 1.0
assign (residue 15 and name HB#) (residue 33 and name HA#) 5.0 3.2 2.0
assign (residue 15 and name HB#) (residue 16 and name HB#) 5.0 3.2 2.0
assign (residue 15 and name HB#) (residue 17 and name HB#) 6.0 4.2 2.0
assign (residue 15 and name HB#) (residue 32 and name HB#) 6.0 4.2 2.0

assign (residue 16 and name HN) (residue 17 and name HN) 4.0 2.2 0.0
assign (residue 16 and name HN) (residue 17 and name HE#) 5.0 3.2 2.4
assign (residue 16 and name HN) (residue 17 and name HD#) 5.0 3.2 2.4
assign (residue 16 and name HN) (residue 17 and name HA) 6.0 4.2 0.0
assign (residue 16 and name HN) (residue 16 and name HA) 3.0 1.2 0.0
assign (residue 16 and name HN) (residue 15 and name HA) 4.0 2.2 0.0
assign (residue 16 and name HN) (residue 16 and name HB#) 4.0 2.2 1.0
assign (residue 16 and name HN) (residue 15 and name HB#) 2.5 0.7 1.0
assign (residue 16 and name HN) (residue 31 and name HG2#) 5.0 3.2 1.0
assign (residue 16 and name HN) (residue 31 and name HD#) 5.0 3.2 1.0
assign (residue 16 and name HA) (residue 16 and name HB#) 4.0 2.2 1.0
assign (residue 16 and name HA) (residue 31 and name HG2#) 3.0 1.2 1.0
assign (residue 16 and name HA) (residue 31 and name HD#) 5.0 3.2 1.0
assign (residue 16 and name HB#) (residue 31 and name HG2#) 4.0 2.2 2.0
assign (residue 16 and name HB#) (residue 31 and name HD#) 5.0 3.2 2.0

assign (residue 17 and name HN) (residue 32 and name HN) 4.0 2.2 0.0
assign (residue 17 and name HN) (residue 18 and name HN) 5.0 3.2 0.0
assign (residue 17 and name HN) (residue 17 and name HE#) 5.0 3.2 2.4
assign (residue 17 and name HN) (residue 17 and name HD#) 4.0 2.2 2.4
assign (residue 17 and name HN) (residue 32 and name HD#) 5.0 3.2 2.4
assign (residue 17 and name HN) (residue 17 and name HA) 4.0 2.2 0.0
assign (residue 17 and name HN) (residue 18 and name HA) 5.0 3.2 0.0
assign (residue 17 and name HN) (residue 16 and name HA) 4.0 2.2 0.0
assign (residue 17 and name HN) (residue 31 and name HA) 5.0 3.2 0.0
assign (residue 17 and name HN) (residue 33 and name HA#) 5.0 3.2 1.0
assign (residue 17 and name HN) (residue 16 and name HB#) 5.0 3.2 1.0
assign (residue 17 and name HN) (residue 17 and name HB#) 2.5 0.7 1.0
assign (residue 17 and name HN) (residue 32 and name HB#) 5.0 3.2 1.0
assign (residue 17 and name HN) (residue 15 and name HB#) 5.0 3.2 1.0
assign (residue 17 and name HN) (residue 31 and name HG2#) 4.0 2.2 1.0
assign (residue 17 and name HN) (residue 31 and name HD#) 5.0 3.2 1.0
assign (residue 17 and name HA) (residue 17 and name HB#) 2.5 0.7 1.0
assign (residue 17 and name HA) (residue 18 and name HB#) 5.0 3.2 1.0
assign (residue 17 and name HA) (residue 18 and name HG#) 6.0 4.2 1.0
assign (residue 17 and name HA) (residue 19 and name HG#) 6.0 4.2 1.0
assign (residue 17 and name HB#) (residue 43 and name HA) 5.0 3.2 1.0
assign (residue 17 and name HB#) (residue 18 and name HA) 6.0 4.2 1.0
assign (residue 17 and name HB#) (residue 31 and name HA) 6.0 4.2 1.0
assign (residue 17 and name HB#) (residue 32 and name HB#) 4.0 2.2 2.0
assign (residue 17 and name HB#) (residue 19 and name HG#) 5.0 3.2 2.0
assign (residue 17 and name HB#) (residue 31 and name HG2#) 5.0 3.2 2.0

assign (residue 18 and name HN) (residue 19 and name HN) 5.0 3.2 0.0
assign (residue 18 and name HN) (residue 17 and name HD#) 5.0 3.2 2.4
assign (residue 18 and name HN) (residue 17 and name HA) 2.5 0.7 0.0
assign (residue 18 and name HN) (residue 18 and name HA) 4.0 2.2 0.0
assign (residue 18 and name HN) (residue 31 and name HA) 6.0 4.2 0.0
assign (residue 18 and name HN) (residue 17 and name HB#) 4.0 2.2 1.0
assign (residue 18 and name HN) (residue 18 and name HG#) 4.0 2.2 1.0
assign (residue 18 and name HN) (residue 18 and name HB#) 4.0 2.2 1.0
assign (residue 18 and name HN) (residue 31 and name HG2#) 6.0 4.2 1.0
assign (residue 18 and name HN) (residue 31 and name HD#) 5.0 3.2 1.0
assign (residue 18 and name HA) (residue 31 and name HA) 5.0 3.2 0.0
assign (residue 18 and name HA) (residue 18 and name HG#) 4.0 2.2 1.0
assign (residue 18 and name HA) (residue 18 and name HB#) 5.0 3.2 1.0
assign (residue 18 and name HA) (residue 19 and name HB#) 5.0 3.2 1.0
assign (residue 18 and name HA) (residue 31 and name HG1#) 5.0 3.2 1.0
assign (residue 18 and name HA) (residue 29 and name HD#) 5.0 3.2 1.0
assign (residue 18 and name HA) (residue 31 and name HG2#) 5.0 3.2 1.0
assign (residue 18 and name HA) (residue 31 and name HD#) 4.0 2.2 1.0
assign (residue 18 and name HA) (residue 18 and name HG#) 4.0 2.2 1.0
assign (residue 18 and name HB#) (residue 31 and name HA) 6.0 4.2 1.0
assign (residue 18 and name HB#) (residue 18 and name HG#) 3.0 1.2 2.0
assign (residue 18 and name HB#) (residue 29 and name HB#) 5.0 3.2 2.0
assign (residue 18 and name HB#) (residue 29 and name HD#) 5.0 3.2 2.0
assign (residue 18 and name HB#) (residue 31 and name HG2#) 5.0 3.2 2.0
assign (residue 18 and name HB#) (residue 31 and name HD#) 5.0 3.2 2.0
assign (residue 18 and name HG#) (residue 31 and name HA) 6.0 4.2 1.0
assign (residue 18 and name HG#) (residue 29 and name HD#) 5.0 3.2 2.0
assign (residue 18 and name HG#) (residue 29 and name HB#) 5.0 3.2 2.0
assign (residue 18 and name HG#) (residue 31 and name HG2#) 5.0 3.2 2.0
assign (residue 18 and name HG#) (residue 31 and name HD#) 5.0 3.2 2.0

assign (residue 19 and name HN) (residue 30 and name HN) 5.0 3.2 0.0
assign (residue 19 and name HN) (residue 32 and name HN) 5.0 3.2 0.0
assign (residue 19 and name HN) (residue 20 and name HN) 5.0 3.2 0.0
assign (residue 19 and name HN) (residue 30 and name HA) 5.0 3.2 0.0
assign (residue 19 and name HN) (residue 19 and name HA) 5.0 3.2 0.0
assign (residue 19 and name HN) (residue 43 and name HA) 6.0 4.2 0.0
assign (residue 19 and name HN) (residue 18 and name HA) 2.5 0.7 0.0
assign (residue 19 and name HN) (residue 31 and name HA) 5.0 3.2 0.0
assign (residue 19 and name HN) (residue 19 and name HD#) 6.0 4.2 1.0
assign (residue 19 and name HN) (residue 32 and name HB#) 6.0 4.2 1.0
assign (residue 19 and name HN) (residue 18 and name HG#) 5.0 3.2 1.0
assign (residue 19 and name HN) (residue 18 and name HB#) 5.0 3.2 1.0
assign (residue 19 and name HN) (residue 19 and name HB#) 5.0 3.2 1.0
assign (residue 19 and name HN) (residue 19 and name HG#) 5.0 3.2 1.0
assign (residue 19 and name HN) (residue 29 and name HB#) 5.0 3.2 1.0
assign (residue 19 and name HN) (residue 31 and name HG2#) 5.0 3.2 1.0
assign (residue 19 and name HN) (residue 31 and name HD#) 5.0 3.2 1.0
assign (residue 19 and name HE) (residue 32 and name HD#) 5.0 3.2 2.4
assign (residue 19 and name HE) (residue 43 and name HA) 5.0 3.2 0.0
assign (residue 19 and name HE) (residue 19 and name HD#) 3.0 1.2 1.0
assign (residue 19 and name HE) (residue 17 and name HB#) 5.0 3.2 1.0
assign (residue 19 and name HE) (residue 19 and name HG#) 4.0 2.2 1.0
assign (residue 19 and name HE) (residue 19 and name HB#) 5.0 3.2 1.0
assign (residue 19 and name HD#) (residue 19 and name HA) 4.0 2.2 1.0
assign (residue 19 and name HD#) (residue 43 and name HA) 4.0 2.2 1.0
assign (residue 19 and name HD#) (residue 43 and name HD#) 5.0 3.2 2.0
assign (residue 19 and name HD#) (residue 19 and name HB#) 4.0 2.2 2.0
assign (residue 19 and name HD#) (residue 32 and name HB#) 5.0 3.2 2.0
assign (residue 19 and name HD#) (residue 43 and name HB#) 5.0 3.2 2.0
assign (residue 19 and name HD#) (residue 43 and name HG#) 6.0 4.2 2.0
assign (residue 19 and name HB#) (residue 43 and name HA) 5.0 3.2 1.0
assign (residue 19 and name HB#) (residue 32 and name HB#) 4.0 2.2 2.0
assign (residue 19 and name HG#) (residue 43 and name HA) 5.0 3.2 1.0
assign (residue 19 and name HG#) (residue 19 and name HD#) 4.0 2.2 2.0
assign (residue 19 and name HG#) (residue 32 and name HB#) 3.0 1.2 2.0
assign (residue 19 and name HA) (residue 19 and name HB#) 4.0 2.2 1.0
assign (residue 19 and name HA) (residue 19 and name HG#) 5.0 3.2 1.0
assign (residue 19 and name HE) (residue 17 and name HB#) 5.0 3.2 1.0

assign (residue 20 and name HN) (residue 21 and name HN) 5.0 3.2 0.0
assign (residue 20 and name HN) (residue 20 and name HE1) 6.0 4.2 0.0
assign (residue 20 and name HN) (residue 42 and name HN) 5.0 3.2 0.0
assign (residue 20 and name HN) (residue 44 and name HN) 5.0 3.2 0.0
assign (residue 20 and name HN) (residue 19 and name HE) 6.0 4.2 0.0
assign (residue 20 and name HN) (residue 44 and name HN) 5.0 3.2 1.0
assign (residue 20 and name HN) (residue 20 and name HD1) 4.0 2.2 0.0
assign (residue 20 and name HN) (residue 20 and name HA) 5.0 3.2 0.0
assign (residue 20 and name HN) (residue 19 and name HA) 4.0 2.2 0.0
assign (residue 20 and name HN) (residue 43 and name HA) 5.0 3.2 0.0
assign (residue 20 and name HN) (residue 19 and name HD#) 5.0 3.2 1.0
assign (residue 20 and name HN) (residue 42 and name HB#) 5.0 3.2 1.0
assign (residue 20 and name HN) (residue 20 and name HB#) 5.0 3.2 1.0
assign (residue 20 and name HN) (residue 19 and name HB#) 4.0 2.2 1.0
assign (residue 20 and name HN) (residue 19 and name HG#) 5.0 3.2 1.0
assign (residue 20 and name HA) (residue 21 and name HA) 5.0 3.2 0.0
assign (residue 20 and name HA) (residue 30 and name HA) 7.0 5.2 0.0
assign (residue 20 and name HA) (residue 29 and name HA) 4.0 2.2 0.0
assign (residue 20 and name HA) (residue 20 and name HB#) 4.0 2.2 1.0
assign (residue 20 and name HB#) (residue 42 and name HB#) 4.0 2.2 2.0
assign (residue 20 and name HB#) (residue 27 and name HB#) 5.0 3.2 2.0
assign (residue 20 and name HB#) (residue 45 and name HA) 5.0 3.2 1.0

assign (residue 21 and name HN) (residue 30 and name HN) 5.0 3.2 2.4
assign (residue 21 and name HN) (residue 22 and name HN) 6.0 4.2 0.0
assign (residue 21 and name HN) (residue 28 and name HN) 4.0 2.2 0.0
assign (residue 21 and name HN) (residue 29 and name HN) 5.0 3.2 0.0
assign (residue 21 and name HN) (residue 20 and name HA) 4.0 2.2 0.0
assign (residue 21 and name HN) (residue 21 and name HA) 5.0 3.2 0.0
assign (residue 21 and name HN) (residue 29 and name HA) 6.0 4.2 0.0
assign (residue 21 and name HN) (residue 20 and name HB#) 5.0 3.2 1.0
assign (residue 21 and name HN) (residue 28 and name HB#) 5.0 3.2 1.0
assign (residue 21 and name HA) (residue 40 and name HD#) 5.0 3.2 2.0
assign (residue 21 and name HA) (residue 21 and name HB#) 4.0 2.2 1.0
assign (residue 21 and name HA) (residue 22 and name HB#) 6.0 4.2 1.0
assign (residue 21 and name HA) (residue 41 and name HA) 6.0 4.2 0.0
assign (residue 21 and name HB#) (residue 41 and name HA)  6.0 4.2 1.0

assign (residue 22 and name HN) (residue 23 and name HN) 5.0 3.2 0.0
assign (residue 22 and name HN) (residue 40 and name HD#) 5.0 3.2 2.4
assign (residue 22 and name HN) (residue 22 and name HD#) 5.0 3.2 2.4
assign (residue 22 and name HN) (residue 21 and name HA) 4.0 2.2 0.0
assign (residue 22 and name HN) (residue 22 and name HA) 5.0 3.2 0.0
assign (residue 22 and name HN) (residue 22 and name HB#) 5.0 3.2 1.0
assign (residue 22 and name HN) (residue 40 and name HB#) 6.0 4.2 1.0
assign (residue 22 and name HN) (residue 21 and name HB#) 5.0 3.2 1.0
assign (residue 22 and name HA) (residue 27 and name HA) 3.0 1.2 0.0
assign (residue 22 and name HA) (residue 22 and name HB#) 5.0 3.2 1.0
assign (residue 22 and name HB#) (residue 40 and name HA) 5.0 3.2 1.0
assign (residue 22 and name HB#) (residue 52 and name HB#) 4.0 2.2 2.0

assign (residue 23 and name HN) (residue 28 and name HN) 5.0 3.2 0.0
assign (residue 23 and name HN) (residue 26 and name HN) 5.0 3.2 0.0
assign (residue 23 and name HN) (residue 25 and name HN) 5.0 3.2 0.0
assign (residue 23 and name HN) (residue 23 and name HD#) 5.0 3.2 1.0
assign (residue 23 and name HN) (residue 27 and name HA) 5.0 3.2 0.0
assign (residue 23 and name HN) (residue 24 and name HN) 5.0 3.2 0.0
assign (residue 23 and name HN) (residue 22 and name HA) 2.5 0.7 0.0
assign (residue 23 and name HN) (residue 23 and name HA) 4.0 2.2 0.0
assign (residue 23 and name HN) (residue 22 and name HB#) 5.0 3.2 1.0
assign (residue 23 and name HN) (residue 23 and name HB#) 4.0 2.2 1.0
assign (residue 23 and name HN) (residue 25 and name HB#) 6.0 3.2 1.0
assign (residue 23 and name HN) (residue 28 and name HB#) 5.0 3.2 1.0
assign (residue 23 and name HN) (residue 26 and name HG2#) 5.0 3.2 1.0
assign (residue 23 and name HD#) (residue 23 and name HA) 5.0 3.2 1.0
assign (residue 23 and name HD#) (residue 23 and name HB#) 4.0 2.2 2.0
assign (residue 23 and name HD#) (residue 25 and name HD#) 6.0 4.2 2.0
assign (residue 23 and name HD#) (residue 25 and name HB#) 5.0 3.2 2.0
assign (residue 23 and name HD#) (residue 25 and name HG#) 5.0 3.2 2.0
assign (residue 23 and name HD#) (residue 28 and name HB#) 5.0 3.2 2.0
assign (residue 23 and name HD#) (residue 26 and name HG2#) 4.0 2.2 2.0
assign (residue 23 and name HA) (residue 23 and name HB#) 3.0 1.2 1.0
assign (residue 23 and name HA) (residue 28 and name HB#) 5.0 3.2 1.0
assign (residue 23 and name HB#) (residue 23 and name HD#) 4.0 2.2 3.4
assign (residue 23 and name HB#) (residue 28 and name HB#) 6.0 4.2 2.0

assign (residue 24 and name HN) (residue 26 and name HN) 5.0 3.2 0.0
assign (residue 24 and name HN) (residue 25 and name HN) 4.0 2.2 0.0
assign (residue 24 and name HN) (residue 22 and name HD#) 6.0 4.2 2.4
assign (residue 24 and name HN) (residue 24 and name HA#) 5.0 3.2 1.0
assign (residue 24 and name HN) (residue 23 and name HA) 5.0 3.2 0.0
assign (residue 24 and name HN) (residue 22 and name HB#) 6.0 4.2 1.0
assign (residue 24 and name HN) (residue 23 and name HB#) 5.0 3.2 1.0
assign (residue 24 and name HN) (residue 25 and name HD#) 6.0 4.2 1.0
assign (residue 24 and name HN) (residue 25 and name HB#) 6.0 4.2 1.0
assign (residue 24 and name HA#) (residue 25 and name HG#) 5.0 3.2 2.0

assign (residue 25 and name HN) (residue 26 and name HN) 2.5 0.7 0.0
assign (residue 25 and name HN) (residue 26 and name HB) 6.0 4.2 0.0
assign (residue 25 and name HN) (residue 23 and name HD#) 5.0 3.2 1.0
assign (residue 25 and name HN) (residue 24 and name HA#) 4.0 2.2 1.0
assign (residue 25 and name HN) (residue 23 and name HA) 6.0 4.2 0.0
assign (residue 25 and name HN) (residue 25 and name HA) 5.0 3.2 0.0
assign (residue 25 and name HN) (residue 25 and name HD#) 4.0 2.2 1.0
assign (residue 25 and name HN) (residue 25 and name HB#) 3.0 1.2 1.0
assign (residue 25 and name HN) (residue 26 and name HG2#) 5.0 3.2 1.0
assign (residue 25 and name HE) (residue 25 and name HD#) 4.0 2.2 1.0
assign (residue 25 and name HE) (residue 25 and name HB#) 5.0 3.2 1.0
assign (residue 25 and name HE) (residue 25 and name HG#) 5.0 3.2 1.0
assign (residue 25 and name HA) (residue 25 and name HB#) 3.0 1.2 1.0
assign (residue 25 and name HA) (residue 25 and name HG#) 4.0 2.2 1.0
assign (residue 25 and name HB#) (residue 25 and name HD#) 4.0 2.2 2.0
assign (residue 25 and name HB#) (residue 26 and name HA) 6.0 4.2 1.0
assign (residue 25 and name HB#) (residue 26 and name HB) 5.0 3.2 1.0
assign (residue 25 and name HB#) (residue 25 and name HG#) 3.0 1.2 2.0
assign (residue 25 and name HB#) (residue 26 and name HG2#) 4.0 2.2 2.0
assign (residue 25 and name HG#) (residue 26 and name HB) 4.0 2.2 1.0
assign (residue 25 and name HG#) (residue 25 and name HD#) 2.5 0.7 2.0
assign (residue 25 and name HG#) (residue 26 and name HG2#) 4.0 2.2 2.0

assign (residue 26 and name HN) (residue 23 and name HD#) 5.0 3.2 1.0
assign (residue 26 and name HN) (residue 27 and name HN) 5.0 3.2 0.0
assign (residue 26 and name HN) (residue 27 and name HA) 7.0 5.2 0.0
assign (residue 26 and name HN) (residue 26 and name HA) 4.0 2.2 0.0
assign (residue 26 and name HN) (residue 24 and name HA#) 5.0 3.2 1.0
assign (residue 26 and name HN) (residue 23 and name HA) 6.0 4.2 0.0
assign (residue 26 and name HN) (residue 25 and name HA) 4.0 2.2 0.0
assign (residue 26 and name HN) (residue 26 and name HB) 5.0 3.2 0.0
assign (residue 26 and name HN) (residue 23 and name HB#) 5.0 3.2 1.0
assign (residue 26 and name HN) (residue 25 and name HB#) 4.0 2.2 1.0
assign (residue 26 and name HN) (residue 25 and name HG#) 4.0 2.2 1.0
assign (residue 26 and name HN) (residue 28 and name HB#) 6.0 4.2 1.0
assign (residue 26 and name HN) (residue 26 and name HG2#) 3.0 1.2 1.0
assign (residue 26 and name HA) (residue 27 and name HA) 5.0 3.2 0.0
assign (residue 26 and name HA) (residue 27 and name HB#) 5.0 3.2 1.0
assign (residue 26 and name HA) (residue 26 and name HB) 4.0 2.2 0.0
assign (residue 26 and name HA) (residue 49 and name HG#)  6.0 4.2 1.0
assign (residue 26 and name HA) (residue 26 and name HG2#) 4.0 2.2 1.0
assign (residue 26 and name HA) (residue 28 and name HB#)  7.0 5.2 1.0
assign (residue 26 and name HB) (residue 27 and name HB#)  6.0 4.2 1.0
assign (residue 26 and name HB) (residue 26 and name HG2#)  2.5 0.7 1.0
assign (residue 26 and name HG2#) (residue 27 and name HA)  5.0 3.2 1.0
assign (residue 26 and name HG2#) (residue 28 and name HA)  5.0 3.2 1.0
assign (residue 26 and name HG2#) (residue 28 and name HB#)  5.0 3.2 2.0

assign (residue 27 and name HN) (residue 28 and name HN) 5.0 3.2 0.0
assign (residue 27 and name HN) (residue 22 and name HD#) 6.0 4.2 2.4
assign (residue 27 and name HN) (residue 45 and name HE#) 6.0 4.2 1.0
assign (residue 27 and name HN) (residue 27 and name HA) 5.0 3.2 0.0
assign (residue 27 and name HN) (residue 22 and name HA) 5.0 3.2 0.0
assign (residue 27 and name HN) (residue 26 and name HA) 2.5 0.7 0.0
assign (residue 27 and name HN) (residue 26 and name HB) 4.0 2.2 0.0
assign (residue 27 and name HN) (residue 27 and name HB#) 3.0 1.2 1.0
assign (residue 27 and name HN) (residue 28 and name HB#) 5.0 3.2 1.0
assign (residue 27 and name HN) (residue 26 and name HG2#) 2.5 0.7 1.0
assign (residue 27 and name HA) (residue 28 and name HA) 5.0 3.2 0.0
assign (residue 27 and name HA) (residue 27 and name HB#) 4.0 2.2 1.0
assign (residue 27 and name HN) (residue 49 and name HG#) 5.0 3.2 2.0
assign (residue 27 and name HA) (residue 28 and name HB#) 5.0 3.2 1.0
assign (residue 27 and name HB#) (residue 45 and name HE#) 5.0 3.2 2.0
assign (residue 27 and name HB#) (residue 48 and name HB#) 5.0 3.2 2.0
assign (residue 27 and name HB#) (residue 49 and name HG#) 4.0 2.2 2.0
assign (residue 27 and name HB#) (residue 42 and name HB#) 5.0 3.2 2.0
assign (residue 27 and name HB#) (residue 45 and name HA) 5.0 3.2 1.0
assign (residue 27 and name HB#) (residue 45 and name HG#) 4.0 2.2 2.0
assign (residue 27 and name HB#) (residue 45 and name HG#) 5.0 3.2 2.0

assign (residue 28 and name HN) (residue 29 and name HN) 5.0 3.2 0.0
assign (residue 28 and name HN) (residue 23 and name HD#) 7.0 5.2 1.0
assign (residue 28 and name HN) (residue 27 and name HA) 2.5 0.7 0.0
assign (residue 28 and name HN) (residue 28 and name HA) 4.0 2.2 0.0
assign (residue 28 and name HN) (residue 22 and name HA) 5.0 3.2 0.0
assign (residue 28 and name HN) (residue 29 and name HA) 7.0 5.2 0.0
assign (residue 28 and name HN) (residue 26 and name HA) 7.0 4.2 0.0
assign (residue 28 and name HN) (residue 27 and name HB#) 5.0 3.2 1.0
assign (residue 28 and name HN) (residue 20 and name HB#) 6.0 4.2 1.0
assign (residue 28 and name HN) (residue 28 and name HB#) 4.0 2.2 1.0
assign (residue 28 and name HN) (residue 26 and name HG2#) 7.0 5.2 1.0
assign (residue 28 and name HA) (residue 28 and name HB#) 2.5 0.7 1.0
assign (residue 28 and name HA) (residue 29 and name HG#) 6.0 4.2 1.0
assign (residue 28 and name HB#) (residue 30 and name HA) 6.0 4.2 1.0
assign (residue 28 and name HB#) (residue 29 and name HA) 6.0 4.2 1.0
assign (residue 28 and name HB#) (residue 30 and name HB#) 6.0 4.2 2.0

assign (residue 29 and name HN) (residue 30 and name HN) 5.0 3.2 0.0
assign (residue 29 and name HN) (residue 20 and name HA) 5.0 3.2 0.0
assign (residue 29 and name HN) (residue 28 and name HA)  3.0 1.2 0.0
assign (residue 29 and name HN) (residue 30 and name HA) 6.0 4.2 0.0
assign (residue 29 and name HN) (residue 29 and name HA) 5.0 3.2 0.0
assign (residue 29 and name HN) (residue 29 and name HE#) 5.0 3.2 1.0
assign (residue 29 and name HN) (residue 29 and name HD#) 5.0 3.2 1.0
assign (residue 29 and name HN) (residue 28 and name HB#) 2.5 0.7 1.0
assign (residue 29 and name HN) (residue 29 and name HB#) 2.5 0.7 1.0
assign (residue 29 and name HN) (residue 29 and name HG#) 5.0 3.2 1.0
assign (residue 29 and name HA) (residue 30 and name HB#) 5.0 3.2 1.0
assign (residue 29 and name HA) (residue 29 and name HD#) 5.0 3.2 1.0
assign (residue 29 and name HA) (residue 29 and name HB#) 3.0 1.2 1.0
assign (residue 29 and name HA) (residue 29 and name HG#) 4.0 2.2 1.0
assign (residue 29 and name HB#) (residue 29 and name HE#) 4.0 2.2 2.0
assign (residue 29 and name HG#) (residue 29 and name HE#) 5.0 3.2 2.0
assign (residue 29 and name HG#) (residue 29 and name HD#) 4.0 2.2 2.0
assign (residue 29 and name HD#) (residue 29 and name HE#) 5.0 3.2 2.0

assign (residue 30 and name HN) (residue 31 and name HN) 5.0 3.2 0.0
assign (residue 30 and name HN) (residue 20 and name HA) 5.0 3.2 0.0
assign (residue 30 and name HN) (residue 30 and name HA) 4.0 2.2 0.0
assign (residue 30 and name HN) (residue 29 and name HA) 2.5 0.7 0.0
assign (residue 30 and name HN) (residue 18 and name HA) 5.0 3.2 0.0
assign (residue 30 and name HN) (residue 31 and name HA) 6.0 4.2 0.0
assign (residue 30 and name HN) (residue 30 and name HB#) 5.0 3.2 1.0
assign (residue 30 and name HN) (residue 18 and name HG#) 6.0 4.2 1.0
assign (residue 30 and name HN) (residue 18 and name HB#) 7.0 5.2 1.0
assign (residue 30 and name HN) (residue 31 and name HG1#) 6.0 4.2 1.0
assign (residue 30 and name HN) (residue 29 and name HD#) 6.0 4.2 1.0
assign (residue 30 and name HN) (residue 29 and name HB#) 4.0 2.2 1.0
assign (residue 30 and name HN) (residue 19 and name HB#) 7.0 5.2 1.0
assign (residue 30 and name HN) (residue 31 and name HD#) 7.0 5.2 1.0
assign (residue 30 and name HN) (residue 29 and name HG#) 5.0 3.2 1.0
assign (residue 30 and name HA) (residue 31 and name HA) 7.0 5.2 0.0
assign (residue 30 and name HA) (residue 30 and name HB#) 2.5 0.7 1.0
assign (residue 30 and name HA) (residue 31 and name HB) 5.0 3.2 0.0
assign (residue 30 and name HA) (residue 31 and name HG1#) 5.0 3.2 1.0
assign (residue 30 and name HA) (residue 31 and name HG2#) 6.0 4.2 1.0
assign (residue 30 and name HA) (residue 31 and name HD#) 5.0 3.2 1.0
assign (residue 30 and name HB#) (residue 31 and name HA) 5.0 3.2 1.0

assign (residue 31 and name HN) (residue 32 and name HN) 5.0 3.2 0.0
assign (residue 31 and name HN) (residue 30 and name HA) 3.0 1.2 0.0
assign (residue 31 and name HN) (residue 18 and name HA) 6.0 4.2 0.0
assign (residue 31 and name HN) (residue 31 and name HA) 3.0 1.2 0.0
assign (residue 31 and name HN) (residue 10 and name HD#) 5.0 3.2 1.0
assign (residue 31 and name HN) (residue 30 and name HB#) 4.0 2.2 1.0
assign (residue 31 and name HN) (residue 10 and name HB#) 6.0 4.2 1.0
assign (residue 31 and name HN) (residue 31 and name HB) 2.5 0.7 0.0
assign (residue 31 and name HN) (residue 31 and name HG1#) 3.0 1.2 1.0
assign (residue 31 and name HN) (residue 31 and name HG2#) 4.0 2.2 1.0
assign (residue 31 and name HN) (residue 31 and name HD#) 5.0 3.2 1.0
assign (residue 31 and name HA) (residue 32 and name HB#) 5.0 3.2 1.0
assign (residue 31 and name HA) (residue 31 and name HB#) 3.0 1.2 1.0
assign (residue 31 and name HA) (residue 31 and name HG1#) 4.0 2.2 1.0
assign (residue 31 and name HA) (residue 31 and name HG2#) 3.0 1.2 1.0
assign (residue 31 and name HA) (residue 31 and name HD#) 4.0 2.2 1.0
assign (residue 31 and name HB) (residue 31 and name HG1#) 3.0 1.2 1.0
assign (residue 31 and name HB) (residue 31 and name HG2#) 2.5 0.7 1.0
assign (residue 31 and name HB) (residue 31 and name HD#) 4.0 2.2 1.0
assign (residue 31 and name HG1#) (residue 31 and name HG2#) 4.0 2.2 2.0
assign (residue 31 and name HG1#) (residue 31 and name HD#) 3.0 1.2 2.0
assign (residue 32 and name HA) (residue 31 and name HG2#) 5.0 3.2 1.0
assign (residue 31 and name HG2#) (residue 33 and name HA#) 5.0 3.2 2.0
assign (residue 31 and name HG2#) (residue 32 and name HB#) 5.0 3.2 2.0
assign (residue 31 and name HG2#) (residue 31 and name HD#) 5.0 3.2 2.0

assign (residue 32 and name HN) (residue 33 and name HN) 5.0 3.2 0.0
assign (residue 32 and name HN) (residue 32 and name HD#) 5.0 3.2 2.4
assign (residue 32 and name HN) (residue 32 and name HE#) 5.0 3.2 2.4
assign (residue 32 and name HN) (residue 18 and name HA) 5.0 3.2 0.0
assign (residue 32 and name HN) (residue 18 and name HA) 5.0 3.2 0.0
assign (residue 32 and name HN) (residue 31 and name HA) 3.0 1.2 0.0
assign (residue 32 and name HN) (residue 17 and name HB#) 5.0 3.2 1.0
assign (residue 32 and name HN) (residue 32 and name HB#) 4.0 2.2 1.0
assign (residue 32 and name HN) (residue 31 and name HB) 5.0 3.2 0.0
assign (residue 32 and name HN) (residue 19 and name HB#) 5.0 3.2 1.0
assign (residue 32 and name HN) (residue 19 and name HG#) 5.0 3.2 1.0
assign (residue 32 and name HN) (residue 31 and name HG1#) 5.0 3.2 1.0
assign (residue 32 and name HN) (residue 31 and name HG2#) 4.0 2.2 1.0
assign (residue 32 and name HN) (residue 31 and name HD#) 5.0 3.2 1.0
assign (residue 32 and name HA) (residue 33 and name HA#) 5.0 3.2 1.0
assign (residue 32 and name HA) (residue 32 and name HB#) 4.0 2.2 1.0

assign (residue 33 and name HN) (residue 35 and name HN) 6.0 4.2 0.0
assign (residue 33 and name HN) (residue 34 and name HN) 5.0 3.2 0.0
assign (residue 33 and name HN) (residue 32 and name HD#) 5.0 3.2 2.4
assign (residue 33 and name HN) (residue 10 and name HE) 5.0 3.2 0.0
assign (residue 33 and name HN) (residue 17 and name HD#) 6.0 4.2 2.4
assign (residue 33 and name HN) (residue 32 and name HD#) 5.0 3.2 2.4
assign (residue 33 and name HN) (residue 32 and name HA) 3.0 1.2 0.0
assign (residue 33 and name HN) (residue 10 and name HA) 4.0 2.2 0.0
assign (residue 33 and name HN) (residue 34 and name HA#) 6.0 4.2 1.0
assign (residue 33 and name HN) (residue 18 and name HA) 7.0 5.2 0.0
assign (residue 33 and name HN) (residue 31 and name HA) 7.0 5.2 0.0
assign (residue 33 and name HN) (residue 33 and name HA#) 3.0 1.2 1.0
assign (residue 33 and name HN) (residue 32 and name HB#) 5.0 3.2 1.0
assign (residue 33 and name HN) (residue 10 and name HB#) 5.0 3.2 1.0
assign (residue 33 and name HN) (residue 10 and name HG#) 4.0 2.2 1.0
assign (residue 33 and name HN) (residue 19 and name HG#) 6.0 4.2 1.0
assign (residue 33 and name HN) (residue 15 and name HB#) 6.0 4.2 1.0
assign (residue 33 and name HN) (residue 31 and name HG2#) 6.0 4.2 1.0
assign (residue 33 and name HA#) (residue 34 and name HA#) 5.0 3.2 2.0
assign (residue 33 and name HA#) (residue 10 and name HA) 5.0 3.2 1.0

assign (residue 34 and name HN) (residue 35 and name HN) 5.0 3.2 0.0
assign (residue 34 and name HN) (residue 32 and name HE#) 5.0 3.2 2.4
assign (residue 34 and name HN) (residue 32 and name HD#) 5.0 3.2 2.4
assign (residue 34 and name HN) (residue 34 and name HA#) 5.0 3.2 1.0
assign (residue 34 and name HN) (residue 33 and name HA#) 5.0 3.2 1.0
assign (residue 34 and name HA#) (residue 35 and name HA) 5.0 3.2 2.0

assign (residue 35 and name HN) (residue 36 and name HN) 5.0 3.2 0.0
assign (residue 35 and name HN) (residue 32 and name HD#) 5.0 3.2 2.4
assign (residue 35 and name HN) (residue 35 and name HA) 5.0 3.2 0.0
assign (residue 35 and name HN) (residue 33 and name HA#) 5.0 3.2 1.0
assign (residue 35 and name HN) (residue 35 and name HB#) 5.0 3.2 1.0
assign (residue 35 and name HN) (residue 13 and name HB#) 4.0 2.2 1.0
assign (residue 35 and name HN) (residue 10 and name HA) 5.0 3.2 0.0
assign (residue 35 and name HN) (residue 11 and name HA#) 6.0 4.2 1.0
assign (residue 35 and name HN) (residue 34 and name HA#) 5.0 3.2 1.0
assign (residue 35 and name HA) (residue 35 and name HB#) 4.0 2.2 1.0
assign (residue 35 and name HA) (residue 36 and name HA#) 5.0 3.2 1.0
assign (residue 35 and name HB#) (residue 36 and name HA#) 4.0 2.2 2.0

assign (residue 36 and name HN) (residue 37 and name HN) 5.0 3.2 0.0
assign (residue 36 and name HN) (residue 32 and name HD#) 5.0 3.2 2.4
assign (residue 36 and name HN) (residue 35 and name HA) 4.0 2.2 0.0
assign (residue 36 and name HN) (residue 36 and name HA#) 3.0 1.2 1.0
assign (residue 36 and name HN) (residue 35 and name HB#) 5.0 3.2 1.0
assign (residue 36 and name HA#) (residue 37 and name HA#) 5.0 3.2 2.0

assign (residue 37 and name HN) (residue 39 and name HN) 7.0 5.2 0.0
assign (residue 37 and name HN) (residue 38 and name HN) 5.0 3.2 0.0
assign (residue 37 and name HN) (residue 41 and name HN) 7.0 5.2 0.0
assign (residue 37 and name HN) (residue 37 and name HA#) 2.5 0.7 1.0
assign (residue 37 and name HN) (residue 36 and name HA#) 4.0 2.2 1.0
assign (residue 37 and name HN) (residue 9 and name HB#) 5.0 3.2 1.0
assign (residue 37 and name HA#) (residue 38 and name HA#) 6.0 4.2 2.0
assign (residue 37 and name HA#) (residue 41 and name HB#) 5.0 3.2 2.0
assign (residue 37 and name HA#) (residue 41 and name HD#) 5.0 3.2 2.0

assign (residue 38 and name HN) (residue 39 and name HN) 5.0 3.2 0.0
assign (residue 38 and name HN) (residue 40 and name HN) 5.0 3.2 0.0
assign (residue 38 and name HN) (residue 38 and name HA) 5.0 3.2 0.0
assign (residue 38 and name HN) (residue 8 and name HG) 5.0 3.2 0.0
assign (residue 38 and name HN) (residue 37 and name HA#) 2.5 0.7 1.0
assign (residue 38 and name HN) (residue 38 and name HB#) 5.0 3.2 1.0
assign (residue 38 and name HD#) (residue 38 and name HA) 5.0 3.2 1.0
assign (residue 38 and name HD#) (residue 6 and name HA) 6.0 4.2 1.0
assign (residue 38 and name HD#) (residue 7 and name HD#) 5.0 3.2 2.0
assign (residue 38 and name HD#) (residue 8 and name HA) 5.0 3.2 1.0
assign (residue 38 and name HD#) (residue 38 and name HB#) 2.5 0.7 2.0
assign (residue 38 and name HD#) (residue 9 and name HB#) 4.0 2.2 2.0
assign (residue 38 and name HD#) (residue 7 and name HG#) 5.0 3.2 2.0
assign (residue 38 and name HD#) (residue 6 and name HG) 4.0 2.2 1.0
assign (residue 38 and name HD#) (residue 6 and name HB#) 5.0 3.2 2.0
assign (residue 38 and name HD#) (residue 6 and name HD#) 5.0 3.2 3.4
assign (residue 38 and name HA) (residue 38 and name HB#) 2.5 0.7 1.0
assign (residue 38 and name HA) (residue 39 and name HA#) 5.0 3.2 1.0
assign (residue 38 and name HB#) (residue 39 and name HA#) 5.0 3.2 2.0

assign (residue 39 and name HN) (residue 40 and name HN) 4.0 2.2 0.0
assign (residue 39 and name HN) (residue 40 and name HA) 6.0 4.2 0.0
assign (residue 39 and name HN) (residue 38 and name HA) 4.0 2.2 0.0
assign (residue 39 and name HN) (residue 37 and name HA#) 6.0 4.2 1.0
assign (residue 39 and name HN) (residue 39 and name HA#) 2.5 0.7 0.0
assign (residue 39 and name HN) (residue 38 and name HB#) 3.0 1.2 1.0
assign (residue 39 and name HN) (residue 6 and name HG) 5.0 3.2 0.0
assign (residue 39 and name HN) (residue 6 and name HB#) 5.0 3.2 1.0
assign (residue 39 and name HN) (residue 3 and name HG2#) 4.0 1.2 1.0
assign (residue 39 and name HN) (residue 6 and name HD#) 4.0 2.2 2.4
assign (residue 39 and name HA#) (residue 40 and name HA) 6.0 4.2 1.0

assign (residue 40 and name HN) (residue 41 and name HN) 5.0 3.2 0.0
assign (residue 40 and name HN) (residue 38 and name HA) 5.0 3.2 0.0
assign (residue 40 and name HN) (residue 40 and name HA) 4.0 2.2 0.0
assign (residue 40 and name HN) (residue 39 and name HA#) 4.0 2.2 1.0
assign (residue 40 and name HN) (residue 40 and name HB#) 3.0 1.2 1.0
assign (residue 40 and name HN) (residue 6 and name HG) 5.0 3.2 0.0
assign (residue 40 and name HN) (residue 3 and name HG2#) 5.0 3.2 1.0
assign (residue 40 and name HN) (residue 6 and name HD#) 4.0 2.2 2.4
assign (residue 40 and name HD#) (residue 40 and name HA) 5.0 3.2 1.0
assign (residue 40 and name HD#) (residue 5 and name HA) 5.0 3.2 1.0
assign (residue 40 and name HD#) (residue 23 and name HA) 6.0 4.2 1.0
assign (residue 40 and name HD#) (residue 4 and name HA) 5.0 3.2 1.0
assign (residue 40 and name HD#) (residue 7 and name HA) 6.0 4.2 1.0
assign (residue 40 and name HD#) (residue 8 and name HA) 7.0 5.2 1.0
assign (residue 40 and name HD#) (residue 40 and name HB#) 4.0 2.2 2.0
assign (residue 40 and name HD#) (residue 21 and name HB#) 5.0 3.2 2.0
assign (residue 40 and name HD#) (residue 22 and name HB#) 5.0 3.2 2.0
assign (residue 40 and name HD#) (residue 6 and name HG) 5.0 3.2 1.0
assign (residue 40 and name HD#) (residue 6 and name HB#) 5.0 3.2 2.0
assign (residue 40 and name HD#) (residue 6 and name HD#) 5.0 3.2 3.4
assign (residue 40 and name HA) (residue 40 and name HB#) 3.0 1.2 1.0

assign (residue 41 and name HN) (residue 42 and name HN) 5.0 3.2 0.0
assign (residue 41 and name HN) (residue 41 and name HA) 5.0 3.2 0.0
assign (residue 41 and name HN) (residue 40 and name HA) 4.0 2.2 0.0
assign (residue 41 and name HN) (residue 39 and name HA#) 6.0 4.2 1.0
assign (residue 41 and name HN) (residue 40 and name HB#) 5.0 3.2 1.0
assign (residue 41 and name HN) (residue 41 and name HE#) 5.0 3.2 1.0
assign (residue 41 and name HN) (residue 41 and name HB#) 4.0 2.2 1.0
assign (residue 41 and name HN) (residue 41 and name HG#) 5.0 3.2 1.0
assign (residue 41 and name HN) (residue 41 and name HD#) 5.0 3.2 1.0
assign (residue 41 and name HN) (residue 3 and name HG2#) 5.0 3.2 1.0
assign (residue 41 and name HA) (residue 42 and name HB#) 6.0 4.2 1.0
assign (residue 41 and name HA) (residue 41 and name HB#) 4.0 2.2 1.0
assign (residue 41 and name HA) (residue 41 and name HG#) 5.0 3.2 1.0
assign (residue 41 and name HA) (residue 41 and name HD#) 6.0 4.2 1.0
assign (residue 41 and name HB#) (residue 41 and name HE#) 4.0 2.2 2.0
assign (residue 41 and name HB#) (residue 41 and name HD#) 4.0 2.2 2.0
assign (residue 41 and name HB#) (residue 41 and name HG#) 4.0 2.2 2.0
assign (residue 41 and name HG#) (residue 41 and name HE#) 5.0 3.2 2.0
assign (residue 41 and name HG#) (residue 41 and name HD#) 3.0 1.2 2.0
assign (residue 41 and name HD#) (residue 41 and name HE#) 4.0 2.2 2.0
assign (residue 41 and name HZ#) (residue 41 and name HD#) 5.0 3.2 2.0

assign (residue 42 and name HN) (residue 44 and name HN) 6.0 4.2 0.0
assign (residue 42 and name HN) (residue 20 and name HD1) 7.0 5.2 0.0
assign (residue 42 and name HN) (residue 21 and name HA) 6.0 4.2 0.0
assign (residue 42 and name HN) (residue 42 and name HA) 5.0 3.2 0.0
assign (residue 42 and name HN) (residue 41 and name HA) 3.0 1.2 0.0
assign (residue 42 and name HN) (residue 43 and name HD#) 5.0 3.2 1.0
assign (residue 42 and name HN) (residue 42 and name HB#) 5.0 3.2 1.0
assign (residue 42 and name HN) (residue 20 and name HB#) 6.0 4.2 1.0
assign (residue 42 and name HN) (residue 19 and name HB#) 5.0 3.2 1.0
assign (residue 42 and name HN) (residue 41 and name HB#) 5.0 3.2 1.0
assign (residue 42 and name HN) (residue 47 and name HB#) 7.0 5.2 1.0
assign (residue 42 and name HN) (residue 41 and name HG#) 5.0 3.2 1.0
assign (residue 42 and name HA) (residue 43 and name HD#) 4.0 2.2 1.0
assign (residue 42 and name HA) (residue 43 and name HB#) 6.0 4.2 1.0
assign (residue 42 and name HA) (residue 43 and name HG#) 5.0 3.2 1.0
assign (residue 42 and name HA) (residue 42 and name HB#) 4.0 2.2 1.0
assign (residue 42 and name HA) (residue 47 and name HB#) 5.0 3.2 1.0
assign (residue 42 and name HB#) (residue 43 and name HD#) 4.0 2.2 2.0
assign (residue 42 and name HB#) (residue 43 and name HG#) 6.0 4.2 2.0
assign (residue 42 and name HB#) (residue 47 and name HB#) 4.0 2.2 2.0
assign (residue 42 and name HB#) (residue 48 and name HA) 5.0 3.2 2.4

assign (residue 43 and name HA) (residue 43 and name HD#) 5.0 3.2 1.0
assign (residue 43 and name HA) (residue 43 and name HB#) 2.5 0.7 1.0
assign (residue 43 and name HA) (residue 43 and name HG#) 4.0 2.2 1.0
assign (residue 43 and name HA) (residue 47 and name HB#) 6.0 4.2 1.0
assign (residue 43 and name HB#) (residue 44 and name HA) 5.0 3.2 1.0
assign (residue 43 and name HB#) (residue 44 and name HB) 6.0 4.2 1.0
assign (residue 43 and name HB#) (residue 43 and name HD#) 4.0 2.2 2.0
assign (residue 43 and name HB#) (residue 43 and name HG#) 2.5 0.7 2.0
assign (residue 43 and name HB#) (residue 44 and name HG2#) 4.0 2.2 2.0
assign (residue 43 and name HB#) (residue 47 and name HB#) 6.0 4.2 1.0
assign (residue 43 and name HG#) (residue 43 and name HD#) 3.0 1.2 2.0
assign (residue 43 and name HG#) (residue 44 and name HA) 5.0 3.2 1.0
assign (residue 43 and name HG#) (residue 44 and name HB) 6.0 4.2 1.0
assign (residue 43 and name HG#) (residue 47 and name HB#) 4.0 2.2 2.0
assign (residue 43 and name HG#) (residue 44 and name HG2#) 4.0 2.2 2.0
assign (residue 43 and name HD#) (residue 47 and name HB#) 4.0 2.2 2.0
assign (residue 43 and name HD#) (residue 44 and name HG2#) 5.0 3.2 2.0

assign (residue 44 and name HN) (residue 20 and name HE1) 6.0 4.2 0.0
assign (residue 44 and name HN) (residue 47 and name HN) 5.0 3.2 0.0
assign (residue 44 and name HN) (residue 46 and name HN) 5.0 3.2 0.0
assign (residue 44 and name HN) (residue 45 and name HN) 5.0 3.2 0.0
assign (residue 44 and name HN) (residue 20 and name HD1) 4.0 2.2 0.0
assign (residue 44 and name HN) (residue 42 and name HA) 5.0 3.2 0.0
assign (residue 44 and name HN) (residue 43 and name HA) 5.0 3.2 0.0
assign (residue 44 and name HN) (residue 44 and name HA) 4.0 2.2 0.0
assign (residue 44 and name HN) (residue 44 and name HB) 5.0 3.2 0.0
assign (residue 44 and name HN) (residue 43 and name HD#) 4.0 2.2 1.0
assign (residue 44 and name HN) (residue 42 and name HB#) 4.0 2.2 1.0
assign (residue 44 and name HN) (residue 20 and name HB#) 5.0 3.2 1.0
assign (residue 44 and name HN) (residue 43 and name HB#) 4.0 2.2 1.0
assign (residue 44 and name HN) (residue 43 and name HG#) 4.0 2.2 1.0
assign (residue 44 and name HN) (residue 47 and name HB#) 3.0 1.2 1.0
assign (residue 44 and name HN) (residue 44 and name HG2#) 4.0 2.2 1.0
assign (residue 44 and name HA) (residue 44 and name HB) 4.0 2.2 0.0
assign (residue 44 and name HA) (residue 45 and name HA) 5.0 3.2 0.0
assign (residue 44 and name HA) (residue 45 and name HB#) 5.0 3.2 1.0
assign (residue 44 and name HA) (residue 47 and name HB#) 5.0 3.2 1.0
assign (residue 44 and name HA) (residue 44 and name HG2#) 2.5 0.7 1.0
assign (residue 44 and name HB) (residue 45 and name HA) 5.0 3.2 0.0
assign (residue 44 and name HB) (residue 44 and name HG1) 5.0 3.2 0.0
assign (residue 44 and name HB) (residue 45 and name HB#) 5.0 3.2 1.0
assign (residue 44 and name HB) (residue 46 and name HB#) 5.0 3.2 1.0
assign (residue 44 and name HB) (residue 44 and name HG2#) 2.5 0.7 1.0
assign (residue 44 and name HG1) (residue 44 and name HG2#) 5.0 3.2 1.0

assign (residue 45 and name HN) (residue 46 and name HN) 4.0 2.2 0.0
assign (residue 45 and name HN) (residue 47 and name HN) 5.0 3.2 0.0
assign (residue 45 and name HN) (residue 20 and name HD1) 5.0 3.2 0.0
assign (residue 45 and name HN) (residue 44 and name HA) 4.0 2.2 0.0
assign (residue 45 and name HN) (residue 44 and name HB) 4.0 2.2 0.0
assign (residue 45 and name HN) (residue 46 and name HA) 6.0 4.2 0.0
assign (residue 45 and name HN) (residue 45 and name HA) 4.0 2.2 0.0
assign (residue 45 and name HN) (residue 46 and name HB#) 5.0 3.2 1.0
assign (residue 45 and name HN) (residue 45 and name HG#) 5.0 3.2 1.0
assign (residue 45 and name HN) (residue 47 and name HB#) 5.0 3.2 1.0
assign (residue 45 and name HN) (residue 44 and name HG2#) 4.0 2.2 1.0
assign (residue 45 and name HN) (residue 45 and name HB#) 3.0 1.2 1.0
assign (residue 45 and name HE#) (residue 45 and name HB#) 5.0 3.2 2.0
assign (residue 45 and name HE#) (residue 45 and name HG#) 4.0 2.2 2.0
assign (residue 45 and name HE#) (residue 49 and name HG#) 5.0 3.2 2.0
assign (residue 45 and name HA) (residue 45 and name HB#) 4.0 2.2 1.0
assign (residue 45 and name HA) (residue 45 and name HG#) 4.0 2.2 1.0
assign (residue 45 and name HA) (residue 48 and name HB#) 4.0 2.2 1.0
assign (residue 45 and name HB#) (residue 46 and name HB#) 5.0 3.2 1.0
assign (residue 45 and name HG#) (residue 49 and name HG#) 4.0 2.2 2.0

assign (residue 46 and name HN) (residue 47 and name HN) 3.0 1.2 0.0
assign (residue 46 and name HN) (residue 48 and name HN) 5.0 3.2 0.0
assign (residue 46 and name HN) (residue 20 and name HD1) 6.0 4.2 0.0
assign (residue 46 and name HN) (residue 44 and name HA) 5.0 3.2 0.0
assign (residue 46 and name HN) (residue 44 and name HB) 4.0 2.2 0.0
assign (residue 46 and name HN) (residue 44 and name HG1) 5.0 3.2 0.0
assign (residue 46 and name HN) (residue 47 and name HA) 6.0 4.2 0.0
assign (residue 46 and name HN) (residue 44 and name HG1) 5.0 3.2 0.0
assign (residue 46 and name HN) (residue 46 and name HA) 3.0 1.2 0.0
assign (residue 46 and name HN) (residue 45 and name HA) 5.0 3.2 0.0
assign (residue 46 and name HN) (residue 46 and name HG#) 5.0 3.2 1.0
assign (residue 46 and name HN) (residue 46 and name HB#) 2.5 0.7 1.0
assign (residue 46 and name HN) (residue 45 and name HG#) 5.0 3.2 1.0
assign (residue 46 and name HN) (residue 47 and name HB#) 5.0 3.2 1.0
assign (residue 46 and name HN) (residue 44 and name HG2#) 5.0 3.2 1.0
assign (residue 46 and name HN) (residue 45 and name HB#) 3.0 1.2 1.0
assign (residue 46 and name HA) (residue 46 and name HG#) 4.0 2.2 1.0
assign (residue 46 and name HA) (residue 49 and name HG#) 4.0 2.2 1.0
assign (residue 46 and name HA) (residue 46 and name HB#) 3.0 1.2 1.0
assign (residue 46 and name HA) (residue 53 and name HB#) 6.0 4.2 1.0
assign (residue 46 and name HB#) (residue 47 and name HA) 5.0 3.2 1.0
assign (residue 46 and name HB#) (residue 46 and name HG#) 3.0 1.2 2.0
assign (residue 46 and name HB#) (residue 47 and name HB#) 6.0 4.2 2.0
assign (residue 46 and name HG#) (residue 47 and name HA) 5.0 3.2 1.0
assign (residue 46 and name HG#) (residue 50 and name HD#) 5.0 3.2 2.0
assign (residue 46 and name HG#) (residue 50 and name HG#) 6.0 4.2 2.0
assign (residue 46 and name HG#) (residue 50 and name HE#) 5.0 3.2 2.0

assign (residue 47 and name HN) (residue 49 and name HN) 5.0 3.2 0.0
assign (residue 47 and name HN) (residue 48 and name HN) 3.0 1.2 0.0
assign (residue 47 and name HN) (residue 20 and name HD1) 6.0 4.2 0.0
assign (residue 47 and name HN) (residue 44 and name HA) 5.0 3.2 0.0
assign (residue 47 and name HN) (residue 44 and name HB) 5.0 3.2 0.0
assign (residue 47 and name HN) (residue 47 and name HA) 3.0 1.2 0.0
assign (residue 47 and name HN) (residue 46 and name HA) 5.0 3.2 0.0
assign (residue 47 and name HN) (residue 43 and name HD#) 6.0 4.2 1.0
assign (residue 47 and name HN) (residue 48 and name HB#) 5.0 3.2 1.0
assign (residue 47 and name HN) (residue 45 and name HA) 5.0 3.2 0.0
assign (residue 47 and name HN) (residue 46 and name HG#) 5.0 3.2 1.0
assign (residue 47 and name HN) (residue 46 and name HB#) 3.0 1.2 1.0
assign (residue 47 and name HN) (residue 47 and name HB#) 2.5 0.7 1.0
assign (residue 47 and name HN) (residue 44 and name HG2#) 5.0 3.2 1.0
assign (residue 47 and name HA) (residue 47 and name HB#) 2.5 0.7 1.0
assign (residue 47 and name HA) (residue 50 and name HB#) 4.0 2.2 1.0
assign (residue 47 and name HA) (residue 50 and name HD#) 5.0 3.2 1.0
assign (residue 47 and name HA) (residue 50 and name HG#) 6.0 4.2 1.0
assign (residue 47 and name HB#) (residue 48 and name HB#) 5.0 3.2 2.0
assign (residue 47 and name HB#) (residue 48 and name HA) 5.0 3.2 1.0

assign (residue 48 and name HN) (residue 49 and name HN) 3.0 1.2 0.0
assign (residue 48 and name HN) (residue 50 and name HN) 5.0 3.2 0.0
assign (residue 48 and name HN) (residue 47 and name HA) 5.0 3.2 0.0
assign (residue 48 and name HN) (residue 46 and name HA) 5.0 3.2 0.0
assign (residue 48 and name HN) (residue 48 and name HB#) 3.0 1.2 1.0
assign (residue 48 and name HN) (residue 45 and name HA) 4.0 2.2 0.0
assign (residue 48 and name HN) (residue 42 and name HB#) 5.0 3.2 1.0
assign (residue 48 and name HN) (residue 48 and name HA) 4.0 2.2 0.0
assign (residue 48 and name HN) (residue 46 and name HB#) 5.0 3.2 1.0
assign (residue 48 and name HN) (residue 47 and name HB#) 4.0 2.2 1.0
assign (residue 48 and name HA) (residue 48 and name HB#) 3.0 1.2 1.0

assign (residue 49 and name HN) (residue 52 and name HN) 6.0 4.2 0.0
assign (residue 49 and name HN) (residue 51 and name HN) 5.0 3.2 0.0
assign (residue 49 and name HN) (residue 50 and name HN) 3.0 1.2 0.0
assign (residue 49 and name HN) (residue 49 and name HA) 3.0 1.2 0.0
assign (residue 49 and name HN) (residue 50 and name HA) 6.0 4.2 0.0
assign (residue 49 and name HN) (residue 47 and name HA) 5.0 3.2 0.0
assign (residue 49 and name HN) (residue 46 and name HA) 4.0 2.2 0.0
assign (residue 49 and name HN) (residue 27 and name HB#) 6.0 4.2 1.0
assign (residue 49 and name HN) (residue 48 and name HB#) 4.0 2.2 1.0
assign (residue 49 and name HN) (residue 49 and name HG#) 4.0 2.2 1.0
assign (residue 49 and name HN) (residue 48 and name HA) 4.0 2.2 0.0
assign (residue 49 and name HN) (residue 49 and name HB#) 2.5 0.7 1.0
assign (residue 49 and name HN) (residue 50 and name HB#) 5.0 3.2 1.0
assign (residue 49 and name HN) (residue 45 and name HG#) 5.0 3.2 1.0
assign (residue 49 and name HN) (residue 47 and name HB#) 5.0 3.2 1.0
assign (residue 49 and name HN) (residue 53 and name HB#) 5.0 3.2 1.0
assign (residue 49 and name HA) (residue 53 and name HA) 5.0 3.2 0.0
assign (residue 49 and name HA) (residue 49 and name HG#) 4.0 2.2 1.0
assign (residue 49 and name HA) (residue 49 and name HB#) 2.5 0.7 1.0
assign (residue 49 and name HA) (residue 52 and name HB#) 5.0 3.2 1.0
assign (residue 49 and name HA) (residue 53 and name HB#) 4.0 2.2 1.0
assign (residue 49 and name HB#) (residue 53 and name HB#) 4.0 2.2 2.0
assign (residue 49 and name HB#) (residue 49 and name HG#) 3.0 1.2 2.0
assign (residue 49 and name HG#) (residue 50 and name HA) 6.0 4.2 1.0
assign (residue 49 and name HG#) (residue 53 and name HA) 6.0 4.2 1.0
assign (residue 49 and name HG#) (residue 53 and name HB#) 4.0 2.2 2.0

assign (residue 50 and name HN) (residue 52 and name HN) 5.0 3.2 0.0
assign (residue 50 and name HN) (residue 51 and name HN) 3.0 1.2 0.0
assign (residue 50 and name HN) (residue 51 and name HA) 6.0 4.2 0.0
assign (residue 50 and name HN) (residue 49 and name HA) 5.0 3.2 0.0
assign (residue 50 and name HN) (residue 47 and name HA) 4.0 2.2 0.0
assign (residue 50 and name HN) (residue 50 and name HA) 3.0 1.2 0.0
assign (residue 50 and name HN) (residue 46 and name HA) 5.0 3.2 0.0
assign (residue 50 and name HN) (residue 48 and name HB#) 5.0 3.2 1.0
assign (residue 50 and name HN) (residue 49 and name HG#) 5.0 3.2 1.0
assign (residue 50 and name HN) (residue 46 and name HG#) 5.0 3.2 1.0
assign (residue 50 and name HN) (residue 48 and name HA) 5.0 3.2 0.0
assign (residue 50 and name HN) (residue 49 and name HB#) 3.0 1.2 1.0
assign (residue 50 and name HN) (residue 50 and name HB#) 2.5 0.7 1.0
assign (residue 50 and name HN) (residue 47 and name HB#) 5.0 3.2 2.4
assign (residue 50 and name HN) (residue 50 and name HG#) 5.0 3.2 1.0
assign (residue 50 and name HA) (residue 50 and name HG#) 4.0 2.2 1.0
assign (residue 50 and name HA) (residue 50 and name HD#) 5.0 3.2 1.0
assign (residue 50 and name HA) (residue 50 and name HB#) 2.5 0.7 1.0
assign (residue 50 and name HA) (residue 49 and name HG#) 6.0 4.2 1.0
assign (residue 50 and name HB#) (residue 50 and name HG#) 3.0 1.2 2.0
assign (residue 50 and name HD#) (residue 50 and name HG#) 4.0 2.2 2.0
assign (residue 50 and name HG#) (residue 50 and name HE#) 4.0 2.2 2.0

assign (residue 51 and name HN) (residue 52 and name HB#) 6.0 4.2 1.0

assign (residue 51 and name HN) (residue 52 and name HN) 3.0 1.2 0.0
assign (residue 51 and name HN) (residue 53 and name HN) 5.0 3.2 0.0
assign (residue 51 and name HN) (residue 51 and name HE) 5.0 3.2 0.0
assign (residue 51 and name HN) (residue 51 and name HA) 5.0 3.2 0.0
assign (residue 51 and name HN) (residue 49 and name HA) 5.0 3.2 0.0
assign (residue 51 and name HN) (residue 47 and name HA) 5.0 3.2 0.0
assign (residue 51 and name HN) (residue 50 and name HA) 5.0 3.2 0.0
assign (residue 51 and name HN) (residue 51 and name HD#) 5.0 3.2 1.0
assign (residue 51 and name HN) (residue 48 and name HA) 5.0 3.2 0.0
assign (residue 51 and name HN) (residue 49 and name HB#) 5.0 3.2 1.0
assign (residue 51 and name HN) (residue 51 and name HB#) 5.0 3.2 1.0
assign (residue 51 and name HN) (residue 50 and name HB#) 4.0 2.2 1.0
assign (residue 51 and name HN) (residue 51 and name HG#) 4.0 2.2 1.0
assign (residue 51 and name HN) (residue 47 and name HB#) 5.0 3.2 2.4
assign (residue 51 and name HN) (residue 50 and name HG#) 5.0 3.2 1.0
assign (residue 51 and name HE) (residue 51 and name HA) 5.0 3.2 0.0
assign (residue 51 and name HE) (residue 51 and name HD#) 4.0 2.2 1.0
assign (residue 51 and name HE) (residue 51 and name HB#) 5.0 3.2 1.0
assign (residue 51 and name HE) (residue 51 and name HG#) 5.0 3.2 1.0
assign (residue 51 and name HA) (residue 50 and name HG#) 3.0 1.2 1.0
assign (residue 51 and name HA) (residue 51 and name HB#) 4.0 2.2 1.0
assign (residue 51 and name HA) (residue 51 and name HG#) 4.0 2.2 1.0
assign (residue 51 and name HB#) (residue 51 and name HD#) 4.0 2.2 2.0
assign (residue 51 and name HB#) (residue 51 and name HG#) 3.0 1.2 2.0
assign (residue 51 and name HG#) (residue 51 and name HD#) 4.0 2.2 2.0

assign (residue 52 and name HN) (residue 53 and name HN) 4.0 2.2 0.0
assign (residue 52 and name HN) (residue 54 and name HN) 5.0 3.2 0.0
assign (residue 52 and name HN) (residue 52 and name HA) 4.0 2.2 0.0
assign (residue 52 and name HN) (residue 51 and name HA) 5.0 3.2 0.0
assign (residue 52 and name HN) (residue 49 and name HA) 5.0 3.2 0.0
assign (residue 52 and name HN) (residue 50 and name HA) 5.0 3.2 0.0
assign (residue 52 and name HN) (residue 51 and name HD#) 6.0 4.2 1.0
assign (residue 52 and name HN) (residue 50 and name HE#) 6.0 4.2 1.0
assign (residue 52 and name HN) (residue 49 and name HG#) 6.0 4.2 1.0
assign (residue 52 and name HN) (residue 52 and name HB#) 3.0 1.2 1.0
assign (residue 52 and name HN) (residue 51 and name HB#) 5.0 3.2 1.0
assign (residue 52 and name HN) (residue 53 and name HB#) 4.0 2.2 1.0
assign (residue 52 and name HA) (residue 52 and name HB#) 4.0 2.2 1.0
assign (residue 52 and name HB#) (residue 53 and name HA) 5.0 3.2 1.0

assign (residue 53 and name HN) (residue 54 and name HN) 4.0 2.2 0.0
assign (residue 53 and name HN) (residue 52 and name HA) 5.0 3.2 0.0
assign (residue 53 and name HN) (residue 54 and name HA) 5.0 3.2 0.0
assign (residue 53 and name HN) (residue 53 and name HA) 4.0 2.2 0.0
assign (residue 53 and name HN) (residue 49 and name HA) 4.0 2.2 0.0
assign (residue 53 and name HN) (residue 50 and name HA) 5.0 3.2 0.0
assign (residue 53 and name HN) (residue 49 and name HG#) 5.0 3.2 1.0
assign (residue 53 and name HN) (residue 52 and name HB#) 4.0 2.2 1.0
assign (residue 53 and name HN) (residue 53 and name HB#) 2.5 0.7 1.0
assign (residue 53 and name HN) (residue 49 and name HG#) 5.0 3.2 1.0
assign (residue 53 and name HN) (residue 49 and name HB#) 5.0 3.2 1.0
assign (residue 53 and name HN) (residue 50 and name HB#) 5.0 3.2 1.0
assign (residue 53 and name HA) (residue 53 and name HB#) 3.0 1.2 1.0
assign (residue 53 and name HA) (residue 54 and name HB#) 5.0 3.2 1.0

assign (residue 54 and name HN) (residue 55 and name HN) 5.0 3.2 0.0
assign (residue 54 and name HN) (residue 54 and name HA) 3.0 1.2 0.0
assign (residue 54 and name HN) (residue 55 and name HA) 6.0 4.2 0.0
assign (residue 54 and name HN) (residue 53 and name HA) 4.0 2.2 0.0
assign (residue 54 and name HN) (residue 54 and name HE#) 5.0 3.2 1.0
assign (residue 54 and name HN) (residue 54 and name HB#) 4.0 2.2 1.0
assign (residue 54 and name HN) (residue 54 and name HD#) 5.0 3.2 1.0
assign (residue 54 and name HN) (residue 53 and name HB#) 4.0 2.2 1.0
assign (residue 54 and name HN) (residue 54 and name HG#) 4.0 2.2 1.0
assign (residue 54 and name HA) (residue 54 and name HB#) 3.0 1.2 1.0
assign (residue 54 and name HA) (residue 54 and name HG#) 4.0 2.2 1.0
assign (residue 54 and name HA) (residue 53 and name HB#) 5.0 3.2 1.0
assign (residue 54 and name HB#) (residue 55 and name HB#) 4.0 2.2 2.0

assign (residue 55 and name HN) (residue 54 and name HA) 4.0 2.2 0.0
assign (residue 55 and name HN) (residue 55 and name HA) 5.0 3.2 0.0
assign (residue 55 and name HN) (residue 50 and name HA) 5.0 3.2 0.0
assign (residue 55 and name HN) (residue 54 and name HB#) 5.0 3.2 1.0
assign (residue 55 and name HN) (residue 52 and name HB#) 6.0 4.2 1.0
assign (residue 55 and name HN) (residue 54 and name HG#) 6.0 4.2 1.0
assign (residue 55 and name HN) (residue 53 and name HB#) 5.0 3.2 1.0
assign (residue 55 and name HN) (residue 55 and name HB#) 4.0 2.2 1.0
assign (residue 55 and name HA) (residue 55 and name HB#) 4.0 2.2 1.0

!Phi restraints
assign (resid 1 and name c) (resid 2 and name n)
       (resid 2 and name ca) (resid 2 and name c) 1.0 -70.0 40.0 2

assign (resid 2 and name c) (resid 3 and name n)
       (resid 3 and name ca) (resid 3 and name c) 1.0 -70.0 20.0 2

assign (resid 3 and name c) (resid 4 and name n)
       (resid 4 and name ca) (resid 4 and name c) 1.0 -70.0 20.0 2

assign (resid 4 and name c) (resid 5 and name n)
       (resid 5 and name ca) (resid 5 and name c) 1.0 -130.0 40.0 2

assign (resid 5 and name c) (resid 6 and name n)
       (resid 6 and name ca) (resid 6 and name c) 1.0 -70.0 40.0 2

assign (resid 7 and name c) (resid 8 and name n)
       (resid 8 and name ca) (resid 8 and name c) 1.0 -70.0 40.0 2
       
assign (resid 8 and name c) (resid 9 and name n)
       (resid 9 and name ca) (resid 9 and name c) 1.0 -130.0 40.0 2

assign (resid 9 and name c) (resid 10 and name n)
       (resid 10 and name ca) (resid 10 and name c) 1.0 -70.0 20.0 2

assign (resid 11 and name c) (resid 12 and name n)
       (resid 12 and name ca) (resid 12 and name c) 1.0 -70.0 40.0 2

assign (resid 13 and name c) (resid 14 and name n)
       (resid 14 and name ca) (resid 14 and name c) 1.0 -70.0 40.0 2

assign (resid 14 and name c) (resid 15 and name n)
       (resid 15 and name ca) (resid 15 and name c) 1.0 -70.0 40.0 2
       
assign (resid 15 and name c) (resid 16 and name n)
       (resid 16 and name ca) (resid 16 and name c) 1.0 -130.0 40 2
       
assign (resid 16 and name c) (resid 17 and name n)
       (resid 17 and name ca) (resid 17 and name c) 1.0 -130.0 40 2

assign (resid 17 and name c) (resid 18 and name n)
       (resid 18 and name ca) (resid 18 and name c) 1.0 -130.0 60 2

assign (resid 18 and name c) (resid 19 and name n)
       (resid 19 and name ca) (resid 19 and name c) 1.0 -130.0 40 2

assign (resid 19 and name c) (resid 20 and name n)
       (resid 20 and name ca) (resid 20 and name c) 1.0 -130.0 40 2

assign (resid 20 and name c) (resid 21 and name n)
       (resid 21 and name ca) (resid 21 and name c) 1.0 -130.0 40 2

assign (resid 21 and name c) (resid 22 and name n)
       (resid 22 and name ca) (resid 22 and name c) 1.0 -130.0 60 2

assign (resid 22 and name c) (resid 23 and name n)
       (resid 23 and name ca) (resid 23 and name c) 1.0 -130.0 60 2

assign (resid 24 and name c) (resid 25 and name n)
       (resid 25 and name ca) (resid 25 and name c) 1.0 -130.0 40 2

assign (resid 25 and name c) (resid 26 and name n)
       (resid 26 and name ca) (resid 26 and name c) 1.0 -130.0 60 2

assign (resid 26 and name c) (resid 27 and name n)
       (resid 27 and name ca) (resid 27 and name c) 1.0 -130.0 40 2

assign (resid 27 and name c) (resid 28 and name n)
       (resid 28 and name ca) (resid 28 and name c) 1.0 -130.0 40 2

assign (resid 28 and name c) (resid 29 and name n)
       (resid 29 and name ca) (resid 29 and name c) 1.0 -130.0 60 2

assign (resid 29 and name c) (resid 30 and name n)
       (resid 30 and name ca) (resid 30 and name c) 1.0 -130.0 60 2

assign (resid 30 and name c) (resid 31 and name n)
       (resid 31 and name ca) (resid 31 and name c) 1.0 -130.0 40 2

assign (resid 31 and name c) (resid 32 and name n)
       (resid 32 and name ca) (resid 32 and name c) 1.0 -130.0 40 2    

assign (resid 34 and name c) (resid 35 and name n)
       (resid 35 and name ca) (resid 35 and name c) 1.0 -70.0 40 2

assign (resid 37 and name c) (resid 38 and name n)
       (resid 38 and name ca) (resid 38 and name c) 1.0 -130.0 40 2    

assign (resid 39 and name c) (resid 40 and name n)
       (resid 40 and name ca) (resid 40 and name c) 1.0 -130.0 40 2
       
assign (resid 40 and name c) (resid 41 and name n)
       (resid 41 and name ca) (resid 41 and name c) 1.0 -130.0 60 2

assign (resid 41 and name c) (resid 42 and name n)
       (resid 42 and name ca) (resid 42 and name c) 1.0 -130.0 40 2
  
assign (resid 43 and name c) (resid 44 and name n)
       (resid 44 and name ca) (resid 44 and name c) 1.0 -130.0 40 2     

assign (resid 44 and name c) (resid 45 and name n)
       (resid 45 and name ca) (resid 45 and name c) 1.0 -70.0 20.0 2

assign (resid 45 and name c) (resid 46 and name n)
       (resid 46 and name ca) (resid 46 and name c) 1.0 -70.0 20.0 2

assign (resid 46 and name c) (resid 47 and name n)
       (resid 47 and name ca) (resid 47 and name c) 1.0 -70.0 20.0 2

assign (resid 47 and name c) (resid 48 and name n)
       (resid 48 and name ca) (resid 48 and name c) 1.0 -70.0 20.0 2

assign (resid 48 and name c) (resid 49 and name n)
       (resid 49 and name ca) (resid 49 and name c) 1.0 -70.0 20.0 2

assign (resid 49 and name c) (resid 50 and name n)
       (resid 50 and name ca) (resid 50 and name c) 1.0 -70.0 20.0 2

assign (resid 50 and name c) (resid 51 and name n)
       (resid 51 and name ca) (resid 51 and name c) 1.0 -70.0 40.0 2
       
assign (resid 51 and name c) (resid 52 and name n)
       (resid 52 and name ca) (resid 52 and name c) 1.0 -130.0 40 2

assign (resid 52 and name c) (resid 53 and name n)
       (resid 53 and name ca) (resid 53 and name c) 1.0 -70.0 40.0 2
       
assign (resid 53 and name c) (resid 54 and name n)
       (resid 54 and name ca) (resid 54 and name c) 1.0 -70.0 40.0 2

assign (resid 54 and name c) (resid 55 and name n)
       (resid 55 and name ca) (resid 55 and name c) 1.0 -70.0 40.0 2

!H-bond                  

assign ( resid 6 and  name N    )
  ( resid 3 and  name O    ) 2.8 0.4 0.7

assign ( resid 6 and  name HN   )
  ( resid 3 and  name O    ) 1.8 0.4 0.7
   
assign ( resid 8 and  name N    )
  ( resid 40 and  name OD1    ) 2.8 0.4 0.9

assign ( resid 8 and  name HN   )
  ( resid 40 and  name OD1    ) 1.8 0.4 0.9

assign ( resid 9 and  name N    )
  ( resid 36 and  name O    ) 2.8 0.4 0.9

assign ( resid 9 and  name HN   )
  ( resid 36 and  name O    ) 1.8 0.4 0.9

assign ( resid 11 and  name N    )
  ( resid 35 and  name O    ) 2.8 0.4 0.9

assign ( resid 11 and  name HN   )
  ( resid 35 and  name O    ) 1.8 0.4 0.9

assign ( resid 15 and  name N    )
  ( resid 12 and  name O    ) 2.8 0.4 0.9

assign ( resid 15 and  name HN   )
  ( resid 12 and  name O    ) 1.8 0.4 0.9

assign ( resid 17 and  name N    )
  ( resid 32 and  name O    ) 2.8 0.4 0.9

assign ( resid 17 and  name HN   )
  ( resid 32 and  name O    ) 1.8 0.4 0.9
  
assign ( resid 19 and  name N    )
  ( resid 30 and  name O    ) 2.8 0.4 0.7

assign ( resid 19 and  name HN   )
  ( resid 30 and  name O    ) 1.8 0.4 0.7
     
assign ( resid 20 and  name N    )
  ( resid 42 and  name O    ) 2.8 0.4 0.7

assign ( resid 20 and  name HN   )
  ( resid 42 and  name O    ) 1.8 0.4 0.7

assign ( resid 21 and  name N    )
  ( resid 28 and  name O    ) 2.8 0.4 0.7

assign ( resid 21 and  name HN   )
  ( resid 28 and  name O    ) 1.8 0.4 0.7
 
assign ( resid 22 and  name N    )
  ( resid 40 and  name O    ) 2.8 0.4 0.7

assign ( resid 22 and  name HN   )
  ( resid 40 and  name O    ) 1.8 0.4 0.7

assign ( resid 23 and  name N    )
  ( resid 26 and  name O    ) 2.8 0.4 0.7

assign ( resid 23 and  name HN   )
  ( resid 26 and  name O    ) 1.8 0.4 0.7

assign ( resid 26 and  name N    )
  ( resid 23 and  name O    ) 2.8 0.4 0.9

assign ( resid 26 and  name HN   )
  ( resid 23 and  name O    ) 1.8 0.4 0.9

assign ( resid 28 and  name N    )
  ( resid 21 and  name O    ) 2.8 0.4 0.7

assign ( resid 28 and  name HN   )
  ( resid 21 and  name O    ) 1.8 0.4 0.7

assign ( resid 29 and  name N    )
  ( resid 21 and  name OH    ) 2.8 0.4 0.7

assign ( resid 29 and  name HN   )
  ( resid 21 and  name OH    ) 1.8 0.4 0.7

assign ( resid 30 and  name HN   )
  ( resid 19 and  name O    ) 1.8 0.4 0.7
  
assign ( resid 30 and  name N    )
  ( resid 19 and  name O    ) 2.8 0.4 0.7
  
assign ( resid 31 and  name HN   )
  ( resid 10 and  name NE    ) 1.8 0.4 0.9
  
assign ( resid 31 and  name N    )
  ( resid 10 and  name NE    ) 2.8 0.4 0.9

assign ( resid 32 and  name N    )
  ( resid 17 and  name O    ) 2.8 0.4 0.7

assign ( resid 32 and  name HN   )
  ( resid 17 and  name O    ) 1.8 0.4 0.7
      
assign ( resid 33 and  name HN   )
  ( resid 10 and  name O    ) 1.8 0.4 0.9
  
assign ( resid 33 and  name N    )
  ( resid 10 and  name O   ) 2.8 0.4 0.9

assign ( resid 40 and  name HN   )
  ( resid 38 and  name OD1    ) 1.8 0.4 0.7
  
assign ( resid 40 and  name N    )
  ( resid 38 and  name OD1   ) 2.8 0.4 0.7

assign ( resid 40 and  name HD2#   )
  ( resid 6 and  name O    ) 1.8 0.4 1.9
  
assign ( resid 40 and  name ND2    )
  ( resid 6 and  name O   ) 2.8 0.4 0.9

assign ( resid 40 and  name HD2#   )
  ( resid 22 and  name O    ) 1.8 0.4 1.9
  
assign ( resid 40 and  name ND2    )
  ( resid 22 and  name O   ) 2.8 0.4 0.9

assign ( resid 41 and  name HN   )
  ( resid 8 and  name OG    ) 1.8 0.4 0.9
  
assign ( resid 41 and  name N    )
  ( resid 8 and  name OG   ) 2.8 0.4 0.9

assign ( resid 42 and  name HN   )
  ( resid 20 and  name O    ) 1.8 0.4 0.7
  
assign ( resid 42 and  name N    )
  ( resid 20 and  name O   ) 2.8 0.4 0.7

assign ( resid 44 and  name HN   )
  ( resid 44 and  name OG1    ) 1.8 0.4 0.9
  
assign ( resid 44 and  name N    )
  ( resid 44 and  name OG1   ) 2.8 0.4 0.9

assign ( resid 48 and  name N    )
  ( resid 44 and  name O    ) 2.8 0.4 0.9

assign ( resid 48 and  name HN   )
  ( resid 44 and  name O    ) 1.8 0.4 0.9
  
assign ( resid 49 and  name N    )
  ( resid 45 and  name O    ) 2.8 0.4 0.7

assign ( resid 49 and  name HN   )
  ( resid 45 and  name O    ) 1.8 0.4 0.7
  
assign ( resid 50 and  name N    )
  ( resid 46 and  name O    ) 2.8 0.4 0.7

assign ( resid 50 and  name HN   )
  ( resid 46 and  name O    ) 1.8 0.4 0.7
  
assign ( resid 51 and  name N    )
  ( resid 47 and  name O    ) 2.8 0.4 0.9

assign ( resid 51 and  name HN   )
  ( resid 47 and  name O    ) 1.8 0.4 0.9
  
assign ( resid 52 and  name N    )
  ( resid 48 and  name O    ) 2.8 0.4 0.7

assign ( resid 52 and  name HN   )
  ( resid 48 and  name O    ) 1.8 0.4 0.7




  Entry H atom name         Submitted Coord H atom name
  Start of MODEL    1
    1   1H    ILE   1          1H        ILE   1   4.480  14.805   4.177
    2   2H    ILE   1          2H        ILE   1   5.657  14.668   2.935
    3   3H    ILE   1          3H        ILE   1   6.064  14.265   4.553
    4    HA   ILE   1           HA       ILE   1   4.789  12.380   4.546
    5    HB   ILE   1           HB       ILE   1   3.359  11.800   2.553
    6   1HG1  ILE   1          2HG1      ILE   1   2.996  14.633   1.859
    7   2HG1  ILE   1          1HG1      ILE   1   4.563  13.979   1.392
    8   1HG2  ILE   1          1HG2      ILE   1   1.953  12.325   4.227
    9   2HG2  ILE   1          2HG2      ILE   1   1.665  13.784   3.278
   10   3HG2  ILE   1          3HG2      ILE   1   2.811  13.815   4.619
   11   1HD1  ILE   1          1HD1      ILE   1   1.858  13.327   0.393
   12   2HD1  ILE   1          2HD1      ILE   1   3.045  12.025   0.453
   13   3HD1  ILE   1          3HD1      ILE   1   3.383  13.486  -0.475
   14    H    ASP   2           H        ASP   2   6.853  11.508   4.415
   15    HA   ASP   2           HA       ASP   2   7.936  11.046   1.727
   16   1HB   ASP   2          2HB       ASP   2   9.279  12.047   3.754
   17   2HB   ASP   2          1HB       ASP   2   9.434  10.356   4.223
   18    H    THR   3           H        THR   3   5.947   9.511   3.823
   19    HA   THR   3           HA       THR   3   7.076   6.866   3.708
   20    HB   THR   3           HB       THR   3   4.283   7.712   4.494
   21    HG1  THR   3           HG1      THR   3   5.048   8.178   6.409
   22   1HG2  THR   3          1HG2      THR   3   5.168   5.171   4.118
   23   2HG2  THR   3          2HG2      THR   3   3.874   5.646   5.218
   24   3HG2  THR   3          3HG2      THR   3   5.515   5.427   5.828
   25    H    CYS   4           H        CYS   4   4.765   8.750   1.892
   26    HA   CYS   4           HA       CYS   4   3.622   6.564   0.460
   27   1HB   CYS   4          2HB       CYS   4   3.676   9.527  -0.139
   28   2HB   CYS   4          1HB       CYS   4   2.734   8.348  -1.045
   29    H    ARG   5           H        ARG   5   6.673   7.926   0.314
   30    HA   ARG   5           HA       ARG   5   7.017   7.581  -2.552
   31   1HB   ARG   5          2HB       ARG   5   9.383   8.069  -0.841
   32   2HB   ARG   5          1HB       ARG   5   8.924   8.811  -2.367
   33   1HG   ARG   5          2HG       ARG   5   7.026   9.837  -0.760
   34   2HG   ARG   5          1HG       ARG   5   8.342   9.637   0.398
   35   1HD   ARG   5          2HD       ARG   5   9.798  10.997  -0.905
   36   2HD   ARG   5          1HD       ARG   5   8.670  11.011  -2.261
   37    HE   ARG   5           HE       ARG   5   7.523  12.112   0.110
   38   1HH1  ARG   5          1HH1      ARG   5   9.617  12.828  -2.588
   39   2HH1  ARG   5          2HH1      ARG   5   9.309  14.531  -2.536
   40   1HH2  ARG   5          1HH2      ARG   5   7.117  14.351   0.181
   41   2HH2  ARG   5          2HH2      ARG   5   7.890  15.396  -0.962
   42    H    LEU   6           H        LEU   6   7.675   5.893   0.418
   43    HA   LEU   6           HA       LEU   6   9.689   4.158  -0.432
   44   1HB   LEU   6          2HB       LEU   6   7.490   3.391   1.470
   45   2HB   LEU   6          1HB       LEU   6   9.139   2.796   1.435
   46    HG   LEU   6           HG       LEU   6   8.212   5.536   2.293
   47   1HD1  LEU   6          1HD1      LEU   6   7.902   3.791   3.955
   48   2HD1  LEU   6          2HD1      LEU   6   9.200   4.885   4.436
   49   3HD1  LEU   6          3HD1      LEU   6   9.585   3.297   3.772
   50   1HD2  LEU   6          1HD2      LEU   6  10.690   5.799   2.865
   51   2HD2  LEU   6          2HD2      LEU   6  10.222   5.975   1.174
   52   3HD2  LEU   6          3HD2      LEU   6  10.965   4.476   1.732
   53    HA   PRO   7           HA       PRO   7   7.322   1.647  -3.269
   54   1HB   PRO   7          2HB       PRO   7   9.544  -0.105  -3.655
   55   2HB   PRO   7          1HB       PRO   7   9.022   1.221  -4.691
   56   1HG   PRO   7          2HG       PRO   7  11.381   1.157  -3.234
   57   2HG   PRO   7          1HG       PRO   7  10.620   2.615  -3.890
   58   1HD   PRO   7          2HD       PRO   7  10.572   1.532  -1.110
   59   2HD   PRO   7          1HD       PRO   7  10.600   3.217  -1.672
   60    H    SER   8           H        SER   8   5.814   0.378  -2.339
   61    HA   SER   8           HA       SER   8   6.509  -1.602  -0.360
   62   1HB   SER   8          2HB       SER   8   3.987  -0.530  -1.525
   63   2HB   SER   8          1HB       SER   8   3.934  -2.151  -0.832
   64    HG   SER   8           HG       SER   8   4.910  -1.171   1.079
   65    H    ASP   9           H        ASP   9   6.838  -3.723  -0.667
   66    HA   ASP   9           HA       ASP   9   6.816  -4.725  -3.399
   67   1HB   ASP   9          2HB       ASP   9   8.449  -5.165  -1.146
   68   2HB   ASP   9          1HB       ASP   9   7.625  -6.691  -1.448
   69    H    ARG  10           H        ARG  10   5.752  -6.638  -4.039
   70    HA   ARG  10           HA       ARG  10   3.241  -7.061  -2.652
   71   1HB   ARG  10          2HB       ARG  10   4.314  -7.942  -5.322
   72   2HB   ARG  10          1HB       ARG  10   2.784  -8.531  -4.688
   73   1HG   ARG  10          2HG       ARG  10   1.830  -6.367  -4.723
   74   2HG   ARG  10          1HG       ARG  10   3.395  -5.608  -5.018
   75   1HD   ARG  10          2HD       ARG  10   2.035  -5.698  -7.052
   76   2HD   ARG  10          1HD       ARG  10   3.509  -6.651  -7.210
   77    HE   ARG  10           HE       ARG  10   1.707  -8.480  -6.395
   78   1HH1  ARG  10          1HH1      ARG  10   1.671  -6.110  -8.957
   79   2HH1  ARG  10          2HH1      ARG  10   0.678  -7.068 -10.002
   80   1HH2  ARG  10          1HH2      ARG  10   0.408  -9.748  -7.777
   81   2HH2  ARG  10          2HH2      ARG  10  -0.041  -9.133  -9.333
   82    HN2  GLY  11           H        GLY  11   6.296  -8.499  -2.656
   83   1HA   GLY  11          2HA       GLY  11   7.072 -10.593  -2.054
   84   2HA   GLY  11          1HA       GLY  11   5.899 -10.370  -0.767
   85    H    ARG  12           H        ARG  12   6.448 -11.811  -3.930
   86    HA   ARG  12           HA       ARG  12   3.998 -13.000  -4.394
   87   1HB   ARG  12          2HB       ARG  12   6.471 -13.120  -5.573
   88   2HB   ARG  12          1HB       ARG  12   6.289 -14.757  -4.958
   89   1HG   ARG  12          2HG       ARG  12   4.757 -15.290  -6.492
   90   2HG   ARG  12          1HG       ARG  12   3.914 -13.748  -6.327
   91   1HD   ARG  12          2HD       ARG  12   5.004 -12.833  -8.065
   92   2HD   ARG  12          1HD       ARG  12   6.545 -13.549  -7.597
   93    HE   ARG  12           HE       ARG  12   4.792 -14.504  -9.588
   94   1HH1  ARG  12          1HH1      ARG  12   6.855 -15.651  -7.018
   95   2HH1  ARG  12          2HH1      ARG  12   7.154 -17.181  -7.773
   96   1HH2  ARG  12          1HH2      ARG  12   5.185 -16.515 -10.582
   97   2HH2  ARG  12          2HH2      ARG  12   6.207 -17.672  -9.796
   98    H    CYS  13           H        CYS  13   6.750 -14.820  -3.045
   99    HA   CYS  13           HA       CYS  13   6.759 -16.719  -1.758
  100   1HB   CYS  13          2HB       CYS  13   4.884 -15.089  -0.040
  101   2HB   CYS  13          1HB       CYS  13   6.060 -16.287   0.490
  102    H    LYS  14           H        LYS  14   4.653 -17.580   0.090
  103    HA   LYS  14           HA       LYS  14   3.001 -18.958  -1.871
  104   1HB   LYS  14          2HB       LYS  14   3.034 -19.459   1.098
  105   2HB   LYS  14          1HB       LYS  14   2.527 -20.553  -0.181
  106   1HG   LYS  14          2HG       LYS  14   4.569 -21.387  -0.351
  107   2HG   LYS  14          1HG       LYS  14   5.257 -19.781  -0.591
  108   1HD   LYS  14          2HD       LYS  14   6.315 -20.624   1.335
  109   2HD   LYS  14          1HD       LYS  14   5.088 -19.506   1.936
  110   1HE   LYS  14          2HE       LYS  14   4.504 -21.207   3.278
  111   2HE   LYS  14          1HE       LYS  14   3.691 -21.835   1.846
  112   1HZ   LYS  14          1HZ       LYS  14   6.509 -22.501   2.124
  113   2HZ   LYS  14          2HZ       LYS  14   5.222 -23.451   1.578
  114   3HZ   LYS  14          3HZ       LYS  14   5.462 -23.228   3.237
  115    H    ALA  15           H        ALA  15   2.635 -16.082  -0.725
  116    HA   ALA  15           HA       ALA  15  -0.167 -16.416   0.109
  117   1HB   ALA  15          1HB       ALA  15   0.843 -15.266   1.839
  118   2HB   ALA  15          2HB       ALA  15   0.166 -13.962   0.864
  119   3HB   ALA  15          3HB       ALA  15   1.885 -14.343   0.754
  120    H    SER  16           H        SER  16  -1.569 -14.482  -0.512
  121    HA   SER  16           HA       SER  16  -0.945 -12.986  -2.837
  122   1HB   SER  16          2HB       SER  16  -1.158 -15.011  -4.076
  123   2HB   SER  16          1HB       SER  16  -2.607 -15.483  -3.190
  124    HG   SER  16           HG       SER  16  -3.718 -13.798  -4.195
  125    H    PHE  17           H        PHE  17  -1.762 -11.588  -1.046
  126    HA   PHE  17           HA       PHE  17  -4.707 -11.469  -1.065
  127   1HB   PHE  17          2HB       PHE  17  -2.708 -10.984   1.094
  128   2HB   PHE  17          1HB       PHE  17  -4.181 -10.018   1.096
  129    HD1  PHE  17           HD1      PHE  17  -6.395 -11.444   0.752
  130    HD2  PHE  17           HD2      PHE  17  -2.715 -12.952   2.267
  131    HE1  PHE  17           HE1      PHE  17  -7.604 -13.289   1.842
  132    HE2  PHE  17           HE2      PHE  17  -3.918 -14.799   3.359
  133    HZ   PHE  17           HZ       PHE  17  -6.366 -14.970   3.148
  134    H    GLU  18           H        GLU  18  -5.675  -9.636  -1.725
  135    HA   GLU  18           HA       GLU  18  -4.072  -7.636  -3.011
  136   1HB   GLU  18          2HB       GLU  18  -6.325  -6.577  -3.474
  137   2HB   GLU  18          1HB       GLU  18  -6.089  -8.197  -4.113
  138   1HG   GLU  18          2HG       GLU  18  -7.228  -8.244  -1.454
  139   2HG   GLU  18          1HG       GLU  18  -8.210  -7.307  -2.578
  140    H    ARG  19           H        ARG  19  -3.387  -5.758  -2.215
  141    HA   ARG  19           HA       ARG  19  -4.755  -4.599   0.105
  142   1HB   ARG  19          2HB       ARG  19  -1.749  -4.800  -0.092
  143   2HB   ARG  19          1HB       ARG  19  -2.686  -4.180   1.260
  144   1HG   ARG  19          2HG       ARG  19  -2.592  -7.033   0.304
  145   2HG   ARG  19          1HG       ARG  19  -1.854  -6.383   1.769
  146   1HD   ARG  19          2HD       ARG  19  -4.610  -5.682   1.771
  147   2HD   ARG  19          1HD       ARG  19  -4.477  -7.402   1.410
  148    HE   ARG  19           HE       ARG  19  -4.077  -6.189   3.918
  149   1HH1  ARG  19          1HH1      ARG  19  -2.719  -8.663   1.866
  150   2HH1  ARG  19          2HH1      ARG  19  -2.085  -9.586   3.187
  151   1HH2  ARG  19          1HH2      ARG  19  -3.247  -7.402   5.656
  152   2HH2  ARG  19          2HH2      ARG  19  -2.385  -8.871   5.339
  153    H    TRP  20           H        TRP  20  -3.754  -2.330   0.557
  154    HA   TRP  20           HA       TRP  20  -3.527  -0.960  -2.038
  155   1HB   TRP  20          2HB       TRP  20  -4.557   0.104   0.600
  156   2HB   TRP  20          1HB       TRP  20  -4.460   1.018  -0.902
  157    HD1  TRP  20           HD1      TRP  20  -6.516  -1.682   0.832
  158    HE1  TRP  20           HE1      TRP  20  -8.689  -2.053  -0.488
  159    HE3  TRP  20           HE3      TRP  20  -5.459   1.173  -3.270
  160    HZ2  TRP  20           HZ2      TRP  20  -9.806  -1.245  -2.946
  161    HZ3  TRP  20           HZ3      TRP  20  -7.133   1.322  -5.064
  162    HH2  TRP  20           HH2      TRP  20  -9.266   0.138  -4.906
  163    H    TYR  21           H        TYR  21  -2.103   0.781  -2.268
  164    HA   TYR  21           HA       TYR  21  -0.166   1.327  -0.162
  165   1HB   TYR  21          2HB       TYR  21   1.687   1.004  -1.965
  166   2HB   TYR  21          1HB       TYR  21   1.057  -0.419  -1.137
  167    HD1  TYR  21           HD1      TYR  21  -0.977  -1.573  -2.324
  168    HD2  TYR  21           HD2      TYR  21   1.806   0.971  -4.287
  169    HE1  TYR  21           HE1      TYR  21  -1.619  -2.545  -4.474
  170    HE2  TYR  21           HE2      TYR  21   1.169  -0.001  -6.457
  171    HH   TYR  21           HH       TYR  21   0.116  -1.943  -7.382
  172    H    PHE  22           H        PHE  22   1.215   3.196  -0.704
  173    HA   PHE  22           HA       PHE  22  -0.315   5.160  -2.187
  174   1HB   PHE  22          2HB       PHE  22   2.370   5.647  -0.912
  175   2HB   PHE  22          1HB       PHE  22   1.081   6.802  -1.221
  176    HD1  PHE  22           HD2      PHE  22   2.178   4.036   0.929
  177    HD2  PHE  22           HD1      PHE  22  -0.710   7.096   0.317
  178    HE1  PHE  22           HE2      PHE  22   1.356   3.712   3.226
  179    HE2  PHE  22           HE1      PHE  22  -1.538   6.781   2.612
  180    HZ   PHE  22           HZ       PHE  22  -0.505   5.086   4.071
  181    H    ASN  23           H        ASN  23   0.241   6.134  -4.076
  182    HA   ASN  23           HA       ASN  23   2.713   5.222  -5.393
  183   1HB   ASN  23          2HB       ASN  23   0.519   4.165  -6.236
  184   2HB   ASN  23          1HB       ASN  23   0.161   5.755  -6.903
  185   1HD2  ASN  23          1HD2      ASN  23   1.506   6.592  -8.539
  186   2HD2  ASN  23          2HD2      ASN  23   2.483   5.552  -9.512
  187    HN2  GLY  24           H        GLY  24   3.498   7.278  -4.461
  188   1HA   GLY  24          2HA       GLY  24   4.338   9.372  -4.994
  189   2HA   GLY  24          1HA       GLY  24   3.327   9.375  -6.431
  190    H    ARG  25           H        ARG  25   0.860   9.384  -5.755
  191    HA   ARG  25           HA       ARG  25   0.406  11.188  -3.508
  192   1HB   ARG  25          2HB       ARG  25  -0.717  12.849  -4.778
  193   2HB   ARG  25          1HB       ARG  25   0.808  12.552  -5.600
  194   1HG   ARG  25          2HG       ARG  25  -0.562  12.547  -7.400
  195   2HG   ARG  25          1HG       ARG  25  -0.703  10.843  -6.961
  196   1HD   ARG  25          2HD       ARG  25  -2.894  11.097  -6.710
  197   2HD   ARG  25          1HD       ARG  25  -2.606  12.278  -5.432
  198    HE   ARG  25           HE       ARG  25  -3.102  13.960  -6.910
  199   1HH1  ARG  25          1HH1      ARG  25  -2.646  10.984  -8.676
  200   2HH1  ARG  25          2HH1      ARG  25  -3.228  11.637 -10.171
  201   1HH2  ARG  25          1HH2      ARG  25  -3.867  14.820  -8.875
  202   2HH2  ARG  25          2HH2      ARG  25  -3.920  13.814 -10.284
  203    H    THR  26           H        THR  26  -0.899   9.101  -6.023
  204    HA   THR  26           HA       THR  26  -3.437   8.906  -4.573
  205    HB   THR  26           HB       THR  26  -3.390   7.304  -6.952
  206    HG1  THR  26           HG1      THR  26  -2.409   8.517  -8.333
  207   1HG2  THR  26          1HG2      THR  26  -5.079   9.209  -5.702
  208   2HG2  THR  26          2HG2      THR  26  -5.457   8.066  -6.991
  209   3HG2  THR  26          3HG2      THR  26  -4.852   9.674  -7.389
  210    H    CYS  27           H        CYS  27  -4.410   6.599  -4.705
  211    HA   CYS  27           HA       CYS  27  -2.501   4.834  -3.401
  212   1HB   CYS  27          2HB       CYS  27  -5.504   4.733  -3.705
  213   2HB   CYS  27          1HB       CYS  27  -4.569   3.459  -2.928
  214    H    ALA  28           H        ALA  28  -2.960   2.401  -3.857
  215    HA   ALA  28           HA       ALA  28  -3.482   1.815  -6.648
  216   1HB   ALA  28          1HB       ALA  28  -0.755   1.597  -5.429
  217   2HB   ALA  28          2HB       ALA  28  -1.234   2.330  -6.959
  218   3HB   ALA  28          3HB       ALA  28  -1.242   0.577  -6.783
  219    H    LYS  29           H        LYS  29  -2.972  -0.692  -6.990
  220    HA   LYS  29           HA       LYS  29  -3.534  -2.218  -4.573
  221   1HB   LYS  29          2HB       LYS  29  -5.605  -1.398  -6.307
  222   2HB   LYS  29          1HB       LYS  29  -5.363  -3.116  -6.598
  223   1HG   LYS  29          2HG       LYS  29  -5.434  -3.314  -4.019
  224   2HG   LYS  29          1HG       LYS  29  -6.196  -1.725  -4.091
  225   1HD   LYS  29          2HD       LYS  29  -8.135  -2.584  -4.795
  226   2HD   LYS  29          1HD       LYS  29  -7.339  -3.586  -6.010
  227   1HE   LYS  29          2HE       LYS  29  -7.379  -5.407  -4.700
  228   2HE   LYS  29          1HE       LYS  29  -6.926  -4.497  -3.260
  229   1HZ   LYS  29          1HZ       LYS  29  -9.312  -5.583  -3.584
  230   2HZ   LYS  29          2HZ       LYS  29  -9.621  -4.071  -4.275
  231   3HZ   LYS  29          3HZ       LYS  29  -9.069  -4.175  -2.679
  232    H    PHE  30           H        PHE  30  -2.835  -4.287  -4.632
  233    HA   PHE  30           HA       PHE  30  -2.310  -5.692  -7.064
  234   1HB   PHE  30          2HB       PHE  30   0.153  -5.968  -6.646
  235   2HB   PHE  30          1HB       PHE  30  -0.332  -4.376  -7.209
  236    HD1  PHE  30           HD2      PHE  30  -1.027  -5.120  -3.724
  237    HD2  PHE  30           HD1      PHE  30   1.889  -3.616  -6.435
  238    HE1  PHE  30           HE2      PHE  30   0.182  -4.104  -1.852
  239    HE2  PHE  30           HE1      PHE  30   3.104  -2.594  -4.559
  240    HZ   PHE  30           HZ       PHE  30   2.252  -2.836  -2.264
  241    H    ILE  31           H        ILE  31  -0.923  -7.783  -6.465
  242    HA   ILE  31           HA       ILE  31  -2.332  -8.935  -4.194
  243    HB   ILE  31           HB       ILE  31  -0.501 -10.272  -6.186
  244   1HG1  ILE  31          2HG1      ILE  31  -2.482  -9.269  -7.259
  245   2HG1  ILE  31          1HG1      ILE  31  -2.536 -11.028  -7.307
  246   1HG2  ILE  31          1HG2      ILE  31  -2.578 -11.818  -4.791
  247   2HG2  ILE  31          2HG2      ILE  31  -1.256 -11.243  -3.777
  248   3HG2  ILE  31          3HG2      ILE  31  -0.914 -12.248  -5.185
  249   1HD1  ILE  31          1HD1      ILE  31  -4.709 -10.034  -6.785
  250   2HD1  ILE  31          2HD1      ILE  31  -4.016  -9.299  -5.339
  251   3HD1  ILE  31          3HD1      ILE  31  -4.114 -11.055  -5.475
  252    H    TYR  32           H        TYR  32  -1.314  -8.170  -2.384
  253    HA   TYR  32           HA       TYR  32   1.574  -8.440  -2.131
  254   1HB   TYR  32          2HB       TYR  32   0.574  -6.365  -1.356
  255   2HB   TYR  32          1HB       TYR  32  -0.503  -7.250  -0.283
  256    HD1  TYR  32           HD1      TYR  32   3.146  -7.729  -0.849
  257    HD2  TYR  32           HD2      TYR  32   0.092  -6.531   1.854
  258    HE1  TYR  32           HE1      TYR  32   4.816  -7.558   0.947
  259    HE2  TYR  32           HE2      TYR  32   1.751  -6.355   3.660
  260    HH   TYR  32           HH       TYR  32   4.934  -7.580   3.357
  261    HN2  GLY  33           H        GLY  33   2.043 -10.586  -1.857
  262   1HA   GLY  33          2HA       GLY  33   0.565 -12.420  -0.327
  263   2HA   GLY  33          1HA       GLY  33   2.266 -12.587  -0.742
  264    HN2  GLY  34           H        GLY  34   2.699  -9.889   0.635
  265   1HA   GLY  34          2HA       GLY  34   2.505  -9.171   2.964
  266   2HA   GLY  34          1HA       GLY  34   2.535 -10.868   3.415
  267    H    CYS  35           H        CYS  35   4.710 -10.304   0.912
  268    HA   CYS  35           HA       CYS  35   6.917 -10.140   2.854
  269   1HB   CYS  35          2HB       CYS  35   7.390 -11.151   0.086
  270   2HB   CYS  35          1HB       CYS  35   8.166 -11.608   1.596
  271    HN2  GLY  36           H        GLY  36   7.601  -8.101   2.966
  272   1HA   GLY  36          2HA       GLY  36   9.093  -6.486   1.957
  273   2HA   GLY  36          1HA       GLY  36   8.273  -6.759   0.428
  274    HN2  GLY  37           H        GLY  37   8.065  -5.221   3.570
  275   1HA   GLY  37          2HA       GLY  37   6.454  -3.108   2.471
  276   2HA   GLY  37          1HA       GLY  37   5.565  -4.126   3.594
  277    H    ASN  38           H        ASN  38   6.531  -1.257   3.662
  278    HA   ASN  38           HA       ASN  38   7.727  -1.420   6.340
  279   1HB   ASN  38          2HB       ASN  38   8.857   0.860   5.566
  280   2HB   ASN  38          1HB       ASN  38   9.624  -0.698   5.274
  281   1HD2  ASN  38          1HD2      ASN  38  10.775   0.219   3.542
  282   2HD2  ASN  38          2HD2      ASN  38  10.020   0.515   2.017
  283    HN2  GLY  39           H        GLY  39   6.954   1.463   4.433
  284   1HA   GLY  39          2HA       GLY  39   4.771   2.023   6.341
  285   2HA   GLY  39          1HA       GLY  39   5.907   3.259   5.822
  286    H    ASN  40           H        ASN  40   5.552   1.559   3.112
  287    HA   ASN  40           HA       ASN  40   3.546   3.389   2.074
  288   1HB   ASN  40          2HB       ASN  40   5.629   3.123   0.821
  289   2HB   ASN  40          1HB       ASN  40   5.336   1.393   0.670
  290   1HD2  ASN  40          1HD2      ASN  40   4.200   4.573  -0.264
  291   2HD2  ASN  40          2HD2      ASN  40   3.361   4.064  -1.687
  292    H    LYS  41           H        LYS  41   3.849   0.105   3.026
  293    HA   LYS  41           HA       LYS  41   1.693  -0.942   1.461
  294   1HB   LYS  41          2HB       LYS  41   3.630  -2.263   2.416
  295   2HB   LYS  41          1HB       LYS  41   2.862  -2.102   3.990
  296   1HG   LYS  41          2HG       LYS  41   2.265  -4.223   3.149
  297   2HG   LYS  41          1HG       LYS  41   0.834  -3.201   2.999
  298   1HD   LYS  41          2HD       LYS  41   2.333  -2.913   0.615
  299   2HD   LYS  41          1HD       LYS  41   2.235  -4.639   0.968
  300   1HE   LYS  41          2HE       LYS  41   0.212  -4.584   0.036
  301   2HE   LYS  41          1HE       LYS  41  -0.322  -3.721   1.477
  302   1HZ   LYS  41          1HZ       LYS  41   0.074  -1.639   0.386
  303   2HZ   LYS  41          2HZ       LYS  41  -0.904  -2.587  -0.615
  304   3HZ   LYS  41          3HZ       LYS  41   0.740  -2.408  -0.965
  305    H    PHE  42           H        PHE  42  -0.335  -1.708   2.292
  306    HA   PHE  42           HA       PHE  42  -1.271  -1.067   4.880
  307   1HB   PHE  42          2HB       PHE  42  -1.580   0.972   2.789
  308   2HB   PHE  42          1HB       PHE  42  -3.080   0.556   3.612
  309    HD1  PHE  42           HD1      PHE  42  -2.948   0.502   6.222
  310    HD2  PHE  42           HD2      PHE  42  -0.199   2.563   3.713
  311    HE1  PHE  42           HE1      PHE  42  -2.314   1.945   8.111
  312    HE2  PHE  42           HE2      PHE  42   0.441   4.011   5.597
  313    HZ   PHE  42           HZ       PHE  42  -0.617   3.704   7.799
  314    HA   PRO  43           HA       PRO  43  -4.063  -4.240   3.556
  315   1HB   PRO  43          2HB       PRO  43  -5.836  -3.378   5.745
  316   2HB   PRO  43          1HB       PRO  43  -5.016  -4.924   5.505
  317   1HG   PRO  43          2HG       PRO  43  -4.239  -3.198   7.407
  318   2HG   PRO  43          1HG       PRO  43  -3.075  -4.205   6.526
  319   1HD   PRO  43          2HD       PRO  43  -3.753  -1.311   6.144
  320   2HD   PRO  43          1HD       PRO  43  -2.168  -2.115   6.110
  321    H    THR  44           H        THR  44  -5.805  -1.343   4.738
  322    HA   THR  44           HA       THR  44  -7.641  -1.642   2.459
  323    HB   THR  44           HB       THR  44  -9.162  -0.170   3.877
  324    HG1  THR  44           HG1      THR  44  -7.388   0.446   5.310
  325   1HG2  THR  44          1HG2      THR  44  -8.752  -2.940   3.974
  326   2HG2  THR  44          2HG2      THR  44 -10.198  -2.039   4.432
  327   3HG2  THR  44          3HG2      THR  44  -8.967  -2.407   5.641
  328    H    GLN  45           H        GLN  45  -8.430   0.265   1.415
  329    HA   GLN  45           HA       GLN  45  -6.373   2.146   0.842
  330   1HB   GLN  45          2HB       GLN  45  -8.206   1.305  -0.730
  331   2HB   GLN  45          1HB       GLN  45  -9.276   2.438   0.084
  332   1HG   GLN  45          2HG       GLN  45  -7.172   4.039  -0.527
  333   2HG   GLN  45          1HG       GLN  45  -7.165   2.916  -1.886
  334   1HE2  GLN  45          1HE2      GLN  45  -8.572   3.223  -3.484
  335   2HE2  GLN  45          2HE2      GLN  45  -9.879   4.352  -3.461
  336    H    GLU  46           H        GLU  46  -9.044   2.074   3.045
  337    HA   GLU  46           HA       GLU  46  -9.582   4.755   3.453
  338   1HB   GLU  46          2HB       GLU  46 -10.485   2.506   4.584
  339   2HB   GLU  46          1HB       GLU  46  -9.394   3.021   5.862
  340   1HG   GLU  46          2HG       GLU  46 -10.555   5.117   6.075
  341   2HG   GLU  46          1HG       GLU  46 -11.580   4.727   4.694
  342    H    ALA  47           H        ALA  47  -6.900   2.815   4.629
  343    HA   ALA  47           HA       ALA  47  -5.864   4.936   6.295
  344   1HB   ALA  47          1HB       ALA  47  -3.825   3.172   6.135
  345   2HB   ALA  47          2HB       ALA  47  -5.188   2.122   5.753
  346   3HB   ALA  47          3HB       ALA  47  -5.167   3.025   7.269
  347    H    CYS  48           H        CYS  48  -5.285   3.596   3.111
  348    HA   CYS  48           HA       CYS  48  -2.841   4.910   2.579
  349   1HB   CYS  48          2HB       CYS  48  -3.480   3.041   1.219
  350   2HB   CYS  48          1HB       CYS  48  -4.990   3.818   0.758
  351    H    MET  49           H        MET  49  -6.207   5.849   2.191
  352    HA   MET  49           HA       MET  49  -5.559   8.280   0.784
  353   1HB   MET  49          2HB       MET  49  -7.915   6.744   1.314
  354   2HB   MET  49          1HB       MET  49  -8.195   8.400   1.831
  355   1HG   MET  49          2HG       MET  49  -6.907   8.416  -0.717
  356   2HG   MET  49          1HG       MET  49  -8.301   7.341  -0.773
  357   1HE   MET  49          1HE       MET  49 -11.123   8.681  -0.656
  358   2HE   MET  49          2HE       MET  49  -9.978   7.985  -1.803
  359   3HE   MET  49          3HE       MET  49 -10.628   9.601  -2.078
  360    H    LYS  50           H        LYS  50  -6.264   7.323   4.079
  361    HA   LYS  50           HA       LYS  50  -6.559  10.002   5.056
  362   1HB   LYS  50          2HB       LYS  50  -7.615   8.015   6.126
  363   2HB   LYS  50          1HB       LYS  50  -6.017   7.471   6.613
  364   1HG   LYS  50          2HG       LYS  50  -5.845   9.794   7.748
  365   2HG   LYS  50          1HG       LYS  50  -7.603   9.798   7.603
  366   1HD   LYS  50          2HD       LYS  50  -7.858   8.257   9.220
  367   2HD   LYS  50          1HD       LYS  50  -6.482   7.303   8.659
  368   1HE   LYS  50          2HE       LYS  50  -5.217   9.488   9.634
  369   2HE   LYS  50          1HE       LYS  50  -6.618   9.420  10.701
  370   1HZ   LYS  50          1HZ       LYS  50  -4.380   7.568  10.452
  371   2HZ   LYS  50          2HZ       LYS  50  -5.895   6.887  10.766
  372   3HZ   LYS  50          3HZ       LYS  50  -5.251   8.036  11.826
  373    H    ARG  51           H        ARG  51  -3.877   8.058   4.258
  374    HA   ARG  51           HA       ARG  51  -2.104   9.454   6.108
  375   1HB   ARG  51          2HB       ARG  51  -2.025   6.931   4.642
  376   2HB   ARG  51          1HB       ARG  51  -0.511   7.822   4.547
  377   1HG   ARG  51          2HG       ARG  51  -1.752   7.578   7.220
  378   2HG   ARG  51          1HG       ARG  51  -1.068   6.114   6.510
  379   1HD   ARG  51          2HD       ARG  51   0.730   7.001   7.670
  380   2HD   ARG  51          1HD       ARG  51   0.996   7.598   6.033
  381    HE   ARG  51           HE       ARG  51  -0.452   9.565   7.247
  382   1HH1  ARG  51          1HH1      ARG  51   2.553   7.938   7.952
  383   2HH1  ARG  51          2HH1      ARG  51   3.252   9.306   8.752
  384   1HH2  ARG  51          1HH2      ARG  51   0.466  11.367   8.298
  385   2HH2  ARG  51          2HH2      ARG  51   2.066  11.252   8.950
  386    H    CYS  52           H        CYS  52  -2.869   9.317   2.684
  387    HA   CYS  52           HA       CYS  52  -0.875  11.446   2.248
  388   1HB   CYS  52          2HB       CYS  52  -1.028   8.926   0.992
  389   2HB   CYS  52          1HB       CYS  52  -1.535  10.108  -0.208
  390    H    ALA  53           H        ALA  53  -4.128  10.310   1.597
  391    HA   ALA  53           HA       ALA  53  -4.709  12.552  -0.145
  392   1HB   ALA  53          1HB       ALA  53  -6.574  11.439  -0.765
  393   2HB   ALA  53          2HB       ALA  53  -6.922  10.882   0.872
  394   3HB   ALA  53          3HB       ALA  53  -5.698  10.063  -0.098
  395    H    LYS  54           H        LYS  54  -5.016  11.739   3.208
  396    HA   LYS  54           HA       LYS  54  -6.770  14.049   3.654
  397   1HB   LYS  54          2HB       LYS  54  -7.343  11.756   4.601
  398   2HB   LYS  54          1HB       LYS  54  -5.986  11.977   5.697
  399   1HG   LYS  54          2HG       LYS  54  -7.055  13.565   6.927
  400   2HG   LYS  54          1HG       LYS  54  -8.018  14.133   5.562
  401   1HD   LYS  54          2HD       LYS  54  -8.926  11.573   5.875
  402   2HD   LYS  54          1HD       LYS  54  -8.597  12.054   7.541
  403   1HE   LYS  54          2HE       LYS  54 -10.274  13.560   7.573
  404   2HE   LYS  54          1HE       LYS  54  -9.997  14.058   5.905
  405   1HZ   LYS  54          1HZ       LYS  54 -11.683  11.902   6.946
  406   2HZ   LYS  54          2HZ       LYS  54 -10.964  11.686   5.430
  407   3HZ   LYS  54          3HZ       LYS  54 -11.989  13.004   5.699
  408    H    ALA  55           H        ALA  55  -3.595  12.770   4.325
  409    HA   ALA  55           HA       ALA  55  -2.938  14.851   6.222
  410   1HB   ALA  55          1HB       ALA  55  -2.002  12.565   6.403
  411   2HB   ALA  55          2HB       ALA  55  -0.764  13.819   6.339
  412   3HB   ALA  55          3HB       ALA  55  -1.109  12.846   4.909
  Start of MODEL    2
    1   1H    ILE   1          1H        ILE   1   8.388  14.101   0.335
    2   2H    ILE   1          2H        ILE   1   9.235  14.196   1.825
    3   3H    ILE   1          3H        ILE   1   7.805  13.254   1.707
    4    HA   ILE   1           HA       ILE   1   8.951  11.900   0.024
    5    HB   ILE   1           HB       ILE   1  10.712  13.541  -0.504
    6   1HG1  ILE   1          2HG1      ILE   1  12.547  11.961  -0.672
    7   2HG1  ILE   1          1HG1      ILE   1  11.859  10.969   0.607
    8   1HG2  ILE   1          1HG2      ILE   1  12.638  13.145   1.450
    9   2HG2  ILE   1          2HG2      ILE   1  11.142  13.399   2.352
   10   3HG2  ILE   1          3HG2      ILE   1  11.685  14.605   1.185
   11   1HD1  ILE   1          1HD1      ILE   1  10.573  11.470  -2.066
   12   2HD1  ILE   1          2HD1      ILE   1   9.986  10.394  -0.798
   13   3HD1  ILE   1          3HD1      ILE   1  11.498  10.033  -1.631
   14    H    ASP   2           H        ASP   2   7.651  11.147   2.062
   15    HA   ASP   2           HA       ASP   2   9.546   9.973   3.980
   16   1HB   ASP   2          2HB       ASP   2   6.583  10.502   4.298
   17   2HB   ASP   2          1HB       ASP   2   7.623   9.766   5.516
   18    H    THR   3           H        THR   3   6.620   8.474   4.377
   19    HA   THR   3           HA       THR   3   7.577   6.088   3.025
   20    HB   THR   3           HB       THR   3   5.225   6.479   4.883
   21    HG1  THR   3           HG1      THR   3   7.816   5.440   5.386
   22   1HG2  THR   3          1HG2      THR   3   5.441   4.024   5.233
   23   2HG2  THR   3          2HG2      THR   3   6.520   3.977   3.839
   24   3HG2  THR   3          3HG2      THR   3   4.844   4.491   3.640
   25    H    CYS   4           H        CYS   4   4.925   8.366   2.882
   26    HA   CYS   4           HA       CYS   4   3.218   6.905   1.200
   27   1HB   CYS   4          2HB       CYS   4   3.492   9.744   2.011
   28   2HB   CYS   4          1HB       CYS   4   2.561   9.426   0.551
   29    H    ARG   5           H        ARG   5   6.235   8.325   0.488
   30    HA   ARG   5           HA       ARG   5   5.576   8.625  -2.343
   31   1HB   ARG   5          2HB       ARG   5   8.281   9.154  -1.151
   32   2HB   ARG   5          1HB       ARG   5   7.569   9.834  -2.605
   33   1HG   ARG   5          2HG       ARG   5   7.025  10.535   0.254
   34   2HG   ARG   5          1HG       ARG   5   7.541  11.578  -1.069
   35   1HD   ARG   5          2HD       ARG   5   5.362  11.358  -2.121
   36   2HD   ARG   5          1HD       ARG   5   4.841  10.260  -0.848
   37    HE   ARG   5           HE       ARG   5   4.771  12.063   0.662
   38   1HH1  ARG   5          1HH1      ARG   5   5.636  13.084  -2.572
   39   2HH1  ARG   5          2HH1      ARG   5   5.260  14.746  -2.275
   40   1HH2  ARG   5          1HH2      ARG   5   4.287  14.248   1.042
   41   2HH2  ARG   5          2HH2      ARG   5   4.498  15.407  -0.229
   42    H    LEU   6           H        LEU   6   7.414   6.569  -0.181
   43    HA   LEU   6           HA       LEU   6   8.763   5.207  -2.333
   44   1HB   LEU   6          2HB       LEU   6   9.795   3.871  -0.677
   45   2HB   LEU   6          1HB       LEU   6   9.730   5.501  -0.039
   46    HG   LEU   6           HG       LEU   6   7.480   4.559   1.054
   47   1HD1  LEU   6          1HD1      LEU   6   8.303   2.289  -0.134
   48   2HD1  LEU   6          2HD1      LEU   6   7.348   2.330   1.348
   49   3HD1  LEU   6          3HD1      LEU   6   9.098   2.129   1.433
   50   1HD2  LEU   6          1HD2      LEU   6   9.545   5.548   2.127
   51   2HD2  LEU   6          2HD2      LEU   6  10.159   3.899   2.248
   52   3HD2  LEU   6          3HD2      LEU   6   8.672   4.350   3.082
   53    HA   PRO   7           HA       PRO   7   5.180   2.628  -3.190
   54   1HB   PRO   7          2HB       PRO   7   7.122   1.168  -4.875
   55   2HB   PRO   7          1HB       PRO   7   5.586   1.917  -5.322
   56   1HG   PRO   7          2HG       PRO   7   7.919   3.001  -6.047
   57   2HG   PRO   7          1HG       PRO   7   6.534   4.011  -5.592
   58   1HD   PRO   7          2HD       PRO   7   8.965   3.295  -3.997
   59   2HD   PRO   7          1HD       PRO   7   8.110   4.848  -4.115
   60    H    SER   8           H        SER   8   4.554   0.458  -2.813
   61    HA   SER   8           HA       SER   8   6.424  -1.034  -1.098
   62   1HB   SER   8          2HB       SER   8   3.752  -0.213  -0.654
   63   2HB   SER   8          1HB       SER   8   3.717  -1.967  -0.840
   64    HG   SER   8           HG       SER   8   5.351  -0.482   0.947
   65    H    ASP   9           H        ASP   9   6.842  -3.164  -1.482
   66    HA   ASP   9           HA       ASP   9   5.882  -4.213  -4.045
   67   1HB   ASP   9          2HB       ASP   9   8.388  -4.423  -2.533
   68   2HB   ASP   9          1HB       ASP   9   7.832  -5.958  -3.195
   69    H    ARG  10           H        ARG  10   4.840  -6.157  -4.233
   70    HA   ARG  10           HA       ARG  10   3.658  -7.202  -1.792
   71   1HB   ARG  10          2HB       ARG  10   2.221  -8.491  -3.336
   72   2HB   ARG  10          1HB       ARG  10   2.160  -6.759  -3.631
   73   1HG   ARG  10          2HG       ARG  10   4.175  -7.637  -5.304
   74   2HG   ARG  10          1HG       ARG  10   2.972  -8.923  -5.381
   75   1HD   ARG  10          2HD       ARG  10   1.921  -6.177  -5.532
   76   2HD   ARG  10          1HD       ARG  10   2.906  -6.695  -6.900
   77    HE   ARG  10           HE       ARG  10   0.743  -8.450  -6.035
   78   1HH1  ARG  10          1HH1      ARG  10   1.918  -6.103  -8.344
   79   2HH1  ARG  10          2HH1      ARG  10   0.767  -6.542  -9.560
   80   1HH2  ARG  10          1HH2      ARG  10  -0.773  -9.019  -7.638
   81   2HH2  ARG  10          2HH2      ARG  10  -0.761  -8.193  -9.160
   82    HN2  GLY  11           H        GLY  11   6.442  -7.862  -3.405
   83   1HA   GLY  11          2HA       GLY  11   7.799  -9.704  -3.643
   84   2HA   GLY  11          1HA       GLY  11   7.145 -10.137  -2.075
   85    H    ARG  12           H        ARG  12   7.766 -12.276  -3.273
   86    HA   ARG  12           HA       ARG  12   5.411 -13.225  -4.765
   87   1HB   ARG  12          2HB       ARG  12   7.035 -15.152  -5.375
   88   2HB   ARG  12          1HB       ARG  12   7.207 -13.603  -6.187
   89   1HG   ARG  12          2HG       ARG  12   9.013 -13.017  -4.606
   90   2HG   ARG  12          1HG       ARG  12   8.874 -14.629  -3.898
   91   1HD   ARG  12          2HD       ARG  12   9.158 -14.599  -6.817
   92   2HD   ARG  12          1HD       ARG  12  10.546 -13.953  -5.945
   93    HE   ARG  12           HE       ARG  12   9.675 -16.690  -6.039
   94   1HH1  ARG  12          1HH1      ARG  12  11.469 -14.316  -4.215
   95   2HH1  ARG  12          2HH1      ARG  12  12.440 -15.494  -3.399
   96   1HH2  ARG  12          1HH2      ARG  12  10.952 -18.241  -4.964
   97   2HH2  ARG  12          2HH2      ARG  12  12.149 -17.723  -3.824
   98    H    CYS  13           H        CYS  13   7.078 -13.467  -1.819
   99    HA   CYS  13           HA       CYS  13   6.968 -15.966  -0.892
  100   1HB   CYS  13          2HB       CYS  13   6.086 -14.916   1.328
  101   2HB   CYS  13          1HB       CYS  13   7.652 -14.433   0.693
  102    H    LYS  14           H        LYS  14   4.174 -14.203   0.346
  103    HA   LYS  14           HA       LYS  14   2.507 -16.481  -0.466
  104   1HB   LYS  14          2HB       LYS  14   2.931 -15.318   2.058
  105   2HB   LYS  14          1HB       LYS  14   1.309 -14.836   1.583
  106   1HG   LYS  14          2HG       LYS  14   0.665 -16.798   2.411
  107   2HG   LYS  14          1HG       LYS  14   1.341 -17.497   0.939
  108   1HD   LYS  14          2HD       LYS  14   3.560 -17.261   2.505
  109   2HD   LYS  14          1HD       LYS  14   2.314 -17.615   3.704
  110   1HE   LYS  14          2HE       LYS  14   1.859 -19.690   2.814
  111   2HE   LYS  14          1HE       LYS  14   2.444 -19.247   1.211
  112   1HZ   LYS  14          1HZ       LYS  14   4.685 -19.045   2.629
  113   2HZ   LYS  14          2HZ       LYS  14   4.206 -20.467   1.847
  114   3HZ   LYS  14          3HZ       LYS  14   3.907 -20.270   3.500
  115    H    ALA  15           H        ALA  15   2.897 -14.556  -2.381
  116    HA   ALA  15           HA       ALA  15   1.128 -12.401  -2.411
  117   1HB   ALA  15          1HB       ALA  15   1.543 -12.224  -4.693
  118   2HB   ALA  15          2HB       ALA  15   1.744 -13.965  -4.889
  119   3HB   ALA  15          3HB       ALA  15   2.990 -13.020  -4.074
  120    H    SER  16           H        SER  16  -0.904 -12.830  -1.650
  121    HA   SER  16           HA       SER  16  -2.790 -13.893  -3.478
  122   1HB   SER  16          2HB       SER  16  -1.963 -15.612  -1.154
  123   2HB   SER  16          1HB       SER  16  -3.593 -15.715  -1.819
  124    HG   SER  16           HG       SER  16  -2.465 -16.016  -3.909
  125    H    PHE  17           H        PHE  17  -2.292 -11.537  -1.768
  126    HA   PHE  17           HA       PHE  17  -4.967 -11.378  -0.609
  127   1HB   PHE  17          2HB       PHE  17  -2.400 -11.008   0.896
  128   2HB   PHE  17          1HB       PHE  17  -3.822 -10.075   1.352
  129    HD1  PHE  17           HD1      PHE  17  -2.670 -13.560   0.772
  130    HD2  PHE  17           HD2      PHE  17  -5.401 -10.987   2.777
  131    HE1  PHE  17           HE1      PHE  17  -3.491 -15.467   2.091
  132    HE2  PHE  17           HE2      PHE  17  -6.228 -12.888   4.100
  133    HZ   PHE  17           HZ       PHE  17  -5.272 -15.132   3.758
  134    H    GLU  18           H        GLU  18  -5.859  -9.738  -1.681
  135    HA   GLU  18           HA       GLU  18  -4.350  -7.699  -2.950
  136   1HB   GLU  18          2HB       GLU  18  -6.626  -6.656  -3.328
  137   2HB   GLU  18          1HB       GLU  18  -6.418  -8.289  -3.948
  138   1HG   GLU  18          2HG       GLU  18  -7.910  -9.177  -2.507
  139   2HG   GLU  18          1HG       GLU  18  -7.499  -8.053  -1.214
  140    H    ARG  19           H        ARG  19  -3.755  -5.737  -2.303
  141    HA   ARG  19           HA       ARG  19  -4.968  -4.550   0.077
  142   1HB   ARG  19          2HB       ARG  19  -2.036  -5.152  -0.274
  143   2HB   ARG  19          1HB       ARG  19  -2.612  -3.924   0.845
  144   1HG   ARG  19          2HG       ARG  19  -4.142  -6.128   1.479
  145   2HG   ARG  19          1HG       ARG  19  -2.557  -6.813   1.114
  146   1HD   ARG  19          2HD       ARG  19  -1.506  -5.596   2.800
  147   2HD   ARG  19          1HD       ARG  19  -2.819  -4.424   2.901
  148    HE   ARG  19           HE       ARG  19  -3.890  -5.805   4.377
  149   1HH1  ARG  19          1HH1      ARG  19  -1.407  -7.632   2.737
  150   2HH1  ARG  19          2HH1      ARG  19  -1.590  -9.025   3.750
  151   1HH2  ARG  19          1HH2      ARG  19  -4.133  -7.638   5.704
  152   2HH2  ARG  19          2HH2      ARG  19  -3.138  -9.030   5.432
  153    H    TRP  20           H        TRP  20  -3.917  -2.267   0.408
  154    HA   TRP  20           HA       TRP  20  -3.775  -0.987  -2.245
  155   1HB   TRP  20          2HB       TRP  20  -4.890   0.045   0.367
  156   2HB   TRP  20          1HB       TRP  20  -4.651   1.053  -1.056
  157    HD1  TRP  20           HD1      TRP  20  -6.792  -1.890   0.185
  158    HE1  TRP  20           HE1      TRP  20  -8.917  -2.006  -1.255
  159    HE3  TRP  20           HE3      TRP  20  -5.615   1.681  -3.273
  160    HZ2  TRP  20           HZ2      TRP  20  -9.957  -0.751  -3.555
  161    HZ3  TRP  20           HZ3      TRP  20  -7.231   2.164  -5.064
  162    HH2  TRP  20           HH2      TRP  20  -9.358   0.972  -5.203
  163    H    TYR  21           H        TYR  21  -2.363   0.753  -2.548
  164    HA   TYR  21           HA       TYR  21  -0.354   1.221  -0.452
  165   1HB   TYR  21          2HB       TYR  21   1.306   1.290  -2.516
  166   2HB   TYR  21          1HB       TYR  21   0.934  -0.235  -1.712
  167    HD1  TYR  21           HD1      TYR  21  -1.236  -1.425  -2.686
  168    HD2  TYR  21           HD2      TYR  21   1.214   1.305  -4.830
  169    HE1  TYR  21           HE1      TYR  21  -2.084  -2.327  -4.787
  170    HE2  TYR  21           HE2      TYR  21   0.366   0.401  -6.955
  171    HH   TYR  21           HH       TYR  21  -0.700  -1.676  -7.796
  172    H    PHE  22           H        PHE  22   0.857   3.221  -0.773
  173    HA   PHE  22           HA       PHE  22  -0.849   5.249  -1.974
  174   1HB   PHE  22          2HB       PHE  22   0.445   5.242   0.381
  175   2HB   PHE  22          1HB       PHE  22   1.667   6.030  -0.614
  176    HD1  PHE  22           HD2      PHE  22  -2.002   6.197   0.032
  177    HD2  PHE  22           HD1      PHE  22   1.595   8.312  -0.789
  178    HE1  PHE  22           HE2      PHE  22  -3.212   8.326   0.241
  179    HE2  PHE  22           HE1      PHE  22   0.394  10.446  -0.583
  180    HZ   PHE  22           HZ       PHE  22  -2.015  10.457  -0.070
  181    H    ASN  23           H        ASN  23  -0.518   5.242  -4.156
  182    HA   ASN  23           HA       ASN  23   2.098   5.069  -5.307
  183   1HB   ASN  23          2HB       ASN  23  -0.383   4.589  -6.282
  184   2HB   ASN  23          1HB       ASN  23  -0.093   6.193  -6.948
  185   1HD2  ASN  23          1HD2      ASN  23  -0.372   3.832  -8.458
  186   2HD2  ASN  23          2HD2      ASN  23   1.123   3.539  -9.271
  187    HN2  GLY  24           H        GLY  24   2.770   6.813  -6.939
  188   1HA   GLY  24          2HA       GLY  24   3.321   9.174  -5.501
  189   2HA   GLY  24          1HA       GLY  24   3.650   8.913  -7.204
  190    H    ARG  25           H        ARG  25   0.501   8.353  -7.230
  191    HA   ARG  25           HA       ARG  25  -0.316  11.164  -7.128
  192   1HB   ARG  25          2HB       ARG  25  -1.444  10.891  -9.355
  193   2HB   ARG  25          1HB       ARG  25   0.313  10.925  -9.404
  194   1HG   ARG  25          2HG       ARG  25  -1.097   8.302  -9.269
  195   2HG   ARG  25          1HG       ARG  25  -1.017   9.175 -10.800
  196   1HD   ARG  25          2HD       ARG  25   1.269   8.181  -9.113
  197   2HD   ARG  25          1HD       ARG  25   0.832   7.682 -10.746
  198    HE   ARG  25           HE       ARG  25   1.332  10.319 -11.032
  199   1HH1  ARG  25          1HH1      ARG  25   3.144   7.701  -9.603
  200   2HH1  ARG  25          2HH1      ARG  25   4.684   8.401  -9.970
  201   1HH2  ARG  25          1HH2      ARG  25   3.358  11.239 -11.518
  202   2HH2  ARG  25          2HH2      ARG  25   4.807  10.408 -11.058
  203    H    THR  26           H        THR  26  -1.023   8.082  -6.181
  204    HA   THR  26           HA       THR  26  -3.502   8.679  -5.099
  205    HB   THR  26           HB       THR  26  -4.517   8.849  -7.222
  206    HG1  THR  26           HG1      THR  26  -5.850   7.596  -6.045
  207   1HG2  THR  26          1HG2      THR  26  -2.553   6.950  -8.053
  208   2HG2  THR  26          2HG2      THR  26  -3.596   7.984  -9.028
  209   3HG2  THR  26          3HG2      THR  26  -4.162   6.394  -8.514
  210    H    CYS  27           H        CYS  27  -4.813   6.583  -4.616
  211    HA   CYS  27           HA       CYS  27  -2.890   4.661  -3.578
  212   1HB   CYS  27          2HB       CYS  27  -4.997   5.756  -2.372
  213   2HB   CYS  27          1HB       CYS  27  -5.817   4.374  -3.090
  214    H    ALA  28           H        ALA  28  -2.317   3.091  -4.911
  215    HA   ALA  28           HA       ALA  28  -4.177   2.051  -6.883
  216   1HB   ALA  28          1HB       ALA  28  -2.198   2.275  -7.956
  217   2HB   ALA  28          2HB       ALA  28  -1.994   0.625  -7.375
  218   3HB   ALA  28          3HB       ALA  28  -1.245   1.966  -6.507
  219    H    LYS  29           H        LYS  29  -3.846  -0.480  -7.233
  220    HA   LYS  29           HA       LYS  29  -4.010  -1.851  -4.652
  221   1HB   LYS  29          2HB       LYS  29  -6.284  -1.109  -5.847
  222   2HB   LYS  29          1HB       LYS  29  -6.015  -2.621  -6.701
  223   1HG   LYS  29          2HG       LYS  29  -5.604  -3.420  -4.157
  224   2HG   LYS  29          1HG       LYS  29  -6.789  -2.136  -3.909
  225   1HD   LYS  29          2HD       LYS  29  -7.821  -3.494  -6.057
  226   2HD   LYS  29          1HD       LYS  29  -7.111  -4.790  -5.090
  227   1HE   LYS  29          2HE       LYS  29  -8.427  -4.235  -3.208
  228   2HE   LYS  29          1HE       LYS  29  -8.909  -2.690  -3.906
  229   1HZ   LYS  29          1HZ       LYS  29 -10.493  -3.652  -5.168
  230   2HZ   LYS  29          2HZ       LYS  29 -10.443  -4.842  -3.967
  231   3HZ   LYS  29          3HZ       LYS  29  -9.611  -5.074  -5.421
  232    H    PHE  30           H        PHE  30  -3.420  -3.983  -4.645
  233    HA   PHE  30           HA       PHE  30  -2.962  -5.493  -7.026
  234   1HB   PHE  30          2HB       PHE  30  -0.518  -5.712  -6.777
  235   2HB   PHE  30          1HB       PHE  30  -0.998  -4.070  -7.172
  236    HD1  PHE  30           HD2      PHE  30  -1.786  -4.582  -3.786
  237    HD2  PHE  30           HD1      PHE  30   1.523  -3.936  -6.386
  238    HE1  PHE  30           HE2      PHE  30  -0.465  -3.758  -1.891
  239    HE2  PHE  30           HE1      PHE  30   2.848  -3.107  -4.490
  240    HZ   PHE  30           HZ       PHE  30   1.856  -3.019  -2.240
  241    H    ILE  31           H        ILE  31  -1.576  -7.565  -6.369
  242    HA   ILE  31           HA       ILE  31  -2.893  -8.582  -3.977
  243    HB   ILE  31           HB       ILE  31  -1.213 -10.027  -6.033
  244   1HG1  ILE  31          2HG1      ILE  31  -3.912 -10.908  -5.989
  245   2HG1  ILE  31          1HG1      ILE  31  -3.940  -9.148  -6.047
  246   1HG2  ILE  31          1HG2      ILE  31  -2.727 -11.010  -3.629
  247   2HG2  ILE  31          2HG2      ILE  31  -1.031 -11.269  -4.038
  248   3HG2  ILE  31          3HG2      ILE  31  -2.295 -12.066  -4.974
  249   1HD1  ILE  31          1HD1      ILE  31  -3.922 -10.457  -8.247
  250   2HD1  ILE  31          2HD1      ILE  31  -2.210 -10.717  -7.907
  251   3HD1  ILE  31          3HD1      ILE  31  -2.838  -9.078  -8.080
  252    H    TYR  32           H        TYR  32  -1.884  -8.072  -2.158
  253    HA   TYR  32           HA       TYR  32   1.012  -7.971  -2.029
  254   1HB   TYR  32          2HB       TYR  32  -0.548  -6.270  -0.951
  255   2HB   TYR  32          1HB       TYR  32  -0.913  -7.511   0.241
  256    HD1  TYR  32           HD2      TYR  32   1.903  -5.577  -1.229
  257    HD2  TYR  32           HD1      TYR  32   0.473  -7.804   2.101
  258    HE1  TYR  32           HE2      TYR  32   3.885  -4.906   0.063
  259    HE2  TYR  32           HE1      TYR  32   2.449  -7.139   3.403
  260    HH   TYR  32           HH       TYR  32   4.928  -6.380   2.732
  261    HN2  GLY  33           H        GLY  33   2.230  -9.597  -1.401
  262   1HA   GLY  33          2HA       GLY  33   0.987 -11.977  -0.267
  263   2HA   GLY  33          1HA       GLY  33   2.635 -11.846  -0.866
  264    HN2  GLY  34           H        GLY  34   3.238  -9.442   0.655
  265   1HA   GLY  34          2HA       GLY  34   2.985  -9.064   3.182
  266   2HA   GLY  34          1HA       GLY  34   3.553 -10.723   3.289
  267    H    CYS  35           H        CYS  35   5.386 -10.286   0.968
  268    HA   CYS  35           HA       CYS  35   7.447  -8.800   2.446
  269   1HB   CYS  35          2HB       CYS  35   9.108 -10.197   1.245
  270   2HB   CYS  35          1HB       CYS  35   8.029 -11.133   2.268
  271    HN2  GLY  36           H        GLY  36   8.646  -7.248   1.473
  272   1HA   GLY  36          2HA       GLY  36   9.529  -6.331  -0.651
  273   2HA   GLY  36          1HA       GLY  36   7.924  -6.589  -1.317
  274    HN2  GLY  37           H        GLY  37   6.542  -5.657   1.076
  275   1HA   GLY  37          2HA       GLY  37   6.730  -2.811   0.507
  276   2HA   GLY  37          1HA       GLY  37   5.477  -3.607   1.447
  277    H    ASN  38           H        ASN  38   5.749  -1.818   2.934
  278    HA   ASN  38           HA       ASN  38   7.384  -2.517   5.138
  279   1HB   ASN  38          2HB       ASN  38   8.557  -0.132   5.024
  280   2HB   ASN  38          1HB       ASN  38   9.280  -1.554   4.279
  281   1HD2  ASN  38          1HD2      ASN  38  10.307  -0.738   2.572
  282   2HD2  ASN  38          2HD2      ASN  38   9.572   0.202   1.323
  283    HN2  GLY  39           H        GLY  39   6.499   0.724   3.982
  284   1HA   GLY  39          2HA       GLY  39   4.442   0.825   6.097
  285   2HA   GLY  39          1HA       GLY  39   5.576   2.144   5.860
  286    H    ASN  40           H        ASN  40   5.012   1.046   2.841
  287    HA   ASN  40           HA       ASN  40   3.093   3.170   2.310
  288   1HB   ASN  40          2HB       ASN  40   5.068   3.055   0.896
  289   2HB   ASN  40          1HB       ASN  40   4.699   1.390   0.462
  290   1HD2  ASN  40          1HD2      ASN  40   3.653   4.719   0.158
  291   2HD2  ASN  40          2HD2      ASN  40   2.731   4.495  -1.285
  292    H    LYS  41           H        LYS  41   3.188  -0.261   2.590
  293    HA   LYS  41           HA       LYS  41   0.872  -0.796   0.987
  294   1HB   LYS  41          2HB       LYS  41   0.983  -3.047   2.144
  295   2HB   LYS  41          1HB       LYS  41   2.403  -2.589   1.216
  296   1HG   LYS  41          2HG       LYS  41   3.710  -2.749   2.998
  297   2HG   LYS  41          1HG       LYS  41   2.647  -1.705   3.945
  298   1HD   LYS  41          2HD       LYS  41   1.385  -3.504   4.731
  299   2HD   LYS  41          1HD       LYS  41   1.940  -4.576   3.444
  300   1HE   LYS  41          2HE       LYS  41   4.276  -4.242   4.510
  301   2HE   LYS  41          1HE       LYS  41   3.372  -3.687   5.919
  302   1HZ   LYS  41          1HZ       LYS  41   3.636  -6.363   4.823
  303   2HZ   LYS  41          2HZ       LYS  41   2.091  -5.951   5.373
  304   3HZ   LYS  41          3HZ       LYS  41   3.413  -5.864   6.425
  305    H    PHE  42           H        PHE  42  -1.190  -1.432   1.725
  306    HA   PHE  42           HA       PHE  42  -1.879  -1.110   4.513
  307   1HB   PHE  42          2HB       PHE  42  -3.067   0.739   2.432
  308   2HB   PHE  42          1HB       PHE  42  -3.570   0.631   4.116
  309    HD1  PHE  42           HD2      PHE  42  -1.630   0.994   5.863
  310    HD2  PHE  42           HD1      PHE  42  -1.567   2.370   1.837
  311    HE1  PHE  42           HE2      PHE  42   0.047   2.688   6.472
  312    HE2  PHE  42           HE1      PHE  42   0.112   4.065   2.438
  313    HZ   PHE  42           HZ       PHE  42   0.920   4.225   4.758
  314    HA   PRO  43           HA       PRO  43  -4.773  -4.266   3.437
  315   1HB   PRO  43          2HB       PRO  43  -6.597  -3.088   5.448
  316   2HB   PRO  43          1HB       PRO  43  -5.902  -4.710   5.373
  317   1HG   PRO  43          2HG       PRO  43  -5.043  -2.917   7.160
  318   2HG   PRO  43          1HG       PRO  43  -3.925  -4.053   6.381
  319   1HD   PRO  43          2HD       PRO  43  -4.389  -1.153   5.805
  320   2HD   PRO  43          1HD       PRO  43  -2.868  -2.068   5.839
  321    H    THR  44           H        THR  44  -6.311  -1.108   4.088
  322    HA   THR  44           HA       THR  44  -7.953  -1.522   1.683
  323    HB   THR  44           HB       THR  44  -9.588   0.041   3.107
  324    HG1  THR  44           HG1      THR  44  -9.524  -0.526   5.264
  325   1HG2  THR  44          1HG2      THR  44 -10.948  -1.780   3.525
  326   2HG2  THR  44          2HG2      THR  44  -9.584  -2.863   3.804
  327   3HG2  THR  44          3HG2      THR  44  -9.962  -2.322   2.168
  328    H    GLN  45           H        GLN  45  -8.786   0.491   0.734
  329    HA   GLN  45           HA       GLN  45  -6.700   2.388   0.394
  330   1HB   GLN  45          2HB       GLN  45  -8.530   1.666  -1.276
  331   2HB   GLN  45          1HB       GLN  45  -9.554   2.831  -0.448
  332   1HG   GLN  45          2HG       GLN  45  -7.472   4.409  -0.904
  333   2HG   GLN  45          1HG       GLN  45  -7.232   3.269  -2.227
  334   1HE2  GLN  45          1HE2      GLN  45  -8.595   6.121  -1.438
  335   2HE2  GLN  45          2HE2      GLN  45  -9.846   6.198  -2.627
  336    H    GLU  46           H        GLU  46  -9.580   2.269   2.359
  337    HA   GLU  46           HA       GLU  46  -9.782   5.009   2.979
  338   1HB   GLU  46          2HB       GLU  46 -11.281   2.810   3.530
  339   2HB   GLU  46          1HB       GLU  46 -10.541   3.101   5.099
  340   1HG   GLU  46          2HG       GLU  46 -11.396   5.385   5.085
  341   2HG   GLU  46          1HG       GLU  46 -12.131   5.102   3.508
  342    H    ALA  47           H        ALA  47  -7.483   2.663   3.914
  343    HA   ALA  47           HA       ALA  47  -6.737   4.045   6.361
  344   1HB   ALA  47          1HB       ALA  47  -6.405   1.847   6.784
  345   2HB   ALA  47          2HB       ALA  47  -4.818   2.202   6.103
  346   3HB   ALA  47          3HB       ALA  47  -6.062   1.459   5.098
  347    H    CYS  48           H        CYS  48  -5.563   3.604   3.069
  348    HA   CYS  48           HA       CYS  48  -3.027   4.825   3.514
  349   1HB   CYS  48          2HB       CYS  48  -2.719   4.710   1.152
  350   2HB   CYS  48          1HB       CYS  48  -3.589   3.256   1.621
  351    H    MET  49           H        MET  49  -6.197   6.028   2.660
  352    HA   MET  49           HA       MET  49  -5.167   8.674   2.040
  353   1HB   MET  49          2HB       MET  49  -7.783   7.294   1.794
  354   2HB   MET  49          1HB       MET  49  -7.824   9.038   2.018
  355   1HG   MET  49          2HG       MET  49  -5.992   8.910   0.084
  356   2HG   MET  49          1HG       MET  49  -6.889   7.437  -0.281
  357   1HE   MET  49          1HE       MET  49 -10.556   9.165  -0.274
  358   2HE   MET  49          2HE       MET  49  -9.624   8.313   0.959
  359   3HE   MET  49          3HE       MET  49  -9.803   7.615  -0.651
  360    H    LYS  50           H        LYS  50  -6.843   7.019   4.638
  361    HA   LYS  50           HA       LYS  50  -7.552   9.364   6.087
  362   1HB   LYS  50          2HB       LYS  50  -8.675   7.171   6.370
  363   2HB   LYS  50          1HB       LYS  50  -7.212   6.539   7.110
  364   1HG   LYS  50          2HG       LYS  50  -7.518   8.533   8.758
  365   2HG   LYS  50          1HG       LYS  50  -9.184   8.502   8.181
  366   1HD   LYS  50          2HD       LYS  50  -9.210   7.115  10.061
  367   2HD   LYS  50          1HD       LYS  50  -9.109   5.990   8.704
  368   1HE   LYS  50          2HE       LYS  50  -6.724   5.750   9.037
  369   2HE   LYS  50          1HE       LYS  50  -6.754   6.959  10.320
  370   1HZ   LYS  50          1HZ       LYS  50  -8.507   4.641  10.616
  371   2HZ   LYS  50          2HZ       LYS  50  -7.659   5.513  11.791
  372   3HZ   LYS  50          3HZ       LYS  50  -6.847   4.387  10.825
  373    H    ARG  51           H        ARG  51  -4.592   7.700   5.676
  374    HA   ARG  51           HA       ARG  51  -3.493   8.864   8.135
  375   1HB   ARG  51          2HB       ARG  51  -3.218   6.356   7.307
  376   2HB   ARG  51          1HB       ARG  51  -1.883   7.055   6.402
  377   1HG   ARG  51          2HG       ARG  51  -0.945   7.930   8.499
  378   2HG   ARG  51          1HG       ARG  51  -2.263   7.161   9.388
  379   1HD   ARG  51          2HD       ARG  51  -0.386   5.709   9.527
  380   2HD   ARG  51          1HD       ARG  51  -1.525   4.977   8.399
  381    HE   ARG  51           HE       ARG  51   0.109   6.378   6.774
  382   1HH1  ARG  51          1HH1      ARG  51   0.712   4.058   9.312
  383   2HH1  ARG  51          2HH1      ARG  51   2.179   3.476   8.603
  384   1HH2  ARG  51          1HH2      ARG  51   2.040   5.612   5.839
  385   2HH2  ARG  51          2HH2      ARG  51   2.933   4.356   6.631
  386    H    CYS  52           H        CYS  52  -3.238   8.968   4.644
  387    HA   CYS  52           HA       CYS  52  -1.015  10.877   4.861
  388   1HB   CYS  52          2HB       CYS  52  -1.239   8.739   3.223
  389   2HB   CYS  52          1HB       CYS  52  -1.917   9.992   2.189
  390    H    ALA  53           H        ALA  53  -4.287  10.523   3.583
  391    HA   ALA  53           HA       ALA  53  -4.298  13.211   2.509
  392   1HB   ALA  53          1HB       ALA  53  -6.161  12.616   1.385
  393   2HB   ALA  53          2HB       ALA  53  -6.848  11.754   2.762
  394   3HB   ALA  53          3HB       ALA  53  -5.611  10.984   1.767
  395    H    LYS  54           H        LYS  54  -5.369  11.551   5.384
  396    HA   LYS  54           HA       LYS  54  -6.972  13.791   6.281
  397   1HB   LYS  54          2HB       LYS  54  -6.871  11.035   6.865
  398   2HB   LYS  54          1HB       LYS  54  -6.438  11.865   8.353
  399   1HG   LYS  54          2HG       LYS  54  -8.923  12.356   6.725
  400   2HG   LYS  54          1HG       LYS  54  -8.831  11.434   8.227
  401   1HD   LYS  54          2HD       LYS  54  -7.626  14.001   8.617
  402   2HD   LYS  54          1HD       LYS  54  -9.228  14.212   7.906
  403   1HE   LYS  54          2HE       LYS  54  -8.996  12.261  10.119
  404   2HE   LYS  54          1HE       LYS  54  -8.810  13.963  10.541
  405   1HZ   LYS  54          1HZ       LYS  54 -11.079  13.124   8.870
  406   2HZ   LYS  54          2HZ       LYS  54 -10.953  14.444   9.917
  407   3HZ   LYS  54          3HZ       LYS  54 -11.147  12.885  10.544
  408    H    ALA  55           H        ALA  55  -4.186  12.027   7.653
  409    HA   ALA  55           HA       ALA  55  -3.506  14.362   9.255
  410   1HB   ALA  55          1HB       ALA  55  -2.546  11.521   9.208
  411   2HB   ALA  55          2HB       ALA  55  -3.355  12.398  10.508
  412   3HB   ALA  55          3HB       ALA  55  -1.680  12.771  10.102
  Start of MODEL    3
    1   1H    ILE   1          1H        ILE   1   4.794  13.604   4.292
    2   2H    ILE   1          2H        ILE   1   3.129  13.967   4.087
    3   3H    ILE   1          3H        ILE   1   4.237  14.257   2.809
    4    HA   ILE   1           HA       ILE   1   3.532  11.634   3.941
    5    HB   ILE   1           HB       ILE   1   2.542  11.261   1.673
    6   1HG1  ILE   1          2HG1      ILE   1   2.156  14.145   1.228
    7   2HG1  ILE   1          1HG1      ILE   1   3.811  13.591   0.994
    8   1HG2  ILE   1          1HG2      ILE   1   1.111  11.679   3.566
    9   2HG2  ILE   1          2HG2      ILE   1   0.459  12.502   2.149
   10   3HG2  ILE   1          3HG2      ILE   1   1.321  13.421   3.384
   11   1HD1  ILE   1          1HD1      ILE   1   2.842  13.426  -1.110
   12   2HD1  ILE   1          2HD1      ILE   1   1.335  12.773  -0.471
   13   3HD1  ILE   1          3HD1      ILE   1   2.790  11.776  -0.490
   14    H    ASP   2           H        ASP   2   5.829  11.244   4.155
   15    HA   ASP   2           HA       ASP   2   7.396  11.202   1.706
   16   1HB   ASP   2          2HB       ASP   2   8.153  10.397   4.524
   17   2HB   ASP   2          1HB       ASP   2   9.259  10.519   3.158
   18    H    THR   3           H        THR   3   5.951   8.961   4.008
   19    HA   THR   3           HA       THR   3   7.067   6.574   3.128
   20    HB   THR   3           HB       THR   3   4.200   6.841   4.017
   21    HG1  THR   3           HG1      THR   3   6.572   7.051   5.533
   22   1HG2  THR   3          1HG2      THR   3   4.717   4.590   3.524
   23   2HG2  THR   3          2HG2      THR   3   4.782   4.754   5.279
   24   3HG2  THR   3          3HG2      THR   3   6.276   4.697   4.342
   25    H    CYS   4           H        CYS   4   4.634   8.569   1.660
   26    HA   CYS   4           HA       CYS   4   3.568   6.580  -0.085
   27   1HB   CYS   4          2HB       CYS   4   3.489   9.599  -0.189
   28   2HB   CYS   4          1HB       CYS   4   2.623   8.557  -1.313
   29    H    ARG   5           H        ARG   5   6.552   8.110  -0.031
   30    HA   ARG   5           HA       ARG   5   6.883   8.143  -2.923
   31   1HB   ARG   5          2HB       ARG   5   8.628   9.010  -0.629
   32   2HB   ARG   5          1HB       ARG   5   9.232   8.931  -2.278
   33   1HG   ARG   5          2HG       ARG   5   8.176  10.807  -2.887
   34   2HG   ARG   5          1HG       ARG   5   6.713  10.392  -1.992
   35   1HD   ARG   5          2HD       ARG   5   8.395  10.885   0.050
   36   2HD   ARG   5          1HD       ARG   5   9.065  11.971  -1.166
   37    HE   ARG   5           HE       ARG   5   6.540  12.228   0.197
   38   1HH1  ARG   5          1HH1      ARG   5   8.397  13.136  -2.617
   39   2HH1  ARG   5          2HH1      ARG   5   7.472  14.569  -2.919
   40   1HH2  ARG   5          1HH2      ARG   5   5.323  14.112  -0.202
   41   2HH2  ARG   5          2HH2      ARG   5   5.728  15.123  -1.549
   42    H    LEU   6           H        LEU   6   7.425   6.021  -0.297
   43    HA   LEU   6           HA       LEU   6   9.320   4.437  -1.899
   44   1HB   LEU   6          2HB       LEU   6   9.580   3.234   0.416
   45   2HB   LEU   6          1HB       LEU   6  10.439   4.724   0.075
   46    HG   LEU   6           HG       LEU   6   7.775   4.890   1.413
   47   1HD1  LEU   6          1HD1      LEU   6  10.225   3.691   2.556
   48   2HD1  LEU   6          2HD1      LEU   6   8.530   3.422   2.962
   49   3HD1  LEU   6          3HD1      LEU   6   9.362   4.858   3.558
   50   1HD2  LEU   6          1HD2      LEU   6  10.340   6.470   1.514
   51   2HD2  LEU   6          2HD2      LEU   6   8.938   6.795   2.532
   52   3HD2  LEU   6          3HD2      LEU   6   8.810   6.953   0.781
   53    HA   PRO   7           HA       PRO   7   5.219   2.267  -2.438
   54   1HB   PRO   7          2HB       PRO   7   7.074   1.005  -4.413
   55   2HB   PRO   7          1HB       PRO   7   5.375   1.457  -4.597
   56   1HG   PRO   7          2HG       PRO   7   7.311   2.964  -5.640
   57   2HG   PRO   7          1HG       PRO   7   5.867   3.696  -4.919
   58   1HD   PRO   7          2HD       PRO   7   8.642   3.564  -3.876
   59   2HD   PRO   7          1HD       PRO   7   7.385   4.784  -3.603
   60    H    SER   8           H        SER   8   4.620   0.229  -1.775
   61    HA   SER   8           HA       SER   8   6.679  -1.305  -0.379
   62   1HB   SER   8          2HB       SER   8   3.763  -0.941  -0.083
   63   2HB   SER   8          1HB       SER   8   4.353  -2.571   0.236
   64    HG   SER   8           HG       SER   8   5.134  -1.876   2.047
   65    H    ASP   9           H        ASP   9   6.780  -3.618  -0.558
   66    HA   ASP   9           HA       ASP   9   6.358  -4.499  -3.302
   67   1HB   ASP   9          2HB       ASP   9   7.765  -5.938  -1.046
   68   2HB   ASP   9          1HB       ASP   9   7.827  -6.349  -2.756
   69    H    ARG  10           H        ARG  10   5.135  -6.251  -3.906
   70    HA   ARG  10           HA       ARG  10   3.027  -6.995  -2.053
   71   1HB   ARG  10          2HB       ARG  10   1.953  -7.980  -4.038
   72   2HB   ARG  10          1HB       ARG  10   2.381  -6.293  -4.279
   73   1HG   ARG  10          2HG       ARG  10   4.503  -7.187  -5.397
   74   2HG   ARG  10          1HG       ARG  10   3.662  -8.737  -5.442
   75   1HD   ARG  10          2HD       ARG  10   2.477  -6.196  -6.530
   76   2HD   ARG  10          1HD       ARG  10   3.457  -7.290  -7.506
   77    HE   ARG  10           HE       ARG  10   1.285  -8.595  -6.164
   78   1HH1  ARG  10          1HH1      ARG  10   2.212  -6.787  -9.004
   79   2HH1  ARG  10          2HH1      ARG  10   0.934  -7.424  -9.984
   80   1HH2  ARG  10          1HH2      ARG  10  -0.402  -9.437  -7.459
   81   2HH2  ARG  10          2HH2      ARG  10  -0.549  -8.928  -9.108
   82    HN2  GLY  11           H        GLY  11   6.023  -8.195  -2.625
   83   1HA   GLY  11          2HA       GLY  11   6.923 -10.362  -2.751
   84   2HA   GLY  11          1HA       GLY  11   6.128 -10.374  -1.190
   85    H    ARG  12           H        ARG  12   5.877 -11.376  -4.546
   86    HA   ARG  12           HA       ARG  12   3.396 -12.561  -4.591
   87   1HB   ARG  12          2HB       ARG  12   4.633 -14.350  -6.083
   88   2HB   ARG  12          1HB       ARG  12   4.418 -12.698  -6.640
   89   1HG   ARG  12          2HG       ARG  12   6.608 -12.370  -6.774
   90   2HG   ARG  12          1HG       ARG  12   6.872 -12.982  -5.143
   91   1HD   ARG  12          2HD       ARG  12   6.245 -15.199  -6.785
   92   2HD   ARG  12          1HD       ARG  12   7.439 -14.230  -7.647
   93    HE   ARG  12           HE       ARG  12   8.222 -14.564  -4.955
   94   1HH1  ARG  12          1HH1      ARG  12   7.966 -16.329  -7.954
   95   2HH1  ARG  12          2HH1      ARG  12   9.247 -17.426  -7.564
   96   1HH2  ARG  12          1HH2      ARG  12   9.909 -16.005  -4.439
   97   2HH2  ARG  12          2HH2      ARG  12  10.351 -17.242  -5.568
   98    H    CYS  13           H        CYS  13   6.375 -14.430  -3.956
   99    HA   CYS  13           HA       CYS  13   6.667 -16.420  -2.864
  100   1HB   CYS  13          2HB       CYS  13   4.932 -15.097  -0.773
  101   2HB   CYS  13          1HB       CYS  13   6.207 -16.283  -0.511
  102    H    LYS  14           H        LYS  14   4.976 -17.714  -0.947
  103    HA   LYS  14           HA       LYS  14   3.138 -18.987  -2.792
  104   1HB   LYS  14          2HB       LYS  14   4.540 -19.730  -0.355
  105   2HB   LYS  14          1HB       LYS  14   2.854 -20.224  -0.316
  106   1HG   LYS  14          2HG       LYS  14   4.048 -22.040  -1.212
  107   2HG   LYS  14          1HG       LYS  14   3.234 -21.274  -2.577
  108   1HD   LYS  14          2HD       LYS  14   5.529 -19.934  -2.689
  109   2HD   LYS  14          1HD       LYS  14   6.124 -21.399  -1.907
  110   1HE   LYS  14          2HE       LYS  14   6.343 -22.130  -4.027
  111   2HE   LYS  14          1HE       LYS  14   4.622 -22.479  -3.868
  112   1HZ   LYS  14          1HZ       LYS  14   5.604 -21.050  -5.849
  113   2HZ   LYS  14          2HZ       LYS  14   5.350 -19.795  -4.744
  114   3HZ   LYS  14          3HZ       LYS  14   4.057 -20.776  -5.221
  115    H    ALA  15           H        ALA  15   2.780 -16.274  -1.185
  116    HA   ALA  15           HA       ALA  15   0.087 -16.890  -0.176
  117   1HB   ALA  15          1HB       ALA  15   2.170 -14.958   0.670
  118   2HB   ALA  15          2HB       ALA  15   1.058 -15.924   1.640
  119   3HB   ALA  15          3HB       ALA  15   0.485 -14.465   0.832
  120    H    SER  16           H        SER  16  -1.492 -15.039  -0.417
  121    HA   SER  16           HA       SER  16  -1.092 -13.207  -2.582
  122   1HB   SER  16          2HB       SER  16  -2.872 -14.127  -4.041
  123   2HB   SER  16          1HB       SER  16  -1.499 -15.223  -3.894
  124    HG   SER  16           HG       SER  16  -2.704 -16.393  -2.341
  125    H    PHE  17           H        PHE  17  -1.813 -11.571  -1.294
  126    HA   PHE  17           HA       PHE  17  -4.669 -11.632  -0.610
  127   1HB   PHE  17          2HB       PHE  17  -2.408 -10.783   1.205
  128   2HB   PHE  17          1HB       PHE  17  -4.092 -10.359   1.500
  129    HD1  PHE  17           HD2      PHE  17  -1.733 -13.186   1.199
  130    HD2  PHE  17           HD1      PHE  17  -5.586 -11.900   2.469
  131    HE1  PHE  17           HE2      PHE  17  -2.067 -15.335   2.351
  132    HE2  PHE  17           HE1      PHE  17  -5.927 -14.046   3.622
  133    HZ   PHE  17           HZ       PHE  17  -4.167 -15.768   3.564
  134    H    GLU  18           H        GLU  18  -5.697  -9.964  -1.484
  135    HA   GLU  18           HA       GLU  18  -4.303  -7.874  -2.812
  136   1HB   GLU  18          2HB       GLU  18  -6.840  -8.941  -2.955
  137   2HB   GLU  18          1HB       GLU  18  -7.131  -7.360  -2.244
  138   1HG   GLU  18          2HG       GLU  18  -6.207  -6.242  -4.097
  139   2HG   GLU  18          1HG       GLU  18  -5.490  -7.722  -4.729
  140    H    ARG  19           H        ARG  19  -3.602  -5.985  -2.052
  141    HA   ARG  19           HA       ARG  19  -4.861  -4.843   0.332
  142   1HB   ARG  19          2HB       ARG  19  -1.863  -5.004   0.049
  143   2HB   ARG  19          1HB       ARG  19  -2.785  -4.481   1.452
  144   1HG   ARG  19          2HG       ARG  19  -2.977  -7.275   0.374
  145   2HG   ARG  19          1HG       ARG  19  -1.743  -6.793   1.539
  146   1HD   ARG  19          2HD       ARG  19  -4.552  -6.079   2.154
  147   2HD   ARG  19          1HD       ARG  19  -4.105  -7.779   2.275
  148    HE   ARG  19           HE       ARG  19  -2.296  -6.001   3.630
  149   1HH1  ARG  19          1HH1      ARG  19  -5.245  -7.847   3.907
  150   2HH1  ARG  19          2HH1      ARG  19  -5.161  -7.956   5.634
  151   1HH2  ARG  19          1HH2      ARG  19  -2.183  -6.145   5.899
  152   2HH2  ARG  19          2HH2      ARG  19  -3.423  -6.989   6.765
  153    H    TRP  20           H        TRP  20  -3.808  -2.589   0.767
  154    HA   TRP  20           HA       TRP  20  -3.650  -1.197  -1.823
  155   1HB   TRP  20          2HB       TRP  20  -4.722  -0.260   0.843
  156   2HB   TRP  20          1HB       TRP  20  -4.503   0.794  -0.550
  157    HD1  TRP  20           HD1      TRP  20  -6.750  -1.988   0.776
  158    HE1  TRP  20           HE1      TRP  20  -8.857  -2.124  -0.690
  159    HE3  TRP  20           HE3      TRP  20  -5.356   1.232  -2.939
  160    HZ2  TRP  20           HZ2      TRP  20  -9.802  -1.018  -3.100
  161    HZ3  TRP  20           HZ3      TRP  20  -6.922   1.638  -4.792
  162    HH2  TRP  20           HH2      TRP  20  -9.101   0.535  -4.872
  163    H    TYR  21           H        TYR  21  -2.247   0.585  -2.038
  164    HA   TYR  21           HA       TYR  21  -0.302   1.133   0.053
  165   1HB   TYR  21          2HB       TYR  21   1.576   0.764  -1.696
  166   2HB   TYR  21          1HB       TYR  21   0.899  -0.656  -0.902
  167    HD1  TYR  21           HD2      TYR  21  -1.075  -1.800  -2.135
  168    HD2  TYR  21           HD1      TYR  21   1.700   0.805  -4.024
  169    HE1  TYR  21           HE2      TYR  21  -1.685  -2.738  -4.306
  170    HE2  TYR  21           HE1      TYR  21   1.084  -0.124  -6.219
  171    HH   TYR  21           HH       TYR  21  -0.649  -2.945  -6.608
  172    H    PHE  22           H        PHE  22   1.175   2.939  -0.608
  173    HA   PHE  22           HA       PHE  22  -0.361   4.981  -1.934
  174   1HB   PHE  22          2HB       PHE  22   2.505   5.154  -0.990
  175   2HB   PHE  22          1HB       PHE  22   1.405   6.490  -1.301
  176    HD1  PHE  22           HD2      PHE  22  -0.855   6.335   0.116
  177    HD2  PHE  22           HD1      PHE  22   2.864   4.568   1.186
  178    HE1  PHE  22           HE2      PHE  22  -1.547   6.313   2.474
  179    HE2  PHE  22           HE1      PHE  22   2.175   4.539   3.548
  180    HZ   PHE  22           HZ       PHE  22  -0.035   5.413   4.194
  181    H    ASN  23           H        ASN  23   0.019   5.959  -3.871
  182    HA   ASN  23           HA       ASN  23   2.218   4.938  -5.525
  183   1HB   ASN  23          2HB       ASN  23  -0.069   3.835  -5.998
  184   2HB   ASN  23          1HB       ASN  23  -0.523   5.393  -6.684
  185   1HD2  ASN  23          1HD2      ASN  23  -0.688   4.775  -8.775
  186   2HD2  ASN  23          2HD2      ASN  23   0.645   4.222  -9.726
  187    HN2  GLY  24           H        GLY  24   2.878   7.132  -4.535
  188   1HA   GLY  24          2HA       GLY  24   3.630   9.223  -5.219
  189   2HA   GLY  24          1HA       GLY  24   2.589   9.105  -6.630
  190    H    ARG  25           H        ARG  25   0.322   9.580  -6.371
  191    HA   ARG  25           HA       ARG  25  -0.182  11.397  -4.105
  192   1HB   ARG  25          2HB       ARG  25  -1.766  12.579  -5.622
  193   2HB   ARG  25          1HB       ARG  25  -0.092  12.656  -6.152
  194   1HG   ARG  25          2HG       ARG  25  -1.162  10.387  -7.387
  195   2HG   ARG  25          1HG       ARG  25  -2.401  11.635  -7.521
  196   1HD   ARG  25          2HD       ARG  25  -0.757  11.564  -9.413
  197   2HD   ARG  25          1HD       ARG  25  -0.902  13.125  -8.607
  198    HE   ARG  25           HE       ARG  25   1.211  11.473  -7.570
  199   1HH1  ARG  25          1HH1      ARG  25   0.343  13.825  -9.999
  200   2HH1  ARG  25          2HH1      ARG  25   1.971  14.369 -10.233
  201   1HH2  ARG  25          1HH2      ARG  25   3.353  12.188  -7.878
  202   2HH2  ARG  25          2HH2      ARG  25   3.679  13.439  -9.031
  203    H    THR  26           H        THR  26  -1.407   8.770  -6.045
  204    HA   THR  26           HA       THR  26  -3.775   8.618  -4.298
  205    HB   THR  26           HB       THR  26  -4.372   8.991  -6.638
  206    HG1  THR  26           HG1      THR  26  -5.811   7.327  -6.787
  207   1HG2  THR  26          1HG2      THR  26  -3.392   8.028  -8.366
  208   2HG2  THR  26          2HG2      THR  26  -3.682   6.419  -7.707
  209   3HG2  THR  26          3HG2      THR  26  -2.235   7.314  -7.243
  210    H    CYS  27           H        CYS  27  -4.641   6.253  -4.286
  211    HA   CYS  27           HA       CYS  27  -2.479   4.609  -3.252
  212   1HB   CYS  27          2HB       CYS  27  -5.007   5.065  -2.354
  213   2HB   CYS  27          1HB       CYS  27  -5.230   3.545  -3.212
  214    H    ALA  28           H        ALA  28  -2.852   2.149  -3.635
  215    HA   ALA  28           HA       ALA  28  -3.640   1.545  -6.374
  216   1HB   ALA  28          1HB       ALA  28  -1.386   0.283  -6.597
  217   2HB   ALA  28          2HB       ALA  28  -0.837   1.417  -5.363
  218   3HB   ALA  28          3HB       ALA  28  -1.451   2.016  -6.903
  219    H    LYS  29           H        LYS  29  -3.125  -0.965  -6.754
  220    HA   LYS  29           HA       LYS  29  -3.604  -2.482  -4.305
  221   1HB   LYS  29          2HB       LYS  29  -5.765  -1.669  -5.680
  222   2HB   LYS  29          1HB       LYS  29  -5.413  -3.154  -6.553
  223   1HG   LYS  29          2HG       LYS  29  -5.462  -4.380  -4.405
  224   2HG   LYS  29          1HG       LYS  29  -5.935  -2.883  -3.600
  225   1HD   LYS  29          2HD       LYS  29  -7.764  -2.977  -5.589
  226   2HD   LYS  29          1HD       LYS  29  -7.507  -4.700  -5.306
  227   1HE   LYS  29          2HE       LYS  29  -7.801  -3.101  -2.867
  228   2HE   LYS  29          1HE       LYS  29  -9.229  -3.118  -3.900
  229   1HZ   LYS  29          1HZ       LYS  29  -7.834  -5.611  -3.137
  230   2HZ   LYS  29          2HZ       LYS  29  -9.406  -5.426  -3.732
  231   3HZ   LYS  29          3HZ       LYS  29  -9.034  -4.930  -2.158
  232    H    PHE  30           H        PHE  30  -2.917  -4.568  -4.351
  233    HA   PHE  30           HA       PHE  30  -2.315  -5.960  -6.779
  234   1HB   PHE  30          2HB       PHE  30   0.132  -6.267  -6.211
  235   2HB   PHE  30          1HB       PHE  30  -0.309  -4.687  -6.834
  236    HD1  PHE  30           HD2      PHE  30  -1.285  -5.263  -3.411
  237    HD2  PHE  30           HD1      PHE  30   1.928  -4.011  -5.907
  238    HE1  PHE  30           HE2      PHE  30  -0.192  -4.227  -1.475
  239    HE2  PHE  30           HE1      PHE  30   3.026  -2.971  -3.970
  240    HZ   PHE  30           HZ       PHE  30   1.967  -3.079  -1.751
  241    H    ILE  31           H        ILE  31  -0.984  -8.057  -6.158
  242    HA   ILE  31           HA       ILE  31  -2.438  -9.235  -3.927
  243    HB   ILE  31           HB       ILE  31  -0.573 -10.543  -5.911
  244   1HG1  ILE  31          2HG1      ILE  31  -2.577  -9.541  -6.969
  245   2HG1  ILE  31          1HG1      ILE  31  -2.573 -11.299  -7.070
  246   1HG2  ILE  31          1HG2      ILE  31  -0.822 -12.451  -4.796
  247   2HG2  ILE  31          2HG2      ILE  31  -2.571 -12.246  -4.702
  248   3HG2  ILE  31          3HG2      ILE  31  -1.529 -11.506  -3.486
  249   1HD1  ILE  31          1HD1      ILE  31  -4.349  -9.486  -5.541
  250   2HD1  ILE  31          2HD1      ILE  31  -3.992 -11.073  -4.858
  251   3HD1  ILE  31          3HD1      ILE  31  -4.729 -10.944  -6.455
  252    H    TYR  32           H        TYR  32  -1.438  -8.483  -2.088
  253    HA   TYR  32           HA       TYR  32   1.445  -8.704  -1.822
  254   1HB   TYR  32          2HB       TYR  32   0.337  -6.710  -0.932
  255   2HB   TYR  32          1HB       TYR  32  -0.646  -7.714   0.127
  256    HD1  TYR  32           HD1      TYR  32   2.935  -8.333  -0.496
  257    HD2  TYR  32           HD2      TYR  32   0.062  -6.699   2.181
  258    HE1  TYR  32           HE1      TYR  32   4.660  -8.172   1.248
  259    HE2  TYR  32           HE2      TYR  32   1.779  -6.533   3.931
  260    HH   TYR  32           HH       TYR  32   4.174  -6.431   4.158
  261    HN2  GLY  33           H        GLY  33   1.949 -10.845  -1.714
  262   1HA   GLY  33          2HA       GLY  33   0.537 -12.796  -0.252
  263   2HA   GLY  33          1HA       GLY  33   2.212 -12.925  -0.769
  264    HN2  GLY  34           H        GLY  34   2.857 -10.410   0.740
  265   1HA   GLY  34          2HA       GLY  34   2.697  -9.873   3.165
  266   2HA   GLY  34          1HA       GLY  34   2.856 -11.600   3.444
  267    H    CYS  35           H        CYS  35   4.801 -10.656   0.866
  268    HA   CYS  35           HA       CYS  35   7.139 -10.547   2.649
  269   1HB   CYS  35          2HB       CYS  35   7.450 -11.221  -0.241
  270   2HB   CYS  35          1HB       CYS  35   8.367 -11.784   1.148
  271    HN2  GLY  36           H        GLY  36   7.972  -8.594   2.865
  272   1HA   GLY  36          2HA       GLY  36   9.150  -6.721   2.044
  273   2HA   GLY  36          1HA       GLY  36   8.369  -6.941   0.486
  274    HN2  GLY  37           H        GLY  37   8.012  -5.668   3.731
  275   1HA   GLY  37          2HA       GLY  37   6.117  -3.706   2.734
  276   2HA   GLY  37          1HA       GLY  37   5.486  -4.803   3.952
  277    H    ASN  38           H        ASN  38   6.579  -1.805   3.607
  278    HA   ASN  38           HA       ASN  38   7.875  -1.770   6.253
  279   1HB   ASN  38          2HB       ASN  38   8.695   0.575   5.273
  280   2HB   ASN  38          1HB       ASN  38   9.580  -0.919   4.988
  281   1HD2  ASN  38          1HD2      ASN  38  10.476  -0.158   3.084
  282   2HD2  ASN  38          2HD2      ASN  38   9.554   0.031   1.636
  283    HN2  GLY  39           H        GLY  39   6.721   1.023   4.422
  284   1HA   GLY  39          2HA       GLY  39   4.561   1.349   6.404
  285   2HA   GLY  39          1HA       GLY  39   5.649   2.677   6.029
  286    H    ASN  40           H        ASN  40   5.256   1.036   3.208
  287    HA   ASN  40           HA       ASN  40   3.337   2.994   2.240
  288   1HB   ASN  40          2HB       ASN  40   5.558   2.419   1.100
  289   2HB   ASN  40          1HB       ASN  40   4.778   0.928   0.587
  290   1HD2  ASN  40          1HD2      ASN  40   5.364   4.123  -0.160
  291   2HD2  ASN  40          2HD2      ASN  40   4.210   4.312  -1.431
  292    H    LYS  41           H        LYS  41   3.497  -0.352   3.055
  293    HA   LYS  41           HA       LYS  41   1.267  -1.185   1.454
  294   1HB   LYS  41          2HB       LYS  41   1.408  -3.269   2.816
  295   2HB   LYS  41          1HB       LYS  41   2.923  -2.825   2.041
  296   1HG   LYS  41          2HG       LYS  41   3.966  -2.388   4.005
  297   2HG   LYS  41          1HG       LYS  41   2.485  -1.850   4.799
  298   1HD   LYS  41          2HD       LYS  41   2.768  -4.721   4.036
  299   2HD   LYS  41          1HD       LYS  41   3.612  -4.123   5.466
  300   1HE   LYS  41          2HE       LYS  41   0.741  -3.431   5.149
  301   2HE   LYS  41          1HE       LYS  41   1.146  -5.090   5.588
  302   1HZ   LYS  41          1HZ       LYS  41   2.509  -4.116   7.427
  303   2HZ   LYS  41          2HZ       LYS  41   0.840  -3.894   7.586
  304   3HZ   LYS  41          3HZ       LYS  41   1.818  -2.613   7.071
  305    H    PHE  42           H        PHE  42  -0.796  -1.798   2.193
  306    HA   PHE  42           HA       PHE  42  -1.652  -1.237   4.871
  307   1HB   PHE  42          2HB       PHE  42  -2.183   0.701   2.667
  308   2HB   PHE  42          1HB       PHE  42  -3.477   0.391   3.821
  309    HD1  PHE  42           HD2      PHE  42  -3.075   0.825   6.248
  310    HD2  PHE  42           HD1      PHE  42  -0.339   2.050   3.228
  311    HE1  PHE  42           HE2      PHE  42  -2.043   2.402   7.829
  312    HE2  PHE  42           HE1      PHE  42   0.700   3.629   4.804
  313    HZ   PHE  42           HZ       PHE  42  -0.154   3.807   7.107
  314    HA   PRO  43           HA       PRO  43  -4.592  -4.292   3.620
  315   1HB   PRO  43          2HB       PRO  43  -6.442  -4.033   5.569
  316   2HB   PRO  43          1HB       PRO  43  -4.837  -4.708   5.872
  317   1HG   PRO  43          2HG       PRO  43  -5.857  -1.940   6.393
  318   2HG   PRO  43          1HG       PRO  43  -4.858  -2.978   7.430
  319   1HD   PRO  43          2HD       PRO  43  -3.830  -0.973   5.906
  320   2HD   PRO  43          1HD       PRO  43  -2.922  -2.445   6.310
  321    H    THR  44           H        THR  44  -5.976  -1.120   4.482
  322    HA   THR  44           HA       THR  44  -7.921  -1.488   2.299
  323    HB   THR  44           HB       THR  44  -9.308   0.182   3.792
  324    HG1  THR  44           HG1      THR  44  -7.718  -1.174   5.707
  325   1HG2  THR  44          1HG2      THR  44  -9.291  -2.543   4.950
  326   2HG2  THR  44          2HG2      THR  44  -9.680  -2.368   3.239
  327   3HG2  THR  44          3HG2      THR  44 -10.644  -1.526   4.452
  328    H    GLN  45           H        GLN  45  -8.578   0.401   1.173
  329    HA   GLN  45           HA       GLN  45  -6.474   2.213   0.635
  330   1HB   GLN  45          2HB       GLN  45  -8.324   1.455  -0.945
  331   2HB   GLN  45          1HB       GLN  45  -9.367   2.605  -0.122
  332   1HG   GLN  45          2HG       GLN  45  -7.437   4.284  -0.688
  333   2HG   GLN  45          1HG       GLN  45  -7.061   3.094  -1.933
  334   1HE2  GLN  45          1HE2      GLN  45  -7.589   4.601  -3.543
  335   2HE2  GLN  45          2HE2      GLN  45  -9.231   4.987  -3.917
  336    H    GLU  46           H        GLU  46  -9.207   2.302   2.781
  337    HA   GLU  46           HA       GLU  46  -9.418   5.066   3.183
  338   1HB   GLU  46          2HB       GLU  46 -10.986   3.224   3.994
  339   2HB   GLU  46          1HB       GLU  46  -9.859   2.989   5.324
  340   1HG   GLU  46          2HG       GLU  46 -10.923   5.717   4.788
  341   2HG   GLU  46          1HG       GLU  46 -11.948   4.529   5.593
  342    H    ALA  47           H        ALA  47  -7.218   2.680   4.502
  343    HA   ALA  47           HA       ALA  47  -6.151   4.329   6.560
  344   1HB   ALA  47          1HB       ALA  47  -6.033   1.745   6.243
  345   2HB   ALA  47          2HB       ALA  47  -4.695   2.600   7.010
  346   3HB   ALA  47          3HB       ALA  47  -4.577   2.116   5.319
  347    H    CYS  48           H        CYS  48  -5.121   3.567   3.248
  348    HA   CYS  48           HA       CYS  48  -2.754   5.149   3.397
  349   1HB   CYS  48          2HB       CYS  48  -2.475   4.692   1.067
  350   2HB   CYS  48          1HB       CYS  48  -3.114   3.231   1.806
  351    H    MET  49           H        MET  49  -6.014   5.688   2.142
  352    HA   MET  49           HA       MET  49  -5.488   8.239   1.029
  353   1HB   MET  49          2HB       MET  49  -7.822   6.543   1.501
  354   2HB   MET  49          1HB       MET  49  -8.176   8.259   1.652
  355   1HG   MET  49          2HG       MET  49  -6.574   7.541  -0.693
  356   2HG   MET  49          1HG       MET  49  -8.201   6.864  -0.670
  357   1HE   MET  49          1HE       MET  49  -6.660   8.811  -2.564
  358   2HE   MET  49          2HE       MET  49  -6.216  10.227  -1.611
  359   3HE   MET  49          3HE       MET  49  -7.503  10.340  -2.811
  360    H    LYS  50           H        LYS  50  -5.862   7.186   4.254
  361    HA   LYS  50           HA       LYS  50  -6.724   9.783   5.235
  362   1HB   LYS  50          2HB       LYS  50  -7.581   7.663   6.229
  363   2HB   LYS  50          1HB       LYS  50  -5.954   7.315   6.799
  364   1HG   LYS  50          2HG       LYS  50  -6.916   8.231   8.668
  365   2HG   LYS  50          1HG       LYS  50  -6.148   9.643   7.942
  366   1HD   LYS  50          2HD       LYS  50  -8.649   9.553   6.750
  367   2HD   LYS  50          1HD       LYS  50  -8.959   9.095   8.426
  368   1HE   LYS  50          2HE       LYS  50  -7.517  11.571   7.483
  369   2HE   LYS  50          1HE       LYS  50  -9.151  11.503   8.142
  370   1HZ   LYS  50          1HZ       LYS  50  -8.375  11.094  10.256
  371   2HZ   LYS  50          2HZ       LYS  50  -7.192  12.150   9.668
  372   3HZ   LYS  50          3HZ       LYS  50  -6.886  10.489   9.727
  373    H    ARG  51           H        ARG  51  -3.789   8.088   4.667
  374    HA   ARG  51           HA       ARG  51  -2.326   9.967   6.391
  375   1HB   ARG  51          2HB       ARG  51  -1.968   7.139   5.742
  376   2HB   ARG  51          1HB       ARG  51  -0.488   8.075   5.577
  377   1HG   ARG  51          2HG       ARG  51  -2.217   7.861   8.033
  378   2HG   ARG  51          1HG       ARG  51  -0.622   7.145   7.791
  379   1HD   ARG  51          2HD       ARG  51  -1.350  10.042   8.098
  380   2HD   ARG  51          1HD       ARG  51  -0.249   9.080   9.078
  381    HE   ARG  51           HE       ARG  51   0.312  10.310   6.507
  382   1HH1  ARG  51          1HH1      ARG  51   1.361   8.080   8.985
  383   2HH1  ARG  51          2HH1      ARG  51   3.021   8.136   8.504
  384   1HH2  ARG  51          1HH2      ARG  51   2.497  10.377   5.875
  385   2HH2  ARG  51          2HH2      ARG  51   3.668   9.437   6.739
  386    H    CYS  52           H        CYS  52  -2.852   9.008   3.110
  387    HA   CYS  52           HA       CYS  52  -0.534  10.568   2.214
  388   1HB   CYS  52          2HB       CYS  52  -1.277   8.152   1.360
  389   2HB   CYS  52          1HB       CYS  52  -2.260   9.121   0.269
  390    H    ALA  53           H        ALA  53  -3.982  10.667   2.396
  391    HA   ALA  53           HA       ALA  53  -4.121  12.863   0.467
  392   1HB   ALA  53          1HB       ALA  53  -6.319  12.389   0.181
  393   2HB   ALA  53          2HB       ALA  53  -6.559  11.943   1.870
  394   3HB   ALA  53          3HB       ALA  53  -5.794  10.807   0.758
  395    H    LYS  54           H        LYS  54  -5.234  12.174   3.790
  396    HA   LYS  54           HA       LYS  54  -5.648  14.981   4.310
  397   1HB   LYS  54          2HB       LYS  54  -7.008  13.018   5.267
  398   2HB   LYS  54          1HB       LYS  54  -5.666  12.799   6.383
  399   1HG   LYS  54          2HG       LYS  54  -6.254  14.560   7.630
  400   2HG   LYS  54          1HG       LYS  54  -6.647  15.550   6.223
  401   1HD   LYS  54          2HD       LYS  54  -8.414  13.316   7.195
  402   2HD   LYS  54          1HD       LYS  54  -8.575  14.978   7.761
  403   1HE   LYS  54          2HE       LYS  54  -8.651  14.211   4.852
  404   2HE   LYS  54          1HE       LYS  54 -10.093  14.306   5.861
  405   1HZ   LYS  54          1HZ       LYS  54  -8.985  16.671   6.357
  406   2HZ   LYS  54          2HZ       LYS  54 -10.109  16.413   5.120
  407   3HZ   LYS  54          3HZ       LYS  54  -8.454  16.436   4.769
  408    H    ALA  55           H        ALA  55  -3.463  12.463   5.566
  409    HA   ALA  55           HA       ALA  55  -1.831  14.524   6.841
  410   1HB   ALA  55          1HB       ALA  55  -1.024  12.913   8.228
  411   2HB   ALA  55          2HB       ALA  55  -1.066  11.663   6.985
  412   3HB   ALA  55          3HB       ALA  55  -2.554  12.149   7.796
  Start of MODEL    4
    1   1H    ILE   1          1H        ILE   1   7.252  12.467   5.770
    2   2H    ILE   1          2H        ILE   1   8.860  12.020   5.377
    3   3H    ILE   1          3H        ILE   1   7.580  10.899   5.163
    4    HA   ILE   1           HA       ILE   1   6.589  12.523   3.595
    5    HB   ILE   1           HB       ILE   1   8.035  14.138   2.570
    6   1HG1  ILE   1          2HG1      ILE   1  10.304  14.527   3.920
    7   2HG1  ILE   1          1HG1      ILE   1  10.134  12.799   4.211
    8   1HG2  ILE   1          1HG2      ILE   1   6.942  14.437   5.006
    9   2HG2  ILE   1          2HG2      ILE   1   7.776  15.731   4.145
   10   3HG2  ILE   1          3HG2      ILE   1   8.626  14.803   5.379
   11   1HD1  ILE   1          1HD1      ILE   1  10.935  14.216   1.813
   12   2HD1  ILE   1          2HD1      ILE   1   9.676  13.017   1.515
   13   3HD1  ILE   1          3HD1      ILE   1  11.191  12.535   2.279
   14    H    ASP   2           H        ASP   2   9.665  10.871   3.958
   15    HA   ASP   2           HA       ASP   2   9.885  10.148   1.197
   16   1HB   ASP   2          2HB       ASP   2  11.522   9.986   3.525
   17   2HB   ASP   2          1HB       ASP   2  11.402   8.372   2.833
   18    H    THR   3           H        THR   3   7.901   9.059   3.669
   19    HA   THR   3           HA       THR   3   7.838   6.280   2.891
   20    HB   THR   3           HB       THR   3   5.873   7.743   4.651
   21    HG1  THR   3           HG1      THR   3   8.376   6.589   5.297
   22   1HG2  THR   3          1HG2      THR   3   6.205   5.300   5.740
   23   2HG2  THR   3          2HG2      THR   3   6.364   4.926   4.024
   24   3HG2  THR   3          3HG2      THR   3   4.911   5.727   4.621
   25    H    CYS   4           H        CYS   4   5.858   9.159   2.421
   26    HA   CYS   4           HA       CYS   4   3.754   7.777   1.067
   27   1HB   CYS   4          2HB       CYS   4   3.885  10.171   2.281
   28   2HB   CYS   4          1HB       CYS   4   4.115  10.683   0.613
   29    H    ARG   5           H        ARG   5   6.860   8.488   0.099
   30    HA   ARG   5           HA       ARG   5   6.048   8.719  -2.721
   31   1HB   ARG   5          2HB       ARG   5   8.315   9.628  -3.132
   32   2HB   ARG   5          1HB       ARG   5   7.362  10.618  -2.037
   33   1HG   ARG   5          2HG       ARG   5   8.555   9.517  -0.137
   34   2HG   ARG   5          1HG       ARG   5   9.606   8.747  -1.327
   35   1HD   ARG   5          2HD       ARG   5  10.717  10.705  -0.533
   36   2HD   ARG   5          1HD       ARG   5  10.175  11.023  -2.181
   37    HE   ARG   5           HE       ARG   5   8.326  11.894  -0.158
   38   1HH1  ARG   5          1HH1      ARG   5  11.134  12.766  -2.039
   39   2HH1  ARG   5          2HH1      ARG   5  10.863  14.469  -1.883
   40   1HH2  ARG   5          1HH2      ARG   5   7.968  14.134   0.046
   41   2HH2  ARG   5          2HH2      ARG   5   9.067  15.246  -0.699
   42    H    LEU   6           H        LEU   6   7.310   6.562  -0.465
   43    HA   LEU   6           HA       LEU   6   8.851   5.090  -2.467
   44   1HB   LEU   6          2HB       LEU   6   9.796   3.844  -0.709
   45   2HB   LEU   6          1HB       LEU   6   9.744   5.500  -0.140
   46    HG   LEU   6           HG       LEU   6   7.498   4.759   0.981
   47   1HD1  LEU   6          1HD1      LEU   6   8.264   2.216   1.697
   48   2HD1  LEU   6          2HD1      LEU   6   8.577   2.256  -0.038
   49   3HD1  LEU   6          3HD1      LEU   6   6.967   2.631   0.577
   50   1HD2  LEU   6          1HD2      LEU   6   8.706   4.195   2.990
   51   2HD2  LEU   6          2HD2      LEU   6   9.572   5.467   2.129
   52   3HD2  LEU   6          3HD2      LEU   6  10.148   3.801   2.054
   53    HA   PRO   7           HA       PRO   7   5.402   2.355  -3.086
   54   1HB   PRO   7          2HB       PRO   7   6.583   0.542  -4.667
   55   2HB   PRO   7          1HB       PRO   7   6.267   2.189  -5.226
   56   1HG   PRO   7          2HG       PRO   7   8.817   0.983  -4.226
   57   2HG   PRO   7          1HG       PRO   7   8.558   2.071  -5.602
   58   1HD   PRO   7          2HD       PRO   7   9.453   2.891  -3.138
   59   2HD   PRO   7          1HD       PRO   7   8.592   3.939  -4.281
   60    H    SER   8           H        SER   8   4.692   0.214  -2.588
   61    HA   SER   8           HA       SER   8   6.304  -1.063  -0.492
   62   1HB   SER   8          2HB       SER   8   3.501  -0.458  -0.748
   63   2HB   SER   8          1HB       SER   8   3.713  -2.197  -0.542
   64    HG   SER   8           HG       SER   8   5.064  -0.358   1.118
   65    H    ASP   9           H        ASP   9   6.559  -3.336  -0.445
   66    HA   ASP   9           HA       ASP   9   6.626  -4.523  -3.100
   67   1HB   ASP   9          2HB       ASP   9   8.164  -4.792  -0.681
   68   2HB   ASP   9          1HB       ASP   9   7.588  -6.374  -1.198
   69    H    ARG  10           H        ARG  10   5.711  -6.555  -3.602
   70    HA   ARG  10           HA       ARG  10   3.227  -7.050  -2.187
   71   1HB   ARG  10          2HB       ARG  10   4.344  -8.025  -4.807
   72   2HB   ARG  10          1HB       ARG  10   2.836  -8.630  -4.137
   73   1HG   ARG  10          2HG       ARG  10   1.788  -6.537  -4.329
   74   2HG   ARG  10          1HG       ARG  10   3.321  -5.706  -4.603
   75   1HD   ARG  10          2HD       ARG  10   2.076  -5.924  -6.680
   76   2HD   ARG  10          1HD       ARG  10   3.564  -6.869  -6.742
   77    HE   ARG  10           HE       ARG  10   1.791  -8.697  -5.931
   78   1HH1  ARG  10          1HH1      ARG  10   1.679  -6.375  -8.535
   79   2HH1  ARG  10          2HH1      ARG  10   0.673  -7.363  -9.541
   80   1HH2  ARG  10          1HH2      ARG  10   0.473 -10.002  -7.259
   81   2HH2  ARG  10          2HH2      ARG  10  -0.010  -9.421  -8.817
   82    HN2  GLY  11           H        GLY  11   6.371  -8.385  -2.312
   83   1HA   GLY  11          2HA       GLY  11   7.189 -10.502  -1.748
   84   2HA   GLY  11          1HA       GLY  11   6.356 -10.053  -0.274
   85    H    ARG  12           H        ARG  12   5.631 -11.520  -3.452
   86    HA   ARG  12           HA       ARG  12   3.269 -12.772  -2.817
   87   1HB   ARG  12          2HB       ARG  12   3.927 -14.507  -4.522
   88   2HB   ARG  12          1HB       ARG  12   4.034 -12.842  -5.072
   89   1HG   ARG  12          2HG       ARG  12   6.492 -12.941  -4.523
   90   2HG   ARG  12          1HG       ARG  12   6.281 -14.679  -4.298
   91   1HD   ARG  12          2HD       ARG  12   7.080 -13.897  -6.585
   92   2HD   ARG  12          1HD       ARG  12   5.717 -15.014  -6.550
   93    HE   ARG  12           HE       ARG  12   4.441 -13.398  -7.524
   94   1HH1  ARG  12          1HH1      ARG  12   7.206 -11.866  -6.048
   95   2HH1  ARG  12          2HH1      ARG  12   6.828 -10.296  -6.674
   96   1HH2  ARG  12          1HH2      ARG  12   3.941 -11.334  -8.348
   97   2HH2  ARG  12          2HH2      ARG  12   4.974  -9.994  -7.979
   98    H    CYS  13           H        CYS  13   6.541 -14.115  -2.434
   99    HA   CYS  13           HA       CYS  13   7.276 -15.992  -1.350
  100   1HB   CYS  13          2HB       CYS  13   5.558 -14.715   0.786
  101   2HB   CYS  13          1HB       CYS  13   6.851 -15.873   1.076
  102    H    LYS  14           H        LYS  14   4.746 -16.448   0.884
  103    HA   LYS  14           HA       LYS  14   3.807 -18.769  -0.658
  104   1HB   LYS  14          2HB       LYS  14   3.816 -18.353   2.336
  105   2HB   LYS  14          1HB       LYS  14   3.258 -19.796   1.503
  106   1HG   LYS  14          2HG       LYS  14   6.063 -18.791   1.188
  107   2HG   LYS  14          1HG       LYS  14   5.592 -19.834   2.531
  108   1HD   LYS  14          2HD       LYS  14   5.832 -21.606   1.213
  109   2HD   LYS  14          1HD       LYS  14   4.544 -20.991   0.176
  110   1HE   LYS  14          2HE       LYS  14   6.283 -19.596  -0.982
  111   2HE   LYS  14          1HE       LYS  14   7.502 -20.476  -0.061
  112   1HZ   LYS  14          1HZ       LYS  14   7.415 -21.692  -1.980
  113   2HZ   LYS  14          2HZ       LYS  14   5.762 -21.430  -2.224
  114   3HZ   LYS  14          3HZ       LYS  14   6.279 -22.532  -1.050
  115    H    ALA  15           H        ALA  15   2.836 -15.872   0.982
  116    HA   ALA  15           HA       ALA  15   0.011 -16.603   0.861
  117   1HB   ALA  15          1HB       ALA  15  -0.054 -14.115   1.837
  118   2HB   ALA  15          2HB       ALA  15   1.593 -14.556   2.288
  119   3HB   ALA  15          3HB       ALA  15   0.235 -15.535   2.843
  120    H    SER  16           H        SER  16  -1.422 -14.582   0.244
  121    HA   SER  16           HA       SER  16  -0.492 -12.869  -1.812
  122   1HB   SER  16          2HB       SER  16  -2.198 -14.105  -3.493
  123   2HB   SER  16          1HB       SER  16  -0.471 -14.460  -3.448
  124    HG   SER  16           HG       SER  16  -2.350 -15.853  -1.857
  125    H    PHE  17           H        PHE  17  -1.608 -11.439  -0.390
  126    HA   PHE  17           HA       PHE  17  -4.543 -11.572  -0.635
  127   1HB   PHE  17          2HB       PHE  17  -2.787 -10.623   1.613
  128   2HB   PHE  17          1HB       PHE  17  -4.438 -10.034   1.451
  129    HD1  PHE  17           HD2      PHE  17  -2.365 -13.026   2.006
  130    HD2  PHE  17           HD1      PHE  17  -6.294 -11.392   2.026
  131    HE1  PHE  17           HE2      PHE  17  -3.188 -15.030   3.172
  132    HE2  PHE  17           HE1      PHE  17  -7.124 -13.392   3.194
  133    HZ   PHE  17           HZ       PHE  17  -5.570 -15.213   3.768
  134    H    GLU  18           H        GLU  18  -5.636  -9.785  -1.329
  135    HA   GLU  18           HA       GLU  18  -4.116  -7.815  -2.756
  136   1HB   GLU  18          2HB       GLU  18  -6.593  -8.903  -3.097
  137   2HB   GLU  18          1HB       GLU  18  -7.000  -7.337  -2.409
  138   1HG   GLU  18          2HG       GLU  18  -5.580  -6.286  -4.173
  139   2HG   GLU  18          1HG       GLU  18  -5.422  -7.880  -4.909
  140    H    ARG  19           H        ARG  19  -3.290  -6.045  -1.880
  141    HA   ARG  19           HA       ARG  19  -4.771  -4.721   0.289
  142   1HB   ARG  19          2HB       ARG  19  -1.772  -5.042   0.091
  143   2HB   ARG  19          1HB       ARG  19  -2.614  -4.110   1.320
  144   1HG   ARG  19          2HG       ARG  19  -2.791  -7.085   0.899
  145   2HG   ARG  19          1HG       ARG  19  -1.948  -6.253   2.206
  146   1HD   ARG  19          2HD       ARG  19  -3.814  -6.236   3.406
  147   2HD   ARG  19          1HD       ARG  19  -4.625  -5.308   2.146
  148    HE   ARG  19           HE       ARG  19  -4.664  -7.928   1.295
  149   1HH1  ARG  19          1HH1      ARG  19  -5.854  -6.148   4.052
  150   2HH1  ARG  19          2HH1      ARG  19  -7.206  -7.200   4.306
  151   1HH2  ARG  19          1HH2      ARG  19  -6.443  -9.312   1.628
  152   2HH2  ARG  19          2HH2      ARG  19  -7.540  -8.997   2.931
  153    H    TRP  20           H        TRP  20  -3.785  -2.407   0.620
  154    HA   TRP  20           HA       TRP  20  -3.582  -1.188  -2.055
  155   1HB   TRP  20          2HB       TRP  20  -4.742  -0.078   0.506
  156   2HB   TRP  20          1HB       TRP  20  -4.532   0.857  -0.971
  157    HD1  TRP  20           HD1      TRP  20  -6.719  -1.855   0.571
  158    HE1  TRP  20           HE1      TRP  20  -8.789  -2.198  -0.912
  159    HE3  TRP  20           HE3      TRP  20  -5.345   1.037  -3.413
  160    HZ2  TRP  20           HZ2      TRP  20  -9.716  -1.359  -3.437
  161    HZ3  TRP  20           HZ3      TRP  20  -6.884   1.214  -5.325
  162    HH2  TRP  20           HH2      TRP  20  -9.025   0.040  -5.336
  163    H    TYR  21           H        TYR  21  -2.181   0.550  -2.388
  164    HA   TYR  21           HA       TYR  21  -0.277   1.225  -0.269
  165   1HB   TYR  21          2HB       TYR  21   1.557   0.976  -2.126
  166   2HB   TYR  21          1HB       TYR  21   1.029  -0.448  -1.233
  167    HD1  TYR  21           HD1      TYR  21  -0.977  -1.743  -2.309
  168    HD2  TYR  21           HD2      TYR  21   1.604   0.869  -4.448
  169    HE1  TYR  21           HE1      TYR  21  -1.636  -2.820  -4.400
  170    HE2  TYR  21           HE2      TYR  21   0.945  -0.204  -6.562
  171    HH   TYR  21           HH       TYR  21  -0.137  -2.805  -7.070
  172    H    PHE  22           H        PHE  22   0.663   3.260  -0.511
  173    HA   PHE  22           HA       PHE  22  -0.803   5.098  -2.141
  174   1HB   PHE  22          2HB       PHE  22   0.576   5.331   0.197
  175   2HB   PHE  22          1HB       PHE  22   1.720   6.041  -0.936
  176    HD1  PHE  22           HD2      PHE  22   1.040   8.000  -2.301
  177    HD2  PHE  22           HD1      PHE  22  -1.390   6.469   0.838
  178    HE1  PHE  22           HE2      PHE  22  -0.221  10.112  -2.253
  179    HE2  PHE  22           HE1      PHE  22  -2.657   8.577   0.891
  180    HZ   PHE  22           HZ       PHE  22  -2.073  10.402  -0.655
  181    H    ASN  23           H        ASN  23  -0.380   5.744  -4.147
  182    HA   ASN  23           HA       ASN  23   2.355   5.416  -5.184
  183   1HB   ASN  23          2HB       ASN  23   1.378   4.786  -7.382
  184   2HB   ASN  23          1HB       ASN  23   1.034   3.614  -6.113
  185   1HD2  ASN  23          1HD2      ASN  23  -0.262   5.750  -8.421
  186   2HD2  ASN  23          2HD2      ASN  23  -1.934   5.488  -8.070
  187    HN2  GLY  24           H        GLY  24   2.669   7.650  -4.734
  188   1HA   GLY  24          2HA       GLY  24   2.960   9.770  -5.624
  189   2HA   GLY  24          1HA       GLY  24   1.863   9.342  -6.927
  190    H    ARG  25           H        ARG  25  -0.413   9.477  -6.545
  191    HA   ARG  25           HA       ARG  25  -1.125  11.231  -4.288
  192   1HB   ARG  25          2HB       ARG  25  -2.707  12.397  -5.752
  193   2HB   ARG  25          1HB       ARG  25  -1.059  12.530  -6.351
  194   1HG   ARG  25          2HG       ARG  25  -2.592  10.269  -7.427
  195   2HG   ARG  25          1HG       ARG  25  -3.191  11.869  -7.870
  196   1HD   ARG  25          2HD       ARG  25  -0.972  12.474  -8.694
  197   2HD   ARG  25          1HD       ARG  25  -0.362  10.885  -8.234
  198    HE   ARG  25           HE       ARG  25  -2.414  10.297  -9.892
  199   1HH1  ARG  25          1HH1      ARG  25   0.361  12.393 -10.189
  200   2HH1  ARG  25          2HH1      ARG  25   0.480  12.199 -11.905
  201   1HH2  ARG  25          1HH2      ARG  25  -2.259  10.042 -12.149
  202   2HH2  ARG  25          2HH2      ARG  25  -1.007  10.865 -13.018
  203    H    THR  26           H        THR  26  -1.996   8.539  -6.317
  204    HA   THR  26           HA       THR  26  -4.469   8.176  -4.759
  205    HB   THR  26           HB       THR  26  -4.574   6.388  -6.883
  206    HG1  THR  26           HG1      THR  26  -3.760   7.321  -8.603
  207   1HG2  THR  26          1HG2      THR  26  -6.249   8.188  -5.894
  208   2HG2  THR  26          2HG2      THR  26  -6.460   7.469  -7.490
  209   3HG2  THR  26          3HG2      THR  26  -5.732   9.068  -7.332
  210    H    CYS  27           H        CYS  27  -5.083   5.740  -4.673
  211    HA   CYS  27           HA       CYS  27  -2.730   4.309  -3.646
  212   1HB   CYS  27          2HB       CYS  27  -5.607   3.681  -2.995
  213   2HB   CYS  27          1HB       CYS  27  -4.162   3.171  -2.128
  214    H    ALA  28           H        ALA  28  -2.099   2.470  -4.552
  215    HA   ALA  28           HA       ALA  28  -3.675   1.400  -6.768
  216   1HB   ALA  28          1HB       ALA  28  -1.415   0.071  -7.054
  217   2HB   ALA  28          2HB       ALA  28  -0.790   1.406  -6.084
  218   3HB   ALA  28          3HB       ALA  28  -1.595   1.731  -7.618
  219    H    LYS  29           H        LYS  29  -3.204  -1.124  -7.046
  220    HA   LYS  29           HA       LYS  29  -3.501  -2.484  -4.475
  221   1HB   LYS  29          2HB       LYS  29  -5.477  -3.724  -5.311
  222   2HB   LYS  29          1HB       LYS  29  -5.775  -2.004  -5.110
  223   1HG   LYS  29          2HG       LYS  29  -6.080  -1.656  -7.318
  224   2HG   LYS  29          1HG       LYS  29  -4.889  -2.869  -7.788
  225   1HD   LYS  29          2HD       LYS  29  -6.643  -4.142  -8.343
  226   2HD   LYS  29          1HD       LYS  29  -6.864  -4.375  -6.608
  227   1HE   LYS  29          2HE       LYS  29  -8.305  -2.316  -6.623
  228   2HE   LYS  29          1HE       LYS  29  -8.219  -2.355  -8.384
  229   1HZ   LYS  29          1HZ       LYS  29  -9.366  -4.382  -8.454
  230   2HZ   LYS  29          2HZ       LYS  29 -10.213  -3.449  -7.325
  231   3HZ   LYS  29          3HZ       LYS  29  -9.165  -4.668  -6.798
  232    H    PHE  30           H        PHE  30  -2.819  -4.576  -4.431
  233    HA   PHE  30           HA       PHE  30  -2.306  -6.116  -6.776
  234   1HB   PHE  30          2HB       PHE  30   0.173  -6.319  -6.369
  235   2HB   PHE  30          1HB       PHE  30  -0.354  -4.788  -7.049
  236    HD1  PHE  30           HD1      PHE  30  -0.918  -5.371  -3.490
  237    HD2  PHE  30           HD2      PHE  30   1.786  -3.815  -6.384
  238    HE1  PHE  30           HE1      PHE  30   0.290  -4.190  -1.718
  239    HE2  PHE  30           HE2      PHE  30   2.998  -2.623  -4.609
  240    HZ   PHE  30           HZ       PHE  30   2.251  -2.810  -2.270
  241    H    ILE  31           H        ILE  31  -0.865  -8.141  -6.055
  242    HA   ILE  31           HA       ILE  31  -2.234  -9.163  -3.698
  243    HB   ILE  31           HB       ILE  31  -0.389 -10.590  -5.613
  244   1HG1  ILE  31          2HG1      ILE  31  -2.400  -9.715  -6.729
  245   2HG1  ILE  31          1HG1      ILE  31  -2.422 -11.473  -6.646
  246   1HG2  ILE  31          1HG2      ILE  31  -2.377 -12.162  -4.172
  247   2HG2  ILE  31          2HG2      ILE  31  -1.196 -11.392  -3.113
  248   3HG2  ILE  31          3HG2      ILE  31  -0.656 -12.457  -4.411
  249   1HD1  ILE  31          1HD1      ILE  31  -4.347  -9.604  -5.694
  250   2HD1  ILE  31          2HD1      ILE  31  -3.724 -10.540  -4.335
  251   3HD1  ILE  31          3HD1      ILE  31  -4.426 -11.365  -5.727
  252    H    TYR  32           H        TYR  32  -1.226  -8.256  -1.949
  253    HA   TYR  32           HA       TYR  32   1.664  -8.425  -1.684
  254   1HB   TYR  32          2HB       TYR  32   0.643  -6.357  -0.979
  255   2HB   TYR  32          1HB       TYR  32  -0.474  -7.214   0.076
  256    HD1  TYR  32           HD1      TYR  32   3.212  -7.612  -0.333
  257    HD2  TYR  32           HD2      TYR  32   0.012  -6.485   2.229
  258    HE1  TYR  32           HE1      TYR  32   4.800  -7.366   1.528
  259    HE2  TYR  32           HE2      TYR  32   1.589  -6.235   4.098
  260    HH   TYR  32           HH       TYR  32   4.760  -7.407   3.999
  261    HN2  GLY  33           H        GLY  33   2.181 -10.557  -1.360
  262   1HA   GLY  33          2HA       GLY  33   0.792 -12.386   0.241
  263   2HA   GLY  33          1HA       GLY  33   2.496 -12.500  -0.179
  264    HN2  GLY  34           H        GLY  34   3.148  -9.930   1.084
  265   1HA   GLY  34          2HA       GLY  34   2.755  -9.148   3.455
  266   2HA   GLY  34          1HA       GLY  34   2.992 -10.830   3.891
  267    H    CYS  35           H        CYS  35   5.072 -10.121   1.362
  268    HA   CYS  35           HA       CYS  35   7.240  -9.596   3.285
  269   1HB   CYS  35          2HB       CYS  35   7.762 -10.747   0.566
  270   2HB   CYS  35          1HB       CYS  35   8.699 -10.910   2.043
  271    HN2  GLY  36           H        GLY  36   8.182  -7.691   3.202
  272   1HA   GLY  36          2HA       GLY  36   9.350  -5.948   2.108
  273   2HA   GLY  36          1HA       GLY  36   8.499  -6.343   0.623
  274    HN2  GLY  37           H        GLY  37   8.452  -4.511   3.556
  275   1HA   GLY  37          2HA       GLY  37   6.606  -2.631   2.488
  276   2HA   GLY  37          1HA       GLY  37   5.820  -3.650   3.685
  277    H    ASN  38           H        ASN  38   5.866  -1.034   4.212
  278    HA   ASN  38           HA       ASN  38   7.375  -0.919   6.641
  279   1HB   ASN  38          2HB       ASN  38   8.347   1.423   5.803
  280   2HB   ASN  38          1HB       ASN  38   9.232  -0.085   5.599
  281   1HD2  ASN  38          1HD2      ASN  38  10.356   0.555   3.810
  282   2HD2  ASN  38          2HD2      ASN  38   9.617   0.833   2.272
  283    HN2  GLY  39           H        GLY  39   6.431   1.862   4.655
  284   1HA   GLY  39          2HA       GLY  39   4.186   2.308   6.522
  285   2HA   GLY  39          1HA       GLY  39   5.257   3.608   6.027
  286    H    ASN  40           H        ASN  40   5.028   1.832   3.325
  287    HA   ASN  40           HA       ASN  40   2.976   3.573   2.223
  288   1HB   ASN  40          2HB       ASN  40   5.143   3.283   1.048
  289   2HB   ASN  40          1HB       ASN  40   4.769   1.577   0.824
  290   1HD2  ASN  40          1HD2      ASN  40   3.596   4.828   0.124
  291   2HD2  ASN  40          2HD2      ASN  40   2.832   4.423  -1.370
  292    H    LYS  41           H        LYS  41   3.425   0.278   3.160
  293    HA   LYS  41           HA       LYS  41   1.347  -0.878   1.609
  294   1HB   LYS  41          2HB       LYS  41   3.274  -2.076   2.760
  295   2HB   LYS  41          1HB       LYS  41   2.370  -1.897   4.258
  296   1HG   LYS  41          2HG       LYS  41   1.925  -4.066   3.445
  297   2HG   LYS  41          1HG       LYS  41   0.476  -3.106   3.139
  298   1HD   LYS  41          2HD       LYS  41   2.169  -2.843   0.881
  299   2HD   LYS  41          1HD       LYS  41   2.088  -4.558   1.286
  300   1HE   LYS  41          2HE       LYS  41   0.155  -4.595   0.180
  301   2HE   LYS  41          1HE       LYS  41  -0.527  -3.703   1.538
  302   1HZ   LYS  41          1HZ       LYS  41  -0.982  -2.633  -0.592
  303   2HZ   LYS  41          2HZ       LYS  41   0.677  -2.469  -0.880
  304   3HZ   LYS  41          3HZ       LYS  41  -0.042  -1.641   0.405
  305    H    PHE  42           H        PHE  42  -0.766  -1.350   2.136
  306    HA   PHE  42           HA       PHE  42  -1.849  -0.581   4.708
  307   1HB   PHE  42          2HB       PHE  42  -2.853   0.737   2.175
  308   2HB   PHE  42          1HB       PHE  42  -3.517   0.953   3.792
  309    HD1  PHE  42           HD1      PHE  42  -1.765   1.775   5.587
  310    HD2  PHE  42           HD2      PHE  42  -1.378   2.302   1.382
  311    HE1  PHE  42           HE1      PHE  42  -0.226   3.657   5.968
  312    HE2  PHE  42           HE2      PHE  42   0.162   4.185   1.756
  313    HZ   PHE  42           HZ       PHE  42   0.740   4.864   4.051
  314    HA   PRO  43           HA       PRO  43  -4.322  -4.123   3.715
  315   1HB   PRO  43          2HB       PRO  43  -6.290  -3.799   5.576
  316   2HB   PRO  43          1HB       PRO  43  -4.677  -4.411   5.958
  317   1HG   PRO  43          2HG       PRO  43  -5.791  -1.657   6.301
  318   2HG   PRO  43          1HG       PRO  43  -4.753  -2.590   7.393
  319   1HD   PRO  43          2HD       PRO  43  -3.792  -0.634   5.789
  320   2HD   PRO  43          1HD       PRO  43  -2.837  -2.066   6.226
  321    H    THR  44           H        THR  44  -6.293  -1.232   4.469
  322    HA   THR  44           HA       THR  44  -7.952  -1.887   2.123
  323    HB   THR  44           HB       THR  44  -9.610  -0.327   3.533
  324    HG1  THR  44           HG1      THR  44  -9.378  -0.770   5.728
  325   1HG2  THR  44          1HG2      THR  44 -10.419  -2.467   4.703
  326   2HG2  THR  44          2HG2      THR  44  -9.159  -3.270   3.766
  327   3HG2  THR  44          3HG2      THR  44 -10.450  -2.397   2.941
  328    H    GLN  45           H        GLN  45  -9.073   0.042   1.175
  329    HA   GLN  45           HA       GLN  45  -7.131   2.022   0.514
  330   1HB   GLN  45          2HB       GLN  45  -9.356   1.017  -0.726
  331   2HB   GLN  45          1HB       GLN  45  -9.922   2.598  -0.207
  332   1HG   GLN  45          2HG       GLN  45  -7.282   2.609  -1.474
  333   2HG   GLN  45          1HG       GLN  45  -8.603   2.096  -2.522
  334   1HE2  GLN  45          1HE2      GLN  45  -9.930   3.589  -3.349
  335   2HE2  GLN  45          2HE2      GLN  45  -9.885   5.274  -2.968
  336    H    GLU  46           H        GLU  46  -9.822   1.851   2.723
  337    HA   GLU  46           HA       GLU  46 -10.278   4.569   3.170
  338   1HB   GLU  46          2HB       GLU  46 -11.535   2.463   4.049
  339   2HB   GLU  46          1HB       GLU  46 -10.413   2.566   5.399
  340   1HG   GLU  46          2HG       GLU  46 -11.174   4.947   5.699
  341   2HG   GLU  46          1HG       GLU  46 -12.450   4.594   4.536
  342    H    ALA  47           H        ALA  47  -7.798   2.419   4.390
  343    HA   ALA  47           HA       ALA  47  -6.821   4.222   6.384
  344   1HB   ALA  47          1HB       ALA  47  -6.536   1.622   6.141
  345   2HB   ALA  47          2HB       ALA  47  -5.283   2.602   6.903
  346   3HB   ALA  47          3HB       ALA  47  -5.100   2.083   5.227
  347    H    CYS  48           H        CYS  48  -5.689   3.247   3.160
  348    HA   CYS  48           HA       CYS  48  -3.386   4.732   2.961
  349   1HB   CYS  48          2HB       CYS  48  -4.034   3.154   1.247
  350   2HB   CYS  48          1HB       CYS  48  -5.443   4.121   0.830
  351    H    MET  49           H        MET  49  -6.707   5.827   2.660
  352    HA   MET  49           HA       MET  49  -5.969   8.443   1.713
  353   1HB   MET  49          2HB       MET  49  -8.567   7.194   2.572
  354   2HB   MET  49          1HB       MET  49  -8.446   8.907   2.194
  355   1HG   MET  49          2HG       MET  49  -7.918   8.486  -0.052
  356   2HG   MET  49          1HG       MET  49  -7.564   6.789   0.266
  357   1HE   MET  49          1HE       MET  49  -9.471   9.067  -1.285
  358   2HE   MET  49          2HE       MET  49 -10.953   9.275  -0.352
  359   3HE   MET  49          3HE       MET  49 -10.942   8.223  -1.767
  360    H    LYS  50           H        LYS  50  -7.066   7.053   4.785
  361    HA   LYS  50           HA       LYS  50  -7.033   9.599   6.117
  362   1HB   LYS  50          2HB       LYS  50  -7.632   8.382   8.107
  363   2HB   LYS  50          1HB       LYS  50  -8.588   7.783   6.758
  364   1HG   LYS  50          2HG       LYS  50  -7.874   5.722   7.112
  365   2HG   LYS  50          1HG       LYS  50  -6.193   6.239   6.976
  366   1HD   LYS  50          2HD       LYS  50  -6.709   7.135   9.440
  367   2HD   LYS  50          1HD       LYS  50  -7.866   5.802   9.384
  368   1HE   LYS  50          2HE       LYS  50  -6.242   4.215   9.331
  369   2HE   LYS  50          1HE       LYS  50  -5.123   5.235   8.428
  370   1HZ   LYS  50          1HZ       LYS  50  -4.684   4.668  10.917
  371   2HZ   LYS  50          2HZ       LYS  50  -5.758   5.942  11.205
  372   3HZ   LYS  50          3HZ       LYS  50  -4.340   6.215  10.322
  373    H    ARG  51           H        ARG  51  -4.544   7.733   5.077
  374    HA   ARG  51           HA       ARG  51  -2.887   8.202   7.449
  375   1HB   ARG  51          2HB       ARG  51  -3.059   6.011   5.812
  376   2HB   ARG  51          1HB       ARG  51  -1.644   6.832   5.170
  377   1HG   ARG  51          2HG       ARG  51  -2.017   6.135   8.073
  378   2HG   ARG  51          1HG       ARG  51  -1.144   5.134   6.911
  379   1HD   ARG  51          2HD       ARG  51  -0.465   7.991   7.597
  380   2HD   ARG  51          1HD       ARG  51   0.347   6.571   8.256
  381    HE   ARG  51           HE       ARG  51   0.337   6.674   5.383
  382   1HH1  ARG  51          1HH1      ARG  51   2.005   7.684   8.278
  383   2HH1  ARG  51          2HH1      ARG  51   3.528   7.886   7.480
  384   1HH2  ARG  51          1HH2      ARG  51   2.341   6.939   4.332
  385   2HH2  ARG  51          2HH2      ARG  51   3.719   7.463   5.241
  386    H    CYS  52           H        CYS  52  -2.834   8.754   3.922
  387    HA   CYS  52           HA       CYS  52  -0.836  10.867   4.406
  388   1HB   CYS  52          2HB       CYS  52  -0.895   8.707   2.516
  389   2HB   CYS  52          1HB       CYS  52  -0.884  10.240   1.651
  390    H    ALA  53           H        ALA  53  -3.952  10.150   3.052
  391    HA   ALA  53           HA       ALA  53  -4.125  12.636   1.590
  392   1HB   ALA  53          1HB       ALA  53  -5.958  11.775   0.614
  393   2HB   ALA  53          2HB       ALA  53  -6.611  11.164   2.135
  394   3HB   ALA  53          3HB       ALA  53  -5.363  10.255   1.281
  395    H    LYS  54           H        LYS  54  -4.879  11.499   4.770
  396    HA   LYS  54           HA       LYS  54  -6.731  13.624   5.364
  397   1HB   LYS  54          2HB       LYS  54  -5.949  11.167   6.578
  398   2HB   LYS  54          1HB       LYS  54  -5.698  12.453   7.749
  399   1HG   LYS  54          2HG       LYS  54  -7.893  11.596   8.063
  400   2HG   LYS  54          1HG       LYS  54  -8.041  13.196   7.330
  401   1HD   LYS  54          2HD       LYS  54  -7.943  11.606   5.126
  402   2HD   LYS  54          1HD       LYS  54  -8.776  10.555   6.273
  403   1HE   LYS  54          2HE       LYS  54 -10.393  12.354   6.716
  404   2HE   LYS  54          1HE       LYS  54  -9.575  13.366   5.525
  405   1HZ   LYS  54          1HZ       LYS  54 -10.169  11.855   3.800
  406   2HZ   LYS  54          2HZ       LYS  54 -11.575  12.208   4.672
  407   3HZ   LYS  54          3HZ       LYS  54 -10.788  10.729   4.901
  408    H    ALA  55           H        ALA  55  -3.648  12.744   6.927
  409    HA   ALA  55           HA       ALA  55  -3.247  15.324   8.016
  410   1HB   ALA  55          1HB       ALA  55  -2.068  13.825   9.240
  411   2HB   ALA  55          2HB       ALA  55  -0.781  14.301   8.132
  412   3HB   ALA  55          3HB       ALA  55  -1.689  12.816   7.844
  Start of MODEL    5
    1   1H    ILE   1          1H        ILE   1   7.699  11.788   6.494
    2   2H    ILE   1          2H        ILE   1   7.231  13.439   6.469
    3   3H    ILE   1          3H        ILE   1   8.587  12.915   5.556
    4    HA   ILE   1           HA       ILE   1   5.975  11.724   5.089
    5    HB   ILE   1           HB       ILE   1   5.663  14.196   5.091
    6   1HG1  ILE   1          2HG1      ILE   1   4.718  14.297   2.740
    7   2HG1  ILE   1          1HG1      ILE   1   5.424  12.707   2.475
    8   1HG2  ILE   1          1HG2      ILE   1   6.967  15.636   3.970
    9   2HG2  ILE   1          2HG2      ILE   1   7.130  14.564   2.579
   10   3HG2  ILE   1          3HG2      ILE   1   8.144  14.323   4.002
   11   1HD1  ILE   1          1HD1      ILE   1   3.920  12.643   4.888
   12   2HD1  ILE   1          2HD1      ILE   1   3.658  11.753   3.388
   13   3HD1  ILE   1          3HD1      ILE   1   2.930  13.344   3.607
   14    H    ASP   2           H        ASP   2   8.188  10.298   4.879
   15    HA   ASP   2           HA       ASP   2   9.024  10.474   2.063
   16   1HB   ASP   2          2HB       ASP   2  10.390   9.197   4.436
   17   2HB   ASP   2          1HB       ASP   2  10.953   9.040   2.775
   18    H    THR   3           H        THR   3   6.924   8.819   4.013
   19    HA   THR   3           HA       THR   3   7.325   6.176   2.941
   20    HB   THR   3           HB       THR   3   5.026   7.315   4.541
   21    HG1  THR   3           HG1      THR   3   6.441   7.221   6.075
   22   1HG2  THR   3          1HG2      THR   3   4.162   5.359   3.629
   23   2HG2  THR   3          2HG2      THR   3   4.779   4.865   5.207
   24   3HG2  THR   3          3HG2      THR   3   5.704   4.512   3.748
   25    H    CYS   4           H        CYS   4   5.070   8.849   2.426
   26    HA   CYS   4           HA       CYS   4   3.378   7.486   0.616
   27   1HB   CYS   4          2HB       CYS   4   3.884  10.453   0.910
   28   2HB   CYS   4          1HB       CYS   4   2.539   9.728   0.033
   29    H    ARG   5           H        ARG   5   6.550   8.611   0.245
   30    HA   ARG   5           HA       ARG   5   6.269   8.986  -2.640
   31   1HB   ARG   5          2HB       ARG   5   8.716   9.624  -2.483
   32   2HB   ARG   5          1HB       ARG   5   7.585  10.688  -1.659
   33   1HG   ARG   5          2HG       ARG   5   8.150   9.707   0.470
   34   2HG   ARG   5          1HG       ARG   5   9.201   8.529  -0.319
   35   1HD   ARG   5          2HD       ARG   5  10.716  10.122   0.384
   36   2HD   ARG   5          1HD       ARG   5  10.394  10.633  -1.271
   37    HE   ARG   5           HE       ARG   5   8.692  11.872   0.692
   38   1HH1  ARG   5          1HH1      ARG   5  11.738  12.066  -1.001
   39   2HH1  ARG   5          2HH1      ARG   5  11.896  13.775  -0.776
   40   1HH2  ARG   5          1HH2      ARG   5   8.900  14.121   0.990
   41   2HH2  ARG   5          2HH2      ARG   5  10.286  14.942   0.355
   42    H    LEU   6           H        LEU   6   7.535   6.736  -0.296
   43    HA   LEU   6           HA       LEU   6   8.964   5.226  -2.326
   44   1HB   LEU   6          2HB       LEU   6   9.810   3.886  -0.576
   45   2HB   LEU   6          1HB       LEU   6   9.838   5.539   0.007
   46    HG   LEU   6           HG       LEU   6   7.462   4.790   1.003
   47   1HD1  LEU   6          1HD1      LEU   6   7.186   2.586   1.382
   48   2HD1  LEU   6          2HD1      LEU   6   8.915   2.292   1.571
   49   3HD1  LEU   6          3HD1      LEU   6   8.215   2.427  -0.042
   50   1HD2  LEU   6          1HD2      LEU   6  10.030   4.032   2.375
   51   2HD2  LEU   6          2HD2      LEU   6   8.528   4.603   3.104
   52   3HD2  LEU   6          3HD2      LEU   6   9.523   5.706   2.152
   53    HA   PRO   7           HA       PRO   7   5.173   2.964  -3.222
   54   1HB   PRO   7          2HB       PRO   7   6.989   1.352  -4.904
   55   2HB   PRO   7          1HB       PRO   7   5.531   2.241  -5.355
   56   1HG   PRO   7          2HG       PRO   7   7.966   3.106  -6.055
   57   2HG   PRO   7          1HG       PRO   7   6.668   4.234  -5.624
   58   1HD   PRO   7          2HD       PRO   7   9.007   3.321  -3.994
   59   2HD   PRO   7          1HD       PRO   7   8.285   4.939  -4.125
   60    H    SER   8           H        SER   8   4.549   0.633  -3.228
   61    HA   SER   8           HA       SER   8   6.115  -0.836  -1.215
   62   1HB   SER   8          2HB       SER   8   3.397  -0.123  -1.240
   63   2HB   SER   8          1HB       SER   8   3.430  -1.855  -1.569
   64    HG   SER   8           HG       SER   8   4.827  -0.620   0.569
   65    H    ASP   9           H        ASP   9   6.382  -3.095  -1.447
   66    HA   ASP   9           HA       ASP   9   5.865  -4.129  -4.155
   67   1HB   ASP   9          2HB       ASP   9   8.366  -3.546  -3.140
   68   2HB   ASP   9          1HB       ASP   9   8.214  -5.275  -2.841
   69    H    ARG  10           H        ARG  10   4.970  -6.104  -4.282
   70    HA   ARG  10           HA       ARG  10   4.231  -7.414  -1.794
   71   1HB   ARG  10          2HB       ARG  10   2.870  -8.871  -3.366
   72   2HB   ARG  10          1HB       ARG  10   2.429  -7.169  -3.302
   73   1HG   ARG  10          2HG       ARG  10   2.934  -6.834  -5.451
   74   2HG   ARG  10          1HG       ARG  10   4.415  -7.786  -5.349
   75   1HD   ARG  10          2HD       ARG  10   3.343  -9.299  -6.587
   76   2HD   ARG  10          1HD       ARG  10   2.448  -9.690  -5.123
   77    HE   ARG  10           HE       ARG  10   0.695  -8.213  -5.888
   78   1HH1  ARG  10          1HH1      ARG  10   3.110  -9.097  -8.265
   79   2HH1  ARG  10          2HH1      ARG  10   2.096  -8.731  -9.617
   80   1HH2  ARG  10          1HH2      ARG  10  -0.636  -7.723  -7.704
   81   2HH2  ARG  10          2HH2      ARG  10  -0.016  -7.958  -9.301
   82    HN2  GLY  11           H        GLY  11   6.862  -7.601  -3.752
   83   1HA   GLY  11          2HA       GLY  11   8.432  -9.215  -4.223
   84   2HA   GLY  11          1HA       GLY  11   7.980  -9.857  -2.651
   85    H    ARG  12           H        ARG  12   8.713 -11.833  -4.020
   86    HA   ARG  12           HA       ARG  12   6.593 -12.836  -5.740
   87   1HB   ARG  12          2HB       ARG  12   9.187 -13.110  -6.066
   88   2HB   ARG  12          1HB       ARG  12   8.983 -14.473  -4.979
   89   1HG   ARG  12          2HG       ARG  12   7.008 -15.001  -6.701
   90   2HG   ARG  12          1HG       ARG  12   8.105 -14.126  -7.771
   91   1HD   ARG  12          2HD       ARG  12   9.835 -15.675  -7.444
   92   2HD   ARG  12          1HD       ARG  12   9.065 -16.361  -6.014
   93    HE   ARG  12           HE       ARG  12   8.557 -17.048  -8.758
   94   1HH1  ARG  12          1HH1      ARG  12   7.243 -17.021  -5.526
   95   2HH1  ARG  12          2HH1      ARG  12   6.124 -18.305  -5.835
   96   1HH2  ARG  12          1HH2      ARG  12   7.086 -18.739  -9.167
   97   2HH2  ARG  12          2HH2      ARG  12   6.036 -19.282  -7.901
   98    H    CYS  13           H        CYS  13   8.448 -14.617  -3.280
   99    HA   CYS  13           HA       CYS  13   7.714 -16.359  -1.947
  100   1HB   CYS  13          2HB       CYS  13   5.885 -14.229  -0.857
  101   2HB   CYS  13          1HB       CYS  13   6.758 -15.478   0.024
  102    H    LYS  14           H        LYS  14   5.076 -16.373  -0.591
  103    HA   LYS  14           HA       LYS  14   3.495 -17.466  -2.818
  104   1HB   LYS  14          2HB       LYS  14   2.292 -18.612  -0.754
  105   2HB   LYS  14          1HB       LYS  14   3.745 -19.298  -1.465
  106   1HG   LYS  14          2HG       LYS  14   3.995 -19.369   0.892
  107   2HG   LYS  14          1HG       LYS  14   5.068 -18.104   0.290
  108   1HD   LYS  14          2HD       LYS  14   4.002 -17.224   2.216
  109   2HD   LYS  14          1HD       LYS  14   3.229 -16.459   0.826
  110   1HE   LYS  14          2HE       LYS  14   1.238 -17.355   1.311
  111   2HE   LYS  14          1HE       LYS  14   1.934 -18.944   1.622
  112   1HZ   LYS  14          1HZ       LYS  14   2.424 -16.889   3.627
  113   2HZ   LYS  14          2HZ       LYS  14   2.105 -18.538   3.822
  114   3HZ   LYS  14          3HZ       LYS  14   0.836 -17.463   3.512
  115    H    ALA  15           H        ALA  15   3.264 -14.854  -2.690
  116    HA   ALA  15           HA       ALA  15   1.581 -13.611  -0.913
  117   1HB   ALA  15          1HB       ALA  15   1.211 -11.951  -2.559
  118   2HB   ALA  15          2HB       ALA  15   1.509 -13.089  -3.874
  119   3HB   ALA  15          3HB       ALA  15   2.838 -12.574  -2.834
  120    H    SER  16           H        SER  16  -0.585 -13.397  -0.613
  121    HA   SER  16           HA       SER  16  -2.488 -14.499  -2.468
  122   1HB   SER  16          2HB       SER  16  -3.418 -15.904  -0.377
  123   2HB   SER  16          1HB       SER  16  -2.300 -16.586  -1.559
  124    HG   SER  16           HG       SER  16  -1.847 -15.785   1.075
  125    H    PHE  17           H        PHE  17  -1.815 -11.974  -0.912
  126    HA   PHE  17           HA       PHE  17  -4.523 -11.562   0.172
  127   1HB   PHE  17          2HB       PHE  17  -1.905 -10.547   1.290
  128   2HB   PHE  17          1HB       PHE  17  -3.480  -9.945   1.795
  129    HD1  PHE  17           HD2      PHE  17  -1.182 -12.794   1.873
  130    HD2  PHE  17           HD1      PHE  17  -4.933 -11.267   3.180
  131    HE1  PHE  17           HE2      PHE  17  -1.341 -14.610   3.525
  132    HE2  PHE  17           HE1      PHE  17  -5.099 -13.079   4.836
  133    HZ   PHE  17           HZ       PHE  17  -3.301 -14.755   5.010
  134    H    GLU  18           H        GLU  18  -5.332  -9.382   0.008
  135    HA   GLU  18           HA       GLU  18  -4.106  -7.908  -2.230
  136   1HB   GLU  18          2HB       GLU  18  -6.406  -6.933  -2.536
  137   2HB   GLU  18          1HB       GLU  18  -6.287  -8.658  -2.850
  138   1HG   GLU  18          2HG       GLU  18  -7.095  -7.733  -0.139
  139   2HG   GLU  18          1HG       GLU  18  -8.266  -7.680  -1.456
  140    H    ARG  19           H        ARG  19  -3.311  -5.935  -1.841
  141    HA   ARG  19           HA       ARG  19  -4.286  -4.468   0.516
  142   1HB   ARG  19          2HB       ARG  19  -1.624  -5.528   0.050
  143   2HB   ARG  19          1HB       ARG  19  -1.590  -3.789   0.296
  144   1HG   ARG  19          2HG       ARG  19  -1.294  -4.722   2.419
  145   2HG   ARG  19          1HG       ARG  19  -2.981  -4.207   2.378
  146   1HD   ARG  19          2HD       ARG  19  -3.401  -6.650   1.565
  147   2HD   ARG  19          1HD       ARG  19  -1.831  -6.962   2.299
  148    HE   ARG  19           HE       ARG  19  -3.043  -5.747   4.304
  149   1HH1  ARG  19          1HH1      ARG  19  -4.295  -8.197   2.148
  150   2HH1  ARG  19          2HH1      ARG  19  -5.379  -8.852   3.328
  151   1HH2  ARG  19          1HH2      ARG  19  -4.468  -6.613   5.849
  152   2HH2  ARG  19          2HH2      ARG  19  -5.478  -7.956   5.427
  153    H    TRP  20           H        TRP  20  -3.319  -2.159   0.482
  154    HA   TRP  20           HA       TRP  20  -3.547  -1.103  -2.261
  155   1HB   TRP  20          2HB       TRP  20  -4.423   0.139   0.357
  156   2HB   TRP  20          1HB       TRP  20  -4.438   0.975  -1.193
  157    HD1  TRP  20           HD1      TRP  20  -6.204  -1.890   0.668
  158    HE1  TRP  20           HE1      TRP  20  -8.478  -2.307  -0.456
  159    HE3  TRP  20           HE3      TRP  20  -5.718   1.251  -3.337
  160    HZ2  TRP  20           HZ2      TRP  20  -9.879  -1.425  -2.732
  161    HZ3  TRP  20           HZ3      TRP  20  -7.576   1.405  -4.943
  162    HH2  TRP  20           HH2      TRP  20  -9.615   0.093  -4.647
  163    H    TYR  21           H        TYR  21  -2.197   0.621  -2.854
  164    HA   TYR  21           HA       TYR  21  -0.047   1.322  -0.978
  165   1HB   TYR  21          2HB       TYR  21   1.475   1.171  -3.131
  166   2HB   TYR  21          1HB       TYR  21   1.153  -0.265  -2.162
  167    HD1  TYR  21           HD1      TYR  21  -1.104  -1.518  -2.899
  168    HD2  TYR  21           HD2      TYR  21   1.288   0.927  -5.425
  169    HE1  TYR  21           HE1      TYR  21  -2.061  -2.621  -4.857
  170    HE2  TYR  21           HE2      TYR  21   0.334  -0.182  -7.404
  171    HH   TYR  21           HH       TYR  21  -0.792  -2.410  -7.922
  172    H    PHE  22           H        PHE  22   0.519   3.417  -1.023
  173    HA   PHE  22           HA       PHE  22  -1.044   5.252  -2.533
  174   1HB   PHE  22          2HB       PHE  22   0.340   5.436  -0.214
  175   2HB   PHE  22          1HB       PHE  22   1.470   6.225  -1.308
  176    HD1  PHE  22           HD1      PHE  22  -1.898   6.365   0.147
  177    HD2  PHE  22           HD2      PHE  22   0.997   8.364  -2.248
  178    HE1  PHE  22           HE1      PHE  22  -3.210   8.440   0.300
  179    HE2  PHE  22           HE2      PHE  22  -0.309  10.444  -2.097
  180    HZ   PHE  22           HZ       PHE  22  -2.416  10.484  -0.823
  181    H    ASN  23           H        ASN  23  -0.779   5.676  -4.613
  182    HA   ASN  23           HA       ASN  23   1.845   5.318  -5.845
  183   1HB   ASN  23          2HB       ASN  23  -0.497   4.471  -6.745
  184   2HB   ASN  23          1HB       ASN  23  -0.571   6.096  -7.421
  185   1HD2  ASN  23          1HD2      ASN  23  -0.562   3.913  -9.052
  186   2HD2  ASN  23          2HD2      ASN  23   0.931   3.831  -9.916
  187    HN2  GLY  24           H        GLY  24   1.726   7.500  -4.150
  188   1HA   GLY  24          2HA       GLY  24   2.464   9.680  -4.166
  189   2HA   GLY  24          1HA       GLY  24   2.544   9.584  -5.917
  190    H    ARG  25           H        ARG  25   0.383   9.700  -7.052
  191    HA   ARG  25           HA       ARG  25  -1.110  11.911  -5.873
  192   1HB   ARG  25          2HB       ARG  25  -2.124  12.079  -8.164
  193   2HB   ARG  25          1HB       ARG  25  -0.384  12.318  -8.105
  194   1HG   ARG  25          2HG       ARG  25  -1.157   9.546  -8.576
  195   2HG   ARG  25          1HG       ARG  25  -1.714  10.659  -9.824
  196   1HD   ARG  25          2HD       ARG  25   0.977  11.316  -9.154
  197   2HD   ARG  25          1HD       ARG  25   0.881   9.581  -9.449
  198    HE   ARG  25           HE       ARG  25  -0.471  10.655 -11.540
  199   1HH1  ARG  25          1HH1      ARG  25   2.707  11.190 -10.198
  200   2HH1  ARG  25          2HH1      ARG  25   3.411  11.629 -11.717
  201   1HH2  ARG  25          1HH2      ARG  25   0.456  11.229 -13.540
  202   2HH2  ARG  25          2HH2      ARG  25   2.135  11.650 -13.614
  203    H    THR  26           H        THR  26  -1.577   8.583  -6.896
  204    HA   THR  26           HA       THR  26  -4.206   8.636  -5.602
  205    HB   THR  26           HB       THR  26  -4.623   8.896  -8.002
  206    HG1  THR  26           HG1      THR  26  -5.270   6.239  -7.293
  207   1HG2  THR  26          1HG2      THR  26  -4.097   6.431  -9.115
  208   2HG2  THR  26          2HG2      THR  26  -2.614   6.830  -8.246
  209   3HG2  THR  26          3HG2      THR  26  -3.255   7.942  -9.457
  210    H    CYS  27           H        CYS  27  -5.067   6.355  -5.313
  211    HA   CYS  27           HA       CYS  27  -2.909   4.720  -4.251
  212   1HB   CYS  27          2HB       CYS  27  -5.292   5.341  -3.187
  213   2HB   CYS  27          1HB       CYS  27  -5.738   3.849  -4.009
  214    H    ALA  28           H        ALA  28  -3.388   2.253  -4.420
  215    HA   ALA  28           HA       ALA  28  -4.392   1.449  -7.020
  216   1HB   ALA  28          1HB       ALA  28  -1.496   1.340  -6.280
  217   2HB   ALA  28          2HB       ALA  28  -2.244   1.943  -7.757
  218   3HB   ALA  28          3HB       ALA  28  -2.187   0.210  -7.444
  219    H    LYS  29           H        LYS  29  -3.905  -1.072  -7.259
  220    HA   LYS  29           HA       LYS  29  -4.143  -2.382  -4.653
  221   1HB   LYS  29          2HB       LYS  29  -6.433  -1.824  -5.573
  222   2HB   LYS  29          1HB       LYS  29  -6.092  -2.946  -6.885
  223   1HG   LYS  29          2HG       LYS  29  -6.452  -4.750  -5.607
  224   2HG   LYS  29          1HG       LYS  29  -5.657  -4.040  -4.200
  225   1HD   LYS  29          2HD       LYS  29  -7.891  -2.501  -4.382
  226   2HD   LYS  29          1HD       LYS  29  -8.495  -4.053  -4.968
  227   1HE   LYS  29          2HE       LYS  29  -7.396  -5.068  -2.902
  228   2HE   LYS  29          1HE       LYS  29  -7.244  -3.414  -2.310
  229   1HZ   LYS  29          1HZ       LYS  29  -9.811  -3.456  -2.997
  230   2HZ   LYS  29          2HZ       LYS  29  -9.259  -3.863  -1.451
  231   3HZ   LYS  29          3HZ       LYS  29  -9.607  -5.081  -2.571
  232    H    PHE  30           H        PHE  30  -3.346  -4.413  -4.551
  233    HA   PHE  30           HA       PHE  30  -2.810  -6.001  -6.862
  234   1HB   PHE  30          2HB       PHE  30  -0.383  -6.019  -6.731
  235   2HB   PHE  30          1HB       PHE  30  -0.957  -4.386  -7.030
  236    HD1  PHE  30           HD1      PHE  30  -1.713  -4.736  -3.722
  237    HD2  PHE  30           HD2      PHE  30   1.700  -4.523  -6.259
  238    HE1  PHE  30           HE1      PHE  30  -0.369  -3.926  -1.837
  239    HE2  PHE  30           HE2      PHE  30   3.050  -3.713  -4.371
  240    HZ   PHE  30           HZ       PHE  30   2.018  -3.412  -2.157
  241    H    ILE  31           H        ILE  31  -1.269  -7.920  -6.155
  242    HA   ILE  31           HA       ILE  31  -2.494  -8.988  -3.749
  243    HB   ILE  31           HB       ILE  31  -0.652 -10.330  -5.734
  244   1HG1  ILE  31          2HG1      ILE  31  -2.776  -9.588  -6.750
  245   2HG1  ILE  31          1HG1      ILE  31  -2.668 -11.344  -6.666
  246   1HG2  ILE  31          1HG2      ILE  31  -1.654 -12.419  -4.735
  247   2HG2  ILE  31          2HG2      ILE  31  -2.297 -11.395  -3.450
  248   3HG2  ILE  31          3HG2      ILE  31  -0.553 -11.522  -3.688
  249   1HD1  ILE  31          1HD1      ILE  31  -4.055 -11.245  -4.594
  250   2HD1  ILE  31          2HD1      ILE  31  -4.874 -10.714  -6.064
  251   3HD1  ILE  31          3HD1      ILE  31  -4.283  -9.524  -4.904
  252    H    TYR  32           H        TYR  32  -1.513  -8.341  -1.937
  253    HA   TYR  32           HA       TYR  32   1.370  -8.019  -1.856
  254   1HB   TYR  32          2HB       TYR  32  -0.085  -6.336  -0.803
  255   2HB   TYR  32          1HB       TYR  32  -0.717  -7.565   0.287
  256    HD1  TYR  32           HD1      TYR  32   2.679  -6.413  -0.797
  257    HD2  TYR  32           HD2      TYR  32   0.093  -7.408   2.431
  258    HE1  TYR  32           HE1      TYR  32   4.483  -5.911   0.797
  259    HE2  TYR  32           HE2      TYR  32   1.887  -6.907   4.033
  260    HH   TYR  32           HH       TYR  32   3.933  -5.658   4.176
  261    HN2  GLY  33           H        GLY  33   2.631  -9.663  -1.431
  262   1HA   GLY  33          2HA       GLY  33   1.567 -11.960   0.049
  263   2HA   GLY  33          1HA       GLY  33   3.034 -11.946  -0.918
  264    HN2  GLY  34           H        GLY  34   2.734  -9.238   1.125
  265   1HA   GLY  34          2HA       GLY  34   3.633  -8.717   3.189
  266   2HA   GLY  34          1HA       GLY  34   3.868 -10.432   3.477
  267    H    CYS  35           H        CYS  35   5.248  -9.737   0.539
  268    HA   CYS  35           HA       CYS  35   7.887  -9.418   1.797
  269   1HB   CYS  35          2HB       CYS  35   7.297 -10.582  -0.927
  270   2HB   CYS  35          1HB       CYS  35   8.832 -10.616  -0.064
  271    HN2  GLY  36           H        GLY  36   8.298  -7.273   1.770
  272   1HA   GLY  36          2HA       GLY  36   9.412  -5.591   0.417
  273   2HA   GLY  36          1HA       GLY  36   8.293  -5.975  -0.880
  274    HN2  GLY  37           H        GLY  37   7.455  -5.488   2.519
  275   1HA   GLY  37          2HA       GLY  37   5.997  -3.052   1.696
  276   2HA   GLY  37          1HA       GLY  37   5.332  -4.224   2.824
  277    H    ASN  38           H        ASN  38   5.678  -1.433   3.305
  278    HA   ASN  38           HA       ASN  38   7.208  -1.613   5.759
  279   1HB   ASN  38          2HB       ASN  38   8.204   0.760   5.036
  280   2HB   ASN  38          1HB       ASN  38   9.038  -0.751   4.690
  281   1HD2  ASN  38          1HD2      ASN  38  10.079  -0.145   2.868
  282   2HD2  ASN  38          2HD2      ASN  38   9.285   0.306   1.400
  283    HN2  GLY  39           H        GLY  39   6.163   1.247   3.934
  284   1HA   GLY  39          2HA       GLY  39   4.004   1.629   5.901
  285   2HA   GLY  39          1HA       GLY  39   5.138   2.929   5.569
  286    H    ASN  40           H        ASN  40   4.740   1.350   2.703
  287    HA   ASN  40           HA       ASN  40   2.899   3.392   1.752
  288   1HB   ASN  40          2HB       ASN  40   5.089   2.761   0.593
  289   2HB   ASN  40          1HB       ASN  40   4.271   1.288   0.081
  290   1HD2  ASN  40          1HD2      ASN  40   3.739   4.794   0.150
  291   2HD2  ASN  40          2HD2      ASN  40   3.032   4.890  -1.424
  292    H    LYS  41           H        LYS  41   3.024  -0.052   2.305
  293    HA   LYS  41           HA       LYS  41   0.653  -0.650   0.805
  294   1HB   LYS  41          2HB       LYS  41   0.819  -2.868   1.978
  295   2HB   LYS  41          1HB       LYS  41   2.243  -2.408   1.055
  296   1HG   LYS  41          2HG       LYS  41   3.519  -2.612   2.850
  297   2HG   LYS  41          1HG       LYS  41   2.521  -1.455   3.731
  298   1HD   LYS  41          2HD       LYS  41   1.601  -4.282   3.411
  299   2HD   LYS  41          1HD       LYS  41   2.802  -3.880   4.640
  300   1HE   LYS  41          2HE       LYS  41   1.145  -2.035   5.340
  301   2HE   LYS  41          1HE       LYS  41  -0.035  -2.941   4.394
  302   1HZ   LYS  41          1HZ       LYS  41   1.527  -4.499   6.280
  303   2HZ   LYS  41          2HZ       LYS  41  -0.121  -4.580   5.911
  304   3HZ   LYS  41          3HZ       LYS  41   0.450  -3.392   6.970
  305    H    PHE  42           H        PHE  42  -1.380  -1.256   1.632
  306    HA   PHE  42           HA       PHE  42  -1.955  -0.779   4.437
  307   1HB   PHE  42          2HB       PHE  42  -3.130   0.893   2.214
  308   2HB   PHE  42          1HB       PHE  42  -3.869   0.766   3.807
  309    HD1  PHE  42           HD2      PHE  42  -2.148   1.202   5.800
  310    HD2  PHE  42           HD1      PHE  42  -1.756   2.683   1.830
  311    HE1  PHE  42           HE2      PHE  42  -0.692   3.008   6.622
  312    HE2  PHE  42           HE1      PHE  42  -0.301   4.491   2.644
  313    HZ   PHE  42           HZ       PHE  42   0.232   4.657   5.043
  314    HA   PRO  43           HA       PRO  43  -4.703  -4.165   3.735
  315   1HB   PRO  43          2HB       PRO  43  -6.571  -3.638   5.681
  316   2HB   PRO  43          1HB       PRO  43  -5.004  -4.395   5.987
  317   1HG   PRO  43          2HG       PRO  43  -5.828  -1.541   6.332
  318   2HG   PRO  43          1HG       PRO  43  -4.829  -2.555   7.389
  319   1HD   PRO  43          2HD       PRO  43  -3.737  -0.737   5.740
  320   2HD   PRO  43          1HD       PRO  43  -2.942  -2.291   6.069
  321    H    THR  44           H        THR  44  -6.326  -1.039   4.317
  322    HA   THR  44           HA       THR  44  -8.153  -1.695   2.102
  323    HB   THR  44           HB       THR  44  -9.831  -0.231   3.420
  324    HG1  THR  44           HG1      THR  44  -8.111  -1.036   5.526
  325   1HG2  THR  44          1HG2      THR  44  -9.185  -3.044   3.722
  326   2HG2  THR  44          2HG2      THR  44 -10.748  -2.249   3.531
  327   3HG2  THR  44          3HG2      THR  44 -10.008  -2.369   5.127
  328    H    GLN  45           H        GLN  45  -9.205   0.262   1.154
  329    HA   GLN  45           HA       GLN  45  -7.240   2.131   0.363
  330   1HB   GLN  45          2HB       GLN  45  -9.463   1.331  -0.802
  331   2HB   GLN  45          1HB       GLN  45 -10.157   2.710   0.039
  332   1HG   GLN  45          2HG       GLN  45  -7.928   3.802  -1.090
  333   2HG   GLN  45          1HG       GLN  45  -8.413   2.614  -2.299
  334   1HE2  GLN  45          1HE2      GLN  45  -9.402   5.447  -0.508
  335   2HE2  GLN  45          2HE2      GLN  45 -10.672   5.921  -1.579
  336    H    GLU  46           H        GLU  46  -9.662   2.143   2.868
  337    HA   GLU  46           HA       GLU  46  -9.874   4.869   3.386
  338   1HB   GLU  46          2HB       GLU  46 -10.889   2.597   4.514
  339   2HB   GLU  46          1HB       GLU  46  -9.797   3.151   5.775
  340   1HG   GLU  46          2HG       GLU  46 -12.089   3.977   6.064
  341   2HG   GLU  46          1HG       GLU  46 -10.915   5.278   5.876
  342    H    ALA  47           H        ALA  47  -7.490   2.519   4.533
  343    HA   ALA  47           HA       ALA  47  -6.100   4.382   6.191
  344   1HB   ALA  47          1HB       ALA  47  -4.345   2.610   6.260
  345   2HB   ALA  47          2HB       ALA  47  -5.315   1.677   5.122
  346   3HB   ALA  47          3HB       ALA  47  -5.953   2.056   6.723
  347    H    CYS  48           H        CYS  48  -5.993   3.544   2.832
  348    HA   CYS  48           HA       CYS  48  -3.400   4.284   2.147
  349   1HB   CYS  48          2HB       CYS  48  -4.980   3.187   0.599
  350   2HB   CYS  48          1HB       CYS  48  -5.919   4.672   0.516
  351    H    MET  49           H        MET  49  -6.341   6.299   2.157
  352    HA   MET  49           HA       MET  49  -4.727   8.691   1.784
  353   1HB   MET  49          2HB       MET  49  -7.712   8.274   1.964
  354   2HB   MET  49          1HB       MET  49  -6.954   9.843   1.741
  355   1HG   MET  49          2HG       MET  49  -5.802   8.570  -0.281
  356   2HG   MET  49          1HG       MET  49  -7.265   7.594  -0.156
  357   1HE   MET  49          1HE       MET  49  -5.754  10.979  -1.444
  358   2HE   MET  49          2HE       MET  49  -6.234  11.314   0.221
  359   3HE   MET  49          3HE       MET  49  -7.084  12.090  -1.116
  360    H    LYS  50           H        LYS  50  -6.431   7.016   4.311
  361    HA   LYS  50           HA       LYS  50  -6.602   9.200   6.124
  362   1HB   LYS  50          2HB       LYS  50  -8.039   7.221   6.312
  363   2HB   LYS  50          1HB       LYS  50  -6.634   6.228   6.670
  364   1HG   LYS  50          2HG       LYS  50  -7.759   6.699   8.716
  365   2HG   LYS  50          1HG       LYS  50  -6.248   7.611   8.700
  366   1HD   LYS  50          2HD       LYS  50  -7.923   9.418   7.593
  367   2HD   LYS  50          1HD       LYS  50  -9.041   8.557   8.652
  368   1HE   LYS  50          2HE       LYS  50  -7.193   8.873  10.443
  369   2HE   LYS  50          1HE       LYS  50  -6.593  10.129   9.359
  370   1HZ   LYS  50          1HZ       LYS  50  -8.144  10.919  11.118
  371   2HZ   LYS  50          2HZ       LYS  50  -9.380  10.036  10.371
  372   3HZ   LYS  50          3HZ       LYS  50  -8.629  11.306   9.544
  373    H    ARG  51           H        ARG  51  -3.996   7.230   5.126
  374    HA   ARG  51           HA       ARG  51  -2.461   7.953   7.529
  375   1HB   ARG  51          2HB       ARG  51  -2.762   5.485   6.575
  376   2HB   ARG  51          1HB       ARG  51  -1.405   5.977   5.572
  377   1HG   ARG  51          2HG       ARG  51  -0.556   4.859   7.501
  378   2HG   ARG  51          1HG       ARG  51  -0.165   6.575   7.640
  379   1HD   ARG  51          2HD       ARG  51  -0.957   5.649   9.764
  380   2HD   ARG  51          1HD       ARG  51  -2.039   6.899   9.153
  381    HE   ARG  51           HE       ARG  51  -3.689   5.322   8.920
  382   1HH1  ARG  51          1HH1      ARG  51  -0.637   3.716   9.457
  383   2HH1  ARG  51          2HH1      ARG  51  -1.355   2.155   9.675
  384   1HH2  ARG  51          1HH2      ARG  51  -4.634   3.270   9.205
  385   2HH2  ARG  51          2HH2      ARG  51  -3.624   1.901   9.531
  386    H    CYS  52           H        CYS  52  -2.607   8.269   4.058
  387    HA   CYS  52           HA       CYS  52  -0.025   9.675   4.075
  388   1HB   CYS  52          2HB       CYS  52  -1.428   8.019   2.111
  389   2HB   CYS  52          1HB       CYS  52  -0.782   9.508   1.431
  390    H    ALA  53           H        ALA  53  -3.440  10.119   3.539
  391    HA   ALA  53           HA       ALA  53  -3.012  12.821   2.511
  392   1HB   ALA  53          1HB       ALA  53  -4.831  10.965   1.792
  393   2HB   ALA  53          2HB       ALA  53  -5.055  12.701   1.572
  394   3HB   ALA  53          3HB       ALA  53  -5.766  11.890   2.968
  395    H    LYS  54           H        LYS  54  -4.816  11.220   5.136
  396    HA   LYS  54           HA       LYS  54  -5.467  13.665   6.440
  397   1HB   LYS  54          2HB       LYS  54  -5.791  10.778   7.000
  398   2HB   LYS  54          1HB       LYS  54  -5.757  11.833   8.406
  399   1HG   LYS  54          2HG       LYS  54  -8.033  11.407   7.608
  400   2HG   LYS  54          1HG       LYS  54  -7.607  13.118   7.532
  401   1HD   LYS  54          2HD       LYS  54  -7.157  12.915   5.147
  402   2HD   LYS  54          1HD       LYS  54  -7.525  11.191   5.211
  403   1HE   LYS  54          2HE       LYS  54  -9.748  11.539   5.219
  404   2HE   LYS  54          1HE       LYS  54  -9.624  12.937   6.286
  405   1HZ   LYS  54          1HZ       LYS  54  -8.651  13.249   3.551
  406   2HZ   LYS  54          2HZ       LYS  54  -9.438  14.362   4.551
  407   3HZ   LYS  54          3HZ       LYS  54 -10.327  13.155   3.766
  408    H    ALA  55           H        ALA  55  -3.261  11.024   7.386
  409    HA   ALA  55           HA       ALA  55  -2.072  12.397   9.526
  410   1HB   ALA  55          1HB       ALA  55  -1.503   9.953   7.987
  411   2HB   ALA  55          2HB       ALA  55  -1.538  10.218   9.730
  412   3HB   ALA  55          3HB       ALA  55  -0.116  10.683   8.795
  Start of MODEL    6
    1   1H    ILE   1          1H        ILE   1   6.662  15.329   3.182
    2   2H    ILE   1          2H        ILE   1   7.205  14.689   1.686
    3   3H    ILE   1          3H        ILE   1   8.338  15.093   2.909
    4    HA   ILE   1           HA       ILE   1   7.849  13.322   4.175
    5    HB   ILE   1           HB       ILE   1   5.759  11.936   3.748
    6   1HG1  ILE   1          2HG1      ILE   1   4.730  14.447   2.432
    7   2HG1  ILE   1          1HG1      ILE   1   5.376  13.105   1.492
    8   1HG2  ILE   1          1HG2      ILE   1   4.482  13.212   5.247
    9   2HG2  ILE   1          2HG2      ILE   1   5.150  14.733   4.656
   10   3HG2  ILE   1          3HG2      ILE   1   6.156  13.636   5.601
   11   1HD1  ILE   1          1HD1      ILE   1   3.088  12.740   1.491
   12   2HD1  ILE   1          2HD1      ILE   1   2.914  13.203   3.185
   13   3HD1  ILE   1          3HD1      ILE   1   3.673  11.668   2.764
   14    H    ASP   2           H        ASP   2   8.753  11.376   3.768
   15    HA   ASP   2           HA       ASP   2   9.159  10.675   0.949
   16   1HB   ASP   2          2HB       ASP   2  10.689  10.032   3.464
   17   2HB   ASP   2          1HB       ASP   2  10.967   9.156   1.963
   18    H    THR   3           H        THR   3   7.686   9.571   3.879
   19    HA   THR   3           HA       THR   3   7.536   6.834   3.475
   20    HB   THR   3           HB       THR   3   5.371   8.592   4.641
   21    HG1  THR   3           HG1      THR   3   7.208   9.038   5.757
   22   1HG2  THR   3          1HG2      THR   3   4.316   6.769   5.301
   23   2HG2  THR   3          2HG2      THR   3   5.796   6.098   5.986
   24   3HG2  THR   3          3HG2      THR   3   5.408   5.826   4.287
   25    H    CYS   4           H        CYS   4   5.737   9.421   1.968
   26    HA   CYS   4           HA       CYS   4   3.782   7.685   0.771
   27   1HB   CYS   4          2HB       CYS   4   4.010  10.439   1.223
   28   2HB   CYS   4          1HB       CYS   4   4.030  10.261  -0.527
   29    H    ARG   5           H        ARG   5   6.987   8.070   0.140
   30    HA   ARG   5           HA       ARG   5   6.626   7.650  -2.751
   31   1HB   ARG   5          2HB       ARG   5   9.195   8.494  -1.426
   32   2HB   ARG   5          1HB       ARG   5   8.777   8.573  -3.132
   33   1HG   ARG   5          2HG       ARG   5   7.086  10.289  -2.609
   34   2HG   ARG   5          1HG       ARG   5   7.598  10.243  -0.921
   35   1HD   ARG   5          2HD       ARG   5   9.975  10.608  -2.167
   36   2HD   ARG   5          1HD       ARG   5   8.893  11.466  -3.263
   37    HE   ARG   5           HE       ARG   5   8.508  12.143  -0.497
   38   1HH1  ARG   5          1HH1      ARG   5  10.333  12.849  -3.387
   39   2HH1  ARG   5          2HH1      ARG   5  10.730  14.460  -2.893
   40   1HH2  ARG   5          1HH2      ARG   5   9.028  14.262   0.154
   41   2HH2  ARG   5          2HH2      ARG   5   9.989  15.263  -0.883
   42    H    LEU   6           H        LEU   6   7.124   5.953   0.009
   43    HA   LEU   6           HA       LEU   6   9.289   4.264  -0.693
   44   1HB   LEU   6          2HB       LEU   6   6.986   3.505   1.089
   45   2HB   LEU   6          1HB       LEU   6   8.630   2.899   1.138
   46    HG   LEU   6           HG       LEU   6   7.740   5.682   1.893
   47   1HD1  LEU   6          1HD1      LEU   6   8.168   5.076   4.129
   48   2HD1  LEU   6          2HD1      LEU   6   8.946   3.567   3.653
   49   3HD1  LEU   6          3HD1      LEU   6   7.204   3.763   3.453
   50   1HD2  LEU   6          1HD2      LEU   6  10.490   4.498   2.182
   51   2HD2  LEU   6          2HD2      LEU   6   9.990   6.171   2.433
   52   3HD2  LEU   6          3HD2      LEU   6  10.013   5.492   0.806
   53    HA   PRO   7           HA       PRO   7   7.010   1.785  -3.637
   54   1HB   PRO   7          2HB       PRO   7   9.046   0.325  -4.547
   55   2HB   PRO   7          1HB       PRO   7   8.946   2.057  -4.890
   56   1HG   PRO   7          2HG       PRO   7  10.624   0.613  -2.884
   57   2HG   PRO   7          1HG       PRO   7  11.040   2.002  -3.903
   58   1HD   PRO   7          2HD       PRO   7  10.263   2.135  -1.233
   59   2HD   PRO   7          1HD       PRO   7  10.228   3.487  -2.382
   60    H    SER   8           H        SER   8   5.725   0.646  -2.078
   61    HA   SER   8           HA       SER   8   6.739  -1.539  -0.569
   62   1HB   SER   8          2HB       SER   8   4.005  -0.507  -1.224
   63   2HB   SER   8          1HB       SER   8   4.173  -2.105  -0.498
   64    HG   SER   8           HG       SER   8   5.377  -1.083   1.195
   65    H    ASP   9           H        ASP   9   6.911  -3.654  -1.037
   66    HA   ASP   9           HA       ASP   9   6.216  -4.478  -3.769
   67   1HB   ASP   9          2HB       ASP   9   8.564  -4.796  -2.264
   68   2HB   ASP   9          1HB       ASP   9   7.830  -6.396  -2.319
   69    H    ARG  10           H        ARG  10   4.600  -5.867  -4.090
   70    HA   ARG  10           HA       ARG  10   3.005  -6.797  -1.958
   71   1HB   ARG  10          2HB       ARG  10   1.835  -8.094  -3.747
   72   2HB   ARG  10          1HB       ARG  10   1.984  -6.379  -4.069
   73   1HG   ARG  10          2HG       ARG  10   2.791  -6.932  -6.057
   74   2HG   ARG  10          1HG       ARG  10   4.249  -7.469  -5.221
   75   1HD   ARG  10          2HD       ARG  10   3.606  -9.293  -6.540
   76   2HD   ARG  10          1HD       ARG  10   3.059  -9.698  -4.915
   77    HE   ARG  10           HE       ARG  10   0.829  -8.760  -5.759
   78   1HH1  ARG  10          1HH1      ARG  10   3.128 -10.495  -7.747
   79   2HH1  ARG  10          2HH1      ARG  10   1.926 -11.077  -8.846
   80   1HH2  ARG  10          1HH2      ARG  10  -0.752  -9.542  -7.225
   81   2HH2  ARG  10          2HH2      ARG  10  -0.266 -10.539  -8.551
   82    HN2  GLY  11           H        GLY  11   5.884  -8.037  -3.263
   83   1HA   GLY  11          2HA       GLY  11   7.027  -9.992  -2.919
   84   2HA   GLY  11          1HA       GLY  11   6.068 -10.133  -1.455
   85    H    ARG  12           H        ARG  12   6.770 -11.508  -4.428
   86    HA   ARG  12           HA       ARG  12   4.255 -12.781  -4.927
   87   1HB   ARG  12          2HB       ARG  12   6.697 -12.477  -6.299
   88   2HB   ARG  12          1HB       ARG  12   6.483 -14.208  -6.073
   89   1HG   ARG  12          2HG       ARG  12   4.169 -12.631  -7.062
   90   2HG   ARG  12          1HG       ARG  12   5.507 -12.945  -8.169
   91   1HD   ARG  12          2HD       ARG  12   4.898 -15.362  -6.802
   92   2HD   ARG  12          1HD       ARG  12   3.390 -14.678  -7.406
   93    HE   ARG  12           HE       ARG  12   5.517 -15.814  -8.956
   94   1HH1  ARG  12          1HH1      ARG  12   2.870 -13.541  -9.002
   95   2HH1  ARG  12          2HH1      ARG  12   2.660 -13.629 -10.719
   96   1HH2  ARG  12          1HH2      ARG  12   5.244 -15.930 -11.214
   97   2HH2  ARG  12          2HH2      ARG  12   4.009 -14.984 -11.975
   98    H    CYS  13           H        CYS  13   6.565 -13.241  -2.565
   99    HA   CYS  13           HA       CYS  13   7.025 -15.904  -2.282
  100   1HB   CYS  13          2HB       CYS  13   6.223 -14.077  -0.010
  101   2HB   CYS  13          1HB       CYS  13   7.191 -15.542   0.110
  102    H    LYS  14           H        LYS  14   4.464 -14.536  -0.236
  103    HA   LYS  14           HA       LYS  14   2.892 -16.968  -0.758
  104   1HB   LYS  14          2HB       LYS  14   2.853 -15.148   1.656
  105   2HB   LYS  14          1HB       LYS  14   1.855 -16.579   1.444
  106   1HG   LYS  14          2HG       LYS  14   3.505 -17.968   2.031
  107   2HG   LYS  14          1HG       LYS  14   4.719 -17.070   1.118
  108   1HD   LYS  14          2HD       LYS  14   5.510 -16.363   3.080
  109   2HD   LYS  14          1HD       LYS  14   4.055 -15.374   3.213
  110   1HE   LYS  14          2HE       LYS  14   3.680 -18.169   4.003
  111   2HE   LYS  14          1HE       LYS  14   4.835 -17.288   5.002
  112   1HZ   LYS  14          1HZ       LYS  14   3.100 -15.543   5.254
  113   2HZ   LYS  14          2HZ       LYS  14   2.694 -17.027   5.957
  114   3HZ   LYS  14          3HZ       LYS  14   2.003 -16.575   4.480
  115    H    ALA  15           H        ALA  15   2.739 -14.822  -2.560
  116    HA   ALA  15           HA       ALA  15   0.831 -12.891  -2.194
  117   1HB   ALA  15          1HB       ALA  15   0.285 -13.608  -4.743
  118   2HB   ALA  15          2HB       ALA  15   1.856 -14.377  -4.515
  119   3HB   ALA  15          3HB       ALA  15   1.680 -12.640  -4.263
  120    H    SER  16           H        SER  16  -0.956 -13.360  -1.002
  121    HA   SER  16           HA       SER  16  -2.915 -15.139  -2.259
  122   1HB   SER  16          2HB       SER  16  -2.638 -15.161   0.727
  123   2HB   SER  16          1HB       SER  16  -3.365 -16.369  -0.333
  124    HG   SER  16           HG       SER  16  -1.506 -17.325  -0.271
  125    H    PHE  17           H        PHE  17  -2.239 -12.375  -0.216
  126    HA   PHE  17           HA       PHE  17  -5.108 -11.719  -0.210
  127   1HB   PHE  17          2HB       PHE  17  -2.910 -10.685   1.594
  128   2HB   PHE  17          1HB       PHE  17  -4.605 -10.220   1.681
  129    HD1  PHE  17           HD2      PHE  17  -2.375 -13.188   1.883
  130    HD2  PHE  17           HD1      PHE  17  -6.062 -11.402   3.036
  131    HE1  PHE  17           HE2      PHE  17  -2.807 -15.073   3.405
  132    HE2  PHE  17           HE1      PHE  17  -6.501 -13.284   4.560
  133    HZ   PHE  17           HZ       PHE  17  -4.873 -15.122   4.745
  134    H    GLU  18           H        GLU  18  -5.465  -9.254  -0.130
  135    HA   GLU  18           HA       GLU  18  -3.700  -7.962  -2.103
  136   1HB   GLU  18          2HB       GLU  18  -5.772  -6.767  -2.907
  137   2HB   GLU  18          1HB       GLU  18  -5.708  -8.487  -3.267
  138   1HG   GLU  18          2HG       GLU  18  -7.106  -8.835  -1.186
  139   2HG   GLU  18          1HG       GLU  18  -7.348  -7.089  -1.179
  140    H    ARG  19           H        ARG  19  -3.193  -5.819  -1.773
  141    HA   ARG  19           HA       ARG  19  -4.440  -4.427   0.477
  142   1HB   ARG  19          2HB       ARG  19  -1.476  -4.942   0.217
  143   2HB   ARG  19          1HB       ARG  19  -2.168  -3.751   1.309
  144   1HG   ARG  19          2HG       ARG  19  -3.577  -5.861   2.095
  145   2HG   ARG  19          1HG       ARG  19  -2.153  -6.706   1.481
  146   1HD   ARG  19          2HD       ARG  19  -0.808  -5.907   3.117
  147   2HD   ARG  19          1HD       ARG  19  -1.642  -4.356   3.194
  148    HE   ARG  19           HE       ARG  19  -2.894  -5.183   4.906
  149   1HH1  ARG  19          1HH1      ARG  19  -1.583  -7.873   3.112
  150   2HH1  ARG  19          2HH1      ARG  19  -2.194  -9.065   4.208
  151   1HH2  ARG  19          1HH2      ARG  19  -3.698  -6.750   6.352
  152   2HH2  ARG  19          2HH2      ARG  19  -3.394  -8.428   6.048
  153    H    TRP  20           H        TRP  20  -3.488  -2.125   0.631
  154    HA   TRP  20           HA       TRP  20  -3.279  -1.071  -2.108
  155   1HB   TRP  20          2HB       TRP  20  -4.396   0.204   0.395
  156   2HB   TRP  20          1HB       TRP  20  -4.187   1.049  -1.136
  157    HD1  TRP  20           HD1      TRP  20  -6.285  -1.742   0.468
  158    HE1  TRP  20           HE1      TRP  20  -8.412  -2.072  -0.936
  159    HE3  TRP  20           HE3      TRP  20  -5.173   1.372  -3.430
  160    HZ2  TRP  20           HZ2      TRP  20  -9.478  -1.139  -3.369
  161    HZ3  TRP  20           HZ3      TRP  20  -6.804   1.594  -5.260
  162    HH2  TRP  20           HH2      TRP  20  -8.912   0.363  -5.229
  163    H    TYR  21           H        TYR  21  -1.895   0.698  -2.509
  164    HA   TYR  21           HA       TYR  21   0.092   1.361  -0.472
  165   1HB   TYR  21          2HB       TYR  21   1.843   1.045  -2.417
  166   2HB   TYR  21          1HB       TYR  21   1.356  -0.332  -1.434
  167    HD1  TYR  21           HD1      TYR  21  -0.764  -1.627  -2.372
  168    HD2  TYR  21           HD2      TYR  21   1.838   0.780  -4.719
  169    HE1  TYR  21           HE1      TYR  21  -1.509  -2.803  -4.385
  170    HE2  TYR  21           HE2      TYR  21   1.097  -0.395  -6.749
  171    HH   TYR  21           HH       TYR  21  -0.675  -1.709  -7.570
  172    H    PHE  22           H        PHE  22   0.614   3.468  -0.536
  173    HA   PHE  22           HA       PHE  22  -0.689   5.192  -2.384
  174   1HB   PHE  22          2HB       PHE  22   0.310   5.534   0.109
  175   2HB   PHE  22          1HB       PHE  22   1.589   6.280  -0.844
  176    HD1  PHE  22           HD1      PHE  22   1.007   8.153  -2.405
  177    HD2  PHE  22           HD2      PHE  22  -1.731   6.629   0.473
  178    HE1  PHE  22           HE1      PHE  22  -0.334  10.207  -2.599
  179    HE2  PHE  22           HE2      PHE  22  -3.077   8.680   0.286
  180    HZ   PHE  22           HZ       PHE  22  -2.380  10.472  -1.252
  181    H    ASN  23           H        ASN  23  -0.068   5.843  -4.320
  182    HA   ASN  23           HA       ASN  23   2.783   5.641  -5.035
  183   1HB   ASN  23          2HB       ASN  23   1.391   3.894  -6.135
  184   2HB   ASN  23          1HB       ASN  23   0.434   5.170  -6.882
  185   1HD2  ASN  23          1HD2      ASN  23   1.041   5.859  -8.803
  186   2HD2  ASN  23          2HD2      ASN  23   2.584   5.592  -9.533
  187    HN2  GLY  24           H        GLY  24   2.985   7.865  -4.406
  188   1HA   GLY  24          2HA       GLY  24   3.358  10.032  -5.148
  189   2HA   GLY  24          1HA       GLY  24   2.445   9.659  -6.601
  190    H    ARG  25           H        ARG  25   0.132   9.738  -6.505
  191    HA   ARG  25           HA       ARG  25  -0.912  11.313  -4.248
  192   1HB   ARG  25          2HB       ARG  25  -2.343  12.529  -5.911
  193   2HB   ARG  25          1HB       ARG  25  -0.624  12.877  -6.022
  194   1HG   ARG  25          2HG       ARG  25  -0.858  10.829  -7.785
  195   2HG   ARG  25          1HG       ARG  25  -2.425  11.619  -7.960
  196   1HD   ARG  25          2HD       ARG  25  -1.513  13.264  -9.142
  197   2HD   ARG  25          1HD       ARG  25  -0.353  13.596  -7.856
  198    HE   ARG  25           HE       ARG  25   0.114  12.115 -10.277
  199   1HH1  ARG  25          1HH1      ARG  25   1.180  12.660  -6.999
  200   2HH1  ARG  25          2HH1      ARG  25   2.795  12.113  -7.301
  201   1HH2  ARG  25          1HH2      ARG  25   2.236  11.397 -10.676
  202   2HH2  ARG  25          2HH2      ARG  25   3.395  11.398  -9.389
  203    H    THR  26           H        THR  26  -1.426   8.801  -6.593
  204    HA   THR  26           HA       THR  26  -4.126   8.346  -5.518
  205    HB   THR  26           HB       THR  26  -2.923   7.286  -8.082
  206    HG1  THR  26           HG1      THR  26  -4.258   8.825  -9.075
  207   1HG2  THR  26          1HG2      THR  26  -4.612   5.801  -7.724
  208   2HG2  THR  26          2HG2      THR  26  -5.492   7.086  -8.553
  209   3HG2  THR  26          3HG2      THR  26  -5.577   6.950  -6.796
  210    H    CYS  27           H        CYS  27  -4.773   6.129  -5.131
  211    HA   CYS  27           HA       CYS  27  -2.599   4.596  -3.960
  212   1HB   CYS  27          2HB       CYS  27  -5.588   4.148  -3.842
  213   2HB   CYS  27          1HB       CYS  27  -4.382   3.254  -2.925
  214    H    ALA  28           H        ALA  28  -2.687   2.189  -4.187
  215    HA   ALA  28           HA       ALA  28  -3.589   1.309  -6.832
  216   1HB   ALA  28          1HB       ALA  28  -0.782   1.242  -5.799
  217   2HB   ALA  28          2HB       ALA  28  -1.382   1.804  -7.358
  218   3HB   ALA  28          3HB       ALA  28  -1.340   0.078  -7.001
  219    H    LYS  29           H        LYS  29  -3.060  -1.222  -6.984
  220    HA   LYS  29           HA       LYS  29  -3.431  -2.515  -4.401
  221   1HB   LYS  29          2HB       LYS  29  -5.465  -3.659  -5.043
  222   2HB   LYS  29          1HB       LYS  29  -5.706  -1.920  -5.137
  223   1HG   LYS  29          2HG       LYS  29  -5.985  -1.939  -7.380
  224   2HG   LYS  29          1HG       LYS  29  -4.854  -3.272  -7.622
  225   1HD   LYS  29          2HD       LYS  29  -6.468  -4.830  -7.468
  226   2HD   LYS  29          1HD       LYS  29  -7.283  -3.993  -6.144
  227   1HE   LYS  29          2HE       LYS  29  -7.496  -3.420  -9.094
  228   2HE   LYS  29          1HE       LYS  29  -8.762  -4.011  -8.020
  229   1HZ   LYS  29          1HZ       LYS  29  -9.321  -1.854  -7.945
  230   2HZ   LYS  29          2HZ       LYS  29  -7.792  -1.313  -8.423
  231   3HZ   LYS  29          3HZ       LYS  29  -8.072  -1.733  -6.809
  232    H    PHE  30           H        PHE  30  -2.847  -4.649  -4.338
  233    HA   PHE  30           HA       PHE  30  -2.341  -6.178  -6.700
  234   1HB   PHE  30          2HB       PHE  30   0.121  -6.490  -6.175
  235   2HB   PHE  30          1HB       PHE  30  -0.329  -4.951  -6.894
  236    HD1  PHE  30           HD1      PHE  30  -1.195  -5.298  -3.406
  237    HD2  PHE  30           HD2      PHE  30   1.922  -4.216  -6.096
  238    HE1  PHE  30           HE1      PHE  30  -0.033  -4.132  -1.584
  239    HE2  PHE  30           HE2      PHE  30   3.086  -3.043  -4.275
  240    HZ   PHE  30           HZ       PHE  30   2.111  -3.000  -2.017
  241    H    ILE  31           H        ILE  31  -1.026  -8.267  -6.000
  242    HA   ILE  31           HA       ILE  31  -2.465  -9.308  -3.694
  243    HB   ILE  31           HB       ILE  31  -0.655 -10.744  -5.640
  244   1HG1  ILE  31          2HG1      ILE  31  -2.657  -9.774  -6.718
  245   2HG1  ILE  31          1HG1      ILE  31  -2.697 -11.535  -6.710
  246   1HG2  ILE  31          1HG2      ILE  31  -2.430 -11.692  -3.414
  247   2HG2  ILE  31          2HG2      ILE  31  -0.733 -12.069  -3.715
  248   3HG2  ILE  31          3HG2      ILE  31  -1.985 -12.747  -4.756
  249   1HD1  ILE  31          1HD1      ILE  31  -4.280 -11.545  -4.915
  250   2HD1  ILE  31          2HD1      ILE  31  -4.866 -10.474  -6.187
  251   3HD1  ILE  31          3HD1      ILE  31  -4.143  -9.797  -4.728
  252    H    TYR  32           H        TYR  32  -1.505  -8.768  -1.820
  253    HA   TYR  32           HA       TYR  32   1.384  -8.733  -1.596
  254   1HB   TYR  32          2HB       TYR  32   0.155  -6.924  -0.558
  255   2HB   TYR  32          1HB       TYR  32  -0.803  -8.063   0.380
  256    HD1  TYR  32           HD2      TYR  32   2.589  -6.650  -0.047
  257    HD2  TYR  32           HD1      TYR  32  -0.004  -8.926   2.440
  258    HE1  TYR  32           HE2      TYR  32   4.231  -6.515   1.777
  259    HE2  TYR  32           HE1      TYR  32   1.630  -8.795   4.273
  260    HH   TYR  32           HH       TYR  32   4.158  -8.456   4.466
  261    HN2  GLY  33           H        GLY  33   2.363 -10.614  -1.346
  262   1HA   GLY  33          2HA       GLY  33   1.089 -12.809   0.058
  263   2HA   GLY  33          1HA       GLY  33   2.652 -12.846  -0.747
  264    HN2  GLY  34           H        GLY  34   3.532 -10.394   0.691
  265   1HA   GLY  34          2HA       GLY  34   3.622 -10.064   3.234
  266   2HA   GLY  34          1HA       GLY  34   4.168 -11.732   3.238
  267    H    CYS  35           H        CYS  35   5.453 -10.454   0.487
  268    HA   CYS  35           HA       CYS  35   7.930  -9.739   1.908
  269   1HB   CYS  35          2HB       CYS  35   7.544 -10.958  -0.829
  270   2HB   CYS  35          1HB       CYS  35   9.091 -10.386  -0.223
  271    HN2  GLY  36           H        GLY  36   7.901  -7.572   2.090
  272   1HA   GLY  36          2HA       GLY  36   8.757  -5.640   0.780
  273   2HA   GLY  36          1HA       GLY  36   7.513  -6.023  -0.399
  274    HN2  GLY  37           H        GLY  37   8.178  -4.661   2.746
  275   1HA   GLY  37          2HA       GLY  37   5.755  -3.075   2.556
  276   2HA   GLY  37          1HA       GLY  37   5.814  -4.183   3.919
  277    H    ASN  38           H        ASN  38   6.425  -1.080   2.979
  278    HA   ASN  38           HA       ASN  38   8.466  -0.722   5.068
  279   1HB   ASN  38          2HB       ASN  38   8.661   1.596   3.735
  280   2HB   ASN  38          1HB       ASN  38   9.588   0.166   3.297
  281   1HD2  ASN  38          1HD2      ASN  38   9.775   0.551   1.154
  282   2HD2  ASN  38          2HD2      ASN  38   8.439   0.594   0.059
  283    HN2  GLY  39           H        GLY  39   6.550   1.851   3.603
  284   1HA   GLY  39          2HA       GLY  39   5.031   2.100   6.106
  285   2HA   GLY  39          1HA       GLY  39   5.980   3.465   5.548
  286    H    ASN  40           H        ASN  40   4.874   1.976   2.809
  287    HA   ASN  40           HA       ASN  40   2.554   3.783   2.720
  288   1HB   ASN  40          2HB       ASN  40   2.867   4.008   0.369
  289   2HB   ASN  40          1HB       ASN  40   4.447   4.212   1.113
  290   1HD2  ASN  40          1HD2      ASN  40   2.680   2.609  -1.227
  291   2HD2  ASN  40          2HD2      ASN  40   3.841   1.405  -1.653
  292    H    LYS  41           H        LYS  41   3.432   0.505   2.752
  293    HA   LYS  41           HA       LYS  41   1.229  -0.487   1.201
  294   1HB   LYS  41          2HB       LYS  41   3.590  -1.565   2.183
  295   2HB   LYS  41          1HB       LYS  41   2.348  -2.359   3.140
  296   1HG   LYS  41          2HG       LYS  41   2.009  -2.218   0.187
  297   2HG   LYS  41          1HG       LYS  41   3.158  -3.373   0.867
  298   1HD   LYS  41          2HD       LYS  41   0.253  -3.156   1.654
  299   2HD   LYS  41          1HD       LYS  41   0.907  -4.339   0.517
  300   1HE   LYS  41          2HE       LYS  41   1.019  -5.621   2.376
  301   2HE   LYS  41          1HE       LYS  41   2.546  -4.767   2.593
  302   1HZ   LYS  41          1HZ       LYS  41   0.474  -3.228   3.704
  303   2HZ   LYS  41          2HZ       LYS  41   1.791  -3.944   4.487
  304   3HZ   LYS  41          3HZ       LYS  41   0.348  -4.805   4.304
  305    H    PHE  42           H        PHE  42  -0.798  -0.219   1.883
  306    HA   PHE  42           HA       PHE  42  -1.375  -0.662   4.738
  307   1HB   PHE  42          2HB       PHE  42  -2.871   1.146   2.829
  308   2HB   PHE  42          1HB       PHE  42  -3.233   0.912   4.536
  309    HD1  PHE  42           HD2      PHE  42  -1.233   1.425   6.165
  310    HD2  PHE  42           HD1      PHE  42  -1.589   2.947   2.206
  311    HE1  PHE  42           HE2      PHE  42   0.291   3.269   6.741
  312    HE2  PHE  42           HE1      PHE  42  -0.064   4.792   2.774
  313    HZ   PHE  42           HZ       PHE  42   0.878   4.955   5.045
  314    HA   PRO  43           HA       PRO  43  -3.999  -4.041   3.682
  315   1HB   PRO  43          2HB       PRO  43  -5.967  -2.924   5.602
  316   2HB   PRO  43          1HB       PRO  43  -5.205  -4.517   5.570
  317   1HG   PRO  43          2HG       PRO  43  -4.470  -2.682   7.360
  318   2HG   PRO  43          1HG       PRO  43  -3.278  -3.762   6.612
  319   1HD   PRO  43          2HD       PRO  43  -3.864  -0.887   6.030
  320   2HD   PRO  43          1HD       PRO  43  -2.306  -1.737   6.072
  321    H    THR  44           H        THR  44  -6.128  -1.275   4.443
  322    HA   THR  44           HA       THR  44  -7.580  -1.822   1.943
  323    HB   THR  44           HB       THR  44  -9.391  -0.401   3.108
  324    HG1  THR  44           HG1      THR  44  -9.211  -0.140   5.253
  325   1HG2  THR  44          1HG2      THR  44  -8.636  -3.131   4.098
  326   2HG2  THR  44          2HG2      THR  44  -9.830  -2.705   2.872
  327   3HG2  THR  44          3HG2      THR  44 -10.125  -2.308   4.565
  328    H    GLN  45           H        GLN  45  -8.684   0.183   1.023
  329    HA   GLN  45           HA       GLN  45  -6.659   2.088   0.380
  330   1HB   GLN  45          2HB       GLN  45  -8.392   3.142  -1.011
  331   2HB   GLN  45          1HB       GLN  45  -8.307   1.407  -1.280
  332   1HG   GLN  45          2HG       GLN  45 -10.204   1.383   0.552
  333   2HG   GLN  45          1HG       GLN  45 -10.444   3.033  -0.021
  334   1HE2  GLN  45          1HE2      GLN  45 -10.899   3.346  -2.271
  335   2HE2  GLN  45          2HE2      GLN  45 -11.684   2.101  -3.177
  336    H    GLU  46           H        GLU  46  -9.361   2.008   2.586
  337    HA   GLU  46           HA       GLU  46  -9.771   4.701   3.076
  338   1HB   GLU  46          2HB       GLU  46 -10.781   2.420   4.113
  339   2HB   GLU  46          1HB       GLU  46  -9.762   2.932   5.452
  340   1HG   GLU  46          2HG       GLU  46 -11.407   5.071   4.335
  341   2HG   GLU  46          1HG       GLU  46 -12.331   3.732   5.016
  342    H    ALA  47           H        ALA  47  -7.287   2.549   4.353
  343    HA   ALA  47           HA       ALA  47  -6.179   4.541   6.107
  344   1HB   ALA  47          1HB       ALA  47  -5.677   2.509   6.979
  345   2HB   ALA  47          2HB       ALA  47  -4.228   2.721   5.997
  346   3HB   ALA  47          3HB       ALA  47  -5.563   1.734   5.399
  347    H    CYS  48           H        CYS  48  -5.698   3.511   2.822
  348    HA   CYS  48           HA       CYS  48  -3.112   4.436   2.345
  349   1HB   CYS  48          2HB       CYS  48  -4.356   3.073   0.736
  350   2HB   CYS  48          1HB       CYS  48  -5.485   4.395   0.466
  351    H    MET  49           H        MET  49  -6.212   6.145   1.935
  352    HA   MET  49           HA       MET  49  -4.836   8.638   1.409
  353   1HB   MET  49          2HB       MET  49  -7.798   8.151   1.752
  354   2HB   MET  49          1HB       MET  49  -7.040   9.573   1.049
  355   1HG   MET  49          2HG       MET  49  -6.657   8.563  -0.934
  356   2HG   MET  49          1HG       MET  49  -6.398   6.980  -0.205
  357   1HE   MET  49          1HE       MET  49  -9.013   9.558   0.230
  358   2HE   MET  49          2HE       MET  49 -10.549   8.726  -0.013
  359   3HE   MET  49          3HE       MET  49  -9.690   9.412  -1.392
  360    H    LYS  50           H        LYS  50  -6.563   7.101   4.038
  361    HA   LYS  50           HA       LYS  50  -6.828   9.433   5.646
  362   1HB   LYS  50          2HB       LYS  50  -8.222   7.389   5.897
  363   2HB   LYS  50          1HB       LYS  50  -6.814   6.541   6.519
  364   1HG   LYS  50          2HG       LYS  50  -6.713   8.294   8.333
  365   2HG   LYS  50          1HG       LYS  50  -8.299   8.831   7.774
  366   1HD   LYS  50          2HD       LYS  50  -9.079   7.330   9.256
  367   2HD   LYS  50          1HD       LYS  50  -8.693   6.151   8.003
  368   1HE   LYS  50          2HE       LYS  50  -6.330   6.178   9.113
  369   2HE   LYS  50          1HE       LYS  50  -7.203   6.826  10.502
  370   1HZ   LYS  50          1HZ       LYS  50  -7.459   4.654  10.969
  371   2HZ   LYS  50          2HZ       LYS  50  -7.244   4.154   9.367
  372   3HZ   LYS  50          3HZ       LYS  50  -8.743   4.753   9.870
  373    H    ARG  51           H        ARG  51  -4.118   7.604   4.824
  374    HA   ARG  51           HA       ARG  51  -2.735   8.354   7.307
  375   1HB   ARG  51          2HB       ARG  51  -2.744   5.939   6.639
  376   2HB   ARG  51          1HB       ARG  51  -1.810   6.382   5.217
  377   1HG   ARG  51          2HG       ARG  51  -0.263   5.586   6.798
  378   2HG   ARG  51          1HG       ARG  51  -0.091   7.343   6.791
  379   1HD   ARG  51          2HD       ARG  51  -0.073   6.543   9.067
  380   2HD   ARG  51          1HD       ARG  51  -1.551   7.459   8.778
  381    HE   ARG  51           HE       ARG  51  -2.308   4.912   8.293
  382   1HH1  ARG  51          1HH1      ARG  51  -0.668   6.434  10.971
  383   2HH1  ARG  51          2HH1      ARG  51  -1.300   5.332  12.147
  384   1HH2  ARG  51          1HH2      ARG  51  -3.142   3.461   9.838
  385   2HH2  ARG  51          2HH2      ARG  51  -2.704   3.643  11.505
  386    H    CYS  52           H        CYS  52  -2.648   8.691   3.806
  387    HA   CYS  52           HA       CYS  52  -0.368  10.533   4.125
  388   1HB   CYS  52          2HB       CYS  52  -0.560   8.270   2.490
  389   2HB   CYS  52          1HB       CYS  52  -0.735   9.640   1.399
  390    H    ALA  53           H        ALA  53  -3.569  10.108   2.807
  391    HA   ALA  53           HA       ALA  53  -3.459  12.594   1.320
  392   1HB   ALA  53          1HB       ALA  53  -5.996  11.098   1.818
  393   2HB   ALA  53          2HB       ALA  53  -4.785  10.441   0.715
  394   3HB   ALA  53          3HB       ALA  53  -5.496  12.024   0.404
  395    H    LYS  54           H        LYS  54  -4.557  11.455   4.418
  396    HA   LYS  54           HA       LYS  54  -5.764  14.082   4.952
  397   1HB   LYS  54          2HB       LYS  54  -6.487  11.364   5.707
  398   2HB   LYS  54          1HB       LYS  54  -6.404  12.438   7.097
  399   1HG   LYS  54          2HG       LYS  54  -8.203  13.642   6.449
  400   2HG   LYS  54          1HG       LYS  54  -7.848  13.454   4.731
  401   1HD   LYS  54          2HD       LYS  54  -9.486  11.943   4.663
  402   2HD   LYS  54          1HD       LYS  54  -8.436  10.880   5.602
  403   1HE   LYS  54          2HE       LYS  54  -9.461  12.417   7.570
  404   2HE   LYS  54          1HE       LYS  54 -10.805  12.429   6.429
  405   1HZ   LYS  54          1HZ       LYS  54 -11.312  10.538   7.523
  406   2HZ   LYS  54          2HZ       LYS  54  -9.718  10.229   7.995
  407   3HZ   LYS  54          3HZ       LYS  54 -10.224   9.850   6.426
  408    H    ALA  55           H        ALA  55  -4.091  11.556   6.836
  409    HA   ALA  55           HA       ALA  55  -3.147  13.271   8.834
  410   1HB   ALA  55          1HB       ALA  55  -1.523  11.433   9.328
  411   2HB   ALA  55          2HB       ALA  55  -2.107  10.607   7.885
  412   3HB   ALA  55          3HB       ALA  55  -3.207  10.917   9.229
  Start of MODEL    7
    1   1H    ILE   1          1H        ILE   1   4.516  11.695   6.113
    2   2H    ILE   1          2H        ILE   1   6.202  11.397   6.007
    3   3H    ILE   1          3H        ILE   1   5.087  10.292   5.314
    4    HA   ILE   1           HA       ILE   1   4.335  12.063   3.840
    5    HB   ILE   1           HB       ILE   1   5.229  13.904   5.299
    6   1HG1  ILE   1          2HG1      ILE   1   4.522  14.179   2.898
    7   2HG1  ILE   1          1HG1      ILE   1   5.664  15.385   3.476
    8   1HG2  ILE   1          1HG2      ILE   1   7.542  14.555   5.131
    9   2HG2  ILE   1          2HG2      ILE   1   7.876  13.214   4.036
   10   3HG2  ILE   1          3HG2      ILE   1   7.441  12.895   5.715
   11   1HD1  ILE   1          1HD1      ILE   1   6.745  14.947   1.574
   12   2HD1  ILE   1          2HD1      ILE   1   5.935  13.396   1.356
   13   3HD1  ILE   1          3HD1      ILE   1   7.334  13.517   2.421
   14    H    ASP   2           H        ASP   2   7.640  11.082   4.677
   15    HA   ASP   2           HA       ASP   2   8.500  10.837   1.972
   16   1HB   ASP   2          2HB       ASP   2  10.427   9.572   3.005
   17   2HB   ASP   2          1HB       ASP   2  10.179  11.199   3.632
   18    H    THR   3           H        THR   3   6.871   8.746   4.214
   19    HA   THR   3           HA       THR   3   7.457   6.247   3.122
   20    HB   THR   3           HB       THR   3   4.859   7.146   4.381
   21    HG1  THR   3           HG1      THR   3   6.012   7.300   6.108
   22   1HG2  THR   3          1HG2      THR   3   4.404   5.032   3.527
   23   2HG2  THR   3          2HG2      THR   3   4.880   4.732   5.199
   24   3HG2  THR   3          3HG2      THR   3   6.024   4.435   3.890
   25    H    CYS   4           H        CYS   4   5.101   8.676   2.159
   26    HA   CYS   4           HA       CYS   4   3.723   7.055   0.282
   27   1HB   CYS   4          2HB       CYS   4   3.965  10.063   0.199
   28   2HB   CYS   4          1HB       CYS   4   2.665   9.071  -0.450
   29    H    ARG   5           H        ARG   5   6.818   8.428   0.226
   30    HA   ARG   5           HA       ARG   5   6.925   8.694  -2.667
   31   1HB   ARG   5          2HB       ARG   5   9.182   8.987  -0.682
   32   2HB   ARG   5          1HB       ARG   5   9.148   9.555  -2.346
   33   1HG   ARG   5          2HG       ARG   5   7.384  11.143  -1.769
   34   2HG   ARG   5          1HG       ARG   5   7.422  10.574  -0.098
   35   1HD   ARG   5          2HD       ARG   5   9.632  11.959  -1.609
   36   2HD   ARG   5          1HD       ARG   5   8.703  12.600  -0.255
   37    HE   ARG   5           HE       ARG   5   9.895  10.287   0.661
   38   1HH1  ARG   5          1HH1      ARG   5  10.952  13.353  -0.629
   39   2HH1  ARG   5          2HH1      ARG   5  12.442  13.353   0.254
   40   1HH2  ARG   5          1HH2      ARG   5  11.855  10.286   1.824
   41   2HH2  ARG   5          2HH2      ARG   5  12.954  11.612   1.647
   42    H    LEU   6           H        LEU   6   7.922   6.477  -0.154
   43    HA   LEU   6           HA       LEU   6   9.500   4.901  -2.023
   44   1HB   LEU   6          2HB       LEU   6  10.176   3.593  -0.142
   45   2HB   LEU   6          1HB       LEU   6  10.288   5.287   0.295
   46    HG   LEU   6           HG       LEU   6   7.785   4.689   1.189
   47   1HD1  LEU   6          1HD1      LEU   6   8.746   2.454   2.526
   48   2HD1  LEU   6          2HD1      LEU   6   9.165   2.175   0.837
   49   3HD1  LEU   6          3HD1      LEU   6   7.490   2.490   1.289
   50   1HD2  LEU   6          1HD2      LEU   6   9.443   5.899   2.449
   51   2HD2  LEU   6          2HD2      LEU   6  10.411   4.438   2.647
   52   3HD2  LEU   6          3HD2      LEU   6   8.836   4.562   3.427
   53    HA   PRO   7           HA       PRO   7   5.785   2.591  -3.117
   54   1HB   PRO   7          2HB       PRO   7   7.821   0.839  -4.382
   55   2HB   PRO   7          1HB       PRO   7   6.377   1.577  -5.085
   56   1HG   PRO   7          2HG       PRO   7   8.806   2.513  -5.659
   57   2HG   PRO   7          1HG       PRO   7   7.429   3.609  -5.447
   58   1HD   PRO   7          2HD       PRO   7   9.671   2.991  -3.566
   59   2HD   PRO   7          1HD       PRO   7   8.868   4.540  -3.893
   60    H    SER   8           H        SER   8   4.931   0.504  -2.649
   61    HA   SER   8           HA       SER   8   6.422  -0.911  -0.543
   62   1HB   SER   8          2HB       SER   8   3.664  -0.023  -0.754
   63   2HB   SER   8          1HB       SER   8   3.763  -1.748  -0.401
   64    HG   SER   8           HG       SER   8   4.532  -1.313   1.516
   65    H    ASP   9           H        ASP   9   6.947  -2.992  -0.805
   66    HA   ASP   9           HA       ASP   9   6.217  -4.282  -3.311
   67   1HB   ASP   9          2HB       ASP   9   8.335  -4.681  -1.254
   68   2HB   ASP   9          1HB       ASP   9   7.835  -6.085  -2.191
   69    H    ARG  10           H        ARG  10   5.077  -6.181  -3.477
   70    HA   ARG  10           HA       ARG  10   3.345  -6.780  -1.235
   71   1HB   ARG  10          2HB       ARG  10   2.189  -8.254  -2.872
   72   2HB   ARG  10          1HB       ARG  10   2.286  -6.573  -3.371
   73   1HG   ARG  10          2HG       ARG  10   4.547  -7.696  -4.474
   74   2HG   ARG  10          1HG       ARG  10   3.337  -8.969  -4.634
   75   1HD   ARG  10          2HD       ARG  10   2.460  -6.241  -5.346
   76   2HD   ARG  10          1HD       ARG  10   3.656  -6.977  -6.415
   77    HE   ARG  10           HE       ARG  10   1.338  -8.603  -5.773
   78   1HH1  ARG  10          1HH1      ARG  10   2.835  -6.399  -8.034
   79   2HH1  ARG  10          2HH1      ARG  10   1.859  -6.910  -9.369
   80   1HH2  ARG  10          1HH2      ARG  10   0.054  -9.270  -7.533
   81   2HH2  ARG  10          2HH2      ARG  10   0.281  -8.536  -9.085
   82    HN2  GLY  11           H        GLY  11   6.263  -8.028  -2.422
   83   1HA   GLY  11          2HA       GLY  11   7.454  -9.925  -1.927
   84   2HA   GLY  11          1HA       GLY  11   6.469  -9.994  -0.477
   85    H    ARG  12           H        ARG  12   7.428 -11.794  -2.981
   86    HA   ARG  12           HA       ARG  12   4.908 -13.054  -3.628
   87   1HB   ARG  12          2HB       ARG  12   7.274 -12.819  -4.968
   88   2HB   ARG  12          1HB       ARG  12   7.394 -14.460  -4.348
   89   1HG   ARG  12          2HG       ARG  12   5.288 -15.038  -5.409
   90   2HG   ARG  12          1HG       ARG  12   5.111 -13.382  -5.990
   91   1HD   ARG  12          2HD       ARG  12   7.651 -14.196  -6.827
   92   2HD   ARG  12          1HD       ARG  12   6.596 -15.577  -7.123
   93    HE   ARG  12           HE       ARG  12   5.514 -13.081  -8.047
   94   1HH1  ARG  12          1HH1      ARG  12   7.579 -15.775  -8.857
   95   2HH1  ARG  12          2HH1      ARG  12   7.393 -15.565 -10.566
   96   1HH2  ARG  12          1HH2      ARG  12   5.268 -12.803 -10.292
   97   2HH2  ARG  12          2HH2      ARG  12   6.082 -13.877 -11.381
   98    H    CYS  13           H        CYS  13   6.773 -13.170  -0.944
   99    HA   CYS  13           HA       CYS  13   7.188 -15.870  -0.423
  100   1HB   CYS  13          2HB       CYS  13   6.966 -15.153   2.036
  101   2HB   CYS  13          1HB       CYS  13   8.229 -14.402   1.072
  102    H    LYS  14           H        LYS  14   4.454 -13.922   0.837
  103    HA   LYS  14           HA       LYS  14   2.898 -16.413   0.958
  104   1HB   LYS  14          2HB       LYS  14   3.024 -14.011   2.702
  105   2HB   LYS  14          1HB       LYS  14   1.457 -14.786   2.513
  106   1HG   LYS  14          2HG       LYS  14   3.951 -16.242   3.356
  107   2HG   LYS  14          1HG       LYS  14   2.784 -15.549   4.483
  108   1HD   LYS  14          2HD       LYS  14   1.088 -17.029   3.808
  109   2HD   LYS  14          1HD       LYS  14   1.956 -17.485   2.341
  110   1HE   LYS  14          2HE       LYS  14   3.060 -18.050   5.075
  111   2HE   LYS  14          1HE       LYS  14   1.933 -19.152   4.285
  112   1HZ   LYS  14          1HZ       LYS  14   4.570 -19.300   4.004
  113   2HZ   LYS  14          2HZ       LYS  14   4.206 -18.302   2.687
  114   3HZ   LYS  14          3HZ       LYS  14   3.483 -19.826   2.819
  115    H    ALA  15           H        ALA  15   3.194 -14.867  -1.450
  116    HA   ALA  15           HA       ALA  15   1.230 -13.049  -2.043
  117   1HB   ALA  15          1HB       ALA  15   1.385 -13.790  -4.357
  118   2HB   ALA  15          2HB       ALA  15   2.187 -15.273  -3.838
  119   3HB   ALA  15          3HB       ALA  15   2.981 -13.715  -3.611
  120    H    SER  16           H        SER  16  -0.761 -13.335  -1.126
  121    HA   SER  16           HA       SER  16  -2.605 -15.013  -2.476
  122   1HB   SER  16          2HB       SER  16  -1.509 -15.946   0.138
  123   2HB   SER  16          1HB       SER  16  -3.229 -16.185  -0.175
  124    HG   SER  16           HG       SER  16  -1.211 -16.972  -1.999
  125    H    PHE  17           H        PHE  17  -2.319 -12.237  -1.743
  126    HA   PHE  17           HA       PHE  17  -4.965 -11.814  -0.674
  127   1HB   PHE  17          2HB       PHE  17  -2.627 -10.567   0.779
  128   2HB   PHE  17          1HB       PHE  17  -4.333 -10.419   1.188
  129    HD1  PHE  17           HD2      PHE  17  -5.526 -12.257   2.239
  130    HD2  PHE  17           HD1      PHE  17  -1.376 -12.542   1.336
  131    HE1  PHE  17           HE2      PHE  17  -5.340 -14.211   3.724
  132    HE2  PHE  17           HE1      PHE  17  -1.183 -14.497   2.819
  133    HZ   PHE  17           HZ       PHE  17  -3.167 -15.332   4.015
  134    H    GLU  18           H        GLU  18  -5.332  -9.331  -0.460
  135    HA   GLU  18           HA       GLU  18  -3.948  -7.970  -2.678
  136   1HB   GLU  18          2HB       GLU  18  -6.897  -7.822  -2.020
  137   2HB   GLU  18          1HB       GLU  18  -6.084  -6.910  -3.285
  138   1HG   GLU  18          2HG       GLU  18  -5.783  -8.776  -4.618
  139   2HG   GLU  18          1HG       GLU  18  -5.972  -9.895  -3.268
  140    H    ARG  19           H        ARG  19  -3.744  -5.681  -2.487
  141    HA   ARG  19           HA       ARG  19  -4.651  -4.386  -0.068
  142   1HB   ARG  19          2HB       ARG  19  -1.757  -5.058  -0.519
  143   2HB   ARG  19          1HB       ARG  19  -2.228  -3.674   0.458
  144   1HG   ARG  19          2HG       ARG  19  -3.760  -5.585   1.576
  145   2HG   ARG  19          1HG       ARG  19  -2.380  -6.552   1.048
  146   1HD   ARG  19          2HD       ARG  19  -0.866  -5.071   2.248
  147   2HD   ARG  19          1HD       ARG  19  -2.221  -4.055   2.735
  148    HE   ARG  19           HE       ARG  19  -2.519  -6.788   3.545
  149   1HH1  ARG  19          1HH1      ARG  19  -1.084  -3.721   4.385
  150   2HH1  ARG  19          2HH1      ARG  19  -1.010  -4.077   6.079
  151   1HH2  ARG  19          1HH2      ARG  19  -2.424  -7.259   5.771
  152   2HH2  ARG  19          2HH2      ARG  19  -1.771  -6.086   6.865
  153    H    TRP  20           H        TRP  20  -3.778  -2.086   0.039
  154    HA   TRP  20           HA       TRP  20  -3.643  -0.991  -2.693
  155   1HB   TRP  20          2HB       TRP  20  -4.852   0.195  -0.186
  156   2HB   TRP  20          1HB       TRP  20  -4.677   1.063  -1.706
  157    HD1  TRP  20           HD1      TRP  20  -6.703  -1.749  -0.085
  158    HE1  TRP  20           HE1      TRP  20  -8.776  -2.210  -1.532
  159    HE3  TRP  20           HE3      TRP  20  -5.576   1.226  -4.087
  160    HZ2  TRP  20           HZ2      TRP  20  -9.799  -1.422  -4.032
  161    HZ3  TRP  20           HZ3      TRP  20  -7.160   1.315  -5.969
  162    HH2  TRP  20           HH2      TRP  20  -9.228   0.017  -5.942
  163    H    TYR  21           H        TYR  21  -2.252   0.739  -3.104
  164    HA   TYR  21           HA       TYR  21  -0.368   1.500  -0.989
  165   1HB   TYR  21          2HB       TYR  21   1.446   1.266  -2.881
  166   2HB   TYR  21          1HB       TYR  21   0.967  -0.147  -1.945
  167    HD1  TYR  21           HD1      TYR  21  -1.142  -1.421  -2.984
  168    HD2  TYR  21           HD2      TYR  21   1.572   1.007  -5.179
  169    HE1  TYR  21           HE1      TYR  21  -1.811  -2.551  -5.043
  170    HE2  TYR  21           HE2      TYR  21   0.909  -0.130  -7.259
  171    HH   TYR  21           HH       TYR  21  -0.194  -2.599  -7.760
  172    H    PHE  22           H        PHE  22   0.504   3.549  -1.216
  173    HA   PHE  22           HA       PHE  22  -0.993   5.380  -2.796
  174   1HB   PHE  22          2HB       PHE  22   0.565   5.581  -0.541
  175   2HB   PHE  22          1HB       PHE  22   1.567   6.370  -1.755
  176    HD1  PHE  22           HD2      PHE  22  -1.803   6.389  -0.226
  177    HD2  PHE  22           HD1      PHE  22   1.098   8.545  -2.470
  178    HE1  PHE  22           HE2      PHE  22  -3.154   8.430  -0.000
  179    HE2  PHE  22           HE1      PHE  22  -0.247  10.592  -2.248
  180    HZ   PHE  22           HZ       PHE  22  -2.378  10.538  -1.013
  181    H    ASN  23           H        ASN  23  -0.735   5.805  -4.874
  182    HA   ASN  23           HA       ASN  23   1.859   5.244  -6.128
  183   1HB   ASN  23          2HB       ASN  23  -0.597   4.394  -6.890
  184   2HB   ASN  23          1HB       ASN  23  -0.470   5.873  -7.839
  185   1HD2  ASN  23          1HD2      ASN  23   0.246   5.523  -9.797
  186   2HD2  ASN  23          2HD2      ASN  23   1.413   4.338 -10.266
  187    HN2  GLY  24           H        GLY  24   2.130   7.462  -4.789
  188   1HA   GLY  24          2HA       GLY  24   2.833   9.637  -5.043
  189   2HA   GLY  24          1HA       GLY  24   2.609   9.438  -6.773
  190    H    ARG  25           H        ARG  25   0.400   9.669  -7.609
  191    HA   ARG  25           HA       ARG  25  -0.950  11.854  -6.231
  192   1HB   ARG  25          2HB       ARG  25  -0.454  12.239  -8.555
  193   2HB   ARG  25          1HB       ARG  25  -1.224  10.728  -9.020
  194   1HG   ARG  25          2HG       ARG  25  -2.876  12.745  -7.603
  195   2HG   ARG  25          1HG       ARG  25  -2.437  13.058  -9.284
  196   1HD   ARG  25          2HD       ARG  25  -3.259  10.660  -9.721
  197   2HD   ARG  25          1HD       ARG  25  -4.034  10.789  -8.144
  198    HE   ARG  25           HE       ARG  25  -5.605  12.173  -9.067
  199   1HH1  ARG  25          1HH1      ARG  25  -2.888  11.944 -11.246
  200   2HH1  ARG  25          2HH1      ARG  25  -3.685  12.794 -12.528
  201   1HH2  ARG  25          1HH2      ARG  25  -6.655  13.290 -10.751
  202   2HH2  ARG  25          2HH2      ARG  25  -5.822  13.559 -12.246
  203    H    THR  26           H        THR  26  -1.755   8.711  -7.686
  204    HA   THR  26           HA       THR  26  -4.173   8.655  -5.998
  205    HB   THR  26           HB       THR  26  -4.745   8.832  -8.369
  206    HG1  THR  26           HG1      THR  26  -5.251   6.154  -7.663
  207   1HG2  THR  26          1HG2      THR  26  -2.813   7.858  -9.422
  208   2HG2  THR  26          2HG2      THR  26  -4.266   6.987  -9.915
  209   3HG2  THR  26          3HG2      THR  26  -3.182   6.286  -8.713
  210    H    CYS  27           H        CYS  27  -4.961   6.292  -5.726
  211    HA   CYS  27           HA       CYS  27  -2.712   4.805  -4.641
  212   1HB   CYS  27          2HB       CYS  27  -5.137   5.276  -3.595
  213   2HB   CYS  27          1HB       CYS  27  -5.483   3.754  -4.411
  214    H    ALA  28           H        ALA  28  -2.952   2.321  -4.822
  215    HA   ALA  28           HA       ALA  28  -3.825   1.503  -7.487
  216   1HB   ALA  28          1HB       ALA  28  -1.015   1.451  -6.492
  217   2HB   ALA  28          2HB       ALA  28  -1.641   1.942  -8.065
  218   3HB   ALA  28          3HB       ALA  28  -1.570   0.234  -7.641
  219    H    LYS  29           H        LYS  29  -3.306  -1.016  -7.696
  220    HA   LYS  29           HA       LYS  29  -3.816  -2.345  -5.142
  221   1HB   LYS  29          2HB       LYS  29  -5.769  -1.932  -7.245
  222   2HB   LYS  29          1HB       LYS  29  -5.523  -3.645  -6.930
  223   1HG   LYS  29          2HG       LYS  29  -5.927  -1.803  -4.628
  224   2HG   LYS  29          1HG       LYS  29  -7.316  -2.274  -5.609
  225   1HD   LYS  29          2HD       LYS  29  -6.048  -4.667  -5.203
  226   2HD   LYS  29          1HD       LYS  29  -5.758  -3.827  -3.678
  227   1HE   LYS  29          2HE       LYS  29  -8.300  -3.273  -3.827
  228   2HE   LYS  29          1HE       LYS  29  -8.343  -4.639  -4.939
  229   1HZ   LYS  29          1HZ       LYS  29  -8.609  -4.871  -2.302
  230   2HZ   LYS  29          2HZ       LYS  29  -6.938  -5.097  -2.442
  231   3HZ   LYS  29          3HZ       LYS  29  -8.001  -6.105  -3.289
  232    H    PHE  30           H        PHE  30  -3.042  -4.377  -4.977
  233    HA   PHE  30           HA       PHE  30  -2.231  -5.904  -7.270
  234   1HB   PHE  30          2HB       PHE  30   0.159  -6.082  -6.513
  235   2HB   PHE  30          1HB       PHE  30  -0.287  -4.522  -7.185
  236    HD1  PHE  30           HD2      PHE  30  -1.598  -4.935  -3.892
  237    HD2  PHE  30           HD1      PHE  30   1.933  -3.929  -6.047
  238    HE1  PHE  30           HE2      PHE  30  -0.699  -3.830  -1.894
  239    HE2  PHE  30           HE1      PHE  30   2.837  -2.821  -4.047
  240    HZ   PHE  30           HZ       PHE  30   1.521  -2.770  -1.967
  241    H    ILE  31           H        ILE  31  -0.903  -7.923  -6.413
  242    HA   ILE  31           HA       ILE  31  -2.550  -9.035  -4.287
  243    HB   ILE  31           HB       ILE  31  -0.447 -10.377  -5.993
  244   1HG1  ILE  31          2HG1      ILE  31  -2.361  -9.505  -7.302
  245   2HG1  ILE  31          1HG1      ILE  31  -2.294 -11.265  -7.304
  246   1HG2  ILE  31          1HG2      ILE  31  -1.330 -12.459  -5.204
  247   2HG2  ILE  31          2HG2      ILE  31  -2.617 -11.636  -4.324
  248   3HG2  ILE  31          3HG2      ILE  31  -0.942 -11.462  -3.803
  249   1HD1  ILE  31          1HD1      ILE  31  -4.106 -11.425  -5.802
  250   2HD1  ILE  31          2HD1      ILE  31  -4.571 -10.243  -7.027
  251   3HD1  ILE  31          3HD1      ILE  31  -4.045  -9.701  -5.433
  252    H    TYR  32           H        TYR  32  -1.884  -8.674  -2.273
  253    HA   TYR  32           HA       TYR  32   0.931  -8.300  -1.689
  254   1HB   TYR  32          2HB       TYR  32  -0.854  -6.825  -0.732
  255   2HB   TYR  32          1HB       TYR  32  -1.401  -8.200   0.221
  256    HD1  TYR  32           HD2      TYR  32   1.511  -5.978  -0.377
  257    HD2  TYR  32           HD1      TYR  32  -0.368  -8.730   2.267
  258    HE1  TYR  32           HE2      TYR  32   3.146  -5.407   1.367
  259    HE2  TYR  32           HE1      TYR  32   1.262  -8.167   4.020
  260    HH   TYR  32           HH       TYR  32   4.085  -6.328   3.383
  261    HN2  GLY  33           H        GLY  33   2.233  -9.826  -1.002
  262   1HA   GLY  33          2HA       GLY  33   1.128 -12.398  -0.179
  263   2HA   GLY  33          1HA       GLY  33   2.807 -12.068  -0.581
  264    HN2  GLY  34           H        GLY  34   3.571 -10.089   1.034
  265   1HA   GLY  34          2HA       GLY  34   2.780  -9.817   3.596
  266   2HA   GLY  34          1HA       GLY  34   3.562 -11.388   3.621
  267    H    CYS  35           H        CYS  35   5.514 -10.409   1.506
  268    HA   CYS  35           HA       CYS  35   7.191  -8.877   3.377
  269   1HB   CYS  35          2HB       CYS  35   9.107  -9.819   1.908
  270   2HB   CYS  35          1HB       CYS  35   8.337 -10.873   3.085
  271    HN2  GLY  36           H        GLY  36   8.656  -7.299   2.530
  272   1HA   GLY  36          2HA       GLY  36   9.440  -5.913   0.740
  273   2HA   GLY  36          1HA       GLY  36   7.974  -6.298  -0.145
  274    HN2  GLY  37           H        GLY  37   6.010  -5.752   1.688
  275   1HA   GLY  37          2HA       GLY  37   5.723  -2.978   1.464
  276   2HA   GLY  37          1HA       GLY  37   4.755  -4.016   2.501
  277    H    ASN  38           H        ASN  38   5.248  -1.521   3.366
  278    HA   ASN  38           HA       ASN  38   6.671  -2.004   5.803
  279   1HB   ASN  38          2HB       ASN  38   8.091   0.175   5.351
  280   2HB   ASN  38          1HB       ASN  38   8.668  -1.402   4.821
  281   1HD2  ASN  38          1HD2      ASN  38   9.857  -0.767   3.106
  282   2HD2  ASN  38          2HD2      ASN  38   9.205  -0.002   1.701
  283    HN2  GLY  39           H        GLY  39   5.913   0.918   3.900
  284   1HA   GLY  39          2HA       GLY  39   3.886   1.606   5.917
  285   2HA   GLY  39          1HA       GLY  39   5.152   2.763   5.547
  286    H    ASN  40           H        ASN  40   4.692   1.368   2.667
  287    HA   ASN  40           HA       ASN  40   2.866   3.478   1.815
  288   1HB   ASN  40          2HB       ASN  40   4.989   3.240   0.613
  289   2HB   ASN  40          1HB       ASN  40   4.584   1.578   0.202
  290   1HD2  ASN  40          1HD2      ASN  40   3.642   4.931  -0.250
  291   2HD2  ASN  40          2HD2      ASN  40   2.853   4.698  -1.769
  292    H    LYS  41           H        LYS  41   2.919   0.081   2.348
  293    HA   LYS  41           HA       LYS  41   0.705  -0.514   0.597
  294   1HB   LYS  41          2HB       LYS  41   0.796  -2.757   1.755
  295   2HB   LYS  41          1HB       LYS  41   2.266  -2.279   0.915
  296   1HG   LYS  41          2HG       LYS  41   3.445  -2.502   2.772
  297   2HG   LYS  41          1HG       LYS  41   2.396  -1.363   3.617
  298   1HD   LYS  41          2HD       LYS  41   0.817  -3.220   4.064
  299   2HD   LYS  41          1HD       LYS  41   1.962  -4.334   3.314
  300   1HE   LYS  41          2HE       LYS  41   3.648  -3.381   5.023
  301   2HE   LYS  41          1HE       LYS  41   2.218  -2.799   5.875
  302   1HZ   LYS  41          1HZ       LYS  41   2.838  -4.925   6.741
  303   2HZ   LYS  41          2HZ       LYS  41   2.855  -5.619   5.199
  304   3HZ   LYS  41          3HZ       LYS  41   1.393  -5.110   5.881
  305    H    PHE  42           H        PHE  42  -1.325  -1.420   1.386
  306    HA   PHE  42           HA       PHE  42  -2.115  -0.888   4.108
  307   1HB   PHE  42          2HB       PHE  42  -3.467   0.648   1.880
  308   2HB   PHE  42          1HB       PHE  42  -3.866   0.712   3.594
  309    HD1  PHE  42           HD2      PHE  42  -2.152   1.653   5.191
  310    HD2  PHE  42           HD1      PHE  42  -1.836   2.049   0.967
  311    HE1  PHE  42           HE2      PHE  42  -0.573   3.516   5.489
  312    HE2  PHE  42           HE1      PHE  42  -0.255   3.912   1.254
  313    HZ   PHE  42           HZ       PHE  42   0.378   4.649   3.518
  314    HA   PRO  43           HA       PRO  43  -4.832  -4.234   3.125
  315   1HB   PRO  43          2HB       PRO  43  -6.674  -3.978   5.090
  316   2HB   PRO  43          1HB       PRO  43  -5.025  -4.535   5.401
  317   1HG   PRO  43          2HG       PRO  43  -6.206  -1.809   5.780
  318   2HG   PRO  43          1HG       PRO  43  -5.129  -2.720   6.854
  319   1HD   PRO  43          2HD       PRO  43  -4.243  -0.751   5.210
  320   2HD   PRO  43          1HD       PRO  43  -3.247  -2.151   5.657
  321    H    THR  44           H        THR  44  -6.267  -1.043   3.650
  322    HA   THR  44           HA       THR  44  -8.236  -1.662   1.556
  323    HB   THR  44           HB       THR  44  -9.773  -0.065   2.947
  324    HG1  THR  44           HG1      THR  44  -9.384  -0.091   5.116
  325   1HG2  THR  44          1HG2      THR  44 -10.541  -2.006   4.381
  326   2HG2  THR  44          2HG2      THR  44  -9.255  -2.939   3.618
  327   3HG2  THR  44          3HG2      THR  44 -10.547  -2.250   2.634
  328    H    GLN  45           H        GLN  45  -9.322   0.432   0.782
  329    HA   GLN  45           HA       GLN  45  -7.252   2.203  -0.086
  330   1HB   GLN  45          2HB       GLN  45  -9.492   1.437  -1.260
  331   2HB   GLN  45          1HB       GLN  45 -10.143   2.856  -0.451
  332   1HG   GLN  45          2HG       GLN  45  -8.108   4.068  -1.519
  333   2HG   GLN  45          1HG       GLN  45  -8.092   2.682  -2.608
  334   1HE2  GLN  45          1HE2      GLN  45  -8.659   3.882  -4.398
  335   2HE2  GLN  45          2HE2      GLN  45 -10.238   4.547  -4.615
  336    H    GLU  46           H        GLU  46  -9.757   2.294   2.348
  337    HA   GLU  46           HA       GLU  46  -9.872   5.028   2.858
  338   1HB   GLU  46          2HB       GLU  46 -10.572   4.357   5.167
  339   2HB   GLU  46          1HB       GLU  46 -11.468   3.562   3.879
  340   1HG   GLU  46          2HG       GLU  46 -11.044   1.673   4.968
  341   2HG   GLU  46          1HG       GLU  46  -9.405   1.819   4.333
  342    H    ALA  47           H        ALA  47  -7.568   2.601   3.946
  343    HA   ALA  47           HA       ALA  47  -6.202   4.384   5.737
  344   1HB   ALA  47          1HB       ALA  47  -6.318   1.682   5.522
  345   2HB   ALA  47          2HB       ALA  47  -5.092   2.559   6.436
  346   3HB   ALA  47          3HB       ALA  47  -4.747   2.014   4.795
  347    H    CYS  48           H        CYS  48  -5.961   3.515   2.381
  348    HA   CYS  48           HA       CYS  48  -3.333   4.202   1.808
  349   1HB   CYS  48          2HB       CYS  48  -4.783   3.126   0.173
  350   2HB   CYS  48          1HB       CYS  48  -5.808   4.554   0.102
  351    H    MET  49           H        MET  49  -6.224   6.278   1.781
  352    HA   MET  49           HA       MET  49  -4.568   8.637   1.382
  353   1HB   MET  49          2HB       MET  49  -7.540   8.650   1.826
  354   2HB   MET  49          1HB       MET  49  -6.557   9.821   0.961
  355   1HG   MET  49          2HG       MET  49  -6.951   8.779  -0.943
  356   2HG   MET  49          1HG       MET  49  -6.246   7.296  -0.302
  357   1HE   MET  49          1HE       MET  49  -9.871   8.862  -1.422
  358   2HE   MET  49          2HE       MET  49  -9.183   9.587   0.031
  359   3HE   MET  49          3HE       MET  49 -10.609   8.557   0.151
  360    H    LYS  50           H        LYS  50  -6.267   7.013   3.945
  361    HA   LYS  50           HA       LYS  50  -6.415   9.219   5.730
  362   1HB   LYS  50          2HB       LYS  50  -7.832   7.226   5.966
  363   2HB   LYS  50          1HB       LYS  50  -6.412   6.258   6.332
  364   1HG   LYS  50          2HG       LYS  50  -6.228   8.261   8.180
  365   2HG   LYS  50          1HG       LYS  50  -7.972   8.032   8.044
  366   1HD   LYS  50          2HD       LYS  50  -6.001   5.797   8.508
  367   2HD   LYS  50          1HD       LYS  50  -6.882   6.624   9.795
  368   1HE   LYS  50          2HE       LYS  50  -8.997   5.995   8.507
  369   2HE   LYS  50          1HE       LYS  50  -7.968   4.893   7.594
  370   1HZ   LYS  50          1HZ       LYS  50  -7.771   3.496   9.330
  371   2HZ   LYS  50          2HZ       LYS  50  -9.222   4.209   9.831
  372   3HZ   LYS  50          3HZ       LYS  50  -7.753   4.732  10.487
  373    H    ARG  51           H        ARG  51  -3.862   7.059   4.847
  374    HA   ARG  51           HA       ARG  51  -2.284   7.904   7.172
  375   1HB   ARG  51          2HB       ARG  51  -2.599   5.417   6.277
  376   2HB   ARG  51          1HB       ARG  51  -1.249   5.880   5.251
  377   1HG   ARG  51          2HG       ARG  51  -0.353   4.822   7.173
  378   2HG   ARG  51          1HG       ARG  51  -0.014   6.547   7.320
  379   1HD   ARG  51          2HD       ARG  51  -0.751   5.879   9.450
  380   2HD   ARG  51          1HD       ARG  51  -2.131   6.693   8.715
  381    HE   ARG  51           HE       ARG  51  -3.275   4.702   8.714
  382   1HH1  ARG  51          1HH1      ARG  51   0.094   4.090   9.396
  383   2HH1  ARG  51          2HH1      ARG  51  -0.168   2.435   9.834
  384   1HH2  ARG  51          1HH2      ARG  51  -3.620   2.527   9.291
  385   2HH2  ARG  51          2HH2      ARG  51  -2.275   1.548   9.774
  386    H    CYS  52           H        CYS  52  -2.445   8.132   3.689
  387    HA   CYS  52           HA       CYS  52   0.116   9.583   3.688
  388   1HB   CYS  52          2HB       CYS  52  -1.214   7.819   1.749
  389   2HB   CYS  52          1HB       CYS  52  -0.506   9.269   1.046
  390    H    ALA  53           H        ALA  53  -3.264   9.807   2.678
  391    HA   ALA  53           HA       ALA  53  -2.910  12.468   1.611
  392   1HB   ALA  53          1HB       ALA  53  -4.640  10.570   0.953
  393   2HB   ALA  53          2HB       ALA  53  -5.014  12.282   0.763
  394   3HB   ALA  53          3HB       ALA  53  -5.622  11.396   2.162
  395    H    LYS  54           H        LYS  54  -3.824  11.020   4.626
  396    HA   LYS  54           HA       LYS  54  -5.006  13.444   5.669
  397   1HB   LYS  54          2HB       LYS  54  -5.522  10.920   6.269
  398   2HB   LYS  54          1HB       LYS  54  -4.221  11.162   7.427
  399   1HG   LYS  54          2HG       LYS  54  -6.785  12.729   7.244
  400   2HG   LYS  54          1HG       LYS  54  -6.337  11.564   8.493
  401   1HD   LYS  54          2HD       LYS  54  -4.480  13.010   9.170
  402   2HD   LYS  54          1HD       LYS  54  -4.929  14.173   7.921
  403   1HE   LYS  54          2HE       LYS  54  -6.955  14.705   9.004
  404   2HE   LYS  54          1HE       LYS  54  -6.841  13.307  10.072
  405   1HZ   LYS  54          1HZ       LYS  54  -5.545  15.905  10.271
  406   2HZ   LYS  54          2HZ       LYS  54  -4.611  14.571  10.727
  407   3HZ   LYS  54          3HZ       LYS  54  -6.090  14.869  11.493
  408    H    ALA  55           H        ALA  55  -2.260  11.417   6.714
  409    HA   ALA  55           HA       ALA  55  -1.128  13.566   8.245
  410   1HB   ALA  55          1HB       ALA  55  -0.669  11.536   9.224
  411   2HB   ALA  55          2HB       ALA  55   0.833  11.839   8.350
  412   3HB   ALA  55          3HB       ALA  55  -0.368  10.738   7.680
  Start of MODEL    8
    1   1H    ILE   1          1H        ILE   1   6.941  13.107   6.929
    2   2H    ILE   1          2H        ILE   1   7.665  13.876   5.576
    3   3H    ILE   1          3H        ILE   1   8.231  12.342   6.099
    4    HA   ILE   1           HA       ILE   1   6.016  11.447   5.629
    5    HB   ILE   1           HB       ILE   1   4.806  13.580   5.658
    6   1HG1  ILE   1          2HG1      ILE   1   3.589  13.252   3.413
    7   2HG1  ILE   1          1HG1      ILE   1   4.732  11.943   3.131
    8   1HG2  ILE   1          1HG2      ILE   1   6.839  14.340   3.770
    9   2HG2  ILE   1          2HG2      ILE   1   5.694  15.348   4.655
   10   3HG2  ILE   1          3HG2      ILE   1   5.230  14.638   3.109
   11   1HD1  ILE   1          1HD1      ILE   1   2.986  12.092   5.567
   12   2HD1  ILE   1          2HD1      ILE   1   3.918  10.716   4.976
   13   3HD1  ILE   1          3HD1      ILE   1   2.508  11.277   4.078
   14    H    ASP   2           H        ASP   2   8.064  10.381   4.855
   15    HA   ASP   2           HA       ASP   2   8.500  10.871   1.987
   16   1HB   ASP   2          2HB       ASP   2  10.317   9.314   3.825
   17   2HB   ASP   2          1HB       ASP   2  10.677   9.919   2.211
   18    H    THR   3           H        THR   3   7.276   8.628   4.273
   19    HA   THR   3           HA       THR   3   7.668   6.181   3.028
   20    HB   THR   3           HB       THR   3   5.123   6.980   4.438
   21    HG1  THR   3           HG1      THR   3   6.206   7.152   6.212
   22   1HG2  THR   3          1HG2      THR   3   6.485   4.383   4.853
   23   2HG2  THR   3          2HG2      THR   3   5.577   4.620   3.359
   24   3HG2  THR   3          3HG2      THR   3   4.771   4.790   4.919
   25    H    CYS   4           H        CYS   4   5.257   8.670   2.382
   26    HA   CYS   4           HA       CYS   4   3.698   7.151   0.574
   27   1HB   CYS   4          2HB       CYS   4   3.908   9.999   1.355
   28   2HB   CYS   4          1HB       CYS   4   3.217   9.681  -0.233
   29    H    ARG   5           H        ARG   5   6.807   8.461   0.268
   30    HA   ARG   5           HA       ARG   5   6.641   8.830  -2.613
   31   1HB   ARG   5          2HB       ARG   5   9.217   8.908  -1.093
   32   2HB   ARG   5          1HB       ARG   5   8.730   9.834  -2.506
   33   1HG   ARG   5          2HG       ARG   5   7.777  10.234   0.320
   34   2HG   ARG   5          1HG       ARG   5   8.872  11.279  -0.586
   35   1HD   ARG   5          2HD       ARG   5   7.043  11.659  -2.229
   36   2HD   ARG   5          1HD       ARG   5   5.969  10.734  -1.182
   37    HE   ARG   5           HE       ARG   5   5.833  12.537   0.230
   38   1HH1  ARG   5          1HH1      ARG   5   8.455  13.038  -2.018
   39   2HH1  ARG   5          2HH1      ARG   5   8.706  14.687  -1.552
   40   1HH2  ARG   5          1HH2      ARG   5   6.161  14.706   0.843
   41   2HH2  ARG   5          2HH2      ARG   5   7.404  15.633   0.073
   42    H    LEU   6           H        LEU   6   7.878   6.530  -0.277
   43    HA   LEU   6           HA       LEU   6   9.177   4.963  -2.356
   44   1HB   LEU   6          2HB       LEU   6  10.037   3.595  -0.593
   45   2HB   LEU   6          1HB       LEU   6  10.248   5.275  -0.143
   46    HG   LEU   6           HG       LEU   6   7.836   4.691   1.019
   47   1HD1  LEU   6          1HD1      LEU   6   7.769   2.571   1.894
   48   2HD1  LEU   6          2HD1      LEU   6   9.505   2.322   1.711
   49   3HD1  LEU   6          3HD1      LEU   6   8.450   2.255   0.299
   50   1HD2  LEU   6          1HD2      LEU   6  10.611   4.454   2.174
   51   2HD2  LEU   6          2HD2      LEU   6   9.131   4.574   3.123
   52   3HD2  LEU   6          3HD2      LEU   6   9.622   5.911   2.084
   53    HA   PRO   7           HA       PRO   7   5.554   2.411  -2.812
   54   1HB   PRO   7          2HB       PRO   7   6.521   0.647  -4.577
   55   2HB   PRO   7          1HB       PRO   7   6.234   2.333  -5.025
   56   1HG   PRO   7          2HG       PRO   7   8.801   0.974  -4.312
   57   2HG   PRO   7          1HG       PRO   7   8.477   2.150  -5.598
   58   1HD   PRO   7          2HD       PRO   7   9.605   2.779  -3.166
   59   2HD   PRO   7          1HD       PRO   7   8.725   3.932  -4.188
   60    H    SER   8           H        SER   8   4.874   0.170  -2.504
   61    HA   SER   8           HA       SER   8   6.614  -1.239  -0.593
   62   1HB   SER   8          2HB       SER   8   3.771  -0.596  -0.587
   63   2HB   SER   8          1HB       SER   8   4.066  -2.313  -0.310
   64    HG   SER   8           HG       SER   8   4.555  -1.752   1.644
   65    H    ASP   9           H        ASP   9   7.180  -3.318  -0.943
   66    HA   ASP   9           HA       ASP   9   6.454  -4.469  -3.522
   67   1HB   ASP   9          2HB       ASP   9   8.705  -4.770  -1.630
   68   2HB   ASP   9          1HB       ASP   9   8.224  -6.238  -2.474
   69    H    ARG  10           H        ARG  10   5.070  -6.094  -3.758
   70    HA   ARG  10           HA       ARG  10   3.647  -7.114  -1.492
   71   1HB   ARG  10          2HB       ARG  10   2.578  -8.582  -3.329
   72   2HB   ARG  10          1HB       ARG  10   2.285  -6.849  -3.353
   73   1HG   ARG  10          2HG       ARG  10   3.320  -6.581  -5.319
   74   2HG   ARG  10          1HG       ARG  10   4.628  -7.687  -4.892
   75   1HD   ARG  10          2HD       ARG  10   3.681  -8.993  -6.464
   76   2HD   ARG  10          1HD       ARG  10   2.596  -9.434  -5.152
   77    HE   ARG  10           HE       ARG  10   0.975  -7.909  -6.052
   78   1HH1  ARG  10          1HH1      ARG  10   3.740  -8.508  -8.113
   79   2HH1  ARG  10          2HH1      ARG  10   2.929  -8.012  -9.558
   80   1HH2  ARG  10          1HH2      ARG  10  -0.085  -7.251  -7.987
   81   2HH2  ARG  10          2HH2      ARG  10   0.774  -7.302  -9.487
   82    HN2  GLY  11           H        GLY  11   6.583  -7.984  -2.775
   83   1HA   GLY  11          2HA       GLY  11   7.892  -9.863  -2.671
   84   2HA   GLY  11          1HA       GLY  11   6.997 -10.197  -1.202
   85    H    ARG  12           H        ARG  12   7.872 -12.330  -2.486
   86    HA   ARG  12           HA       ARG  12   5.582 -13.335  -4.039
   87   1HB   ARG  12          2HB       ARG  12   8.069 -13.312  -4.923
   88   2HB   ARG  12          1HB       ARG  12   8.197 -14.774  -3.954
   89   1HG   ARG  12          2HG       ARG  12   5.833 -15.040  -5.434
   90   2HG   ARG  12          1HG       ARG  12   7.041 -14.404  -6.551
   91   1HD   ARG  12          2HD       ARG  12   8.539 -16.265  -5.411
   92   2HD   ARG  12          1HD       ARG  12   6.966 -16.996  -5.096
   93    HE   ARG  12           HE       ARG  12   7.334 -16.172  -7.825
   94   1HH1  ARG  12          1HH1      ARG  12   7.842 -18.742  -5.520
   95   2HH1  ARG  12          2HH1      ARG  12   7.910 -19.981  -6.728
   96   1HH2  ARG  12          1HH2      ARG  12   7.422 -17.800  -9.415
   97   2HH2  ARG  12          2HH2      ARG  12   7.672 -19.446  -8.939
   98    H    CYS  13           H        CYS  13   7.086 -13.507  -1.035
   99    HA   CYS  13           HA       CYS  13   7.101 -16.055  -0.173
  100   1HB   CYS  13          2HB       CYS  13   6.106 -15.083   2.043
  101   2HB   CYS  13          1HB       CYS  13   7.682 -14.552   1.475
  102    H    LYS  14           H        LYS  14   4.182 -14.308   0.835
  103    HA   LYS  14           HA       LYS  14   2.640 -16.703   0.114
  104   1HB   LYS  14          2HB       LYS  14   2.045 -14.615   2.219
  105   2HB   LYS  14          1HB       LYS  14   1.054 -16.025   1.869
  106   1HG   LYS  14          2HG       LYS  14   3.920 -16.388   2.609
  107   2HG   LYS  14          1HG       LYS  14   2.723 -16.054   3.862
  108   1HD   LYS  14          2HD       LYS  14   1.622 -18.050   3.528
  109   2HD   LYS  14          1HD       LYS  14   2.170 -18.193   1.856
  110   1HE   LYS  14          2HE       LYS  14   3.307 -19.850   3.147
  111   2HE   LYS  14          1HE       LYS  14   4.473 -18.598   2.723
  112   1HZ   LYS  14          1HZ       LYS  14   3.610 -17.692   5.067
  113   2HZ   LYS  14          2HZ       LYS  14   4.942 -18.722   4.905
  114   3HZ   LYS  14          3HZ       LYS  14   3.430 -19.355   5.324
  115    H    ALA  15           H        ALA  15   2.994 -15.146  -2.002
  116    HA   ALA  15           HA       ALA  15   1.279 -12.967  -2.366
  117   1HB   ALA  15          1HB       ALA  15   1.537 -13.360  -4.754
  118   2HB   ALA  15          2HB       ALA  15   2.197 -14.964  -4.430
  119   3HB   ALA  15          3HB       ALA  15   3.081 -13.525  -3.918
  120    H    SER  16           H        SER  16  -0.763 -13.306  -1.540
  121    HA   SER  16           HA       SER  16  -2.610 -14.638  -3.266
  122   1HB   SER  16          2HB       SER  16  -2.103 -15.817  -0.529
  123   2HB   SER  16          1HB       SER  16  -3.508 -16.196  -1.525
  124    HG   SER  16           HG       SER  16  -1.877 -16.792  -3.175
  125    H    PHE  17           H        PHE  17  -2.087 -12.007  -1.851
  126    HA   PHE  17           HA       PHE  17  -4.847 -11.642  -0.933
  127   1HB   PHE  17          2HB       PHE  17  -2.361 -10.818   0.563
  128   2HB   PHE  17          1HB       PHE  17  -3.925 -10.064   0.853
  129    HD1  PHE  17           HD2      PHE  17  -1.946 -13.122   1.196
  130    HD2  PHE  17           HD1      PHE  17  -5.693 -11.258   1.971
  131    HE1  PHE  17           HE2      PHE  17  -2.518 -14.931   2.763
  132    HE2  PHE  17           HE1      PHE  17  -6.271 -13.063   3.540
  133    HZ   PHE  17           HZ       PHE  17  -4.683 -14.902   3.937
  134    H    GLU  18           H        GLU  18  -5.403  -9.263  -0.793
  135    HA   GLU  18           HA       GLU  18  -3.950  -7.748  -2.863
  136   1HB   GLU  18          2HB       GLU  18  -6.124  -6.775  -3.540
  137   2HB   GLU  18          1HB       GLU  18  -6.053  -8.514  -3.792
  138   1HG   GLU  18          2HG       GLU  18  -7.165  -7.580  -1.219
  139   2HG   GLU  18          1HG       GLU  18  -8.131  -7.292  -2.666
  140    H    ARG  19           H        ARG  19  -3.493  -5.631  -2.431
  141    HA   ARG  19           HA       ARG  19  -4.772  -4.337  -0.148
  142   1HB   ARG  19          2HB       ARG  19  -1.768  -4.391  -0.293
  143   2HB   ARG  19          1HB       ARG  19  -2.787  -3.876   1.043
  144   1HG   ARG  19          2HG       ARG  19  -2.672  -6.716   0.069
  145   2HG   ARG  19          1HG       ARG  19  -1.621  -6.080   1.335
  146   1HD   ARG  19          2HD       ARG  19  -4.408  -5.431   1.803
  147   2HD   ARG  19          1HD       ARG  19  -4.149  -7.170   1.668
  148    HE   ARG  19           HE       ARG  19  -2.252  -5.887   3.389
  149   1HH1  ARG  19          1HH1      ARG  19  -5.461  -7.246   3.223
  150   2HH1  ARG  19          2HH1      ARG  19  -5.536  -7.596   4.917
  151   1HH2  ARG  19          1HH2      ARG  19  -2.346  -6.347   5.616
  152   2HH2  ARG  19          2HH2      ARG  19  -3.768  -7.086   6.276
  153    H    TRP  20           H        TRP  20  -3.759  -2.045   0.122
  154    HA   TRP  20           HA       TRP  20  -3.552  -0.871  -2.570
  155   1HB   TRP  20          2HB       TRP  20  -4.540   0.374   0.007
  156   2HB   TRP  20          1HB       TRP  20  -4.425   1.203  -1.541
  157    HD1  TRP  20           HD1      TRP  20  -6.471  -1.497   0.259
  158    HE1  TRP  20           HE1      TRP  20  -8.685  -1.823  -1.005
  159    HE3  TRP  20           HE3      TRP  20  -5.526   1.454  -3.807
  160    HZ2  TRP  20           HZ2      TRP  20  -9.873  -0.950  -3.403
  161    HZ3  TRP  20           HZ3      TRP  20  -7.258   1.654  -5.544
  162    HH2  TRP  20           HH2      TRP  20  -9.388   0.476  -5.345
  163    H    TYR  21           H        TYR  21  -2.077   0.836  -2.925
  164    HA   TYR  21           HA       TYR  21  -0.076   1.344  -0.848
  165   1HB   TYR  21          2HB       TYR  21   1.687   1.049  -2.765
  166   2HB   TYR  21          1HB       TYR  21   1.102  -0.370  -1.900
  167    HD1  TYR  21           HD1      TYR  21  -1.107  -1.410  -2.980
  168    HD2  TYR  21           HD2      TYR  21   1.780   0.902  -5.075
  169    HE1  TYR  21           HE1      TYR  21  -1.880  -2.372  -5.083
  170    HE2  TYR  21           HE2      TYR  21   1.012  -0.067  -7.205
  171    HH   TYR  21           HH       TYR  21  -0.818  -1.165  -8.168
  172    H    PHE  22           H        PHE  22   0.916   3.335  -1.003
  173    HA   PHE  22           HA       PHE  22  -0.454   5.313  -2.531
  174   1HB   PHE  22          2HB       PHE  22   0.908   5.415  -0.218
  175   2HB   PHE  22          1HB       PHE  22   2.171   5.974  -1.311
  176    HD1  PHE  22           HD2      PHE  22  -1.372   6.608  -0.381
  177    HD2  PHE  22           HD1      PHE  22   2.256   8.196  -1.936
  178    HE1  PHE  22           HE2      PHE  22  -2.354   8.862  -0.356
  179    HE2  PHE  22           HE1      PHE  22   1.281  10.455  -1.914
  180    HZ   PHE  22           HZ       PHE  22  -1.028  10.790  -1.123
  181    H    ASN  23           H        ASN  23  -0.084   5.922  -4.549
  182    HA   ASN  23           HA       ASN  23   2.561   5.361  -5.722
  183   1HB   ASN  23          2HB       ASN  23   0.484   4.085  -6.590
  184   2HB   ASN  23          1HB       ASN  23   0.041   5.613  -7.345
  185   1HD2  ASN  23          1HD2      ASN  23   1.414   6.492  -8.941
  186   2HD2  ASN  23          2HD2      ASN  23   2.507   5.487  -9.826
  187    HN2  GLY  24           H        GLY  24   3.118   7.505  -4.832
  188   1HA   GLY  24          2HA       GLY  24   3.776   9.648  -5.410
  189   2HA   GLY  24          1HA       GLY  24   2.810   9.514  -6.872
  190    H    ARG  25           H        ARG  25   0.523   9.903  -6.724
  191    HA   ARG  25           HA       ARG  25  -0.186  11.615  -4.431
  192   1HB   ARG  25          2HB       ARG  25  -1.634  12.878  -5.998
  193   2HB   ARG  25          1HB       ARG  25   0.072  12.969  -6.413
  194   1HG   ARG  25          2HG       ARG  25  -1.669  10.912  -7.700
  195   2HG   ARG  25          1HG       ARG  25  -1.691  12.581  -8.271
  196   1HD   ARG  25          2HD       ARG  25   0.317  12.392  -9.249
  197   2HD   ARG  25          1HD       ARG  25   0.999  11.510  -7.883
  198    HE   ARG  25           HE       ARG  25   0.546   9.542  -8.965
  199   1HH1  ARG  25          1HH1      ARG  25  -1.195  12.128 -10.533
  200   2HH1  ARG  25          2HH1      ARG  25  -1.701  11.147 -11.867
  201   1HH2  ARG  25          1HH2      ARG  25  -0.120   8.249 -10.717
  202   2HH2  ARG  25          2HH2      ARG  25  -1.092   8.945 -11.972
  203    H    THR  26           H        THR  26  -1.249   9.136  -6.668
  204    HA   THR  26           HA       THR  26  -3.755   8.874  -5.142
  205    HB   THR  26           HB       THR  26  -3.439   7.436  -7.717
  206    HG1  THR  26           HG1      THR  26  -2.655   9.318  -8.458
  207   1HG2  THR  26          1HG2      THR  26  -5.631   8.839  -6.266
  208   2HG2  THR  26          2HG2      THR  26  -5.570   7.193  -6.895
  209   3HG2  THR  26          3HG2      THR  26  -5.756   8.554  -8.002
  210    H    CYS  27           H        CYS  27  -4.587   6.568  -5.057
  211    HA   CYS  27           HA       CYS  27  -2.434   4.889  -4.052
  212   1HB   CYS  27          2HB       CYS  27  -5.002   5.380  -3.167
  213   2HB   CYS  27          1HB       CYS  27  -5.138   3.786  -3.902
  214    H    ALA  28           H        ALA  28  -2.864   2.431  -4.418
  215    HA   ALA  28           HA       ALA  28  -3.681   1.875  -7.165
  216   1HB   ALA  28          1HB       ALA  28  -1.432   2.288  -7.588
  217   2HB   ALA  28          2HB       ALA  28  -1.520   0.535  -7.437
  218   3HB   ALA  28          3HB       ALA  28  -0.911   1.507  -6.097
  219    H    LYS  29           H        LYS  29  -3.301  -0.640  -7.565
  220    HA   LYS  29           HA       LYS  29  -3.984  -2.132  -5.133
  221   1HB   LYS  29          2HB       LYS  29  -5.751  -1.571  -7.399
  222   2HB   LYS  29          1HB       LYS  29  -5.634  -3.284  -7.015
  223   1HG   LYS  29          2HG       LYS  29  -6.011  -1.548  -4.688
  224   2HG   LYS  29          1HG       LYS  29  -7.347  -1.535  -5.843
  225   1HD   LYS  29          2HD       LYS  29  -6.798  -4.198  -5.672
  226   2HD   LYS  29          1HD       LYS  29  -6.432  -3.656  -4.032
  227   1HE   LYS  29          2HE       LYS  29  -8.593  -3.468  -3.545
  228   2HE   LYS  29          1HE       LYS  29  -8.878  -2.462  -4.965
  229   1HZ   LYS  29          1HZ       LYS  29  -8.565  -5.339  -5.382
  230   2HZ   LYS  29          2HZ       LYS  29  -9.549  -4.230  -6.197
  231   3HZ   LYS  29          3HZ       LYS  29 -10.008  -4.807  -4.675
  232    H    PHE  30           H        PHE  30  -3.128  -4.114  -5.021
  233    HA   PHE  30           HA       PHE  30  -2.337  -5.593  -7.346
  234   1HB   PHE  30          2HB       PHE  30   0.044  -5.665  -6.898
  235   2HB   PHE  30          1HB       PHE  30  -0.461  -3.999  -7.129
  236    HD1  PHE  30           HD2      PHE  30  -1.668  -4.565  -4.002
  237    HD2  PHE  30           HD1      PHE  30   2.073  -4.306  -6.019
  238    HE1  PHE  30           HE2      PHE  30  -0.578  -3.953  -1.891
  239    HE2  PHE  30           HE1      PHE  30   3.169  -3.692  -3.905
  240    HZ   PHE  30           HZ       PHE  30   1.844  -3.515  -1.838
  241    H    ILE  31           H        ILE  31  -0.950  -7.594  -6.571
  242    HA   ILE  31           HA       ILE  31  -2.501  -8.772  -4.412
  243    HB   ILE  31           HB       ILE  31  -0.460 -10.045  -6.244
  244   1HG1  ILE  31          2HG1      ILE  31  -2.446  -9.176  -7.440
  245   2HG1  ILE  31          1HG1      ILE  31  -2.356 -10.934  -7.482
  246   1HG2  ILE  31          1HG2      ILE  31  -0.641 -11.346  -4.260
  247   2HG2  ILE  31          2HG2      ILE  31  -1.586 -12.165  -5.503
  248   3HG2  ILE  31          3HG2      ILE  31  -2.400 -11.215  -4.260
  249   1HD1  ILE  31          1HD1      ILE  31  -4.603 -10.433  -7.077
  250   2HD1  ILE  31          2HD1      ILE  31  -4.201  -9.198  -5.883
  251   3HD1  ILE  31          3HD1      ILE  31  -3.952 -10.903  -5.507
  252    H    TYR  32           H        TYR  32  -1.728  -8.351  -2.426
  253    HA   TYR  32           HA       TYR  32   1.127  -8.044  -2.016
  254   1HB   TYR  32          2HB       TYR  32  -0.676  -6.558  -0.970
  255   2HB   TYR  32          1HB       TYR  32  -0.994  -7.908   0.116
  256    HD1  TYR  32           HD1      TYR  32   1.825  -5.777  -1.091
  257    HD2  TYR  32           HD2      TYR  32   0.177  -8.044   2.111
  258    HE1  TYR  32           HE1      TYR  32   3.646  -5.017   0.376
  259    HE2  TYR  32           HE2      TYR  32   1.993  -7.289   3.587
  260    HH   TYR  32           HH       TYR  32   4.465  -6.440   3.180
  261    HN2  GLY  33           H        GLY  33   2.388  -9.672  -1.534
  262   1HA   GLY  33          2HA       GLY  33   1.283 -12.198  -0.644
  263   2HA   GLY  33          1HA       GLY  33   2.966 -11.875  -1.036
  264    HN2  GLY  34           H        GLY  34   3.058  -9.519   0.739
  265   1HA   GLY  34          2HA       GLY  34   2.547  -9.350   3.209
  266   2HA   GLY  34          1HA       GLY  34   3.173 -10.988   3.298
  267    H    CYS  35           H        CYS  35   5.309 -10.402   1.326
  268    HA   CYS  35           HA       CYS  35   7.046  -8.867   3.134
  269   1HB   CYS  35          2HB       CYS  35   8.933 -10.160   2.057
  270   2HB   CYS  35          1HB       CYS  35   7.841 -11.098   3.066
  271    HN2  GLY  36           H        GLY  36   8.552  -7.411   2.303
  272   1HA   GLY  36          2HA       GLY  36   9.628  -6.365   0.389
  273   2HA   GLY  36          1HA       GLY  36   8.157  -6.663  -0.525
  274    HN2  GLY  37           H        GLY  37   6.496  -5.818   1.814
  275   1HA   GLY  37          2HA       GLY  37   6.449  -3.009   1.148
  276   2HA   GLY  37          1HA       GLY  37   5.308  -3.857   2.180
  277    H    ASN  38           H        ASN  38   5.649  -1.703   3.318
  278    HA   ASN  38           HA       ASN  38   7.172  -2.168   5.660
  279   1HB   ASN  38          2HB       ASN  38   8.524   0.074   5.255
  280   2HB   ASN  38          1HB       ASN  38   9.150  -1.477   4.706
  281   1HD2  ASN  38          1HD2      ASN  38  10.320  -0.792   2.997
  282   2HD2  ASN  38          2HD2      ASN  38   9.646  -0.028   1.601
  283    HN2  GLY  39           H        GLY  39   6.457   0.864   3.936
  284   1HA   GLY  39          2HA       GLY  39   4.384   1.427   5.955
  285   2HA   GLY  39          1HA       GLY  39   5.606   2.627   5.565
  286    H    ASN  40           H        ASN  40   5.046   1.091   2.733
  287    HA   ASN  40           HA       ASN  40   3.262   3.212   1.825
  288   1HB   ASN  40          2HB       ASN  40   5.412   2.643   0.631
  289   2HB   ASN  40          1HB       ASN  40   4.673   1.116   0.165
  290   1HD2  ASN  40          1HD2      ASN  40   4.415   4.604  -0.112
  291   2HD2  ASN  40          2HD2      ASN  40   3.539   4.606  -1.600
  292    H    LYS  41           H        LYS  41   3.238  -0.174   2.506
  293    HA   LYS  41           HA       LYS  41   1.013  -0.876   0.871
  294   1HB   LYS  41          2HB       LYS  41   2.622  -2.548   1.659
  295   2HB   LYS  41          1HB       LYS  41   2.139  -2.242   3.321
  296   1HG   LYS  41          2HG       LYS  41  -0.012  -3.001   1.446
  297   2HG   LYS  41          1HG       LYS  41   1.166  -4.250   1.853
  298   1HD   LYS  41          2HD       LYS  41  -0.399  -2.617   3.852
  299   2HD   LYS  41          1HD       LYS  41  -0.790  -4.265   3.357
  300   1HE   LYS  41          2HE       LYS  41   1.608  -4.831   4.095
  301   2HE   LYS  41          1HE       LYS  41   1.564  -3.280   4.933
  302   1HZ   LYS  41          1HZ       LYS  41   0.788  -5.533   6.062
  303   2HZ   LYS  41          2HZ       LYS  41  -0.687  -5.078   5.372
  304   3HZ   LYS  41          3HZ       LYS  41   0.094  -4.040   6.454
  305    H    PHE  42           H        PHE  42  -1.122  -1.338   1.518
  306    HA   PHE  42           HA       PHE  42  -2.015  -0.442   4.132
  307   1HB   PHE  42          2HB       PHE  42  -3.051   0.815   1.582
  308   2HB   PHE  42          1HB       PHE  42  -3.706   1.087   3.193
  309    HD1  PHE  42           HD1      PHE  42  -1.721   1.734   4.949
  310    HD2  PHE  42           HD2      PHE  42  -1.748   2.502   0.764
  311    HE1  PHE  42           HE1      PHE  42  -0.133   3.582   5.283
  312    HE2  PHE  42           HE2      PHE  42  -0.161   4.354   1.090
  313    HZ   PHE  42           HZ       PHE  42   0.649   4.896   3.352
  314    HA   PRO  43           HA       PRO  43  -4.316  -4.240   3.360
  315   1HB   PRO  43          2HB       PRO  43  -5.830  -3.118   5.678
  316   2HB   PRO  43          1HB       PRO  43  -5.209  -4.754   5.424
  317   1HG   PRO  43          2HG       PRO  43  -3.960  -3.079   7.069
  318   2HG   PRO  43          1HG       PRO  43  -3.041  -4.166   6.009
  319   1HD   PRO  43          2HD       PRO  43  -3.521  -1.232   5.764
  320   2HD   PRO  43          1HD       PRO  43  -2.092  -2.186   5.316
  321    H    THR  44           H        THR  44  -6.006  -1.214   4.218
  322    HA   THR  44           HA       THR  44  -7.987  -1.853   2.134
  323    HB   THR  44           HB       THR  44  -9.419  -0.269   3.797
  324    HG1  THR  44           HG1      THR  44  -7.576  -0.399   5.301
  325   1HG2  THR  44          1HG2      THR  44 -10.326  -2.381   4.828
  326   2HG2  THR  44          2HG2      THR  44  -9.121  -3.251   3.878
  327   3HG2  THR  44          3HG2      THR  44 -10.361  -2.294   3.067
  328    H    GLN  45           H        GLN  45  -9.018  -0.009   1.136
  329    HA   GLN  45           HA       GLN  45  -7.175   2.005   0.412
  330   1HB   GLN  45          2HB       GLN  45  -9.196   1.064  -0.902
  331   2HB   GLN  45          1HB       GLN  45 -10.142   2.245  -0.005
  332   1HG   GLN  45          2HG       GLN  45  -7.702   3.136  -1.461
  333   2HG   GLN  45          1HG       GLN  45  -9.181   2.812  -2.363
  334   1HE2  GLN  45          1HE2      GLN  45 -11.113   3.973  -1.700
  335   2HE2  GLN  45          2HE2      GLN  45 -10.956   5.567  -1.050
  336    H    GLU  46           H        GLU  46  -9.707   1.843   2.809
  337    HA   GLU  46           HA       GLU  46 -10.110   4.554   3.312
  338   1HB   GLU  46          2HB       GLU  46 -10.280   2.117   5.067
  339   2HB   GLU  46          1HB       GLU  46 -10.619   3.722   5.698
  340   1HG   GLU  46          2HG       GLU  46 -12.637   3.779   4.766
  341   2HG   GLU  46          1HG       GLU  46 -12.035   3.174   3.222
  342    H    ALA  47           H        ALA  47  -7.569   2.381   4.388
  343    HA   ALA  47           HA       ALA  47  -6.418   4.210   6.257
  344   1HB   ALA  47          1HB       ALA  47  -5.733   1.554   5.162
  345   2HB   ALA  47          2HB       ALA  47  -5.745   2.127   6.830
  346   3HB   ALA  47          3HB       ALA  47  -4.394   2.527   5.770
  347    H    CYS  48           H        CYS  48  -6.038   3.561   2.855
  348    HA   CYS  48           HA       CYS  48  -3.558   4.808   2.425
  349   1HB   CYS  48          2HB       CYS  48  -4.594   3.338   0.773
  350   2HB   CYS  48          1HB       CYS  48  -5.914   4.482   0.555
  351    H    MET  49           H        MET  49  -6.868   6.085   2.166
  352    HA   MET  49           HA       MET  49  -6.057   8.700   1.414
  353   1HB   MET  49          2HB       MET  49  -8.595   7.381   2.191
  354   2HB   MET  49          1HB       MET  49  -8.525   9.127   2.382
  355   1HG   MET  49          2HG       MET  49  -7.628   9.088  -0.056
  356   2HG   MET  49          1HG       MET  49  -8.364   7.488  -0.102
  357   1HE   MET  49          1HE       MET  49  -8.960  10.084  -1.893
  358   2HE   MET  49          2HE       MET  49  -8.979  11.259  -0.579
  359   3HE   MET  49          3HE       MET  49 -10.448  10.947  -1.503
  360    H    LYS  50           H        LYS  50  -6.824   7.208   4.526
  361    HA   LYS  50           HA       LYS  50  -6.677   9.700   5.945
  362   1HB   LYS  50          2HB       LYS  50  -7.015   8.413   7.939
  363   2HB   LYS  50          1HB       LYS  50  -8.085   7.794   6.690
  364   1HG   LYS  50          2HG       LYS  50  -7.287   5.766   7.039
  365   2HG   LYS  50          1HG       LYS  50  -5.691   6.315   6.523
  366   1HD   LYS  50          2HD       LYS  50  -5.531   7.224   8.966
  367   2HD   LYS  50          1HD       LYS  50  -6.811   6.051   9.282
  368   1HE   LYS  50          2HE       LYS  50  -5.318   4.331   8.178
  369   2HE   LYS  50          1HE       LYS  50  -4.034   5.537   8.244
  370   1HZ   LYS  50          1HZ       LYS  50  -3.915   5.421  10.514
  371   2HZ   LYS  50          2HZ       LYS  50  -4.315   3.818  10.153
  372   3HZ   LYS  50          3HZ       LYS  50  -5.509   4.883  10.698
  373    H    ARG  51           H        ARG  51  -4.289   7.956   4.529
  374    HA   ARG  51           HA       ARG  51  -2.356   8.323   6.691
  375   1HB   ARG  51          2HB       ARG  51  -2.631   6.335   4.809
  376   2HB   ARG  51          1HB       ARG  51  -1.333   7.311   4.138
  377   1HG   ARG  51          2HG       ARG  51  -0.455   5.518   5.514
  378   2HG   ARG  51          1HG       ARG  51  -0.081   7.091   6.219
  379   1HD   ARG  51          2HD       ARG  51  -0.917   6.265   8.119
  380   2HD   ARG  51          1HD       ARG  51  -2.499   6.461   7.367
  381    HE   ARG  51           HE       ARG  51  -2.644   4.183   7.138
  382   1HH1  ARG  51          1HH1      ARG  51   0.638   5.043   7.958
  383   2HH1  ARG  51          2HH1      ARG  51   1.131   3.406   8.231
  384   1HH2  ARG  51          1HH2      ARG  51  -1.997   2.030   7.496
  385   2HH2  ARG  51          2HH2      ARG  51  -0.363   1.695   7.968
  386    H    CYS  52           H        CYS  52  -2.704   9.183   3.242
  387    HA   CYS  52           HA       CYS  52  -0.851  11.423   3.730
  388   1HB   CYS  52          2HB       CYS  52  -0.950   9.437   1.651
  389   2HB   CYS  52          1HB       CYS  52  -1.134  11.041   0.948
  390    H    ALA  53           H        ALA  53  -3.985  10.511   2.492
  391    HA   ALA  53           HA       ALA  53  -4.546  13.084   1.339
  392   1HB   ALA  53          1HB       ALA  53  -6.366  12.110   0.459
  393   2HB   ALA  53          2HB       ALA  53  -6.833  11.365   1.987
  394   3HB   ALA  53          3HB       ALA  53  -5.601  10.608   0.976
  395    H    LYS  54           H        LYS  54  -4.868  11.623   4.462
  396    HA   LYS  54           HA       LYS  54  -6.923  13.215   5.522
  397   1HB   LYS  54          2HB       LYS  54  -5.397  11.140   6.448
  398   2HB   LYS  54          1HB       LYS  54  -4.789  12.483   7.403
  399   1HG   LYS  54          2HG       LYS  54  -7.380  12.929   7.736
  400   2HG   LYS  54          1HG       LYS  54  -7.455  11.195   7.416
  401   1HD   LYS  54          2HD       LYS  54  -7.257  11.418   9.761
  402   2HD   LYS  54          1HD       LYS  54  -5.663  10.928   9.184
  403   1HE   LYS  54          2HE       LYS  54  -4.855  13.186   9.336
  404   2HE   LYS  54          1HE       LYS  54  -6.468  13.782   9.725
  405   1HZ   LYS  54          1HZ       LYS  54  -5.104  11.798  11.438
  406   2HZ   LYS  54          2HZ       LYS  54  -6.394  12.818  11.830
  407   3HZ   LYS  54          3HZ       LYS  54  -4.841  13.459  11.632
  408    H    ALA  55           H        ALA  55  -3.466  13.517   6.328
  409    HA   ALA  55           HA       ALA  55  -3.824  16.266   7.106
  410   1HB   ALA  55          1HB       ALA  55  -1.375  14.517   6.949
  411   2HB   ALA  55          2HB       ALA  55  -2.299  14.943   8.390
  412   3HB   ALA  55          3HB       ALA  55  -1.370  16.179   7.542
  Start of MODEL    9
    1   1H    ILE   1          1H        ILE   1   5.470  10.993   5.563
    2   2H    ILE   1          2H        ILE   1   4.439  12.329   5.877
    3   3H    ILE   1          3H        ILE   1   6.107  12.585   5.562
    4    HA   ILE   1           HA       ILE   1   3.982  11.742   3.732
    5    HB   ILE   1           HB       ILE   1   4.403  14.160   4.093
    6   1HG1  ILE   1          2HG1      ILE   1   3.635  13.123   1.890
    7   2HG1  ILE   1          1HG1      ILE   1   4.291  14.754   1.809
    8   1HG2  ILE   1          1HG2      ILE   1   7.152  13.464   3.095
    9   2HG2  ILE   1          2HG2      ILE   1   6.709  14.232   4.619
   10   3HG2  ILE   1          3HG2      ILE   1   6.509  15.106   3.101
   11   1HD1  ILE   1          1HD1      ILE   1   6.463  13.030   1.405
   12   2HD1  ILE   1          2HD1      ILE   1   5.656  14.056   0.220
   13   3HD1  ILE   1          3HD1      ILE   1   5.132  12.387   0.444
   14    H    ASP   2           H        ASP   2   7.412  11.606   4.416
   15    HA   ASP   2           HA       ASP   2   8.378  10.848   1.912
   16   1HB   ASP   2          2HB       ASP   2   9.766  11.463   3.909
   17   2HB   ASP   2          1HB       ASP   2   9.414   9.872   4.580
   18    H    THR   3           H        THR   3   6.573   9.054   4.269
   19    HA   THR   3           HA       THR   3   7.235   6.436   3.598
   20    HB   THR   3           HB       THR   3   4.381   6.984   4.169
   21    HG1  THR   3           HG1      THR   3   6.468   7.731   5.930
   22   1HG2  THR   3          1HG2      THR   3   4.500   5.182   5.585
   23   2HG2  THR   3          2HG2      THR   3   6.225   5.395   5.885
   24   3HG2  THR   3          3HG2      THR   3   5.672   4.743   4.343
   25    H    CYS   4           H        CYS   4   5.249   8.763   1.932
   26    HA   CYS   4           HA       CYS   4   3.995   6.872   0.179
   27   1HB   CYS   4          2HB       CYS   4   4.275   9.869  -0.110
   28   2HB   CYS   4          1HB       CYS   4   3.178   8.841  -1.024
   29    H    ARG   5           H        ARG   5   7.137   7.882   0.364
   30    HA   ARG   5           HA       ARG   5   7.583   7.986  -2.516
   31   1HB   ARG   5          2HB       ARG   5   9.750   8.134  -0.444
   32   2HB   ARG   5          1HB       ARG   5   9.721   8.823  -2.061
   33   1HG   ARG   5          2HG       ARG   5   7.891   9.763   0.127
   34   2HG   ARG   5          1HG       ARG   5   9.500  10.440  -0.134
   35   1HD   ARG   5          2HD       ARG   5   8.439  11.868  -1.502
   36   2HD   ARG   5          1HD       ARG   5   8.470  10.527  -2.647
   37    HE   ARG   5           HE       ARG   5   6.188  10.094  -1.274
   38   1HH1  ARG   5          1HH1      ARG   5   7.474  12.897  -2.907
   39   2HH1  ARG   5          2HH1      ARG   5   5.914  13.533  -3.311
   40   1HH2  ARG   5          1HH2      ARG   5   4.135  10.928  -1.805
   41   2HH2  ARG   5          2HH2      ARG   5   4.020  12.415  -2.684
   42    H    LEU   6           H        LEU   6   7.782   5.754   0.102
   43    HA   LEU   6           HA       LEU   6   9.741   4.041  -1.114
   44   1HB   LEU   6          2HB       LEU   6   7.883   2.928   0.905
   45   2HB   LEU   6          1HB       LEU   6   9.622   2.759   0.766
   46    HG   LEU   6           HG       LEU   6   8.069   5.024   1.995
   47   1HD1  LEU   6          1HD1      LEU   6  10.368   3.501   3.164
   48   2HD1  LEU   6          2HD1      LEU   6   8.720   2.879   3.243
   49   3HD1  LEU   6          3HD1      LEU   6   9.113   4.428   3.987
   50   1HD2  LEU   6          1HD2      LEU   6   9.631   6.409   1.176
   51   2HD2  LEU   6          2HD2      LEU   6  10.696   5.085   0.703
   52   3HD2  LEU   6          3HD2      LEU   6  10.699   5.669   2.367
   53    HA   PRO   7           HA       PRO   7   6.711   2.161  -3.846
   54   1HB   PRO   7          2HB       PRO   7   8.410   0.522  -5.149
   55   2HB   PRO   7          1HB       PRO   7   8.361   2.262  -5.460
   56   1HG   PRO   7          2HG       PRO   7  10.268   0.692  -3.767
   57   2HG   PRO   7          1HG       PRO   7  10.607   2.005  -4.909
   58   1HD   PRO   7          2HD       PRO   7  10.466   2.374  -2.215
   59   2HD   PRO   7          1HD       PRO   7  10.049   3.638  -3.391
   60    H    SER   8           H        SER   8   5.547   1.035  -2.233
   61    HA   SER   8           HA       SER   8   6.487  -1.237  -0.873
   62   1HB   SER   8          2HB       SER   8   4.034   0.239  -1.064
   63   2HB   SER   8          1HB       SER   8   3.680  -1.484  -1.172
   64    HG   SER   8           HG       SER   8   5.391  -0.437   0.816
   65    H    ASP   9           H        ASP   9   6.961  -3.184  -1.619
   66    HA   ASP   9           HA       ASP   9   6.004  -4.000  -4.245
   67   1HB   ASP   9          2HB       ASP   9   8.238  -4.771  -2.464
   68   2HB   ASP   9          1HB       ASP   9   7.547  -6.073  -3.428
   69    H    ARG  10           H        ARG  10   4.928  -5.982  -4.627
   70    HA   ARG  10           HA       ARG  10   3.152  -6.735  -2.455
   71   1HB   ARG  10          2HB       ARG  10   1.926  -7.957  -4.233
   72   2HB   ARG  10          1HB       ARG  10   2.127  -6.249  -4.580
   73   1HG   ARG  10          2HG       ARG  10   3.987  -6.779  -6.080
   74   2HG   ARG  10          1HG       ARG  10   3.758  -8.495  -5.743
   75   1HD   ARG  10          2HD       ARG  10   1.539  -6.781  -6.809
   76   2HD   ARG  10          1HD       ARG  10   2.714  -7.542  -7.877
   77    HE   ARG  10           HE       ARG  10   1.465  -9.357  -6.025
   78   1HH1  ARG  10          1HH1      ARG  10   1.192  -7.804  -9.139
   79   2HH1  ARG  10          2HH1      ARG  10   0.251  -9.080  -9.837
   80   1HH2  ARG  10          1HH2      ARG  10   0.245 -11.058  -6.963
   81   2HH2  ARG  10          2HH2      ARG  10  -0.290 -10.920  -8.602
   82    HN2  GLY  11           H        GLY  11   5.982  -7.944  -3.942
   83   1HA   GLY  11          2HA       GLY  11   7.149  -9.900  -3.673
   84   2HA   GLY  11          1HA       GLY  11   6.260 -10.071  -2.169
   85    H    ARG  12           H        ARG  12   7.063 -12.211  -3.840
   86    HA   ARG  12           HA       ARG  12   4.484 -13.158  -4.895
   87   1HB   ARG  12          2HB       ARG  12   7.289 -13.544  -5.748
   88   2HB   ARG  12          1HB       ARG  12   6.261 -14.967  -5.844
   89   1HG   ARG  12          2HG       ARG  12   4.653 -13.141  -6.999
   90   2HG   ARG  12          1HG       ARG  12   6.236 -12.499  -7.442
   91   1HD   ARG  12          2HD       ARG  12   6.806 -14.852  -8.211
   92   2HD   ARG  12          1HD       ARG  12   5.088 -15.210  -8.051
   93    HE   ARG  12           HE       ARG  12   5.359 -12.910  -9.614
   94   1HH1  ARG  12          1HH1      ARG  12   6.086 -16.320  -9.786
   95   2HH1  ARG  12          2HH1      ARG  12   5.947 -16.390 -11.511
   96   1HH2  ARG  12          1HH2      ARG  12   5.177 -13.001 -11.882
   97   2HH2  ARG  12          2HH2      ARG  12   5.432 -14.506 -12.701
   98    H    CYS  13           H        CYS  13   6.655 -13.496  -2.342
   99    HA   CYS  13           HA       CYS  13   6.844 -16.102  -1.669
  100   1HB   CYS  13          2HB       CYS  13   6.325 -15.195   0.784
  101   2HB   CYS  13          1HB       CYS  13   7.822 -14.823  -0.058
  102    H    LYS  14           H        LYS  14   4.288 -14.370   0.080
  103    HA   LYS  14           HA       LYS  14   2.575 -16.728  -0.310
  104   1HB   LYS  14          2HB       LYS  14   3.161 -15.015   2.006
  105   2HB   LYS  14          1HB       LYS  14   1.455 -15.380   1.791
  106   1HG   LYS  14          2HG       LYS  14   2.520 -16.978   3.277
  107   2HG   LYS  14          1HG       LYS  14   1.949 -17.763   1.803
  108   1HD   LYS  14          2HD       LYS  14   4.115 -18.632   2.259
  109   2HD   LYS  14          1HD       LYS  14   4.283 -17.523   0.896
  110   1HE   LYS  14          2HE       LYS  14   4.964 -15.756   2.538
  111   2HE   LYS  14          1HE       LYS  14   4.990 -17.007   3.780
  112   1HZ   LYS  14          1HZ       LYS  14   7.115 -16.340   2.351
  113   2HZ   LYS  14          2HZ       LYS  14   6.501 -17.562   1.357
  114   3HZ   LYS  14          3HZ       LYS  14   6.881 -17.897   2.971
  115    H    ALA  15           H        ALA  15   2.694 -14.658  -2.261
  116    HA   ALA  15           HA       ALA  15   0.830 -12.647  -2.126
  117   1HB   ALA  15          1HB       ALA  15   1.905 -12.517  -4.108
  118   2HB   ALA  15          2HB       ALA  15   0.487 -13.396  -4.684
  119   3HB   ALA  15          3HB       ALA  15   1.974 -14.267  -4.310
  120    H    SER  16           H        SER  16  -1.207 -12.745  -1.441
  121    HA   SER  16           HA       SER  16  -3.158 -14.312  -2.775
  122   1HB   SER  16          2HB       SER  16  -1.831 -15.664  -0.706
  123   2HB   SER  16          1HB       SER  16  -3.391 -15.193  -0.030
  124    HG   SER  16           HG       SER  16  -4.412 -16.264  -1.701
  125    H    PHE  17           H        PHE  17  -2.266 -12.294  -0.046
  126    HA   PHE  17           HA       PHE  17  -5.050 -11.455   0.289
  127   1HB   PHE  17          2HB       PHE  17  -2.670 -10.656   1.968
  128   2HB   PHE  17          1HB       PHE  17  -4.373 -10.463   2.367
  129    HD1  PHE  17           HD2      PHE  17  -5.752 -12.692   2.451
  130    HD2  PHE  17           HD1      PHE  17  -1.520 -12.450   2.829
  131    HE1  PHE  17           HE2      PHE  17  -5.733 -14.872   3.591
  132    HE2  PHE  17           HE1      PHE  17  -1.492 -14.629   3.969
  133    HZ   PHE  17           HZ       PHE  17  -3.602 -15.843   4.353
  134    H    GLU  18           H        GLU  18  -5.704  -9.776  -0.865
  135    HA   GLU  18           HA       GLU  18  -3.894  -8.040  -2.197
  136   1HB   GLU  18          2HB       GLU  18  -6.885  -8.016  -1.841
  137   2HB   GLU  18          1HB       GLU  18  -6.042  -6.744  -2.715
  138   1HG   GLU  18          2HG       GLU  18  -5.655  -8.044  -4.508
  139   2HG   GLU  18          1HG       GLU  18  -5.399  -9.493  -3.538
  140    H    ARG  19           H        ARG  19  -3.290  -5.966  -1.759
  141    HA   ARG  19           HA       ARG  19  -4.326  -4.700   0.671
  142   1HB   ARG  19          2HB       ARG  19  -1.718  -5.845   0.369
  143   2HB   ARG  19          1HB       ARG  19  -1.556  -4.102   0.521
  144   1HG   ARG  19          2HG       ARG  19  -1.417  -5.272   2.676
  145   2HG   ARG  19          1HG       ARG  19  -2.757  -4.125   2.608
  146   1HD   ARG  19          2HD       ARG  19  -4.345  -5.771   2.614
  147   2HD   ARG  19          1HD       ARG  19  -3.284  -6.947   1.840
  148    HE   ARG  19           HE       ARG  19  -2.203  -6.487   4.330
  149   1HH1  ARG  19          1HH1      ARG  19  -5.242  -7.658   3.074
  150   2HH1  ARG  19          2HH1      ARG  19  -5.562  -8.669   4.443
  151   1HH2  ARG  19          1HH2      ARG  19  -2.621  -7.816   6.131
  152   2HH2  ARG  19          2HH2      ARG  19  -4.074  -8.758   6.179
  153    H    TRP  20           H        TRP  20  -3.735  -2.390   0.816
  154    HA   TRP  20           HA       TRP  20  -3.703  -1.184  -1.865
  155   1HB   TRP  20          2HB       TRP  20  -4.709  -0.126   0.783
  156   2HB   TRP  20          1HB       TRP  20  -4.652   0.822  -0.698
  157    HD1  TRP  20           HD1      TRP  20  -6.590  -2.002   0.974
  158    HE1  TRP  20           HE1      TRP  20  -8.753  -2.425  -0.349
  159    HE3  TRP  20           HE3      TRP  20  -5.669   0.997  -3.062
  160    HZ2  TRP  20           HZ2      TRP  20  -9.913  -1.600  -2.777
  161    HZ3  TRP  20           HZ3      TRP  20  -7.361   1.123  -4.844
  162    HH2  TRP  20           HH2      TRP  20  -9.440  -0.151  -4.704
  163    H    TYR  21           H        TYR  21  -2.374   0.605  -2.307
  164    HA   TYR  21           HA       TYR  21  -0.366   1.346  -0.318
  165   1HB   TYR  21          2HB       TYR  21   1.379   1.094  -2.255
  166   2HB   TYR  21          1HB       TYR  21   0.925  -0.318  -1.306
  167    HD1  TYR  21           HD2      TYR  21  -1.226  -1.583  -2.304
  168    HD2  TYR  21           HD1      TYR  21   1.472   0.817  -4.548
  169    HE1  TYR  21           HE2      TYR  21  -1.920  -2.733  -4.345
  170    HE2  TYR  21           HE1      TYR  21   0.781  -0.333  -6.611
  171    HH   TYR  21           HH       TYR  21  -0.278  -2.369  -7.335
  172    H    PHE  22           H        PHE  22   0.064   3.461  -0.378
  173    HA   PHE  22           HA       PHE  22  -1.185   5.061  -2.447
  174   1HB   PHE  22          2HB       PHE  22  -0.230   6.977  -0.989
  175   2HB   PHE  22          1HB       PHE  22  -1.551   6.007  -0.348
  176    HD1  PHE  22           HD1      PHE  22   2.002   6.814  -0.069
  177    HD2  PHE  22           HD2      PHE  22  -1.199   4.487   1.493
  178    HE1  PHE  22           HE1      PHE  22   3.344   6.315   1.933
  179    HE2  PHE  22           HE2      PHE  22   0.138   3.985   3.496
  180    HZ   PHE  22           HZ       PHE  22   2.413   4.900   3.718
  181    H    ASN  23           H        ASN  23  -0.119   5.277  -4.292
  182    HA   ASN  23           HA       ASN  23   2.791   5.391  -4.309
  183   1HB   ASN  23          2HB       ASN  23   1.271   4.054  -5.955
  184   2HB   ASN  23          1HB       ASN  23   1.074   5.606  -6.763
  185   1HD2  ASN  23          1HD2      ASN  23   2.834   6.557  -7.772
  186   2HD2  ASN  23          2HD2      ASN  23   4.271   5.674  -8.143
  187    HN2  GLY  24           H        GLY  24   3.233   7.416  -3.450
  188   1HA   GLY  24          2HA       GLY  24   3.863   9.624  -3.768
  189   2HA   GLY  24          1HA       GLY  24   3.049   9.597  -5.325
  190    H    ARG  25           H        ARG  25   0.523   9.210  -4.921
  191    HA   ARG  25           HA       ARG  25  -0.473  10.722  -2.663
  192   1HB   ARG  25          2HB       ARG  25  -1.636  12.392  -4.033
  193   2HB   ARG  25          1HB       ARG  25   0.109  12.505  -4.218
  194   1HG   ARG  25          2HG       ARG  25  -1.236  10.784  -6.180
  195   2HG   ARG  25          1HG       ARG  25  -1.657  12.496  -6.265
  196   1HD   ARG  25          2HD       ARG  25   0.606  13.125  -6.583
  197   2HD   ARG  25          1HD       ARG  25   1.185  11.513  -6.166
  198    HE   ARG  25           HE       ARG  25  -0.358  11.057  -8.332
  199   1HH1  ARG  25          1HH1      ARG  25   2.244  13.296  -7.706
  200   2HH1  ARG  25          2HH1      ARG  25   2.776  13.333  -9.353
  201   1HH2  ARG  25          1HH2      ARG  25   0.340  11.103 -10.500
  202   2HH2  ARG  25          2HH2      ARG  25   1.695  12.088 -10.940
  203    H    THR  26           H        THR  26  -1.079   8.879  -5.591
  204    HA   THR  26           HA       THR  26  -3.876   8.496  -4.865
  205    HB   THR  26           HB       THR  26  -3.314   8.915  -7.222
  206    HG1  THR  26           HG1      THR  26  -5.083   7.480  -6.578
  207   1HG2  THR  26          1HG2      THR  26  -1.133   7.370  -6.902
  208   2HG2  THR  26          2HG2      THR  26  -1.855   7.758  -8.463
  209   3HG2  THR  26          3HG2      THR  26  -2.232   6.227  -7.673
  210    H    CYS  27           H        CYS  27  -4.733   6.210  -5.044
  211    HA   CYS  27           HA       CYS  27  -2.976   4.460  -3.486
  212   1HB   CYS  27          2HB       CYS  27  -5.497   5.186  -2.932
  213   2HB   CYS  27          1HB       CYS  27  -5.831   3.753  -3.900
  214    H    ALA  28           H        ALA  28  -3.404   2.048  -3.879
  215    HA   ALA  28           HA       ALA  28  -3.991   1.336  -6.622
  216   1HB   ALA  28          1HB       ALA  28  -1.731   0.166  -6.818
  217   2HB   ALA  28          2HB       ALA  28  -1.215   1.220  -5.501
  218   3HB   ALA  28          3HB       ALA  28  -1.766   1.916  -7.023
  219    H    LYS  29           H        LYS  29  -3.417  -1.176  -6.875
  220    HA   LYS  29           HA       LYS  29  -3.896  -2.590  -4.367
  221   1HB   LYS  29          2HB       LYS  29  -5.953  -2.024  -6.280
  222   2HB   LYS  29          1HB       LYS  29  -5.673  -3.759  -6.234
  223   1HG   LYS  29          2HG       LYS  29  -5.813  -2.534  -3.590
  224   2HG   LYS  29          1HG       LYS  29  -7.291  -2.354  -4.537
  225   1HD   LYS  29          2HD       LYS  29  -6.292  -5.027  -4.816
  226   2HD   LYS  29          1HD       LYS  29  -6.409  -4.616  -3.103
  227   1HE   LYS  29          2HE       LYS  29  -8.699  -3.840  -4.799
  228   2HE   LYS  29          1HE       LYS  29  -8.465  -5.570  -4.549
  229   1HZ   LYS  29          1HZ       LYS  29  -9.910  -4.681  -2.863
  230   2HZ   LYS  29          2HZ       LYS  29  -8.767  -3.513  -2.427
  231   3HZ   LYS  29          3HZ       LYS  29  -8.452  -5.151  -2.146
  232    H    PHE  30           H        PHE  30  -3.120  -4.628  -4.302
  233    HA   PHE  30           HA       PHE  30  -2.469  -6.129  -6.654
  234   1HB   PHE  30          2HB       PHE  30  -0.020  -6.298  -6.083
  235   2HB   PHE  30          1HB       PHE  30  -0.530  -4.764  -6.770
  236    HD1  PHE  30           HD2      PHE  30  -1.462  -5.235  -3.315
  237    HD2  PHE  30           HD1      PHE  30   1.673  -3.960  -5.896
  238    HE1  PHE  30           HE2      PHE  30  -0.400  -4.065  -1.438
  239    HE2  PHE  30           HE1      PHE  30   2.739  -2.785  -4.019
  240    HZ   PHE  30           HZ       PHE  30   1.704  -2.836  -1.786
  241    H    ILE  31           H        ILE  31  -1.051  -8.155  -5.903
  242    HA   ILE  31           HA       ILE  31  -2.512  -9.240  -3.625
  243    HB   ILE  31           HB       ILE  31  -0.568 -10.607  -5.480
  244   1HG1  ILE  31          2HG1      ILE  31  -2.554  -9.731  -6.660
  245   2HG1  ILE  31          1HG1      ILE  31  -2.519 -11.492  -6.639
  246   1HG2  ILE  31          1HG2      ILE  31  -1.432 -12.679  -4.619
  247   2HG2  ILE  31          2HG2      ILE  31  -2.611 -11.819  -3.627
  248   3HG2  ILE  31          3HG2      ILE  31  -0.888 -11.685  -3.268
  249   1HD1  ILE  31          1HD1      ILE  31  -4.535  -9.706  -5.685
  250   2HD1  ILE  31          2HD1      ILE  31  -3.957 -10.721  -4.363
  251   3HD1  ILE  31          3HD1      ILE  31  -4.577 -11.462  -5.839
  252    H    TYR  32           H        TYR  32  -1.645  -8.696  -1.710
  253    HA   TYR  32           HA       TYR  32   1.234  -8.482  -1.409
  254   1HB   TYR  32          2HB       TYR  32  -0.112  -6.758  -0.379
  255   2HB   TYR  32          1HB       TYR  32  -1.041  -7.958   0.511
  256    HD1  TYR  32           HD1      TYR  32   2.641  -7.916   0.069
  257    HD2  TYR  32           HD2      TYR  32  -0.617  -7.274   2.729
  258    HE1  TYR  32           HE1      TYR  32   4.218  -7.734   1.947
  259    HE2  TYR  32           HE2      TYR  32   0.950  -7.090   4.614
  260    HH   TYR  32           HH       TYR  32   3.268  -6.602   5.042
  261    HN2  GLY  33           H        GLY  33   2.308 -10.309  -1.168
  262   1HA   GLY  33          2HA       GLY  33   1.129 -12.535   0.307
  263   2HA   GLY  33          1HA       GLY  33   2.614 -12.580  -0.634
  264    HN2  GLY  34           H        GLY  34   3.562 -10.071   0.692
  265   1HA   GLY  34          2HA       GLY  34   3.866  -9.736   3.226
  266   2HA   GLY  34          1HA       GLY  34   4.495 -11.372   3.161
  267    H    CYS  35           H        CYS  35   5.504 -10.242   0.316
  268    HA   CYS  35           HA       CYS  35   8.009  -9.218   1.479
  269   1HB   CYS  35          2HB       CYS  35   7.669 -10.559  -1.208
  270   2HB   CYS  35          1HB       CYS  35   9.181 -10.122  -0.427
  271    HN2  GLY  36           H        GLY  36   8.038  -7.069   1.363
  272   1HA   GLY  36          2HA       GLY  36   8.630  -5.353  -0.393
  273   2HA   GLY  36          1HA       GLY  36   7.108  -5.811  -1.139
  274    HN2  GLY  37           H        GLY  37   6.143  -6.073   1.836
  275   1HA   GLY  37          2HA       GLY  37   5.101  -3.365   1.914
  276   2HA   GLY  37          1HA       GLY  37   4.601  -4.706   2.933
  277    H    ASN  38           H        ASN  38   5.863  -1.770   3.111
  278    HA   ASN  38           HA       ASN  38   7.368  -2.414   5.548
  279   1HB   ASN  38          2HB       ASN  38   8.775  -0.291   4.866
  280   2HB   ASN  38          1HB       ASN  38   9.191  -1.881   4.236
  281   1HD2  ASN  38          1HD2      ASN  38  10.266  -0.648   2.561
  282   2HD2  ASN  38          2HD2      ASN  38   9.351  -0.079   1.210
  283    HN2  GLY  39           H        GLY  39   6.568   0.624   3.868
  284   1HA   GLY  39          2HA       GLY  39   4.781   1.319   6.093
  285   2HA   GLY  39          1HA       GLY  39   6.095   2.409   5.682
  286    H    ASN  40           H        ASN  40   5.137   1.058   2.831
  287    HA   ASN  40           HA       ASN  40   3.482   3.390   2.209
  288   1HB   ASN  40          2HB       ASN  40   5.511   2.982   0.843
  289   2HB   ASN  40          1HB       ASN  40   4.831   1.442   0.330
  290   1HD2  ASN  40          1HD2      ASN  40   4.122   4.904   0.407
  291   2HD2  ASN  40          2HD2      ASN  40   3.276   4.943  -1.098
  292    H    LYS  41           H        LYS  41   3.237   0.026   2.724
  293    HA   LYS  41           HA       LYS  41   0.844  -0.275   1.102
  294   1HB   LYS  41          2HB       LYS  41   2.725  -2.043   1.526
  295   2HB   LYS  41          1HB       LYS  41   1.833  -2.362   3.007
  296   1HG   LYS  41          2HG       LYS  41  -0.173  -2.847   1.695
  297   2HG   LYS  41          1HG       LYS  41   0.731  -2.538   0.210
  298   1HD   LYS  41          2HD       LYS  41   1.347  -4.685   2.242
  299   2HD   LYS  41          1HD       LYS  41   0.567  -4.936   0.679
  300   1HE   LYS  41          2HE       LYS  41   2.949  -3.502   0.191
  301   2HE   LYS  41          1HE       LYS  41   3.356  -4.804   1.308
  302   1HZ   LYS  41          1HZ       LYS  41   3.401  -6.129  -0.453
  303   2HZ   LYS  41          2HZ       LYS  41   2.754  -4.940  -1.467
  304   3HZ   LYS  41          3HZ       LYS  41   1.722  -5.951  -0.585
  305    H    PHE  42           H        PHE  42  -1.137  -1.126   2.013
  306    HA   PHE  42           HA       PHE  42  -1.627  -0.838   4.835
  307   1HB   PHE  42          2HB       PHE  42  -2.311   1.300   2.942
  308   2HB   PHE  42          1HB       PHE  42  -3.669   0.765   3.926
  309    HD1  PHE  42           HD1      PHE  42  -2.297   0.108   6.460
  310    HD2  PHE  42           HD2      PHE  42  -1.785   3.388   3.798
  311    HE1  PHE  42           HE1      PHE  42  -1.489   1.491   8.326
  312    HE2  PHE  42           HE2      PHE  42  -0.973   4.777   5.659
  313    HZ   PHE  42           HZ       PHE  42  -0.826   3.829   7.928
  314    HA   PRO  43           HA       PRO  43  -4.430  -4.121   3.852
  315   1HB   PRO  43          2HB       PRO  43  -6.060  -3.067   6.101
  316   2HB   PRO  43          1HB       PRO  43  -5.408  -4.689   5.846
  317   1HG   PRO  43          2HG       PRO  43  -4.322  -3.049   7.643
  318   2HG   PRO  43          1HG       PRO  43  -3.311  -4.117   6.650
  319   1HD   PRO  43          2HD       PRO  43  -3.804  -1.179   6.385
  320   2HD   PRO  43          1HD       PRO  43  -2.307  -2.101   6.132
  321    H    THR  44           H        THR  44  -5.885  -0.963   4.654
  322    HA   THR  44           HA       THR  44  -7.896  -1.483   2.562
  323    HB   THR  44           HB       THR  44  -9.394   0.055   3.886
  324    HG1  THR  44           HG1      THR  44  -8.068   1.079   5.270
  325   1HG2  THR  44          1HG2      THR  44  -8.622  -2.317   5.543
  326   2HG2  THR  44          2HG2      THR  44  -9.481  -2.480   4.010
  327   3HG2  THR  44          3HG2      THR  44 -10.211  -1.577   5.338
  328    H    GLN  45           H        GLN  45  -8.687   0.362   1.407
  329    HA   GLN  45           HA       GLN  45  -6.615   2.168   0.658
  330   1HB   GLN  45          2HB       GLN  45  -8.337   1.300  -0.912
  331   2HB   GLN  45          1HB       GLN  45  -9.549   2.251  -0.065
  332   1HG   GLN  45          2HG       GLN  45  -7.809   4.194  -0.621
  333   2HG   GLN  45          1HG       GLN  45  -7.448   3.100  -1.957
  334   1HE2  GLN  45          1HE2      GLN  45  -9.403   5.576  -0.909
  335   2HE2  GLN  45          2HE2      GLN  45 -10.660   5.447  -2.086
  336    H    GLU  46           H        GLU  46  -9.260   2.291   2.890
  337    HA   GLU  46           HA       GLU  46  -9.648   5.052   3.088
  338   1HB   GLU  46          2HB       GLU  46  -9.925   2.873   5.159
  339   2HB   GLU  46          1HB       GLU  46 -10.446   4.532   5.418
  340   1HG   GLU  46          2HG       GLU  46 -12.205   4.357   3.960
  341   2HG   GLU  46          1HG       GLU  46 -11.449   3.061   3.035
  342    H    ALA  47           H        ALA  47  -7.048   3.054   4.175
  343    HA   ALA  47           HA       ALA  47  -6.044   5.045   6.036
  344   1HB   ALA  47          1HB       ALA  47  -4.342   3.457   6.586
  345   2HB   ALA  47          2HB       ALA  47  -4.727   2.478   5.170
  346   3HB   ALA  47          3HB       ALA  47  -5.881   2.600   6.498
  347    H    CYS  48           H        CYS  48  -5.185   3.674   2.884
  348    HA   CYS  48           HA       CYS  48  -2.740   4.995   2.555
  349   1HB   CYS  48          2HB       CYS  48  -2.837   4.367   0.284
  350   2HB   CYS  48          1HB       CYS  48  -3.719   3.109   1.137
  351    H    MET  49           H        MET  49  -6.010   6.116   2.184
  352    HA   MET  49           HA       MET  49  -5.190   8.545   0.822
  353   1HB   MET  49          2HB       MET  49  -7.666   7.106   1.232
  354   2HB   MET  49          1HB       MET  49  -7.864   8.808   1.619
  355   1HG   MET  49          2HG       MET  49  -8.420   8.308  -0.708
  356   2HG   MET  49          1HG       MET  49  -7.076   9.441  -0.569
  357   1HE   MET  49          1HE       MET  49  -8.029   7.746  -3.102
  358   2HE   MET  49          2HE       MET  49  -6.543   7.109  -3.805
  359   3HE   MET  49          3HE       MET  49  -6.629   8.799  -3.306
  360    H    LYS  50           H        LYS  50  -6.381   7.551   3.994
  361    HA   LYS  50           HA       LYS  50  -6.528  10.202   5.038
  362   1HB   LYS  50          2HB       LYS  50  -7.887   8.386   5.952
  363   2HB   LYS  50          1HB       LYS  50  -6.433   7.540   6.465
  364   1HG   LYS  50          2HG       LYS  50  -5.925   9.252   8.062
  365   2HG   LYS  50          1HG       LYS  50  -7.244  10.260   7.464
  366   1HD   LYS  50          2HD       LYS  50  -8.155   9.286   9.367
  367   2HD   LYS  50          1HD       LYS  50  -8.748   8.247   8.069
  368   1HE   LYS  50          2HE       LYS  50  -7.972   6.601   9.403
  369   2HE   LYS  50          1HE       LYS  50  -6.433   7.002   8.642
  370   1HZ   LYS  50          1HZ       LYS  50  -7.235   8.451  11.065
  371   2HZ   LYS  50          2HZ       LYS  50  -5.685   8.069  10.505
  372   3HZ   LYS  50          3HZ       LYS  50  -6.643   6.874  11.221
  373    H    ARG  51           H        ARG  51  -3.891   8.274   4.295
  374    HA   ARG  51           HA       ARG  51  -2.243   9.523   6.389
  375   1HB   ARG  51          2HB       ARG  51  -2.119   6.911   4.989
  376   2HB   ARG  51          1HB       ARG  51  -0.583   7.680   5.364
  377   1HG   ARG  51          2HG       ARG  51  -1.274   6.115   7.106
  378   2HG   ARG  51          1HG       ARG  51  -1.165   7.767   7.715
  379   1HD   ARG  51          2HD       ARG  51  -3.810   7.158   6.696
  380   2HD   ARG  51          1HD       ARG  51  -3.323   6.040   7.969
  381    HE   ARG  51           HE       ARG  51  -3.974   8.815   8.262
  382   1HH1  ARG  51          1HH1      ARG  51  -2.127   6.179   9.611
  383   2HH1  ARG  51          2HH1      ARG  51  -2.090   6.856  11.204
  384   1HH2  ARG  51          1HH2      ARG  51  -3.925   9.707  10.356
  385   2HH2  ARG  51          2HH2      ARG  51  -3.111   8.857  11.628
  386    H    CYS  52           H        CYS  52  -2.653   9.158   2.934
  387    HA   CYS  52           HA       CYS  52  -0.359  10.968   2.534
  388   1HB   CYS  52          2HB       CYS  52  -0.367   8.528   1.559
  389   2HB   CYS  52          1HB       CYS  52  -1.397   9.241   0.323
  390    H    ALA  53           H        ALA  53  -3.713  10.326   1.773
  391    HA   ALA  53           HA       ALA  53  -3.859  12.530  -0.106
  392   1HB   ALA  53          1HB       ALA  53  -5.194  10.270  -0.121
  393   2HB   ALA  53          2HB       ALA  53  -5.936  11.764  -0.691
  394   3HB   ALA  53          3HB       ALA  53  -6.294  11.164   0.929
  395    H    LYS  54           H        LYS  54  -4.598  11.882   3.242
  396    HA   LYS  54           HA       LYS  54  -5.934  14.472   3.507
  397   1HB   LYS  54          2HB       LYS  54  -5.775  12.020   5.215
  398   2HB   LYS  54          1HB       LYS  54  -6.168  13.564   5.958
  399   1HG   LYS  54          2HG       LYS  54  -8.110  13.805   4.574
  400   2HG   LYS  54          1HG       LYS  54  -7.676  12.371   3.642
  401   1HD   LYS  54          2HD       LYS  54  -8.513  10.971   5.186
  402   2HD   LYS  54          1HD       LYS  54  -7.859  11.911   6.529
  403   1HE   LYS  54          2HE       LYS  54  -9.786  13.586   5.685
  404   2HE   LYS  54          1HE       LYS  54 -10.504  12.044   5.221
  405   1HZ   LYS  54          1HZ       LYS  54  -9.937  13.105   7.881
  406   2HZ   LYS  54          2HZ       LYS  54  -9.761  11.437   7.663
  407   3HZ   LYS  54          3HZ       LYS  54 -11.247  12.179   7.342
  408    H    ALA  55           H        ALA  55  -3.349  12.624   5.126
  409    HA   ALA  55           HA       ALA  55  -2.386  14.756   6.681
  410   1HB   ALA  55          1HB       ALA  55  -0.184  13.176   6.321
  411   2HB   ALA  55          2HB       ALA  55  -1.505  12.056   5.988
  412   3HB   ALA  55          3HB       ALA  55  -1.443  12.911   7.529
  Start of MODEL   10
    1   1H    ILE   1          1H        ILE   1   8.788  14.405   2.219
    2   2H    ILE   1          2H        ILE   1   8.579  14.301   3.920
    3   3H    ILE   1          3H        ILE   1   7.372  15.038   2.949
    4    HA   ILE   1           HA       ILE   1   7.068  12.669   3.799
    5    HB   ILE   1           HB       ILE   1   5.570  13.863   2.245
    6   1HG1  ILE   1          2HG1      ILE   1   4.700  11.824   1.068
    7   2HG1  ILE   1          1HG1      ILE   1   6.151  10.971   1.585
    8   1HG2  ILE   1          1HG2      ILE   1   6.734  12.620  -0.151
    9   2HG2  ILE   1          2HG2      ILE   1   7.659  13.955   0.537
   10   3HG2  ILE   1          3HG2      ILE   1   5.979  14.200   0.059
   11   1HD1  ILE   1          1HD1      ILE   1   4.913  12.229   3.837
   12   2HD1  ILE   1          2HD1      ILE   1   5.234  10.520   3.544
   13   3HD1  ILE   1          3HD1      ILE   1   3.735  11.249   2.966
   14    H    ASP   2           H        ASP   2   8.298  10.930   4.029
   15    HA   ASP   2           HA       ASP   2  10.093  10.159   1.829
   16   1HB   ASP   2          2HB       ASP   2  10.248   9.549   4.784
   17   2HB   ASP   2          1HB       ASP   2  11.339   8.880   3.574
   18    H    THR   3           H        THR   3   7.371   9.174   3.701
   19    HA   THR   3           HA       THR   3   7.628   6.370   3.051
   20    HB   THR   3           HB       THR   3   5.182   7.725   4.170
   21    HG1  THR   3           HG1      THR   3   6.802   8.350   5.526
   22   1HG2  THR   3          1HG2      THR   3   6.018   4.973   3.815
   23   2HG2  THR   3          2HG2      THR   3   4.428   5.640   4.186
   24   3HG2  THR   3          3HG2      THR   3   5.585   5.346   5.483
   25    H    CYS   4           H        CYS   4   5.461   9.034   2.129
   26    HA   CYS   4           HA       CYS   4   3.901   7.519   0.333
   27   1HB   CYS   4          2HB       CYS   4   3.723  10.026   1.383
   28   2HB   CYS   4          1HB       CYS   4   4.188  10.385  -0.276
   29    H    ARG   5           H        ARG   5   7.101   8.627   0.052
   30    HA   ARG   5           HA       ARG   5   6.995   8.751  -2.862
   31   1HB   ARG   5          2HB       ARG   5   9.404   9.385  -2.665
   32   2HB   ARG   5          1HB       ARG   5   8.300  10.482  -1.846
   33   1HG   ARG   5          2HG       ARG   5   9.100   9.980   0.200
   34   2HG   ARG   5          1HG       ARG   5   9.407   8.292  -0.212
   35   1HD   ARG   5          2HD       ARG   5  11.296   9.231  -1.697
   36   2HD   ARG   5          1HD       ARG   5  11.107  10.704  -0.745
   37    HE   ARG   5           HE       ARG   5  11.367   8.797   1.146
   38   1HH1  ARG   5          1HH1      ARG   5  13.253   9.604  -1.678
   39   2HH1  ARG   5          2HH1      ARG   5  14.744   9.052  -0.993
   40   1HH2  ARG   5          1HH2      ARG   5  13.329   8.073   2.049
   41   2HH2  ARG   5          2HH2      ARG   5  14.788   8.184   1.123
   42    H    LEU   6           H        LEU   6   8.129   6.684  -0.281
   43    HA   LEU   6           HA       LEU   6   9.597   4.973  -2.100
   44   1HB   LEU   6          2HB       LEU   6  10.299   3.762  -0.203
   45   2HB   LEU   6          1HB       LEU   6  10.316   5.450   0.267
   46    HG   LEU   6           HG       LEU   6   7.893   4.865   1.174
   47   1HD1  LEU   6          1HD1      LEU   6   9.091   2.282   1.907
   48   2HD1  LEU   6          2HD1      LEU   6   8.536   2.410   0.239
   49   3HD1  LEU   6          3HD1      LEU   6   7.413   2.703   1.568
   50   1HD2  LEU   6          1HD2      LEU   6  10.080   5.581   2.360
   51   2HD2  LEU   6          2HD2      LEU   6  10.213   3.874   2.783
   52   3HD2  LEU   6          3HD2      LEU   6   8.808   4.805   3.302
   53    HA   PRO   7           HA       PRO   7   5.912   2.562  -2.916
   54   1HB   PRO   7          2HB       PRO   7   7.015   0.802  -4.628
   55   2HB   PRO   7          1HB       PRO   7   6.689   2.477  -5.090
   56   1HG   PRO   7          2HG       PRO   7   9.267   1.216  -4.236
   57   2HG   PRO   7          1HG       PRO   7   8.965   2.359  -5.557
   58   1HD   PRO   7          2HD       PRO   7   9.967   3.104  -3.132
   59   2HD   PRO   7          1HD       PRO   7   8.991   4.177  -4.154
   60    H    SER   8           H        SER   8   5.204   0.329  -2.666
   61    HA   SER   8           HA       SER   8   6.814  -1.097  -0.659
   62   1HB   SER   8          2HB       SER   8   3.947  -0.526  -0.908
   63   2HB   SER   8          1HB       SER   8   4.299  -2.210  -0.520
   64    HG   SER   8           HG       SER   8   5.719  -1.279   1.166
   65    H    ASP   9           H        ASP   9   7.026  -3.359  -0.783
   66    HA   ASP   9           HA       ASP   9   6.931  -4.375  -3.508
   67   1HB   ASP   9          2HB       ASP   9   8.480  -4.956  -1.089
   68   2HB   ASP   9          1HB       ASP   9   7.972  -6.403  -1.954
   69    H    ARG  10           H        ARG  10   5.900  -6.304  -4.107
   70    HA   ARG  10           HA       ARG  10   3.497  -6.854  -2.573
   71   1HB   ARG  10          2HB       ARG  10   4.414  -7.636  -5.331
   72   2HB   ARG  10          1HB       ARG  10   2.939  -8.263  -4.613
   73   1HG   ARG  10          2HG       ARG  10   1.916  -6.158  -4.593
   74   2HG   ARG  10          1HG       ARG  10   3.448  -5.319  -4.848
   75   1HD   ARG  10          2HD       ARG  10   2.097  -5.342  -6.882
   76   2HD   ARG  10          1HD       ARG  10   3.595  -6.246  -7.095
   77    HE   ARG  10           HE       ARG  10   1.837  -8.162  -6.379
   78   1HH1  ARG  10          1HH1      ARG  10   1.748  -5.662  -8.814
   79   2HH1  ARG  10          2HH1      ARG  10   0.776  -6.587  -9.908
   80   1HH2  ARG  10          1HH2      ARG  10   0.562  -9.382  -7.824
   81   2HH2  ARG  10          2HH2      ARG  10   0.101  -8.697  -9.346
   82    HN2  GLY  11           H        GLY  11   6.591  -8.171  -2.809
   83   1HA   GLY  11          2HA       GLY  11   7.448 -10.310  -2.455
   84   2HA   GLY  11          1HA       GLY  11   6.521 -10.086  -0.985
   85    H    ARG  12           H        ARG  12   6.605 -11.629  -4.122
   86    HA   ARG  12           HA       ARG  12   4.104 -12.773  -4.276
   87   1HB   ARG  12          2HB       ARG  12   6.800 -13.500  -5.242
   88   2HB   ARG  12          1HB       ARG  12   5.650 -14.827  -5.163
   89   1HG   ARG  12          2HG       ARG  12   4.109 -13.045  -6.395
   90   2HG   ARG  12          1HG       ARG  12   5.686 -12.445  -6.916
   91   1HD   ARG  12          2HD       ARG  12   5.369 -13.959  -8.571
   92   2HD   ARG  12          1HD       ARG  12   6.051 -15.054  -7.370
   93    HE   ARG  12           HE       ARG  12   3.302 -15.010  -6.974
   94   1HH1  ARG  12          1HH1      ARG  12   5.548 -15.978  -9.462
   95   2HH1  ARG  12          2HH1      ARG  12   4.517 -17.220 -10.086
   96   1HH2  ARG  12          1HH2      ARG  12   1.943 -16.645  -7.792
   97   2HH2  ARG  12          2HH2      ARG  12   2.468 -17.599  -9.138
   98    H    CYS  13           H        CYS  13   6.933 -14.530  -3.004
   99    HA   CYS  13           HA       CYS  13   7.058 -16.293  -1.555
  100   1HB   CYS  13          2HB       CYS  13   5.150 -14.553   0.023
  101   2HB   CYS  13          1HB       CYS  13   6.250 -15.765   0.676
  102    H    LYS  14           H        LYS  14   5.109 -17.245   0.333
  103    HA   LYS  14           HA       LYS  14   3.514 -18.819  -1.497
  104   1HB   LYS  14          2HB       LYS  14   4.822 -19.454   0.792
  105   2HB   LYS  14          1HB       LYS  14   3.189 -19.237   1.405
  106   1HG   LYS  14          2HG       LYS  14   2.899 -21.375   0.843
  107   2HG   LYS  14          1HG       LYS  14   2.751 -20.768  -0.808
  108   1HD   LYS  14          2HD       LYS  14   4.563 -21.912  -1.401
  109   2HD   LYS  14          1HD       LYS  14   5.520 -21.039  -0.203
  110   1HE   LYS  14          2HE       LYS  14   5.029 -22.659   1.478
  111   2HE   LYS  14          1HE       LYS  14   3.830 -23.445   0.451
  112   1HZ   LYS  14          1HZ       LYS  14   5.552 -24.818   0.041
  113   2HZ   LYS  14          2HZ       LYS  14   6.730 -23.665   0.421
  114   3HZ   LYS  14          3HZ       LYS  14   5.976 -23.635  -1.093
  115    H    ALA  15           H        ALA  15   2.989 -15.877  -0.289
  116    HA   ALA  15           HA       ALA  15   0.144 -16.382   0.271
  117   1HB   ALA  15          1HB       ALA  15   2.089 -14.655   1.519
  118   2HB   ALA  15          2HB       ALA  15   0.480 -15.125   2.068
  119   3HB   ALA  15          3HB       ALA  15   0.674 -13.748   0.983
  120    H    SER  16           H        SER  16  -1.339 -14.592  -0.416
  121    HA   SER  16           HA       SER  16  -0.561 -12.926  -2.606
  122   1HB   SER  16          2HB       SER  16  -2.237 -15.382  -3.168
  123   2HB   SER  16          1HB       SER  16  -2.091 -14.016  -4.272
  124    HG   SER  16           HG       SER  16  -0.549 -16.042  -4.261
  125    H    PHE  17           H        PHE  17  -1.499 -11.539  -0.923
  126    HA   PHE  17           HA       PHE  17  -4.444 -11.539  -0.979
  127   1HB   PHE  17          2HB       PHE  17  -2.476 -10.971   1.146
  128   2HB   PHE  17          1HB       PHE  17  -3.817  -9.834   1.053
  129    HD1  PHE  17           HD1      PHE  17  -6.186 -10.823   1.036
  130    HD2  PHE  17           HD2      PHE  17  -2.732 -13.000   2.236
  131    HE1  PHE  17           HE1      PHE  17  -7.617 -12.408   2.261
  132    HE2  PHE  17           HE2      PHE  17  -4.155 -14.589   3.462
  133    HZ   PHE  17           HZ       PHE  17  -6.600 -14.295   3.476
  134    H    GLU  18           H        GLU  18  -5.355  -9.242  -0.680
  135    HA   GLU  18           HA       GLU  18  -3.968  -7.511  -2.601
  136   1HB   GLU  18          2HB       GLU  18  -6.844  -7.879  -1.855
  137   2HB   GLU  18          1HB       GLU  18  -6.320  -6.355  -2.557
  138   1HG   GLU  18          2HG       GLU  18  -6.872  -7.415  -4.467
  139   2HG   GLU  18          1HG       GLU  18  -5.219  -8.010  -4.325
  140    H    ARG  19           H        ARG  19  -3.360  -5.470  -2.106
  141    HA   ARG  19           HA       ARG  19  -4.228  -4.273   0.407
  142   1HB   ARG  19          2HB       ARG  19  -1.378  -4.975  -0.258
  143   2HB   ARG  19          1HB       ARG  19  -1.771  -3.687   0.873
  144   1HG   ARG  19          2HG       ARG  19  -3.298  -5.882   1.684
  145   2HG   ARG  19          1HG       ARG  19  -1.707  -6.529   1.286
  146   1HD   ARG  19          2HD       ARG  19  -0.638  -5.037   2.807
  147   2HD   ARG  19          1HD       ARG  19  -2.126  -4.127   3.051
  148    HE   ARG  19           HE       ARG  19  -2.703  -6.694   3.833
  149   1HH1  ARG  19          1HH1      ARG  19  -0.388  -4.254   4.757
  150   2HH1  ARG  19          2HH1      ARG  19  -0.294  -4.786   6.402
  151   1HH2  ARG  19          1HH2      ARG  19  -2.585  -7.395   5.997
  152   2HH2  ARG  19          2HH2      ARG  19  -1.544  -6.569   7.107
  153    H    TRP  20           H        TRP  20  -3.477  -1.993   0.606
  154    HA   TRP  20           HA       TRP  20  -3.407  -0.743  -2.055
  155   1HB   TRP  20          2HB       TRP  20  -4.378   0.354   0.591
  156   2HB   TRP  20          1HB       TRP  20  -4.335   1.263  -0.916
  157    HD1  TRP  20           HD1      TRP  20  -6.341  -1.378   0.926
  158    HE1  TRP  20           HE1      TRP  20  -8.513  -1.839  -0.367
  159    HE3  TRP  20           HE3      TRP  20  -5.313   1.240  -3.343
  160    HZ2  TRP  20           HZ2      TRP  20  -9.642  -1.185  -2.861
  161    HZ3  TRP  20           HZ3      TRP  20  -6.995   1.269  -5.138
  162    HH2  TRP  20           HH2      TRP  20  -9.117   0.080  -4.902
  163    H    TYR  21           H        TYR  21  -1.947   0.863  -2.536
  164    HA   TYR  21           HA       TYR  21   0.095   1.487  -0.504
  165   1HB   TYR  21          2HB       TYR  21   1.690   1.456  -2.623
  166   2HB   TYR  21          1HB       TYR  21   1.358  -0.018  -1.719
  167    HD1  TYR  21           HD2      TYR  21  -0.834  -1.285  -2.559
  168    HD2  TYR  21           HD1      TYR  21   1.534   1.331  -4.929
  169    HE1  TYR  21           HE2      TYR  21  -1.721  -2.329  -4.582
  170    HE2  TYR  21           HE1      TYR  21   0.640   0.293  -6.973
  171    HH   TYR  21           HH       TYR  21  -0.428  -2.073  -7.542
  172    H    PHE  22           H        PHE  22   1.163   3.504  -0.793
  173    HA   PHE  22           HA       PHE  22  -0.519   5.548  -1.832
  174   1HB   PHE  22          2HB       PHE  22   2.355   5.696  -0.892
  175   2HB   PHE  22          1HB       PHE  22   1.307   7.079  -1.187
  176    HD1  PHE  22           HD2      PHE  22  -1.101   6.732   0.083
  177    HD2  PHE  22           HD1      PHE  22   2.673   5.195   1.311
  178    HE1  PHE  22           HE2      PHE  22  -1.906   6.618   2.405
  179    HE2  PHE  22           HE1      PHE  22   1.874   5.079   3.635
  180    HZ   PHE  22           HZ       PHE  22  -0.418   5.792   4.184
  181    H    ASN  23           H        ASN  23  -0.202   6.934  -3.577
  182    HA   ASN  23           HA       ASN  23   1.986   6.462  -5.416
  183   1HB   ASN  23          2HB       ASN  23  -0.153   4.888  -5.829
  184   2HB   ASN  23          1HB       ASN  23  -0.684   6.316  -6.711
  185   1HD2  ASN  23          1HD2      ASN  23   0.213   6.789  -8.641
  186   2HD2  ASN  23          2HD2      ASN  23   1.415   5.820  -9.416
  187    HN2  GLY  24           H        GLY  24   2.201   8.689  -4.484
  188   1HA   GLY  24          2HA       GLY  24   2.310  10.924  -5.099
  189   2HA   GLY  24          1HA       GLY  24   1.167  10.592  -6.391
  190    H    ARG  25           H        ARG  25  -1.086  10.515  -5.885
  191    HA   ARG  25           HA       ARG  25  -1.766  11.987  -3.422
  192   1HB   ARG  25          2HB       ARG  25  -3.629  13.003  -4.659
  193   2HB   ARG  25          1HB       ARG  25  -2.080  13.386  -5.396
  194   1HG   ARG  25          2HG       ARG  25  -3.182  10.993  -6.553
  195   2HG   ARG  25          1HG       ARG  25  -4.339  12.322  -6.640
  196   1HD   ARG  25          2HD       ARG  25  -2.047  13.572  -7.378
  197   2HD   ARG  25          1HD       ARG  25  -1.768  11.953  -8.017
  198    HE   ARG  25           HE       ARG  25  -4.360  12.948  -8.684
  199   1HH1  ARG  25          1HH1      ARG  25  -0.990  13.066  -9.580
  200   2HH1  ARG  25          2HH1      ARG  25  -1.314  13.479 -11.230
  201   1HH2  ARG  25          1HH2      ARG  25  -4.789  13.489 -10.853
  202   2HH2  ARG  25          2HH2      ARG  25  -3.471  13.719 -11.954
  203    H    THR  26           H        THR  26  -2.588   9.382  -5.598
  204    HA   THR  26           HA       THR  26  -4.688   8.511  -3.723
  205    HB   THR  26           HB       THR  26  -5.552   9.035  -5.965
  206    HG1  THR  26           HG1      THR  26  -6.432   7.266  -4.745
  207   1HG2  THR  26          1HG2      THR  26  -4.437   6.728  -7.314
  208   2HG2  THR  26          2HG2      THR  26  -3.220   7.947  -6.937
  209   3HG2  THR  26          3HG2      THR  26  -4.644   8.386  -7.880
  210    H    CYS  27           H        CYS  27  -5.029   6.025  -3.971
  211    HA   CYS  27           HA       CYS  27  -2.373   4.787  -3.734
  212   1HB   CYS  27          2HB       CYS  27  -4.391   3.128  -2.569
  213   2HB   CYS  27          1HB       CYS  27  -3.027   3.912  -1.787
  214    H    ALA  28           H        ALA  28  -2.219   2.509  -4.314
  215    HA   ALA  28           HA       ALA  28  -4.005   1.808  -6.544
  216   1HB   ALA  28          1HB       ALA  28  -1.779   0.484  -7.222
  217   2HB   ALA  28          2HB       ALA  28  -1.062   1.859  -6.380
  218   3HB   ALA  28          3HB       ALA  28  -2.133   2.125  -7.755
  219    H    LYS  29           H        LYS  29  -3.607  -0.703  -7.059
  220    HA   LYS  29           HA       LYS  29  -3.646  -2.170  -4.515
  221   1HB   LYS  29          2HB       LYS  29  -5.911  -1.585  -6.067
  222   2HB   LYS  29          1HB       LYS  29  -5.557  -3.281  -6.371
  223   1HG   LYS  29          2HG       LYS  29  -5.470  -3.593  -3.874
  224   2HG   LYS  29          1HG       LYS  29  -6.114  -1.956  -3.732
  225   1HD   LYS  29          2HD       LYS  29  -8.129  -2.934  -3.825
  226   2HD   LYS  29          1HD       LYS  29  -7.814  -3.101  -5.553
  227   1HE   LYS  29          2HE       LYS  29  -6.586  -5.296  -4.775
  228   2HE   LYS  29          1HE       LYS  29  -7.652  -5.133  -3.378
  229   1HZ   LYS  29          1HZ       LYS  29  -9.392  -4.782  -5.346
  230   2HZ   LYS  29          2HZ       LYS  29  -9.031  -6.303  -4.699
  231   3HZ   LYS  29          3HZ       LYS  29  -8.293  -5.798  -6.135
  232    H    PHE  30           H        PHE  30  -2.766  -4.164  -4.531
  233    HA   PHE  30           HA       PHE  30  -2.253  -5.575  -6.992
  234   1HB   PHE  30          2HB       PHE  30   0.219  -5.744  -6.527
  235   2HB   PHE  30          1HB       PHE  30  -0.334  -4.178  -7.101
  236    HD1  PHE  30           HD1      PHE  30  -1.168  -4.800  -3.660
  237    HD2  PHE  30           HD2      PHE  30   1.936  -3.463  -6.249
  238    HE1  PHE  30           HE1      PHE  30  -0.053  -3.721  -1.759
  239    HE2  PHE  30           HE2      PHE  30   3.055  -2.379  -4.347
  240    HZ   PHE  30           HZ       PHE  30   2.061  -2.507  -2.098
  241    H    ILE  31           H        ILE  31  -0.793  -7.605  -6.427
  242    HA   ILE  31           HA       ILE  31  -2.138  -8.866  -4.175
  243    HB   ILE  31           HB       ILE  31  -0.271 -10.070  -6.219
  244   1HG1  ILE  31          2HG1      ILE  31  -2.355  -9.155  -7.200
  245   2HG1  ILE  31          1HG1      ILE  31  -2.268 -10.910  -7.322
  246   1HG2  ILE  31          1HG2      ILE  31  -2.048 -11.323  -4.136
  247   2HG2  ILE  31          2HG2      ILE  31  -0.292 -11.429  -4.257
  248   3HG2  ILE  31          3HG2      ILE  31  -1.308 -12.217  -5.465
  249   1HD1  ILE  31          1HD1      ILE  31  -3.923  -9.284  -5.415
  250   2HD1  ILE  31          2HD1      ILE  31  -3.711 -11.029  -5.284
  251   3HD1  ILE  31          3HD1      ILE  31  -4.483 -10.342  -6.711
  252    H    TYR  32           H        TYR  32  -1.142  -8.087  -2.353
  253    HA   TYR  32           HA       TYR  32   1.756  -8.214  -2.118
  254   1HB   TYR  32          2HB       TYR  32   0.657  -6.227  -1.266
  255   2HB   TYR  32          1HB       TYR  32  -0.381  -7.203  -0.234
  256    HD1  TYR  32           HD1      TYR  32   3.305  -7.390  -0.795
  257    HD2  TYR  32           HD2      TYR  32   0.148  -6.615   1.946
  258    HE1  TYR  32           HE1      TYR  32   4.944  -7.193   1.025
  259    HE2  TYR  32           HE2      TYR  32   1.777  -6.417   3.776
  260    HH   TYR  32           HH       TYR  32   4.091  -7.222   4.277
  261    HN2  GLY  33           H        GLY  33   2.399 -10.305  -1.881
  262   1HA   GLY  33          2HA       GLY  33   1.028 -12.292  -0.429
  263   2HA   GLY  33          1HA       GLY  33   2.733 -12.338  -0.851
  264    HN2  GLY  34           H        GLY  34   2.901  -9.628   0.652
  265   1HA   GLY  34          2HA       GLY  34   2.669  -9.057   3.012
  266   2HA   GLY  34          1HA       GLY  34   2.869 -10.763   3.375
  267    H    CYS  35           H        CYS  35   4.997 -10.124   0.942
  268    HA   CYS  35           HA       CYS  35   7.160  -9.628   2.876
  269   1HB   CYS  35          2HB       CYS  35   7.694 -10.829   0.188
  270   2HB   CYS  35          1HB       CYS  35   8.554 -11.055   1.704
  271    HN2  GLY  36           H        GLY  36   8.285  -7.813   2.715
  272   1HA   GLY  36          2HA       GLY  36   9.488  -6.132   1.582
  273   2HA   GLY  36          1HA       GLY  36   8.598  -6.514   0.116
  274    HN2  GLY  37           H        GLY  37   7.965  -5.292   3.410
  275   1HA   GLY  37          2HA       GLY  37   6.529  -3.034   2.244
  276   2HA   GLY  37          1HA       GLY  37   5.598  -4.108   3.277
  277    H    ASN  38           H        ASN  38   6.345  -1.253   3.581
  278    HA   ASN  38           HA       ASN  38   7.481  -1.491   6.275
  279   1HB   ASN  38          2HB       ASN  38   8.502   0.897   5.638
  280   2HB   ASN  38          1HB       ASN  38   9.379  -0.604   5.360
  281   1HD2  ASN  38          1HD2      ASN  38  10.475  -0.323   3.550
  282   2HD2  ASN  38          2HD2      ASN  38   9.828   0.250   2.053
  283    HN2  GLY  39           H        GLY  39   6.603   1.416   4.445
  284   1HA   GLY  39          2HA       GLY  39   4.295   1.753   6.251
  285   2HA   GLY  39          1HA       GLY  39   5.426   3.066   5.968
  286    H    ASN  40           H        ASN  40   5.207   1.454   3.103
  287    HA   ASN  40           HA       ASN  40   3.396   3.462   2.035
  288   1HB   ASN  40          2HB       ASN  40   5.522   3.084   0.884
  289   2HB   ASN  40          1HB       ASN  40   5.107   1.389   0.641
  290   1HD2  ASN  40          1HD2      ASN  40   4.481   4.666  -0.322
  291   2HD2  ASN  40          2HD2      ASN  40   3.600   4.290  -1.761
  292    H    LYS  41           H        LYS  41   3.497   0.045   2.685
  293    HA   LYS  41           HA       LYS  41   1.206  -0.589   1.064
  294   1HB   LYS  41          2HB       LYS  41   1.349  -2.807   2.187
  295   2HB   LYS  41          1HB       LYS  41   2.846  -2.312   1.408
  296   1HG   LYS  41          2HG       LYS  41   3.882  -2.755   3.315
  297   2HG   LYS  41          1HG       LYS  41   3.057  -1.360   4.014
  298   1HD   LYS  41          2HD       LYS  41   1.456  -2.654   5.043
  299   2HD   LYS  41          1HD       LYS  41   1.625  -3.973   3.884
  300   1HE   LYS  41          2HE       LYS  41   3.784  -4.559   4.852
  301   2HE   LYS  41          1HE       LYS  41   3.649  -3.220   5.990
  302   1HZ   LYS  41          1HZ       LYS  41   1.888  -4.262   7.102
  303   2HZ   LYS  41          2HZ       LYS  41   3.014  -5.496   6.837
  304   3HZ   LYS  41          3HZ       LYS  41   1.636  -5.386   5.862
  305    H    PHE  42           H        PHE  42  -0.827  -1.331   1.866
  306    HA   PHE  42           HA       PHE  42  -1.516  -0.819   4.627
  307   1HB   PHE  42          2HB       PHE  42  -2.274   1.013   2.420
  308   2HB   PHE  42          1HB       PHE  42  -3.545   0.600   3.567
  309    HD1  PHE  42           HD2      PHE  42  -0.288   2.229   3.147
  310    HD2  PHE  42           HD1      PHE  42  -3.478   1.379   5.831
  311    HE1  PHE  42           HE2      PHE  42   0.591   3.906   4.717
  312    HE2  PHE  42           HE1      PHE  42  -2.606   3.054   7.406
  313    HZ   PHE  42           HZ       PHE  42  -0.567   4.322   6.851
  314    HA   PRO  43           HA       PRO  43  -4.307  -4.110   3.671
  315   1HB   PRO  43          2HB       PRO  43  -5.924  -4.021   5.817
  316   2HB   PRO  43          1HB       PRO  43  -4.232  -4.518   5.942
  317   1HG   PRO  43          2HG       PRO  43  -5.484  -1.876   6.585
  318   2HG   PRO  43          1HG       PRO  43  -4.255  -2.781   7.486
  319   1HD   PRO  43          2HD       PRO  43  -3.682  -0.684   5.823
  320   2HD   PRO  43          1HD       PRO  43  -2.545  -1.999   6.178
  321    H    THR  44           H        THR  44  -5.912  -1.122   4.800
  322    HA   THR  44           HA       THR  44  -8.101  -1.702   2.918
  323    HB   THR  44           HB       THR  44  -9.248   0.111   4.488
  324    HG1  THR  44           HG1      THR  44  -8.387   0.286   6.411
  325   1HG2  THR  44          1HG2      THR  44  -8.942  -2.817   5.004
  326   2HG2  THR  44          2HG2      THR  44 -10.326  -1.938   4.354
  327   3HG2  THR  44          3HG2      THR  44  -9.913  -1.795   6.063
  328    H    GLN  45           H        GLN  45  -9.028   0.035   1.748
  329    HA   GLN  45           HA       GLN  45  -7.102   1.905   0.773
  330   1HB   GLN  45          2HB       GLN  45  -9.126   0.737  -0.432
  331   2HB   GLN  45          1HB       GLN  45 -10.021   2.130   0.157
  332   1HG   GLN  45          2HG       GLN  45  -7.801   3.283  -0.951
  333   2HG   GLN  45          1HG       GLN  45  -8.103   1.918  -2.024
  334   1HE2  GLN  45          1HE2      GLN  45  -8.479   4.955  -2.140
  335   2HE2  GLN  45          2HE2      GLN  45 -10.076   5.138  -2.769
  336    H    GLU  46           H        GLU  46  -9.521   1.977   3.223
  337    HA   GLU  46           HA       GLU  46 -10.040   4.759   3.259
  338   1HB   GLU  46          2HB       GLU  46 -10.905   4.350   5.534
  339   2HB   GLU  46          1HB       GLU  46 -11.531   3.196   4.364
  340   1HG   GLU  46          2HG       GLU  46 -10.542   1.446   5.361
  341   2HG   GLU  46          1HG       GLU  46  -9.088   2.359   5.765
  342    H    ALA  47           H        ALA  47  -7.477   2.786   4.550
  343    HA   ALA  47           HA       ALA  47  -6.472   4.777   6.353
  344   1HB   ALA  47          1HB       ALA  47  -6.087   2.413   6.778
  345   2HB   ALA  47          2HB       ALA  47  -4.556   3.271   6.605
  346   3HB   ALA  47          3HB       ALA  47  -5.164   2.280   5.280
  347    H    CYS  48           H        CYS  48  -5.384   3.498   3.209
  348    HA   CYS  48           HA       CYS  48  -3.170   5.166   2.892
  349   1HB   CYS  48          2HB       CYS  48  -3.203   4.554   0.573
  350   2HB   CYS  48          1HB       CYS  48  -3.717   3.151   1.502
  351    H    MET  49           H        MET  49  -6.568   5.719   2.222
  352    HA   MET  49           HA       MET  49  -6.140   8.180   0.815
  353   1HB   MET  49          2HB       MET  49  -8.521   6.688   1.828
  354   2HB   MET  49          1HB       MET  49  -8.704   8.384   1.403
  355   1HG   MET  49          2HG       MET  49  -7.401   7.459  -0.775
  356   2HG   MET  49          1HG       MET  49  -8.325   6.032  -0.310
  357   1HE   MET  49          1HE       MET  49  -9.687   9.450  -2.730
  358   2HE   MET  49          2HE       MET  49  -8.863   7.965  -3.206
  359   3HE   MET  49          3HE       MET  49  -8.073   9.101  -2.111
  360    H    LYS  50           H        LYS  50  -6.717   7.240   4.126
  361    HA   LYS  50           HA       LYS  50  -7.130   9.989   4.977
  362   1HB   LYS  50          2HB       LYS  50  -8.444   8.134   5.967
  363   2HB   LYS  50          1HB       LYS  50  -6.959   7.461   6.624
  364   1HG   LYS  50          2HG       LYS  50  -6.643   9.461   7.984
  365   2HG   LYS  50          1HG       LYS  50  -8.125  10.151   7.316
  366   1HD   LYS  50          2HD       LYS  50  -8.672   9.218   9.439
  367   2HD   LYS  50          1HD       LYS  50  -9.344   8.146   8.209
  368   1HE   LYS  50          2HE       LYS  50  -8.324   6.505   9.336
  369   2HE   LYS  50          1HE       LYS  50  -6.842   7.102   8.588
  370   1HZ   LYS  50          1HZ       LYS  50  -6.124   7.992  10.512
  371   2HZ   LYS  50          2HZ       LYS  50  -7.149   6.840  11.209
  372   3HZ   LYS  50          3HZ       LYS  50  -7.672   8.439  11.033
  373    H    ARG  51           H        ARG  51  -4.464   8.228   4.203
  374    HA   ARG  51           HA       ARG  51  -2.834   9.333   6.377
  375   1HB   ARG  51          2HB       ARG  51  -2.815   6.827   5.492
  376   2HB   ARG  51          1HB       ARG  51  -1.674   7.501   4.337
  377   1HG   ARG  51          2HG       ARG  51  -0.436   6.608   6.162
  378   2HG   ARG  51          1HG       ARG  51  -0.346   8.368   6.256
  379   1HD   ARG  51          2HD       ARG  51  -0.732   7.335   8.454
  380   2HD   ARG  51          1HD       ARG  51  -2.055   8.396   7.972
  381    HE   ARG  51           HE       ARG  51  -2.543   5.685   7.239
  382   1HH1  ARG  51          1HH1      ARG  51  -2.639   7.915   9.922
  383   2HH1  ARG  51          2HH1      ARG  51  -3.863   7.032  10.773
  384   1HH2  ARG  51          1HH2      ARG  51  -4.151   4.524   8.355
  385   2HH2  ARG  51          2HH2      ARG  51  -4.723   5.109   9.882
  386    H    CYS  52           H        CYS  52  -2.735   8.988   2.819
  387    HA   CYS  52           HA       CYS  52  -1.029  11.392   2.759
  388   1HB   CYS  52          2HB       CYS  52  -0.393   8.931   1.788
  389   2HB   CYS  52          1HB       CYS  52  -1.074   9.690   0.353
  390    H    ALA  53           H        ALA  53  -3.986   9.987   1.632
  391    HA   ALA  53           HA       ALA  53  -4.348  11.968  -0.454
  392   1HB   ALA  53          1HB       ALA  53  -6.594  10.240   0.425
  393   2HB   ALA  53          2HB       ALA  53  -5.204   9.469  -0.339
  394   3HB   ALA  53          3HB       ALA  53  -6.099  10.721  -1.198
  395    H    LYS  54           H        LYS  54  -4.830  11.846   2.881
  396    HA   LYS  54           HA       LYS  54  -6.931  13.898   2.746
  397   1HB   LYS  54          2HB       LYS  54  -6.313  11.749   4.689
  398   2HB   LYS  54          1HB       LYS  54  -6.868  13.273   5.366
  399   1HG   LYS  54          2HG       LYS  54  -8.629  12.790   3.288
  400   2HG   LYS  54          1HG       LYS  54  -8.354  11.199   3.997
  401   1HD   LYS  54          2HD       LYS  54  -9.403  11.735   5.924
  402   2HD   LYS  54          1HD       LYS  54  -8.785  13.387   5.921
  403   1HE   LYS  54          2HE       LYS  54 -10.503  14.167   4.590
  404   2HE   LYS  54          1HE       LYS  54 -10.838  12.575   3.910
  405   1HZ   LYS  54          1HZ       LYS  54 -11.304  13.088   6.774
  406   2HZ   LYS  54          2HZ       LYS  54 -12.029  11.942   5.763
  407   3HZ   LYS  54          3HZ       LYS  54 -12.452  13.574   5.630
  408    H    ALA  55           H        ALA  55  -4.067  13.036   4.690
  409    HA   ALA  55           HA       ALA  55  -3.735  15.572   5.852
  410   1HB   ALA  55          1HB       ALA  55  -2.533  14.049   7.023
  411   2HB   ALA  55          2HB       ALA  55  -1.241  14.626   5.971
  412   3HB   ALA  55          3HB       ALA  55  -2.090  13.128   5.586
  Start of MODEL   11
    1   1H    ILE   1          1H        ILE   1   6.444  14.207   6.558
    2   2H    ILE   1          2H        ILE   1   6.845  14.535   4.921
    3   3H    ILE   1          3H        ILE   1   8.022  13.873   5.980
    4    HA   ILE   1           HA       ILE   1   6.996  11.850   6.079
    5    HB   ILE   1           HB       ILE   1   4.704  12.785   6.349
    6   1HG1  ILE   1          2HG1      ILE   1   5.194  10.347   5.941
    7   2HG1  ILE   1          1HG1      ILE   1   3.568  10.861   5.510
    8   1HG2  ILE   1          1HG2      ILE   1   4.082  12.655   3.492
    9   2HG2  ILE   1          2HG2      ILE   1   5.118  14.002   3.958
   10   3HG2  ILE   1          3HG2      ILE   1   3.546  13.794   4.727
   11   1HD1  ILE   1          1HD1      ILE   1   4.145   9.522   3.738
   12   2HD1  ILE   1          2HD1      ILE   1   5.828  10.051   3.747
   13   3HD1  ILE   1          3HD1      ILE   1   4.571  11.121   3.129
   14    H    ASP   2           H        ASP   2   8.403  10.877   4.772
   15    HA   ASP   2           HA       ASP   2   8.292  11.469   1.894
   16   1HB   ASP   2          2HB       ASP   2  10.617  10.437   1.880
   17   2HB   ASP   2          1HB       ASP   2  10.459  11.992   2.690
   18    H    THR   3           H        THR   3   7.532   9.112   4.180
   19    HA   THR   3           HA       THR   3   8.157   6.701   2.998
   20    HB   THR   3           HB       THR   3   5.618   7.422   4.473
   21    HG1  THR   3           HG1      THR   3   8.173   6.582   5.333
   22   1HG2  THR   3          1HG2      THR   3   5.686   5.029   5.191
   23   2HG2  THR   3          2HG2      THR   3   6.884   4.754   3.926
   24   3HG2  THR   3          3HG2      THR   3   5.260   5.293   3.500
   25    H    CYS   4           H        CYS   4   5.796   9.053   2.020
   26    HA   CYS   4           HA       CYS   4   4.263   7.316   0.354
   27   1HB   CYS   4          2HB       CYS   4   4.232  10.105   1.121
   28   2HB   CYS   4          1HB       CYS   4   3.962   9.933  -0.610
   29    H    ARG   5           H        ARG   5   7.356   8.607   0.037
   30    HA   ARG   5           HA       ARG   5   7.274   8.804  -2.862
   31   1HB   ARG   5          2HB       ARG   5   9.501   9.224  -0.867
   32   2HB   ARG   5          1HB       ARG   5   9.697   9.396  -2.605
   33   1HG   ARG   5          2HG       ARG   5   8.728  11.412  -2.637
   34   2HG   ARG   5          1HG       ARG   5   7.465  10.931  -1.503
   35   1HD   ARG   5          2HD       ARG   5   9.342  11.018   0.268
   36   2HD   ARG   5          1HD       ARG   5  10.222  11.961  -0.934
   37    HE   ARG   5           HE       ARG   5   7.920  12.798   0.600
   38   1HH1  ARG   5          1HH1      ARG   5   9.903  13.401  -2.211
   39   2HH1  ARG   5          2HH1      ARG   5   9.437  15.064  -2.336
   40   1HH2  ARG   5          1HH2      ARG   5   7.308  14.983   0.434
   41   2HH2  ARG   5          2HH2      ARG   5   7.965  15.963  -0.834
   42    H    LEU   6           H        LEU   6   8.164   6.530  -0.411
   43    HA   LEU   6           HA       LEU   6   9.560   4.862  -2.380
   44   1HB   LEU   6          2HB       LEU   6   9.992   3.460  -0.219
   45   2HB   LEU   6          1HB       LEU   6  10.933   4.904  -0.545
   46    HG   LEU   6           HG       LEU   6   8.478   5.231   1.095
   47   1HD1  LEU   6          1HD1      LEU   6   9.286   3.288   2.160
   48   2HD1  LEU   6          2HD1      LEU   6   9.857   4.645   3.129
   49   3HD1  LEU   6          3HD1      LEU   6  10.962   3.821   2.029
   50   1HD2  LEU   6          1HD2      LEU   6   9.765   7.180   0.593
   51   2HD2  LEU   6          2HD2      LEU   6  11.257   6.393   1.105
   52   3HD2  LEU   6          3HD2      LEU   6  10.017   6.791   2.294
   53    HA   PRO   7           HA       PRO   7   5.561   2.732  -2.589
   54   1HB   PRO   7          2HB       PRO   7   6.291   1.064  -4.627
   55   2HB   PRO   7          1HB       PRO   7   5.724   2.720  -4.872
   56   1HG   PRO   7          2HG       PRO   7   8.524   1.664  -4.815
   57   2HG   PRO   7          1HG       PRO   7   7.795   2.849  -5.915
   58   1HD   PRO   7          2HD       PRO   7   9.360   3.588  -3.851
   59   2HD   PRO   7          1HD       PRO   7   7.983   4.572  -4.387
   60    H    SER   8           H        SER   8   4.859   0.528  -2.286
   61    HA   SER   8           HA       SER   8   6.861  -1.093  -0.864
   62   1HB   SER   8          2HB       SER   8   3.891  -0.772  -0.478
   63   2HB   SER   8          1HB       SER   8   4.768  -2.145   0.197
   64    HG   SER   8           HG       SER   8   6.107  -0.623   1.290
   65    H    ASP   9           H        ASP   9   6.609  -3.436  -0.973
   66    HA   ASP   9           HA       ASP   9   5.733  -4.267  -3.650
   67   1HB   ASP   9          2HB       ASP   9   8.149  -4.648  -2.450
   68   2HB   ASP   9          1HB       ASP   9   7.329  -6.150  -2.034
   69    H    ARG  10           H        ARG  10   4.504  -6.166  -3.920
   70    HA   ARG  10           HA       ARG  10   2.758  -6.741  -1.667
   71   1HB   ARG  10          2HB       ARG  10   1.435  -7.972  -3.373
   72   2HB   ARG  10          1HB       ARG  10   1.683  -6.280  -3.760
   73   1HG   ARG  10          2HG       ARG  10   2.347  -6.966  -5.763
   74   2HG   ARG  10          1HG       ARG  10   3.817  -7.536  -4.974
   75   1HD   ARG  10          2HD       ARG  10   3.111  -9.424  -6.088
   76   2HD   ARG  10          1HD       ARG  10   2.416  -9.667  -4.486
   77    HE   ARG  10           HE       ARG  10   0.377  -8.526  -5.638
   78   1HH1  ARG  10          1HH1      ARG  10   2.539 -10.901  -7.017
   79   2HH1  ARG  10          2HH1      ARG  10   1.352 -11.532  -8.107
   80   1HH2  ARG  10          1HH2      ARG  10  -1.186  -9.365  -7.086
   81   2HH2  ARG  10          2HH2      ARG  10  -0.756 -10.663  -8.146
   82    HN2  GLY  11           H        GLY  11   5.629  -7.959  -2.655
   83   1HA   GLY  11          2HA       GLY  11   6.694  -9.981  -2.430
   84   2HA   GLY  11          1HA       GLY  11   5.681 -10.128  -1.004
   85    H    ARG  12           H        ARG  12   6.198 -11.154  -4.266
   86    HA   ARG  12           HA       ARG  12   3.770 -12.486  -4.738
   87   1HB   ARG  12          2HB       ARG  12   6.012 -12.067  -6.198
   88   2HB   ARG  12          1HB       ARG  12   6.233 -13.759  -5.772
   89   1HG   ARG  12          2HG       ARG  12   3.664 -13.807  -6.575
   90   2HG   ARG  12          1HG       ARG  12   4.288 -12.499  -7.582
   91   1HD   ARG  12          2HD       ARG  12   6.132 -14.712  -7.529
   92   2HD   ARG  12          1HD       ARG  12   4.528 -15.253  -8.021
   93    HE   ARG  12           HE       ARG  12   4.768 -14.087  -9.981
   94   1HH1  ARG  12          1HH1      ARG  12   7.236 -13.062  -7.736
   95   2HH1  ARG  12          2HH1      ARG  12   8.099 -12.134  -8.915
   96   1HH2  ARG  12          1HH2      ARG  12   5.901 -12.867 -11.534
   97   2HH2  ARG  12          2HH2      ARG  12   7.341 -12.022 -11.072
   98    H    CYS  13           H        CYS  13   6.291 -13.126  -2.555
   99    HA   CYS  13           HA       CYS  13   6.716 -15.690  -2.176
  100   1HB   CYS  13          2HB       CYS  13   6.092 -15.164   0.392
  101   2HB   CYS  13          1HB       CYS  13   7.554 -14.576  -0.389
  102    H    LYS  14           H        LYS  14   4.038 -14.646  -0.107
  103    HA   LYS  14           HA       LYS  14   2.638 -17.119  -0.872
  104   1HB   LYS  14          2HB       LYS  14   3.161 -15.821   1.698
  105   2HB   LYS  14          1HB       LYS  14   1.483 -16.304   1.493
  106   1HG   LYS  14          2HG       LYS  14   2.600 -18.097   2.554
  107   2HG   LYS  14          1HG       LYS  14   2.313 -18.588   0.884
  108   1HD   LYS  14          2HD       LYS  14   4.574 -18.224   0.289
  109   2HD   LYS  14          1HD       LYS  14   4.902 -17.352   1.788
  110   1HE   LYS  14          2HE       LYS  14   4.310 -20.293   1.485
  111   2HE   LYS  14          1HE       LYS  14   5.850 -19.561   1.933
  112   1HZ   LYS  14          1HZ       LYS  14   4.482 -18.576   3.871
  113   2HZ   LYS  14          2HZ       LYS  14   4.987 -20.188   3.956
  114   3HZ   LYS  14          3HZ       LYS  14   3.392 -19.824   3.529
  115    H    ALA  15           H        ALA  15   2.090 -15.288  -2.663
  116    HA   ALA  15           HA       ALA  15   0.223 -13.311  -2.246
  117   1HB   ALA  15          1HB       ALA  15  -0.625 -14.206  -4.619
  118   2HB   ALA  15          2HB       ALA  15   0.919 -15.054  -4.527
  119   3HB   ALA  15          3HB       ALA  15   0.871 -13.295  -4.415
  120    H    SER  16           H        SER  16  -1.859 -13.230  -1.629
  121    HA   SER  16           HA       SER  16  -3.751 -15.263  -2.212
  122   1HB   SER  16          2HB       SER  16  -2.377 -15.340   0.426
  123   2HB   SER  16          1HB       SER  16  -4.116 -15.635   0.407
  124    HG   SER  16           HG       SER  16  -3.815 -17.396  -0.853
  125    H    PHE  17           H        PHE  17  -2.894 -12.496  -0.182
  126    HA   PHE  17           HA       PHE  17  -5.729 -11.716  -0.140
  127   1HB   PHE  17          2HB       PHE  17  -3.435 -10.830   1.622
  128   2HB   PHE  17          1HB       PHE  17  -5.072 -10.190   1.717
  129    HD1  PHE  17           HD1      PHE  17  -3.239 -13.432   1.835
  130    HD2  PHE  17           HD2      PHE  17  -6.551 -11.137   3.203
  131    HE1  PHE  17           HE1      PHE  17  -3.848 -15.242   3.386
  132    HE2  PHE  17           HE2      PHE  17  -7.167 -12.944   4.757
  133    HZ   PHE  17           HZ       PHE  17  -5.813 -14.999   4.850
  134    H    GLU  18           H        GLU  18  -6.012  -9.252  -0.087
  135    HA   GLU  18           HA       GLU  18  -4.288  -8.079  -2.166
  136   1HB   GLU  18          2HB       GLU  18  -7.221  -8.177  -1.851
  137   2HB   GLU  18          1HB       GLU  18  -6.576  -6.609  -2.320
  138   1HG   GLU  18          2HG       GLU  18  -5.351  -7.804  -4.171
  139   2HG   GLU  18          1HG       GLU  18  -6.317  -9.223  -3.773
  140    H    ARG  19           H        ARG  19  -3.614  -5.953  -1.932
  141    HA   ARG  19           HA       ARG  19  -4.419  -4.527   0.495
  142   1HB   ARG  19          2HB       ARG  19  -1.635  -5.416  -0.183
  143   2HB   ARG  19          1HB       ARG  19  -1.899  -3.979   0.792
  144   1HG   ARG  19          2HG       ARG  19  -3.462  -5.656   2.137
  145   2HG   ARG  19          1HG       ARG  19  -2.336  -6.829   1.453
  146   1HD   ARG  19          2HD       ARG  19  -0.487  -5.823   2.503
  147   2HD   ARG  19          1HD       ARG  19  -1.394  -4.356   2.874
  148    HE   ARG  19           HE       ARG  19  -2.742  -6.231   4.250
  149   1HH1  ARG  19          1HH1      ARG  19   0.657  -5.454   4.068
  150   2HH1  ARG  19          2HH1      ARG  19   0.991  -5.981   5.683
  151   1HH2  ARG  19          1HH2      ARG  19  -2.303  -6.925   6.373
  152   2HH2  ARG  19          2HH2      ARG  19  -0.689  -6.818   6.992
  153    H    TRP  20           H        TRP  20  -3.414  -2.277   0.539
  154    HA   TRP  20           HA       TRP  20  -3.337  -1.192  -2.200
  155   1HB   TRP  20          2HB       TRP  20  -4.593  -0.049   0.295
  156   2HB   TRP  20          1HB       TRP  20  -4.306   0.905  -1.156
  157    HD1  TRP  20           HD1      TRP  20  -6.391  -2.099   0.058
  158    HE1  TRP  20           HE1      TRP  20  -8.434  -2.337  -1.479
  159    HE3  TRP  20           HE3      TRP  20  -5.212   1.467  -3.409
  160    HZ2  TRP  20           HZ2      TRP  20  -9.417  -1.173  -3.849
  161    HZ3  TRP  20           HZ3      TRP  20  -6.759   1.842  -5.284
  162    HH2  TRP  20           HH2      TRP  20  -8.820   0.547  -5.500
  163    H    TYR  21           H        TYR  21  -2.016   0.630  -2.580
  164    HA   TYR  21           HA       TYR  21  -0.053   1.301  -0.500
  165   1HB   TYR  21          2HB       TYR  21   1.645   1.239  -2.538
  166   2HB   TYR  21          1HB       TYR  21   1.298  -0.217  -1.609
  167    HD1  TYR  21           HD1      TYR  21  -0.807  -1.565  -2.511
  168    HD2  TYR  21           HD2      TYR  21   1.579   1.062  -4.848
  169    HE1  TYR  21           HE1      TYR  21  -1.598  -2.666  -4.538
  170    HE2  TYR  21           HE2      TYR  21   0.789  -0.045  -6.899
  171    HH   TYR  21           HH       TYR  21  -0.211  -2.461  -7.446
  172    H    PHE  22           H        PHE  22   1.107   3.299  -0.939
  173    HA   PHE  22           HA       PHE  22  -0.599   5.199  -2.328
  174   1HB   PHE  22          2HB       PHE  22   0.756   5.390   0.010
  175   2HB   PHE  22          1HB       PHE  22   1.910   6.147  -1.083
  176    HD1  PHE  22           HD1      PHE  22   1.065   8.047  -2.561
  177    HD2  PHE  22           HD2      PHE  22  -1.062   6.583   0.819
  178    HE1  PHE  22           HE1      PHE  22  -0.217  10.145  -2.465
  179    HE2  PHE  22           HE2      PHE  22  -2.348   8.678   0.922
  180    HZ   PHE  22           HZ       PHE  22  -1.926  10.463  -0.722
  181    H    ASN  23           H        ASN  23  -0.308   5.394  -4.446
  182    HA   ASN  23           HA       ASN  23   2.330   5.029  -5.615
  183   1HB   ASN  23          2HB       ASN  23  -0.004   4.193  -6.531
  184   2HB   ASN  23          1HB       ASN  23  -0.059   5.805  -7.236
  185   1HD2  ASN  23          1HD2      ASN  23   2.148   6.412  -8.277
  186   2HD2  ASN  23          2HD2      ASN  23   2.797   5.214  -9.339
  187    HN2  GLY  24           H        GLY  24   2.536   7.171  -4.080
  188   1HA   GLY  24          2HA       GLY  24   3.308   9.335  -4.159
  189   2HA   GLY  24          1HA       GLY  24   3.203   9.243  -5.910
  190    H    ARG  25           H        ARG  25   0.818   9.245  -6.709
  191    HA   ARG  25           HA       ARG  25  -0.520  11.473  -5.332
  192   1HB   ARG  25          2HB       ARG  25   0.184  12.047  -7.570
  193   2HB   ARG  25          1HB       ARG  25  -0.584  10.608  -8.226
  194   1HG   ARG  25          2HG       ARG  25  -2.297  12.528  -6.753
  195   2HG   ARG  25          1HG       ARG  25  -1.713  12.996  -8.353
  196   1HD   ARG  25          2HD       ARG  25  -2.811  10.266  -8.102
  197   2HD   ARG  25          1HD       ARG  25  -3.967  11.588  -7.944
  198    HE   ARG  25           HE       ARG  25  -2.349  12.022 -10.205
  199   1HH1  ARG  25          1HH1      ARG  25  -4.907   9.931  -9.081
  200   2HH1  ARG  25          2HH1      ARG  25  -5.531   9.632 -10.668
  201   1HH2  ARG  25          1HH2      ARG  25  -3.167  11.630 -12.295
  202   2HH2  ARG  25          2HH2      ARG  25  -4.543  10.596 -12.494
  203    H    THR  26           H        THR  26  -1.176   8.438  -7.066
  204    HA   THR  26           HA       THR  26  -3.803   8.349  -5.732
  205    HB   THR  26           HB       THR  26  -3.939   8.438  -8.186
  206    HG1  THR  26           HG1      THR  26  -5.399   7.104  -6.862
  207   1HG2  THR  26          1HG2      THR  26  -2.344   5.894  -8.094
  208   2HG2  THR  26          2HG2      THR  26  -1.914   7.406  -8.895
  209   3HG2  THR  26          3HG2      THR  26  -3.264   6.442  -9.495
  210    H    CYS  27           H        CYS  27  -4.600   6.175  -5.177
  211    HA   CYS  27           HA       CYS  27  -2.407   4.552  -4.107
  212   1HB   CYS  27          2HB       CYS  27  -5.182   5.133  -3.249
  213   2HB   CYS  27          1HB       CYS  27  -4.604   3.499  -2.940
  214    H    ALA  28           H        ALA  28  -1.849   2.809  -5.187
  215    HA   ALA  28           HA       ALA  28  -3.683   1.593  -7.086
  216   1HB   ALA  28          1HB       ALA  28  -1.485   0.130  -7.407
  217   2HB   ALA  28          2HB       ALA  28  -0.755   1.562  -6.677
  218   3HB   ALA  28          3HB       ALA  28  -1.696   1.709  -8.160
  219    H    LYS  29           H        LYS  29  -3.345  -0.976  -7.180
  220    HA   LYS  29           HA       LYS  29  -3.477  -2.074  -4.473
  221   1HB   LYS  29          2HB       LYS  29  -5.779  -1.495  -5.078
  222   2HB   LYS  29          1HB       LYS  29  -5.641  -2.453  -6.546
  223   1HG   LYS  29          2HG       LYS  29  -5.164  -4.431  -5.025
  224   2HG   LYS  29          1HG       LYS  29  -5.715  -3.402  -3.702
  225   1HD   LYS  29          2HD       LYS  29  -7.661  -3.129  -5.680
  226   2HD   LYS  29          1HD       LYS  29  -7.251  -4.845  -5.683
  227   1HE   LYS  29          2HE       LYS  29  -7.529  -4.775  -3.167
  228   2HE   LYS  29          1HE       LYS  29  -8.237  -3.175  -3.384
  229   1HZ   LYS  29          1HZ       LYS  29  -9.884  -4.999  -3.270
  230   2HZ   LYS  29          2HZ       LYS  29  -9.252  -5.632  -4.705
  231   3HZ   LYS  29          3HZ       LYS  29  -9.977  -4.104  -4.703
  232    H    PHE  30           H        PHE  30  -3.010  -4.234  -4.278
  233    HA   PHE  30           HA       PHE  30  -2.570  -5.899  -6.585
  234   1HB   PHE  30          2HB       PHE  30  -0.158  -6.344  -5.934
  235   2HB   PHE  30          1HB       PHE  30  -0.471  -4.797  -6.704
  236    HD1  PHE  30           HD2      PHE  30  -1.515  -5.024  -3.249
  237    HD2  PHE  30           HD1      PHE  30   1.775  -4.167  -5.813
  238    HE1  PHE  30           HE2      PHE  30  -0.373  -3.891  -1.397
  239    HE2  PHE  30           HE1      PHE  30   2.921  -3.031  -3.960
  240    HZ   PHE  30           HZ       PHE  30   1.848  -2.891  -1.749
  241    H    ILE  31           H        ILE  31  -1.455  -8.050  -5.760
  242    HA   ILE  31           HA       ILE  31  -3.019  -8.865  -3.438
  243    HB   ILE  31           HB       ILE  31  -1.395 -10.546  -5.347
  244   1HG1  ILE  31          2HG1      ILE  31  -4.182  -9.510  -5.394
  245   2HG1  ILE  31          1HG1      ILE  31  -3.085  -9.841  -6.728
  246   1HG2  ILE  31          1HG2      ILE  31  -1.832 -11.457  -3.019
  247   2HG2  ILE  31          2HG2      ILE  31  -2.384 -12.455  -4.365
  248   3HG2  ILE  31          3HG2      ILE  31  -3.540 -11.482  -3.457
  249   1HD1  ILE  31          1HD1      ILE  31  -4.663 -11.865  -5.162
  250   2HD1  ILE  31          2HD1      ILE  31  -3.514 -12.246  -6.444
  251   3HD1  ILE  31          3HD1      ILE  31  -4.974 -11.328  -6.812
  252    H    TYR  32           H        TYR  32  -2.116  -8.792  -1.497
  253    HA   TYR  32           HA       TYR  32   0.774  -8.719  -1.221
  254   1HB   TYR  32          2HB       TYR  32  -0.776  -7.171   0.022
  255   2HB   TYR  32          1HB       TYR  32  -1.326  -8.562   0.948
  256    HD1  TYR  32           HD2      TYR  32   0.266  -9.730   2.471
  257    HD2  TYR  32           HD1      TYR  32   1.278  -6.086   0.522
  258    HE1  TYR  32           HE2      TYR  32   2.100  -9.388   4.073
  259    HE2  TYR  32           HE1      TYR  32   3.114  -5.736   2.119
  260    HH   TYR  32           HH       TYR  32   4.168  -8.190   4.277
  261    HN2  GLY  33           H        GLY  33   1.762 -10.618  -1.285
  262   1HA   GLY  33          2HA       GLY  33   0.504 -13.025  -0.320
  263   2HA   GLY  33          1HA       GLY  33   2.111 -12.895  -1.015
  264    HN2  GLY  34           H        GLY  34   2.871 -10.761   0.915
  265   1HA   GLY  34          2HA       GLY  34   2.670 -11.160   3.533
  266   2HA   GLY  34          1HA       GLY  34   3.590 -12.583   3.078
  267    H    CYS  35           H        CYS  35   4.765 -10.614   0.890
  268    HA   CYS  35           HA       CYS  35   6.814  -9.546   2.713
  269   1HB   CYS  35          2HB       CYS  35   7.242 -10.067  -0.225
  270   2HB   CYS  35          1HB       CYS  35   8.448  -9.846   1.030
  271    HN2  GLY  36           H        GLY  36   5.897  -7.582   3.128
  272   1HA   GLY  36          2HA       GLY  36   4.801  -5.875   1.148
  273   2HA   GLY  36          1HA       GLY  36   5.232  -5.415   2.783
  274    HN2  GLY  37           H        GLY  37   6.433  -3.648   2.654
  275   1HA   GLY  37          2HA       GLY  37   8.906  -3.770   1.100
  276   2HA   GLY  37          1HA       GLY  37   7.793  -2.459   0.733
  277    H    ASN  38           H        ASN  38   6.953  -1.433   2.972
  278    HA   ASN  38           HA       ASN  38   8.829  -1.298   5.087
  279   1HB   ASN  38          2HB       ASN  38   9.255   1.282   4.508
  280   2HB   ASN  38          1HB       ASN  38  10.342   0.001   3.984
  281   1HD2  ASN  38          1HD2      ASN  38  11.044   0.500   2.039
  282   2HD2  ASN  38          2HD2      ASN  38  10.073   1.036   0.714
  283    HN2  GLY  39           H        GLY  39   7.151   1.515   3.734
  284   1HA   GLY  39          2HA       GLY  39   5.120   1.241   5.851
  285   2HA   GLY  39          1HA       GLY  39   5.999   2.747   5.657
  286    H    ASN  40           H        ASN  40   5.602   1.536   2.611
  287    HA   ASN  40           HA       ASN  40   3.415   3.380   2.096
  288   1HB   ASN  40          2HB       ASN  40   5.391   3.472   0.664
  289   2HB   ASN  40          1HB       ASN  40   5.164   1.787   0.209
  290   1HD2  ASN  40          1HD2      ASN  40   4.243   5.035  -0.340
  291   2HD2  ASN  40          2HD2      ASN  40   3.147   4.739  -1.642
  292    H    LYS  41           H        LYS  41   3.545   0.230   2.993
  293    HA   LYS  41           HA       LYS  41   1.499  -0.755   1.175
  294   1HB   LYS  41          2HB       LYS  41   1.714  -2.864   2.449
  295   2HB   LYS  41          1HB       LYS  41   3.254  -2.303   1.810
  296   1HG   LYS  41          2HG       LYS  41   2.606  -1.419   4.544
  297   2HG   LYS  41          1HG       LYS  41   2.892  -3.149   4.335
  298   1HD   LYS  41          2HD       LYS  41   4.944  -2.109   2.899
  299   2HD   LYS  41          1HD       LYS  41   4.760  -0.883   4.154
  300   1HE   LYS  41          2HE       LYS  41   5.342  -3.814   4.474
  301   2HE   LYS  41          1HE       LYS  41   6.316  -2.442   5.000
  302   1HZ   LYS  41          1HZ       LYS  41   4.024  -3.683   6.275
  303   2HZ   LYS  41          2HZ       LYS  41   4.059  -1.994   6.337
  304   3HZ   LYS  41          3HZ       LYS  41   5.351  -2.889   6.963
  305    H    PHE  42           H        PHE  42  -0.594  -1.283   1.766
  306    HA   PHE  42           HA       PHE  42  -1.502  -0.744   4.474
  307   1HB   PHE  42          2HB       PHE  42  -2.449   0.829   2.076
  308   2HB   PHE  42          1HB       PHE  42  -3.353   0.741   3.584
  309    HD1  PHE  42           HD2      PHE  42  -2.176   1.515   5.713
  310    HD2  PHE  42           HD1      PHE  42  -0.760   2.399   1.798
  311    HE1  PHE  42           HE2      PHE  42  -0.850   3.381   6.617
  312    HE2  PHE  42           HE1      PHE  42   0.569   4.265   2.695
  313    HZ   PHE  42           HZ       PHE  42   0.524   4.759   5.108
  314    HA   PRO  43           HA       PRO  43  -4.313  -3.998   3.484
  315   1HB   PRO  43          2HB       PRO  43  -6.337  -3.548   5.201
  316   2HB   PRO  43          1HB       PRO  43  -4.737  -4.058   5.750
  317   1HG   PRO  43          2HG       PRO  43  -5.949  -1.323   5.728
  318   2HG   PRO  43          1HG       PRO  43  -4.982  -2.108   6.989
  319   1HD   PRO  43          2HD       PRO  43  -3.966  -0.299   5.206
  320   2HD   PRO  43          1HD       PRO  43  -2.999  -1.577   5.968
  321    H    THR  44           H        THR  44  -5.978  -0.854   3.802
  322    HA   THR  44           HA       THR  44  -7.631  -1.606   1.482
  323    HB   THR  44           HB       THR  44  -9.296   0.084   2.581
  324    HG1  THR  44           HG1      THR  44  -9.145   0.066   4.845
  325   1HG2  THR  44          1HG2      THR  44  -8.894  -2.649   3.773
  326   2HG2  THR  44          2HG2      THR  44  -9.828  -2.269   2.326
  327   3HG2  THR  44          3HG2      THR  44 -10.356  -1.669   3.899
  328    H    GLN  45           H        GLN  45  -8.688   0.469   0.521
  329    HA   GLN  45           HA       GLN  45  -6.530   2.153  -0.329
  330   1HB   GLN  45          2HB       GLN  45  -8.320   1.418  -1.865
  331   2HB   GLN  45          1HB       GLN  45  -9.486   2.350  -0.936
  332   1HG   GLN  45          2HG       GLN  45  -7.722   4.284  -1.475
  333   2HG   GLN  45          1HG       GLN  45  -7.446   3.244  -2.872
  334   1HE2  GLN  45          1HE2      GLN  45  -8.367   5.671  -3.389
  335   2HE2  GLN  45          2HE2      GLN  45 -10.036   5.639  -3.831
  336    H    GLU  46           H        GLU  46  -9.218   2.425   1.885
  337    HA   GLU  46           HA       GLU  46  -9.151   5.247   2.177
  338   1HB   GLU  46          2HB       GLU  46 -10.882   3.334   2.965
  339   2HB   GLU  46          1HB       GLU  46 -10.028   3.600   4.479
  340   1HG   GLU  46          2HG       GLU  46 -11.531   5.214   4.802
  341   2HG   GLU  46          1HG       GLU  46 -10.529   6.151   3.694
  342    H    ALA  47           H        ALA  47  -7.399   2.607   3.643
  343    HA   ALA  47           HA       ALA  47  -6.345   4.018   5.858
  344   1HB   ALA  47          1HB       ALA  47  -6.366   1.592   5.788
  345   2HB   ALA  47          2HB       ALA  47  -4.718   2.184   5.991
  346   3HB   ALA  47          3HB       ALA  47  -5.258   1.603   4.417
  347    H    CYS  48           H        CYS  48  -4.860   3.163   2.726
  348    HA   CYS  48           HA       CYS  48  -2.461   4.539   3.118
  349   1HB   CYS  48          2HB       CYS  48  -2.122   4.346   0.733
  350   2HB   CYS  48          1HB       CYS  48  -2.868   2.866   1.322
  351    H    MET  49           H        MET  49  -5.607   5.670   2.130
  352    HA   MET  49           HA       MET  49  -4.605   8.254   1.288
  353   1HB   MET  49          2HB       MET  49  -7.396   7.134   1.547
  354   2HB   MET  49          1HB       MET  49  -7.057   8.779   1.026
  355   1HG   MET  49          2HG       MET  49  -5.699   6.571  -0.408
  356   2HG   MET  49          1HG       MET  49  -7.425   6.796  -0.683
  357   1HE   MET  49          1HE       MET  49  -6.755   7.407  -3.487
  358   2HE   MET  49          2HE       MET  49  -7.387   9.053  -3.518
  359   3HE   MET  49          3HE       MET  49  -8.168   7.828  -2.518
  360    H    LYS  50           H        LYS  50  -6.119   6.819   4.098
  361    HA   LYS  50           HA       LYS  50  -6.501   9.412   5.357
  362   1HB   LYS  50          2HB       LYS  50  -7.636   8.248   7.102
  363   2HB   LYS  50          1HB       LYS  50  -8.173   7.558   5.577
  364   1HG   LYS  50          2HG       LYS  50  -7.692   5.561   6.403
  365   2HG   LYS  50          1HG       LYS  50  -5.987   6.007   6.334
  366   1HD   LYS  50          2HD       LYS  50  -5.915   6.588   8.577
  367   2HD   LYS  50          1HD       LYS  50  -7.660   6.833   8.671
  368   1HE   LYS  50          2HE       LYS  50  -8.100   4.554   8.791
  369   2HE   LYS  50          1HE       LYS  50  -6.536   4.118   8.104
  370   1HZ   LYS  50          1HZ       LYS  50  -6.163   3.652  10.283
  371   2HZ   LYS  50          2HZ       LYS  50  -7.223   4.840  10.855
  372   3HZ   LYS  50          3HZ       LYS  50  -5.691   5.277  10.287
  373    H    ARG  51           H        ARG  51  -3.880   7.488   4.930
  374    HA   ARG  51           HA       ARG  51  -2.797   8.051   7.606
  375   1HB   ARG  51          2HB       ARG  51  -2.053   5.996   5.535
  376   2HB   ARG  51          1HB       ARG  51  -1.012   6.372   6.899
  377   1HG   ARG  51          2HG       ARG  51  -3.866   5.625   7.361
  378   2HG   ARG  51          1HG       ARG  51  -2.658   4.379   7.047
  379   1HD   ARG  51          2HD       ARG  51  -2.212   4.439   9.230
  380   2HD   ARG  51          1HD       ARG  51  -1.450   6.001   8.931
  381    HE   ARG  51           HE       ARG  51  -4.051   6.645   9.278
  382   1HH1  ARG  51          1HH1      ARG  51  -1.793   4.763  11.159
  383   2HH1  ARG  51          2HH1      ARG  51  -2.541   5.148  12.672
  384   1HH2  ARG  51          1HH2      ARG  51  -5.036   7.153  11.269
  385   2HH2  ARG  51          2HH2      ARG  51  -4.381   6.505  12.736
  386    H    CYS  52           H        CYS  52  -2.110   8.362   4.145
  387    HA   CYS  52           HA       CYS  52   0.116  10.164   4.843
  388   1HB   CYS  52          2HB       CYS  52   0.724   8.099   3.570
  389   2HB   CYS  52          1HB       CYS  52  -0.271   8.682   2.239
  390    H    ALA  53           H        ALA  53  -2.860   9.858   3.059
  391    HA   ALA  53           HA       ALA  53  -2.464  12.339   1.621
  392   1HB   ALA  53          1HB       ALA  53  -3.975  10.109   1.134
  393   2HB   ALA  53          2HB       ALA  53  -4.133  11.656   0.302
  394   3HB   ALA  53          3HB       ALA  53  -5.183  11.279   1.667
  395    H    LYS  54           H        LYS  54  -3.943  11.282   4.577
  396    HA   LYS  54           HA       LYS  54  -5.455  13.738   4.894
  397   1HB   LYS  54          2HB       LYS  54  -5.794  11.163   5.831
  398   2HB   LYS  54          1HB       LYS  54  -5.226  12.028   7.253
  399   1HG   LYS  54          2HG       LYS  54  -7.208  12.968   7.549
  400   2HG   LYS  54          1HG       LYS  54  -7.231  13.569   5.891
  401   1HD   LYS  54          2HD       LYS  54  -7.759  10.683   6.252
  402   2HD   LYS  54          1HD       LYS  54  -9.003  11.788   6.842
  403   1HE   LYS  54          2HE       LYS  54  -7.917  12.377   4.164
  404   2HE   LYS  54          1HE       LYS  54  -8.863  10.895   4.300
  405   1HZ   LYS  54          1HZ       LYS  54  -9.797  13.572   5.182
  406   2HZ   LYS  54          2HZ       LYS  54 -10.704  12.145   5.160
  407   3HZ   LYS  54          3HZ       LYS  54 -10.205  12.850   3.707
  408    H    ALA  55           H        ALA  55  -3.204  12.064   7.093
  409    HA   ALA  55           HA       ALA  55  -2.487  14.515   8.386
  410   1HB   ALA  55          1HB       ALA  55  -1.499  13.221   9.958
  411   2HB   ALA  55          2HB       ALA  55  -0.789  12.128   8.771
  412   3HB   ALA  55          3HB       ALA  55  -2.490  11.970   9.210
  Start of MODEL   12
    1   1H    ILE   1          1H        ILE   1   5.106  11.325   4.460
    2   2H    ILE   1          2H        ILE   1   4.107  12.710   4.628
    3   3H    ILE   1          3H        ILE   1   5.813  12.859   4.748
    4    HA   ILE   1           HA       ILE   1   4.160  12.308   2.394
    5    HB   ILE   1           HB       ILE   1   4.586  14.657   2.994
    6   1HG1  ILE   1          2HG1      ILE   1   5.619  15.339   0.812
    7   2HG1  ILE   1          1HG1      ILE   1   6.019  13.648   0.529
    8   1HG2  ILE   1          1HG2      ILE   1   7.322  14.924   2.322
    9   2HG2  ILE   1          2HG2      ILE   1   7.197  13.678   3.562
   10   3HG2  ILE   1          3HG2      ILE   1   6.530  15.282   3.856
   11   1HD1  ILE   1          1HD1      ILE   1   3.673  14.974  -0.166
   12   2HD1  ILE   1          2HD1      ILE   1   3.236  13.929   1.187
   13   3HD1  ILE   1          3HD1      ILE   1   3.990  13.241  -0.252
   14    H    ASP   2           H        ASP   2   7.224  11.710   3.923
   15    HA   ASP   2           HA       ASP   2   8.615  10.980   1.528
   16   1HB   ASP   2          2HB       ASP   2   9.206  10.668   4.462
   17   2HB   ASP   2          1HB       ASP   2  10.248   9.957   3.233
   18    H    THR   3           H        THR   3   6.268   9.439   3.406
   19    HA   THR   3           HA       THR   3   7.202   6.745   2.833
   20    HB   THR   3           HB       THR   3   4.590   7.558   4.108
   21    HG1  THR   3           HG1      THR   3   5.595   7.767   5.975
   22   1HG2  THR   3          1HG2      THR   3   5.011   5.146   3.368
   23   2HG2  THR   3          2HG2      THR   3   4.474   5.431   5.023
   24   3HG2  THR   3          3HG2      THR   3   6.173   5.091   4.693
   25    H    CYS   4           H        CYS   4   4.831   9.051   1.711
   26    HA   CYS   4           HA       CYS   4   3.370   7.173   0.113
   27   1HB   CYS   4          2HB       CYS   4   3.335  10.126   0.513
   28   2HB   CYS   4          1HB       CYS   4   2.590   9.479  -0.945
   29    H    ARG   5           H        ARG   5   6.421   8.405  -0.253
   30    HA   ARG   5           HA       ARG   5   6.238   8.508  -3.181
   31   1HB   ARG   5          2HB       ARG   5   8.589   9.445  -2.998
   32   2HB   ARG   5          1HB       ARG   5   7.297  10.459  -2.368
   33   1HG   ARG   5          2HG       ARG   5   8.082  10.377  -0.276
   34   2HG   ARG   5          1HG       ARG   5   8.488   8.664  -0.390
   35   1HD   ARG   5          2HD       ARG   5  10.430   9.421  -1.881
   36   2HD   ARG   5          1HD       ARG   5  10.105  11.039  -1.259
   37    HE   ARG   5           HE       ARG   5  10.314   9.575   0.991
   38   1HH1  ARG   5          1HH1      ARG   5  12.363   9.875  -1.818
   39   2HH1  ARG   5          2HH1      ARG   5  13.821   9.546  -0.943
   40   1HH2  ARG   5          1HH2      ARG   5  12.227   9.144   2.142
   41   2HH2  ARG   5          2HH2      ARG   5  13.744   9.131   1.305
   42    H    LEU   6           H        LEU   6   7.230   6.476  -0.633
   43    HA   LEU   6           HA       LEU   6   9.108   5.029  -2.357
   44   1HB   LEU   6          2HB       LEU   6   9.758   3.807  -0.351
   45   2HB   LEU   6          1HB       LEU   6   9.898   5.538  -0.114
   46    HG   LEU   6           HG       LEU   6   7.438   5.180   0.890
   47   1HD1  LEU   6          1HD1      LEU   6   7.051   3.138   1.858
   48   2HD1  LEU   6          2HD1      LEU   6   8.760   2.704   1.883
   49   3HD1  LEU   6          3HD1      LEU   6   7.858   2.647   0.369
   50   1HD2  LEU   6          1HD2      LEU   6   8.447   5.220   3.079
   51   2HD2  LEU   6          2HD2      LEU   6   9.390   6.229   1.982
   52   3HD2  LEU   6          3HD2      LEU   6   9.971   4.622   2.425
   53    HA   PRO   7           HA       PRO   7   5.922   2.030  -3.168
   54   1HB   PRO   7          2HB       PRO   7   7.382   0.249  -4.543
   55   2HB   PRO   7          1HB       PRO   7   6.988   1.837  -5.213
   56   1HG   PRO   7          2HG       PRO   7   9.523   0.901  -3.922
   57   2HG   PRO   7          1HG       PRO   7   9.309   1.887  -5.380
   58   1HD   PRO   7          2HD       PRO   7   9.907   2.924  -2.916
   59   2HD   PRO   7          1HD       PRO   7   9.042   3.821  -4.179
   60    H    SER   8           H        SER   8   5.314  -0.116  -2.608
   61    HA   SER   8           HA       SER   8   6.908  -1.250  -0.410
   62   1HB   SER   8          2HB       SER   8   4.047  -0.750  -0.749
   63   2HB   SER   8          1HB       SER   8   4.397  -2.395  -0.218
   64    HG   SER   8           HG       SER   8   5.653  -1.463   1.480
   65    H    ASP   9           H        ASP   9   7.152  -3.511  -0.253
   66    HA   ASP   9           HA       ASP   9   7.138  -4.848  -2.838
   67   1HB   ASP   9          2HB       ASP   9   8.646  -5.100  -0.342
   68   2HB   ASP   9          1HB       ASP   9   8.170  -6.654  -1.022
   69    H    ARG  10           H        ARG  10   6.032  -6.732  -3.295
   70    HA   ARG  10           HA       ARG  10   3.690  -7.198  -1.641
   71   1HB   ARG  10          2HB       ARG  10   4.446  -7.698  -4.449
   72   2HB   ARG  10          1HB       ARG  10   3.384  -8.897  -3.723
   73   1HG   ARG  10          2HG       ARG  10   1.801  -7.145  -3.124
   74   2HG   ARG  10          1HG       ARG  10   2.871  -5.936  -3.831
   75   1HD   ARG  10          2HD       ARG  10   0.852  -6.905  -5.183
   76   2HD   ARG  10          1HD       ARG  10   2.381  -6.555  -5.979
   77    HE   ARG  10           HE       ARG  10   2.068  -9.263  -5.007
   78   1HH1  ARG  10          1HH1      ARG  10   1.690  -7.081  -7.708
   79   2HH1  ARG  10          2HH1      ARG  10   1.714  -8.345  -8.891
   80   1HH2  ARG  10          1HH2      ARG  10   2.097 -10.923  -6.562
   81   2HH2  ARG  10          2HH2      ARG  10   1.943 -10.527  -8.241
   82    HN2  GLY  11           H        GLY  11   6.771  -8.520  -1.844
   83   1HA   GLY  11          2HA       GLY  11   7.681 -10.524  -1.162
   84   2HA   GLY  11          1HA       GLY  11   6.377 -10.507   0.017
   85    H    ARG  12           H        ARG  12   7.385 -11.657  -3.136
   86    HA   ARG  12           HA       ARG  12   5.216 -12.898  -4.163
   87   1HB   ARG  12          2HB       ARG  12   7.883 -13.018  -4.673
   88   2HB   ARG  12          1HB       ARG  12   7.584 -14.654  -4.102
   89   1HG   ARG  12          2HG       ARG  12   7.309 -14.780  -6.412
   90   2HG   ARG  12          1HG       ARG  12   5.663 -14.704  -5.780
   91   1HD   ARG  12          2HD       ARG  12   5.250 -12.757  -6.800
   92   2HD   ARG  12          1HD       ARG  12   6.799 -12.075  -6.306
   93    HE   ARG  12           HE       ARG  12   6.164 -13.246  -8.833
   94   1HH1  ARG  12          1HH1      ARG  12   8.753 -12.691  -6.559
   95   2HH1  ARG  12          2HH1      ARG  12   9.995 -12.761  -7.765
   96   1HH2  ARG  12          1HH2      ARG  12   7.795 -13.337 -10.420
   97   2HH2  ARG  12          2HH2      ARG  12   9.452 -13.127  -9.957
   98    H    CYS  13           H        CYS  13   7.080 -13.988  -1.389
   99    HA   CYS  13           HA       CYS  13   6.627 -16.429  -0.709
  100   1HB   CYS  13          2HB       CYS  13   5.284 -14.439   1.115
  101   2HB   CYS  13          1HB       CYS  13   6.185 -15.887   1.550
  102    H    LYS  14           H        LYS  14   5.114 -17.974  -0.840
  103    HA   LYS  14           HA       LYS  14   2.863 -18.017  -2.182
  104   1HB   LYS  14          2HB       LYS  14   3.557 -19.422   0.349
  105   2HB   LYS  14          1HB       LYS  14   1.918 -19.594  -0.263
  106   1HG   LYS  14          2HG       LYS  14   4.405 -20.203  -1.847
  107   2HG   LYS  14          1HG       LYS  14   3.440 -21.401  -0.983
  108   1HD   LYS  14          2HD       LYS  14   1.521 -20.171  -2.441
  109   2HD   LYS  14          1HD       LYS  14   2.907 -20.008  -3.523
  110   1HE   LYS  14          2HE       LYS  14   3.235 -22.353  -3.602
  111   2HE   LYS  14          1HE       LYS  14   2.125 -22.624  -2.259
  112   1HZ   LYS  14          1HZ       LYS  14   0.287 -22.157  -3.593
  113   2HZ   LYS  14          2HZ       LYS  14   1.279 -23.098  -4.590
  114   3HZ   LYS  14          3HZ       LYS  14   1.215 -21.420  -4.802
  115    H    ALA  15           H        ALA  15   2.036 -15.866  -2.091
  116    HA   ALA  15           HA       ALA  15   0.307 -15.330   0.228
  117   1HB   ALA  15          1HB       ALA  15   0.286 -13.002  -0.592
  118   2HB   ALA  15          2HB       ALA  15   1.396 -13.480  -1.877
  119   3HB   ALA  15          3HB       ALA  15   1.899 -13.595  -0.191
  120    H    SER  16           H        SER  16  -1.669 -13.990  -0.358
  121    HA   SER  16           HA       SER  16  -2.894 -14.284  -2.891
  122   1HB   SER  16          2HB       SER  16  -2.963 -16.652  -1.658
  123   2HB   SER  16          1HB       SER  16  -4.370 -15.922  -0.885
  124    HG   SER  16           HG       SER  16  -3.966 -16.049  -3.690
  125    H    PHE  17           H        PHE  17  -2.420 -12.247  -0.906
  126    HA   PHE  17           HA       PHE  17  -5.210 -11.491  -0.330
  127   1HB   PHE  17          2HB       PHE  17  -2.813 -10.777   1.370
  128   2HB   PHE  17          1HB       PHE  17  -4.500 -10.402   1.714
  129    HD1  PHE  17           HD1      PHE  17  -1.995 -13.090   1.542
  130    HD2  PHE  17           HD2      PHE  17  -5.957 -12.023   2.670
  131    HE1  PHE  17           HE1      PHE  17  -2.209 -15.206   2.780
  132    HE2  PHE  17           HE2      PHE  17  -6.178 -14.136   3.910
  133    HZ   PHE  17           HZ       PHE  17  -4.302 -15.731   3.967
  134    H    GLU  18           H        GLU  18  -5.807  -9.775  -1.454
  135    HA   GLU  18           HA       GLU  18  -3.825  -8.059  -2.679
  136   1HB   GLU  18          2HB       GLU  18  -6.672  -8.640  -3.061
  137   2HB   GLU  18          1HB       GLU  18  -6.277  -6.937  -3.248
  138   1HG   GLU  18          2HG       GLU  18  -4.297  -8.171  -4.684
  139   2HG   GLU  18          1HG       GLU  18  -5.697  -9.198  -4.986
  140    H    ARG  19           H        ARG  19  -3.234  -6.084  -1.994
  141    HA   ARG  19           HA       ARG  19  -4.858  -4.801   0.094
  142   1HB   ARG  19          2HB       ARG  19  -1.869  -5.218   0.104
  143   2HB   ARG  19          1HB       ARG  19  -2.689  -4.082   1.167
  144   1HG   ARG  19          2HG       ARG  19  -4.130  -6.238   1.728
  145   2HG   ARG  19          1HG       ARG  19  -2.640  -7.040   1.227
  146   1HD   ARG  19          2HD       ARG  19  -1.542  -6.403   3.073
  147   2HD   ARG  19          1HD       ARG  19  -2.217  -4.775   3.027
  148    HE   ARG  19           HE       ARG  19  -4.320  -6.132   3.878
  149   1HH1  ARG  19          1HH1      ARG  19  -0.982  -6.387   4.878
  150   2HH1  ARG  19          2HH1      ARG  19  -1.375  -6.892   6.485
  151   1HH2  ARG  19          1HH2      ARG  19  -4.832  -6.794   5.991
  152   2HH2  ARG  19          2HH2      ARG  19  -3.559  -7.123   7.118
  153    H    TRP  20           H        TRP  20  -3.953  -2.476   0.484
  154    HA   TRP  20           HA       TRP  20  -3.701  -1.236  -2.168
  155   1HB   TRP  20          2HB       TRP  20  -4.782  -0.125   0.425
  156   2HB   TRP  20          1HB       TRP  20  -4.619   0.797  -1.065
  157    HD1  TRP  20           HD1      TRP  20  -6.676  -2.043   0.480
  158    HE1  TRP  20           HE1      TRP  20  -8.829  -2.333  -0.891
  159    HE3  TRP  20           HE3      TRP  20  -5.628   1.165  -3.357
  160    HZ2  TRP  20           HZ2      TRP  20  -9.937  -1.338  -3.281
  161    HZ3  TRP  20           HZ3      TRP  20  -7.290   1.437  -5.152
  162    HH2  TRP  20           HH2      TRP  20  -9.401   0.210  -5.113
  163    H    TYR  21           H        TYR  21  -2.332   0.544  -2.477
  164    HA   TYR  21           HA       TYR  21  -0.359   1.158  -0.408
  165   1HB   TYR  21          2HB       TYR  21   1.456   0.888  -2.252
  166   2HB   TYR  21          1HB       TYR  21   0.875  -0.559  -1.430
  167    HD1  TYR  21           HD2      TYR  21  -1.238  -1.661  -2.594
  168    HD2  TYR  21           HD1      TYR  21   1.601   0.808  -4.570
  169    HE1  TYR  21           HE2      TYR  21  -1.912  -2.614  -4.733
  170    HE2  TYR  21           HE1      TYR  21   0.926  -0.147  -6.736
  171    HH   TYR  21           HH       TYR  21  -0.185  -2.076  -7.649
  172    H    PHE  22           H        PHE  22   0.903   3.082  -0.914
  173    HA   PHE  22           HA       PHE  22  -0.665   4.949  -2.505
  174   1HB   PHE  22          2HB       PHE  22   0.506   5.259  -0.097
  175   2HB   PHE  22          1HB       PHE  22   1.792   5.876  -1.130
  176    HD1  PHE  22           HD1      PHE  22   1.422   7.854  -2.522
  177    HD2  PHE  22           HD2      PHE  22  -1.547   6.446   0.179
  178    HE1  PHE  22           HE1      PHE  22   0.251  10.010  -2.691
  179    HE2  PHE  22           HE2      PHE  22  -2.724   8.599   0.015
  180    HZ   PHE  22           HZ       PHE  22  -1.826  10.386  -1.423
  181    H    ASN  23           H        ASN  23  -0.062   5.797  -4.406
  182    HA   ASN  23           HA       ASN  23   2.688   5.337  -5.334
  183   1HB   ASN  23          2HB       ASN  23   1.102   3.645  -6.298
  184   2HB   ASN  23          1HB       ASN  23   0.240   4.973  -7.070
  185   1HD2  ASN  23          1HD2      ASN  23   0.814   5.431  -9.061
  186   2HD2  ASN  23          2HD2      ASN  23   2.329   5.049  -9.799
  187    HN2  GLY  24           H        GLY  24   3.031   7.558  -4.766
  188   1HA   GLY  24          2HA       GLY  24   3.493   9.662  -5.668
  189   2HA   GLY  24          1HA       GLY  24   2.337   9.341  -6.951
  190    H    ARG  25           H        ARG  25   0.101   9.662  -6.539
  191    HA   ARG  25           HA       ARG  25  -0.508  11.226  -4.126
  192   1HB   ARG  25          2HB       ARG  25  -1.892  12.751  -5.542
  193   2HB   ARG  25          1HB       ARG  25  -0.162  12.866  -5.835
  194   1HG   ARG  25          2HG       ARG  25  -0.821  11.035  -7.687
  195   2HG   ARG  25          1HG       ARG  25  -2.329  11.949  -7.604
  196   1HD   ARG  25          2HD       ARG  25  -1.406  13.807  -8.505
  197   2HD   ARG  25          1HD       ARG  25   0.147  13.546  -7.714
  198    HE   ARG  25           HE       ARG  25   0.869  12.409  -9.569
  199   1HH1  ARG  25          1HH1      ARG  25  -2.597  12.790  -9.743
  200   2HH1  ARG  25          2HH1      ARG  25  -2.704  12.213 -11.372
  201   1HH2  ARG  25          1HH2      ARG  25   0.729  11.649 -11.711
  202   2HH2  ARG  25          2HH2      ARG  25  -0.815  11.562 -12.488
  203    H    THR  26           H        THR  26  -1.255   8.543  -5.868
  204    HA   THR  26           HA       THR  26  -4.002   8.539  -4.830
  205    HB   THR  26           HB       THR  26  -3.356   7.159  -7.412
  206    HG1  THR  26           HG1      THR  26  -3.710   8.966  -8.542
  207   1HG2  THR  26          1HG2      THR  26  -5.485   6.586  -7.200
  208   2HG2  THR  26          2HG2      THR  26  -5.869   8.271  -7.553
  209   3HG2  THR  26          3HG2      THR  26  -5.744   7.727  -5.880
  210    H    CYS  27           H        CYS  27  -4.906   6.238  -4.840
  211    HA   CYS  27           HA       CYS  27  -2.930   4.526  -3.563
  212   1HB   CYS  27          2HB       CYS  27  -5.537   5.093  -2.953
  213   2HB   CYS  27          1HB       CYS  27  -5.696   3.544  -3.775
  214    H    ALA  28           H        ALA  28  -3.343   2.072  -3.974
  215    HA   ALA  28           HA       ALA  28  -3.942   1.467  -6.752
  216   1HB   ALA  28          1HB       ALA  28  -1.714   0.301  -7.010
  217   2HB   ALA  28          2HB       ALA  28  -1.189   1.207  -5.589
  218   3HB   ALA  28          3HB       ALA  28  -1.688   2.062  -7.047
  219    H    LYS  29           H        LYS  29  -3.402  -1.013  -7.131
  220    HA   LYS  29           HA       LYS  29  -4.041  -2.550  -4.715
  221   1HB   LYS  29          2HB       LYS  29  -5.790  -2.109  -7.023
  222   2HB   LYS  29          1HB       LYS  29  -5.578  -3.806  -6.616
  223   1HG   LYS  29          2HG       LYS  29  -6.024  -2.459  -4.189
  224   2HG   LYS  29          1HG       LYS  29  -7.200  -1.826  -5.341
  225   1HD   LYS  29          2HD       LYS  29  -8.323  -3.778  -5.460
  226   2HD   LYS  29          1HD       LYS  29  -6.849  -4.745  -5.397
  227   1HE   LYS  29          2HE       LYS  29  -6.717  -4.515  -3.022
  228   2HE   LYS  29          1HE       LYS  29  -8.026  -3.335  -3.010
  229   1HZ   LYS  29          1HZ       LYS  29  -9.238  -5.143  -2.498
  230   2HZ   LYS  29          2HZ       LYS  29  -8.143  -6.232  -3.189
  231   3HZ   LYS  29          3HZ       LYS  29  -9.237  -5.395  -4.171
  232    H    PHE  30           H        PHE  30  -3.131  -4.523  -4.607
  233    HA   PHE  30           HA       PHE  30  -2.195  -5.952  -6.894
  234   1HB   PHE  30          2HB       PHE  30   0.192  -5.838  -6.426
  235   2HB   PHE  30          1HB       PHE  30  -0.449  -4.237  -6.742
  236    HD1  PHE  30           HD1      PHE  30  -1.585  -4.879  -3.558
  237    HD2  PHE  30           HD2      PHE  30   2.051  -4.117  -5.639
  238    HE1  PHE  30           HE1      PHE  30  -0.573  -4.054  -1.481
  239    HE2  PHE  30           HE2      PHE  30   3.066  -3.290  -3.560
  240    HZ   PHE  30           HZ       PHE  30   1.755  -3.257  -1.477
  241    H    ILE  31           H        ILE  31  -0.678  -7.870  -6.052
  242    HA   ILE  31           HA       ILE  31  -2.206  -9.097  -3.901
  243    HB   ILE  31           HB       ILE  31  -0.048 -10.283  -5.647
  244   1HG1  ILE  31          2HG1      ILE  31  -2.034  -9.518  -6.913
  245   2HG1  ILE  31          1HG1      ILE  31  -1.855 -11.269  -6.940
  246   1HG2  ILE  31          1HG2      ILE  31  -1.291 -12.430  -4.913
  247   2HG2  ILE  31          2HG2      ILE  31  -1.886 -11.434  -3.584
  248   3HG2  ILE  31          3HG2      ILE  31  -0.152 -11.678  -3.796
  249   1HD1  ILE  31          1HD1      ILE  31  -4.110  -9.781  -6.214
  250   2HD1  ILE  31          2HD1      ILE  31  -3.495 -10.500  -4.725
  251   3HD1  ILE  31          3HD1      ILE  31  -3.884 -11.527  -6.106
  252    H    TYR  32           H        TYR  32  -1.523  -8.471  -1.920
  253    HA   TYR  32           HA       TYR  32   1.321  -8.219  -1.371
  254   1HB   TYR  32          2HB       TYR  32  -0.328  -6.547  -0.519
  255   2HB   TYR  32          1HB       TYR  32  -1.006  -7.806   0.509
  256    HD1  TYR  32           HD1      TYR  32   2.326  -6.291  -0.264
  257    HD2  TYR  32           HD2      TYR  32  -0.279  -7.892   2.694
  258    HE1  TYR  32           HE1      TYR  32   3.981  -5.758   1.474
  259    HE2  TYR  32           HE2      TYR  32   1.368  -7.361   4.441
  260    HH   TYR  32           HH       TYR  32   3.249  -5.864   4.804
  261    HN2  GLY  33           H        GLY  33   2.493  -9.474  -0.005
  262   1HA   GLY  33          2HA       GLY  33   1.188 -11.959   0.920
  263   2HA   GLY  33          1HA       GLY  33   2.846 -11.889   0.340
  264    HN2  GLY  34           H        GLY  34   3.491  -9.424   1.724
  265   1HA   GLY  34          2HA       GLY  34   3.390  -8.725   4.104
  266   2HA   GLY  34          1HA       GLY  34   3.472 -10.434   4.503
  267    H    CYS  35           H        CYS  35   5.464 -10.207   1.950
  268    HA   CYS  35           HA       CYS  35   7.798  -9.797   3.685
  269   1HB   CYS  35          2HB       CYS  35   7.941 -11.077   0.971
  270   2HB   CYS  35          1HB       CYS  35   9.008 -11.290   2.352
  271    HN2  GLY  36           H        GLY  36   8.335  -7.695   3.579
  272   1HA   GLY  36          2HA       GLY  36   9.730  -6.117   2.412
  273   2HA   GLY  36          1HA       GLY  36   8.971  -6.624   0.911
  274    HN2  GLY  37           H        GLY  37   8.533  -4.772   3.867
  275   1HA   GLY  37          2HA       GLY  37   6.920  -2.843   2.492
  276   2HA   GLY  37          1HA       GLY  37   5.978  -3.819   3.610
  277    H    ASN  38           H        ASN  38   6.464  -0.972   3.736
  278    HA   ASN  38           HA       ASN  38   7.649  -0.888   6.413
  279   1HB   ASN  38          2HB       ASN  38   8.508   1.497   5.575
  280   2HB   ASN  38          1HB       ASN  38   9.482   0.040   5.409
  281   1HD2  ASN  38          1HD2      ASN  38  10.583   0.386   3.593
  282   2HD2  ASN  38          2HD2      ASN  38   9.881   0.741   2.054
  283    HN2  GLY  39           H        GLY  39   6.586   1.798   4.360
  284   1HA   GLY  39          2HA       GLY  39   4.262   2.130   6.148
  285   2HA   GLY  39          1HA       GLY  39   5.293   3.487   5.724
  286    H    ASN  40           H        ASN  40   5.169   1.599   3.028
  287    HA   ASN  40           HA       ASN  40   3.207   3.360   1.802
  288   1HB   ASN  40          2HB       ASN  40   5.409   2.948   0.717
  289   2HB   ASN  40          1HB       ASN  40   4.959   1.257   0.515
  290   1HD2  ASN  40          1HD2      ASN  40   3.739   4.512  -0.174
  291   2HD2  ASN  40          2HD2      ASN  40   3.087   4.125  -1.726
  292    H    LYS  41           H        LYS  41   3.547   0.046   2.793
  293    HA   LYS  41           HA       LYS  41   1.380  -0.974   1.232
  294   1HB   LYS  41          2HB       LYS  41   3.105  -2.486   1.973
  295   2HB   LYS  41          1HB       LYS  41   2.818  -2.064   3.655
  296   1HG   LYS  41          2HG       LYS  41   0.406  -3.028   2.394
  297   2HG   LYS  41          1HG       LYS  41   1.723  -4.192   2.244
  298   1HD   LYS  41          2HD       LYS  41   1.401  -4.814   4.354
  299   2HD   LYS  41          1HD       LYS  41   1.782  -3.178   4.890
  300   1HE   LYS  41          2HE       LYS  41  -0.719  -2.741   4.153
  301   2HE   LYS  41          1HE       LYS  41  -0.858  -4.473   4.447
  302   1HZ   LYS  41          1HZ       LYS  41  -1.260  -3.788   6.534
  303   2HZ   LYS  41          2HZ       LYS  41  -0.484  -2.299   6.330
  304   3HZ   LYS  41          3HZ       LYS  41   0.426  -3.690   6.645
  305    H    PHE  42           H        PHE  42  -0.721  -1.377   1.816
  306    HA   PHE  42           HA       PHE  42  -1.654  -0.722   4.482
  307   1HB   PHE  42          2HB       PHE  42  -2.720   0.765   2.071
  308   2HB   PHE  42          1HB       PHE  42  -3.308   0.913   3.724
  309    HD1  PHE  42           HD1      PHE  42  -1.737   1.829   5.479
  310    HD2  PHE  42           HD2      PHE  42  -0.945   2.071   1.305
  311    HE1  PHE  42           HE1      PHE  42  -0.121   3.638   5.894
  312    HE2  PHE  42           HE2      PHE  42   0.673   3.880   1.712
  313    HZ   PHE  42           HZ       PHE  42   1.087   4.665   4.010
  314    HA   PRO  43           HA       PRO  43  -4.313  -4.124   3.444
  315   1HB   PRO  43          2HB       PRO  43  -6.196  -3.790   5.386
  316   2HB   PRO  43          1HB       PRO  43  -4.597  -4.477   5.690
  317   1HG   PRO  43          2HG       PRO  43  -5.577  -1.684   6.144
  318   2HG   PRO  43          1HG       PRO  43  -4.572  -2.702   7.193
  319   1HD   PRO  43          2HD       PRO  43  -3.517  -0.761   5.648
  320   2HD   PRO  43          1HD       PRO  43  -2.651  -2.275   5.980
  321    H    THR  44           H        THR  44  -5.922  -1.034   4.212
  322    HA   THR  44           HA       THR  44  -7.788  -1.564   1.995
  323    HB   THR  44           HB       THR  44  -9.283   0.067   3.466
  324    HG1  THR  44           HG1      THR  44  -7.622   0.220   5.091
  325   1HG2  THR  44          1HG2      THR  44 -10.595  -1.698   3.680
  326   2HG2  THR  44          2HG2      THR  44  -9.453  -2.495   4.763
  327   3HG2  THR  44          3HG2      THR  44  -9.285  -2.672   3.017
  328    H    GLN  45           H        GLN  45  -8.537   0.265   0.820
  329    HA   GLN  45           HA       GLN  45  -6.566   2.150   0.194
  330   1HB   GLN  45          2HB       GLN  45  -8.300   3.261  -1.142
  331   2HB   GLN  45          1HB       GLN  45  -8.322   1.520  -1.380
  332   1HG   GLN  45          2HG       GLN  45 -10.349   1.266  -0.397
  333   2HG   GLN  45          1HG       GLN  45 -10.114   2.628   0.698
  334   1HE2  GLN  45          1HE2      GLN  45  -9.901   4.785  -0.563
  335   2HE2  GLN  45          2HE2      GLN  45 -11.121   5.054  -1.758
  336    H    GLU  46           H        GLU  46  -9.144   2.210   2.535
  337    HA   GLU  46           HA       GLU  46  -9.283   4.981   2.983
  338   1HB   GLU  46          2HB       GLU  46 -10.552   2.741   3.987
  339   2HB   GLU  46          1HB       GLU  46  -9.664   3.346   5.378
  340   1HG   GLU  46          2HG       GLU  46 -10.818   5.355   5.405
  341   2HG   GLU  46          1HG       GLU  46 -11.341   5.190   3.729
  342    H    ALA  47           H        ALA  47  -7.000   2.563   4.001
  343    HA   ALA  47           HA       ALA  47  -5.838   4.080   6.121
  344   1HB   ALA  47          1HB       ALA  47  -3.888   2.347   5.512
  345   2HB   ALA  47          2HB       ALA  47  -5.251   1.539   4.736
  346   3HB   ALA  47          3HB       ALA  47  -5.310   1.909   6.459
  347    H    CYS  48           H        CYS  48  -5.037   3.567   2.705
  348    HA   CYS  48           HA       CYS  48  -2.614   5.050   2.786
  349   1HB   CYS  48          2HB       CYS  48  -2.518   4.772   0.451
  350   2HB   CYS  48          1HB       CYS  48  -3.338   3.331   1.033
  351    H    MET  49           H        MET  49  -5.960   5.895   2.204
  352    HA   MET  49           HA       MET  49  -5.305   8.594   1.384
  353   1HB   MET  49          2HB       MET  49  -7.737   6.926   1.518
  354   2HB   MET  49          1HB       MET  49  -7.987   8.643   1.800
  355   1HG   MET  49          2HG       MET  49  -6.644   8.995  -0.352
  356   2HG   MET  49          1HG       MET  49  -6.925   7.280  -0.644
  357   1HE   MET  49          1HE       MET  49  -8.093  10.050  -2.463
  358   2HE   MET  49          2HE       MET  49  -8.057  10.757  -0.848
  359   3HE   MET  49          3HE       MET  49  -9.581  10.648  -1.729
  360    H    LYS  50           H        LYS  50  -5.960   6.928   4.319
  361    HA   LYS  50           HA       LYS  50  -6.836   9.284   5.747
  362   1HB   LYS  50          2HB       LYS  50  -7.731   7.092   6.355
  363   2HB   LYS  50          1HB       LYS  50  -6.113   6.526   6.748
  364   1HG   LYS  50          2HG       LYS  50  -5.985   8.212   8.536
  365   2HG   LYS  50          1HG       LYS  50  -7.637   8.705   8.161
  366   1HD   LYS  50          2HD       LYS  50  -8.314   7.164   9.624
  367   2HD   LYS  50          1HD       LYS  50  -7.791   5.947   8.458
  368   1HE   LYS  50          2HE       LYS  50  -6.799   5.454  10.589
  369   2HE   LYS  50          1HE       LYS  50  -5.536   6.001   9.487
  370   1HZ   LYS  50          1HZ       LYS  50  -6.733   7.425  11.775
  371   2HZ   LYS  50          2HZ       LYS  50  -5.977   8.285  10.531
  372   3HZ   LYS  50          3HZ       LYS  50  -5.099   7.153  11.429
  373    H    ARG  51           H        ARG  51  -3.844   7.969   4.843
  374    HA   ARG  51           HA       ARG  51  -2.470   9.311   7.067
  375   1HB   ARG  51          2HB       ARG  51  -0.478   8.008   6.357
  376   2HB   ARG  51          1HB       ARG  51  -1.834   7.000   6.845
  377   1HG   ARG  51          2HG       ARG  51  -1.656   5.912   4.928
  378   2HG   ARG  51          1HG       ARG  51  -2.120   7.390   4.083
  379   1HD   ARG  51          2HD       ARG  51   0.661   6.450   4.750
  380   2HD   ARG  51          1HD       ARG  51  -0.060   6.618   3.152
  381    HE   ARG  51           HE       ARG  51   0.104   8.974   3.358
  382   1HH1  ARG  51          1HH1      ARG  51   1.579   7.263   6.028
  383   2HH1  ARG  51          2HH1      ARG  51   2.548   8.611   6.512
  384   1HH2  ARG  51          1HH2      ARG  51   1.379  10.742   4.002
  385   2HH2  ARG  51          2HH2      ARG  51   2.435  10.584   5.367
  386    H    CYS  52           H        CYS  52  -2.932   9.378   3.618
  387    HA   CYS  52           HA       CYS  52  -0.927  11.527   3.418
  388   1HB   CYS  52          2HB       CYS  52  -1.299   9.237   1.832
  389   2HB   CYS  52          1HB       CYS  52  -1.849  10.589   0.850
  390    H    ALA  53           H        ALA  53  -4.269  10.666   2.816
  391    HA   ALA  53           HA       ALA  53  -4.796  13.271   1.605
  392   1HB   ALA  53          1HB       ALA  53  -7.074  11.489   2.097
  393   2HB   ALA  53          2HB       ALA  53  -5.820  10.818   1.055
  394   3HB   ALA  53          3HB       ALA  53  -6.594  12.344   0.631
  395    H    LYS  54           H        LYS  54  -5.945  11.323   4.356
  396    HA   LYS  54           HA       LYS  54  -7.488  13.461   5.452
  397   1HB   LYS  54          2HB       LYS  54  -7.862  10.966   5.806
  398   2HB   LYS  54          1HB       LYS  54  -6.522  11.026   6.943
  399   1HG   LYS  54          2HG       LYS  54  -8.035  11.501   8.497
  400   2HG   LYS  54          1HG       LYS  54  -8.147  13.100   7.758
  401   1HD   LYS  54          2HD       LYS  54 -10.102  12.602   6.654
  402   2HD   LYS  54          1HD       LYS  54  -9.764  10.869   6.618
  403   1HE   LYS  54          2HE       LYS  54 -11.508  11.096   8.164
  404   2HE   LYS  54          1HE       LYS  54 -10.056  10.938   9.153
  405   1HZ   LYS  54          1HZ       LYS  54 -11.464  13.467   8.488
  406   2HZ   LYS  54          2HZ       LYS  54 -10.016  13.370   9.357
  407   3HZ   LYS  54          3HZ       LYS  54 -11.433  12.701   9.996
  408    H    ALA  55           H        ALA  55  -4.486  11.869   6.543
  409    HA   ALA  55           HA       ALA  55  -3.963  13.855   8.530
  410   1HB   ALA  55          1HB       ALA  55  -1.876  11.999   7.448
  411   2HB   ALA  55          2HB       ALA  55  -3.187  11.395   8.461
  412   3HB   ALA  55          3HB       ALA  55  -2.079  12.615   9.087
  Start of MODEL   13
    1   1H    ILE   1          1H        ILE   1   5.490  14.223   5.063
    2   2H    ILE   1          2H        ILE   1   4.757  14.031   3.523
    3   3H    ILE   1          3H        ILE   1   6.460  14.200   3.651
    4    HA   ILE   1           HA       ILE   1   6.263  12.143   5.141
    5    HB   ILE   1           HB       ILE   1   3.797  12.108   5.099
    6   1HG1  ILE   1          2HG1      ILE   1   4.605   9.658   3.594
    7   2HG1  ILE   1          1HG1      ILE   1   5.422  10.009   5.114
    8   1HG2  ILE   1          1HG2      ILE   1   3.392  10.973   2.502
    9   2HG2  ILE   1          2HG2      ILE   1   4.146  12.558   2.345
   10   3HG2  ILE   1          3HG2      ILE   1   2.632  12.386   3.233
   11   1HD1  ILE   1          1HD1      ILE   1   2.441  10.012   4.980
   12   2HD1  ILE   1          2HD1      ILE   1   3.503   9.724   6.359
   13   3HD1  ILE   1          3HD1      ILE   1   3.333   8.495   5.106
   14    H    ASP   2           H        ASP   2   7.574  10.623   4.298
   15    HA   ASP   2           HA       ASP   2   8.102  10.768   1.406
   16   1HB   ASP   2          2HB       ASP   2   9.945   9.790   3.597
   17   2HB   ASP   2          1HB       ASP   2  10.353   9.979   1.895
   18    H    THR   3           H        THR   3   7.297   8.666   4.060
   19    HA   THR   3           HA       THR   3   7.891   6.173   2.987
   20    HB   THR   3           HB       THR   3   5.571   6.958   4.761
   21    HG1  THR   3           HG1      THR   3   7.686   7.420   5.575
   22   1HG2  THR   3          1HG2      THR   3   4.909   4.855   4.769
   23   2HG2  THR   3          2HG2      THR   3   6.501   4.366   5.351
   24   3HG2  THR   3          3HG2      THR   3   6.176   4.429   3.619
   25    H    CYS   4           H        CYS   4   5.354   8.395   2.169
   26    HA   CYS   4           HA       CYS   4   3.724   6.460   0.810
   27   1HB   CYS   4          2HB       CYS   4   3.603   9.337   1.396
   28   2HB   CYS   4          1HB       CYS   4   2.895   8.884  -0.152
   29    H    ARG   5           H        ARG   5   6.678   7.655   0.029
   30    HA   ARG   5           HA       ARG   5   6.091   7.653  -2.857
   31   1HB   ARG   5          2HB       ARG   5   8.609   8.793  -1.692
   32   2HB   ARG   5          1HB       ARG   5   7.842   9.153  -3.231
   33   1HG   ARG   5          2HG       ARG   5   6.183  10.477  -2.214
   34   2HG   ARG   5          1HG       ARG   5   6.581   9.875  -0.604
   35   1HD   ARG   5          2HD       ARG   5   8.181  11.730  -2.348
   36   2HD   ARG   5          1HD       ARG   5   7.504  12.050  -0.752
   37    HE   ARG   5           HE       ARG   5   9.192  10.031  -0.244
   38   1HH1  ARG   5          1HH1      ARG   5   9.613  13.020  -1.999
   39   2HH1  ARG   5          2HH1      ARG   5  11.301  13.141  -1.634
   40   1HH2  ARG   5          1HH2      ARG   5  11.413  10.191   0.234
   41   2HH2  ARG   5          2HH2      ARG   5  12.322  11.536  -0.366
   42    H    LEU   6           H        LEU   6   7.254   5.671  -0.515
   43    HA   LEU   6           HA       LEU   6   9.506   4.614  -2.013
   44   1HB   LEU   6          2HB       LEU   6   8.406   3.222   0.376
   45   2HB   LEU   6          1HB       LEU   6  10.071   3.415  -0.136
   46    HG   LEU   6           HG       LEU   6   8.342   5.499   1.194
   47   1HD1  LEU   6          1HD1      LEU   6  10.684   3.844   2.080
   48   2HD1  LEU   6          2HD1      LEU   6   9.097   4.002   2.833
   49   3HD1  LEU   6          3HD1      LEU   6  10.237   5.346   2.887
   50   1HD2  LEU   6          1HD2      LEU   6  11.227   5.786   0.393
   51   2HD2  LEU   6          2HD2      LEU   6  10.146   7.024   1.031
   52   3HD2  LEU   6          3HD2      LEU   6   9.891   6.381  -0.591
   53    HA   PRO   7           HA       PRO   7   6.805   1.814  -4.257
   54   1HB   PRO   7          2HB       PRO   7   9.339   0.508  -5.021
   55   2HB   PRO   7          1HB       PRO   7   8.090   1.220  -6.045
   56   1HG   PRO   7          2HG       PRO   7  10.470   2.404  -5.711
   57   2HG   PRO   7          1HG       PRO   7   8.977   3.346  -5.877
   58   1HD   PRO   7          2HD       PRO   7  10.539   2.687  -3.410
   59   2HD   PRO   7          1HD       PRO   7   9.739   4.205  -3.867
   60    H    SER   8           H        SER   8   5.786   0.455  -2.875
   61    HA   SER   8           HA       SER   8   7.289  -1.432  -1.261
   62   1HB   SER   8          2HB       SER   8   4.428  -0.582  -1.427
   63   2HB   SER   8          1HB       SER   8   4.830  -2.113  -0.658
   64    HG   SER   8           HG       SER   8   6.389  -0.004   0.160
   65    H    ASP   9           H        ASP   9   6.711  -3.745  -1.216
   66    HA   ASP   9           HA       ASP   9   6.033  -4.723  -3.917
   67   1HB   ASP   9          2HB       ASP   9   8.405  -5.083  -2.611
   68   2HB   ASP   9          1HB       ASP   9   7.535  -6.546  -2.157
   69    H    ARG  10           H        ARG  10   5.014  -6.870  -4.007
   70    HA   ARG  10           HA       ARG  10   3.006  -7.106  -1.915
   71   1HB   ARG  10          2HB       ARG  10   2.003  -8.814  -3.478
   72   2HB   ARG  10          1HB       ARG  10   2.045  -7.167  -4.067
   73   1HG   ARG  10          2HG       ARG  10   4.421  -8.320  -4.959
   74   2HG   ARG  10          1HG       ARG  10   3.187  -9.557  -5.186
   75   1HD   ARG  10          2HD       ARG  10   2.775  -6.721  -6.080
   76   2HD   ARG  10          1HD       ARG  10   3.582  -7.907  -7.100
   77    HE   ARG  10           HE       ARG  10   1.012  -8.764  -6.110
   78   1HH1  ARG  10          1HH1      ARG  10   2.692  -7.029  -8.633
   79   2HH1  ARG  10          2HH1      ARG  10   1.457  -7.294  -9.817
   80   1HH2  ARG  10          1HH2      ARG  10  -0.616  -9.121  -7.689
   81   2HH2  ARG  10          2HH2      ARG  10  -0.416  -8.477  -9.281
   82    HN2  GLY  11           H        GLY  11   5.993  -8.510  -2.507
   83   1HA   GLY  11          2HA       GLY  11   7.020 -10.391  -1.678
   84   2HA   GLY  11          1HA       GLY  11   5.801 -10.332  -0.415
   85    H    ARG  12           H        ARG  12   6.898 -11.955  -3.212
   86    HA   ARG  12           HA       ARG  12   4.537 -13.302  -3.965
   87   1HB   ARG  12          2HB       ARG  12   6.732 -13.123  -5.253
   88   2HB   ARG  12          1HB       ARG  12   7.320 -14.425  -4.228
   89   1HG   ARG  12          2HG       ARG  12   6.155 -15.989  -5.327
   90   2HG   ARG  12          1HG       ARG  12   4.734 -14.956  -5.494
   91   1HD   ARG  12          2HD       ARG  12   5.442 -15.210  -7.687
   92   2HD   ARG  12          1HD       ARG  12   6.163 -13.671  -7.222
   93    HE   ARG  12           HE       ARG  12   8.085 -15.513  -6.643
   94   1HH1  ARG  12          1HH1      ARG  12   6.261 -14.700  -9.506
   95   2HH1  ARG  12          2HH1      ARG  12   7.522 -15.174 -10.595
   96   1HH2  ARG  12          1HH2      ARG  12   9.744 -16.136  -8.074
   97   2HH2  ARG  12          2HH2      ARG  12   9.498 -15.989  -9.783
   98    H    CYS  13           H        CYS  13   6.368 -13.558  -1.151
   99    HA   CYS  13           HA       CYS  13   6.589 -16.133  -0.417
  100   1HB   CYS  13          2HB       CYS  13   5.371 -14.013   1.362
  101   2HB   CYS  13          1HB       CYS  13   6.225 -15.459   1.885
  102    H    LYS  14           H        LYS  14   3.685 -14.527   0.858
  103    HA   LYS  14           HA       LYS  14   2.198 -16.997   0.272
  104   1HB   LYS  14          2HB       LYS  14   1.565 -14.928   2.379
  105   2HB   LYS  14          1HB       LYS  14   0.793 -16.495   2.171
  106   1HG   LYS  14          2HG       LYS  14   2.433 -17.592   3.240
  107   2HG   LYS  14          1HG       LYS  14   3.704 -16.589   2.538
  108   1HD   LYS  14          2HD       LYS  14   3.234 -14.819   4.114
  109   2HD   LYS  14          1HD       LYS  14   1.856 -15.714   4.757
  110   1HE   LYS  14          2HE       LYS  14   3.557 -17.559   5.290
  111   2HE   LYS  14          1HE       LYS  14   4.784 -16.321   5.023
  112   1HZ   LYS  14          1HZ       LYS  14   3.465 -14.964   6.701
  113   2HZ   LYS  14          2HZ       LYS  14   4.366 -16.265   7.300
  114   3HZ   LYS  14          3HZ       LYS  14   2.692 -16.413   7.109
  115    H    ALA  15           H        ALA  15   2.199 -15.592  -1.904
  116    HA   ALA  15           HA       ALA  15   0.508 -13.416  -2.230
  117   1HB   ALA  15          1HB       ALA  15   2.049 -14.812  -3.902
  118   2HB   ALA  15          2HB       ALA  15   0.779 -13.722  -4.457
  119   3HB   ALA  15          3HB       ALA  15   0.476 -15.458  -4.368
  120    H    SER  16           H        SER  16  -1.445 -13.423  -1.198
  121    HA   SER  16           HA       SER  16  -3.579 -14.860  -2.393
  122   1HB   SER  16          2HB       SER  16  -2.285 -16.439  -0.627
  123   2HB   SER  16          1HB       SER  16  -3.432 -15.651   0.457
  124    HG   SER  16           HG       SER  16  -4.555 -17.335  -0.301
  125    H    PHE  17           H        PHE  17  -2.857 -12.122  -1.611
  126    HA   PHE  17           HA       PHE  17  -5.394 -11.419  -0.415
  127   1HB   PHE  17          2HB       PHE  17  -2.907 -10.342   0.909
  128   2HB   PHE  17          1HB       PHE  17  -4.573 -10.199   1.451
  129    HD1  PHE  17           HD1      PHE  17  -5.755 -12.224   2.312
  130    HD2  PHE  17           HD2      PHE  17  -1.575 -12.187   1.512
  131    HE1  PHE  17           HE1      PHE  17  -5.473 -14.227   3.713
  132    HE2  PHE  17           HE2      PHE  17  -1.285 -14.192   2.910
  133    HZ   PHE  17           HZ       PHE  17  -3.236 -15.214   4.013
  134    H    GLU  18           H        GLU  18  -5.703  -9.025  -0.370
  135    HA   GLU  18           HA       GLU  18  -4.196  -7.741  -2.553
  136   1HB   GLU  18          2HB       GLU  18  -7.134  -7.609  -1.882
  137   2HB   GLU  18          1HB       GLU  18  -6.353  -6.430  -2.925
  138   1HG   GLU  18          2HG       GLU  18  -6.597  -7.774  -4.658
  139   2HG   GLU  18          1HG       GLU  18  -5.651  -9.020  -3.845
  140    H    ARG  19           H        ARG  19  -3.469  -5.673  -2.224
  141    HA   ARG  19           HA       ARG  19  -4.344  -4.264   0.185
  142   1HB   ARG  19          2HB       ARG  19  -1.617  -5.336  -0.312
  143   2HB   ARG  19          1HB       ARG  19  -1.741  -3.752   0.439
  144   1HG   ARG  19          2HG       ARG  19  -3.460  -5.054   1.989
  145   2HG   ARG  19          1HG       ARG  19  -2.464  -6.423   1.492
  146   1HD   ARG  19          2HD       ARG  19  -0.457  -5.065   2.185
  147   2HD   ARG  19          1HD       ARG  19  -1.583  -3.913   2.902
  148    HE   ARG  19           HE       ARG  19  -2.044  -6.577   3.815
  149   1HH1  ARG  19          1HH1      ARG  19  -0.015  -3.772   4.261
  150   2HH1  ARG  19          2HH1      ARG  19   0.372  -4.160   5.904
  151   1HH2  ARG  19          1HH2      ARG  19  -1.533  -7.089   5.975
  152   2HH2  ARG  19          2HH2      ARG  19  -0.487  -6.043   6.876
  153    H    TRP  20           H        TRP  20  -3.128  -2.053   0.278
  154    HA   TRP  20           HA       TRP  20  -3.119  -0.944  -2.450
  155   1HB   TRP  20          2HB       TRP  20  -4.058   0.323   0.127
  156   2HB   TRP  20          1HB       TRP  20  -3.907   1.178  -1.403
  157    HD1  TRP  20           HD1      TRP  20  -5.958  -1.660   0.213
  158    HE1  TRP  20           HE1      TRP  20  -8.186  -1.863  -1.052
  159    HE3  TRP  20           HE3      TRP  20  -5.075   1.703  -3.536
  160    HZ2  TRP  20           HZ2      TRP  20  -9.408  -0.752  -3.330
  161    HZ3  TRP  20           HZ3      TRP  20  -6.829   2.074  -5.221
  162    HH2  TRP  20           HH2      TRP  20  -8.953   0.871  -5.119
  163    H    TYR  21           H        TYR  21  -1.747   0.860  -2.853
  164    HA   TYR  21           HA       TYR  21   0.402   1.374  -0.936
  165   1HB   TYR  21          2HB       TYR  21   1.997   1.138  -3.018
  166   2HB   TYR  21          1HB       TYR  21   1.545  -0.289  -2.093
  167    HD1  TYR  21           HD2      TYR  21  -0.674  -1.458  -2.938
  168    HD2  TYR  21           HD1      TYR  21   1.816   1.021  -5.330
  169    HE1  TYR  21           HE2      TYR  21  -1.621  -2.465  -4.949
  170    HE2  TYR  21           HE1      TYR  21   0.868   0.013  -7.365
  171    HH   TYR  21           HH       TYR  21  -0.300  -2.100  -8.019
  172    H    PHE  22           H        PHE  22   1.245   3.421  -1.098
  173    HA   PHE  22           HA       PHE  22  -0.250   5.293  -2.699
  174   1HB   PHE  22          2HB       PHE  22   1.316   5.415  -0.344
  175   2HB   PHE  22          1HB       PHE  22   2.076   6.492  -1.512
  176    HD1  PHE  22           HD2      PHE  22   0.911   8.447  -2.344
  177    HD2  PHE  22           HD1      PHE  22  -0.882   5.858   0.512
  178    HE1  PHE  22           HE2      PHE  22  -0.785  10.163  -1.863
  179    HE2  PHE  22           HE1      PHE  22  -2.584   7.564   0.998
  180    HZ   PHE  22           HZ       PHE  22  -2.538   9.721  -0.190
  181    H    ASN  23           H        ASN  23   0.194   4.972  -4.851
  182    HA   ASN  23           HA       ASN  23   2.932   4.850  -5.783
  183   1HB   ASN  23          2HB       ASN  23   1.889   4.701  -8.041
  184   2HB   ASN  23          1HB       ASN  23   1.312   3.467  -6.926
  185   1HD2  ASN  23          1HD2      ASN  23  -0.787   3.612  -6.105
  186   2HD2  ASN  23          2HD2      ASN  23  -1.992   4.586  -6.868
  187    HN2  GLY  24           H        GLY  24   3.651   6.917  -5.049
  188   1HA   GLY  24          2HA       GLY  24   4.362   9.040  -5.656
  189   2HA   GLY  24          1HA       GLY  24   3.262   8.982  -7.025
  190    H    ARG  25           H        ARG  25   0.833   8.689  -5.942
  191    HA   ARG  25           HA       ARG  25   0.389  10.432  -3.713
  192   1HB   ARG  25          2HB       ARG  25  -0.817  12.179  -4.903
  193   2HB   ARG  25          1HB       ARG  25   0.840  12.083  -5.482
  194   1HG   ARG  25          2HG       ARG  25  -0.277  10.485  -7.276
  195   2HG   ARG  25          1HG       ARG  25  -1.699  11.447  -6.868
  196   1HD   ARG  25          2HD       ARG  25  -0.757  13.409  -7.645
  197   2HD   ARG  25          1HD       ARG  25   0.891  12.810  -7.462
  198    HE   ARG  25           HE       ARG  25  -0.129  11.212  -9.386
  199   1HH1  ARG  25          1HH1      ARG  25   0.002  14.677  -8.994
  200   2HH1  ARG  25          2HH1      ARG  25   0.052  14.993 -10.697
  201   1HH2  ARG  25          1HH2      ARG  25  -0.064  11.625 -11.624
  202   2HH2  ARG  25          2HH2      ARG  25   0.014  13.260 -12.190
  203    H    THR  26           H        THR  26  -0.874   8.587  -6.424
  204    HA   THR  26           HA       THR  26  -3.533   8.478  -5.253
  205    HB   THR  26           HB       THR  26  -2.640   6.900  -7.648
  206    HG1  THR  26           HG1      THR  26  -1.967   8.913  -8.187
  207   1HG2  THR  26          1HG2      THR  26  -5.087   8.075  -8.143
  208   2HG2  THR  26          2HG2      THR  26  -5.174   7.594  -6.449
  209   3HG2  THR  26          3HG2      THR  26  -4.795   6.397  -7.687
  210    H    CYS  27           H        CYS  27  -4.608   6.381  -4.959
  211    HA   CYS  27           HA       CYS  27  -2.803   4.495  -3.643
  212   1HB   CYS  27          2HB       CYS  27  -5.121   5.598  -2.758
  213   2HB   CYS  27          1HB       CYS  27  -5.723   4.087  -3.432
  214    H    ALA  28           H        ALA  28  -2.123   2.863  -4.832
  215    HA   ALA  28           HA       ALA  28  -3.757   1.840  -7.020
  216   1HB   ALA  28          1HB       ALA  28  -0.869   1.629  -6.309
  217   2HB   ALA  28          2HB       ALA  28  -1.620   2.206  -7.796
  218   3HB   ALA  28          3HB       ALA  28  -1.595   0.482  -7.435
  219    H    LYS  29           H        LYS  29  -3.373  -0.698  -7.339
  220    HA   LYS  29           HA       LYS  29  -3.694  -2.070  -4.771
  221   1HB   LYS  29          2HB       LYS  29  -5.942  -1.350  -5.788
  222   2HB   LYS  29          1HB       LYS  29  -5.637  -2.575  -7.011
  223   1HG   LYS  29          2HG       LYS  29  -6.047  -4.286  -5.597
  224   2HG   LYS  29          1HG       LYS  29  -5.370  -3.442  -4.204
  225   1HD   LYS  29          2HD       LYS  29  -7.442  -2.999  -3.526
  226   2HD   LYS  29          1HD       LYS  29  -7.659  -1.995  -4.961
  227   1HE   LYS  29          2HE       LYS  29  -9.428  -3.529  -5.033
  228   2HE   LYS  29          1HE       LYS  29  -8.245  -4.155  -6.179
  229   1HZ   LYS  29          1HZ       LYS  29  -8.069  -5.108  -3.425
  230   2HZ   LYS  29          2HZ       LYS  29  -7.785  -5.932  -4.875
  231   3HZ   LYS  29          3HZ       LYS  29  -9.371  -5.669  -4.350
  232    H    PHE  30           H        PHE  30  -2.971  -4.130  -4.720
  233    HA   PHE  30           HA       PHE  30  -2.390  -5.571  -7.154
  234   1HB   PHE  30          2HB       PHE  30  -0.037  -5.762  -6.857
  235   2HB   PHE  30          1HB       PHE  30  -0.418  -4.052  -6.750
  236    HD1  PHE  30           HD2      PHE  30  -1.557  -4.914  -3.729
  237    HD2  PHE  30           HD1      PHE  30   2.141  -4.925  -5.839
  238    HE1  PHE  30           HE2      PHE  30  -0.341  -4.823  -1.601
  239    HE2  PHE  30           HE1      PHE  30   3.356  -4.833  -3.709
  240    HZ   PHE  30           HZ       PHE  30   2.114  -4.787  -1.589
  241    H    ILE  31           H        ILE  31  -1.159  -7.734  -6.489
  242    HA   ILE  31           HA       ILE  31  -2.820  -8.886  -4.391
  243    HB   ILE  31           HB       ILE  31  -0.871 -10.253  -6.246
  244   1HG1  ILE  31          2HG1      ILE  31  -2.705  -9.137  -7.465
  245   2HG1  ILE  31          1HG1      ILE  31  -2.815 -10.891  -7.575
  246   1HG2  ILE  31          1HG2      ILE  31  -1.150 -11.885  -4.715
  247   2HG2  ILE  31          2HG2      ILE  31  -2.674 -12.139  -5.567
  248   3HG2  ILE  31          3HG2      ILE  31  -2.641 -11.184  -4.085
  249   1HD1  ILE  31          1HD1      ILE  31  -4.559 -10.912  -5.900
  250   2HD1  ILE  31          2HD1      ILE  31  -4.992  -9.832  -7.225
  251   3HD1  ILE  31          3HD1      ILE  31  -4.413  -9.166  -5.698
  252    H    TYR  32           H        TYR  32  -1.988  -8.391  -2.428
  253    HA   TYR  32           HA       TYR  32   0.870  -8.558  -1.952
  254   1HB   TYR  32          2HB       TYR  32  -0.426  -6.702  -0.999
  255   2HB   TYR  32          1HB       TYR  32  -1.401  -7.847  -0.086
  256    HD1  TYR  32           HD2      TYR  32   1.961  -6.369  -0.420
  257    HD2  TYR  32           HD1      TYR  32  -0.606  -8.785   1.959
  258    HE1  TYR  32           HE2      TYR  32   3.569  -6.238   1.437
  259    HE2  TYR  32           HE1      TYR  32   0.992  -8.658   3.823
  260    HH   TYR  32           HH       TYR  32   3.442  -8.249   4.125
  261    HN2  GLY  33           H        GLY  33   1.810 -10.381  -1.408
  262   1HA   GLY  33          2HA       GLY  33   0.254 -12.625  -0.448
  263   2HA   GLY  33          1HA       GLY  33   1.964 -12.636  -0.850
  264    HN2  GLY  34           H        GLY  34   2.827 -10.537   0.834
  265   1HA   GLY  34          2HA       GLY  34   2.093 -10.383   3.412
  266   2HA   GLY  34          1HA       GLY  34   2.810 -11.983   3.353
  267    H    CYS  35           H        CYS  35   4.681 -10.704   1.176
  268    HA   CYS  35           HA       CYS  35   6.544  -9.595   3.166
  269   1HB   CYS  35          2HB       CYS  35   7.148 -11.034   0.574
  270   2HB   CYS  35          1HB       CYS  35   8.356 -10.336   1.643
  271    HN2  GLY  36           H        GLY  36   6.006  -7.447   3.030
  272   1HA   GLY  36          2HA       GLY  36   6.121  -6.154   0.404
  273   2HA   GLY  36          1HA       GLY  36   5.529  -5.422   1.889
  274    HN2  GLY  37           H        GLY  37   7.578  -5.841   3.630
  275   1HA   GLY  37          2HA       GLY  37   9.614  -5.025   4.291
  276   2HA   GLY  37          1HA       GLY  37  10.158  -5.301   2.642
  277    H    ASN  38           H        ASN  38   7.637  -3.130   3.884
  278    HA   ASN  38           HA       ASN  38   9.209  -0.786   3.611
  279   1HB   ASN  38          2HB       ASN  38   8.809  -1.529   1.203
  280   2HB   ASN  38          1HB       ASN  38   7.123  -1.110   1.470
  281   1HD2  ASN  38          1HD2      ASN  38  10.355   0.088   1.122
  282   2HD2  ASN  38          2HD2      ASN  38   9.937   1.752   0.918
  283    HN2  GLY  39           H        GLY  39   7.851   1.202   3.714
  284   1HA   GLY  39          2HA       GLY  39   5.599   0.736   5.537
  285   2HA   GLY  39          1HA       GLY  39   6.557   2.205   5.445
  286    H    ASN  40           H        ASN  40   5.934   1.273   2.329
  287    HA   ASN  40           HA       ASN  40   3.927   3.346   2.050
  288   1HB   ASN  40          2HB       ASN  40   5.673   3.480   0.471
  289   2HB   ASN  40          1HB       ASN  40   5.613   1.759   0.127
  290   1HD2  ASN  40          1HD2      ASN  40   3.751   4.739  -0.158
  291   2HD2  ASN  40          2HD2      ASN  40   2.958   4.310  -1.630
  292    H    LYS  41           H        LYS  41   3.885  -0.007   2.459
  293    HA   LYS  41           HA       LYS  41   1.686  -0.674   0.775
  294   1HB   LYS  41          2HB       LYS  41   2.761  -2.038   3.246
  295   2HB   LYS  41          1HB       LYS  41   1.514  -2.712   2.209
  296   1HG   LYS  41          2HG       LYS  41   4.177  -1.939   1.104
  297   2HG   LYS  41          1HG       LYS  41   3.937  -3.490   1.901
  298   1HD   LYS  41          2HD       LYS  41   3.616  -3.858  -0.426
  299   2HD   LYS  41          1HD       LYS  41   2.019  -3.888   0.322
  300   1HE   LYS  41          2HE       LYS  41   1.324  -2.138  -0.877
  301   2HE   LYS  41          1HE       LYS  41   2.783  -1.220  -0.521
  302   1HZ   LYS  41          1HZ       LYS  41   2.067  -2.510  -2.909
  303   2HZ   LYS  41          2HZ       LYS  41   3.483  -3.224  -2.320
  304   3HZ   LYS  41          3HZ       LYS  41   3.428  -1.559  -2.596
  305    H    PHE  42           H        PHE  42  -0.398  -1.495   1.626
  306    HA   PHE  42           HA       PHE  42  -1.395  -0.401   4.089
  307   1HB   PHE  42          2HB       PHE  42  -2.426   0.689   1.459
  308   2HB   PHE  42          1HB       PHE  42  -3.155   0.986   3.034
  309    HD1  PHE  42           HD1      PHE  42  -1.707   2.145   4.798
  310    HD2  PHE  42           HD2      PHE  42  -0.762   2.086   0.649
  311    HE1  PHE  42           HE1      PHE  42  -0.243   4.098   5.108
  312    HE2  PHE  42           HE2      PHE  42   0.705   4.038   0.951
  313    HZ   PHE  42           HZ       PHE  42   0.966   5.046   3.183
  314    HA   PRO  43           HA       PRO  43  -4.015  -3.931   3.498
  315   1HB   PRO  43          2HB       PRO  43  -5.883  -3.460   5.386
  316   2HB   PRO  43          1HB       PRO  43  -4.225  -3.916   5.795
  317   1HG   PRO  43          2HG       PRO  43  -5.498  -1.207   5.787
  318   2HG   PRO  43          1HG       PRO  43  -4.404  -1.925   6.982
  319   1HD   PRO  43          2HD       PRO  43  -3.581  -0.167   5.069
  320   2HD   PRO  43          1HD       PRO  43  -2.529  -1.425   5.751
  321    H    THR  44           H        THR  44  -5.734  -0.816   3.842
  322    HA   THR  44           HA       THR  44  -7.477  -1.638   1.622
  323    HB   THR  44           HB       THR  44  -9.314  -0.326   2.871
  324    HG1  THR  44           HG1      THR  44  -7.674  -0.991   5.082
  325   1HG2  THR  44          1HG2      THR  44 -10.110  -2.223   4.026
  326   2HG2  THR  44          2HG2      THR  44  -8.486  -2.891   4.192
  327   3HG2  THR  44          3HG2      THR  44  -9.252  -2.820   2.605
  328    H    GLN  45           H        GLN  45  -8.649   0.236   0.645
  329    HA   GLN  45           HA       GLN  45  -6.820   2.243  -0.110
  330   1HB   GLN  45          2HB       GLN  45  -8.881   1.328  -1.374
  331   2HB   GLN  45          1HB       GLN  45  -9.797   2.503  -0.441
  332   1HG   GLN  45          2HG       GLN  45  -7.737   4.011  -1.425
  333   2HG   GLN  45          1HG       GLN  45  -8.053   2.883  -2.743
  334   1HE2  GLN  45          1HE2      GLN  45 -10.533   2.571  -3.075
  335   2HE2  GLN  45          2HE2      GLN  45 -11.433   4.041  -3.197
  336    H    GLU  46           H        GLU  46  -9.425   2.164   2.246
  337    HA   GLU  46           HA       GLU  46  -9.492   4.942   2.780
  338   1HB   GLU  46          2HB       GLU  46 -10.687   4.296   4.848
  339   2HB   GLU  46          1HB       GLU  46 -11.346   3.521   3.415
  340   1HG   GLU  46          2HG       GLU  46  -9.621   1.626   4.165
  341   2HG   GLU  46          1HG       GLU  46  -9.952   2.351   5.738
  342    H    ALA  47           H        ALA  47  -7.361   2.406   3.756
  343    HA   ALA  47           HA       ALA  47  -6.359   3.623   6.122
  344   1HB   ALA  47          1HB       ALA  47  -4.569   1.825   4.621
  345   2HB   ALA  47          2HB       ALA  47  -6.139   1.157   5.069
  346   3HB   ALA  47          3HB       ALA  47  -5.062   1.789   6.314
  347    H    CYS  48           H        CYS  48  -5.392   3.706   2.722
  348    HA   CYS  48           HA       CYS  48  -3.008   5.213   3.243
  349   1HB   CYS  48          2HB       CYS  48  -2.680   5.248   0.889
  350   2HB   CYS  48          1HB       CYS  48  -3.346   3.666   1.273
  351    H    MET  49           H        MET  49  -6.250   5.974   2.037
  352    HA   MET  49           HA       MET  49  -5.778   8.686   1.472
  353   1HB   MET  49          2HB       MET  49  -8.022   6.898   1.521
  354   2HB   MET  49          1HB       MET  49  -8.470   8.410   2.298
  355   1HG   MET  49          2HG       MET  49  -7.467   9.545   0.237
  356   2HG   MET  49          1HG       MET  49  -7.534   7.949  -0.507
  357   1HE   MET  49          1HE       MET  49  -9.803  11.209   0.168
  358   2HE   MET  49          2HE       MET  49  -9.460  10.350   1.670
  359   3HE   MET  49          3HE       MET  49 -11.100  10.376   1.023
  360    H    LYS  50           H        LYS  50  -6.614   7.018   4.440
  361    HA   LYS  50           HA       LYS  50  -6.992   9.520   5.872
  362   1HB   LYS  50          2HB       LYS  50  -8.446   7.550   6.304
  363   2HB   LYS  50          1HB       LYS  50  -7.043   6.688   6.921
  364   1HG   LYS  50          2HG       LYS  50  -6.799   8.343   8.697
  365   2HG   LYS  50          1HG       LYS  50  -8.200   9.219   8.076
  366   1HD   LYS  50          2HD       LYS  50  -9.430   7.967   9.457
  367   2HD   LYS  50          1HD       LYS  50  -9.118   6.623   8.355
  368   1HE   LYS  50          2HE       LYS  50  -8.118   5.576  10.041
  369   2HE   LYS  50          1HE       LYS  50  -6.843   6.790   9.961
  370   1HZ   LYS  50          1HZ       LYS  50  -7.445   7.167  12.073
  371   2HZ   LYS  50          2HZ       LYS  50  -8.978   6.478  11.890
  372   3HZ   LYS  50          3HZ       LYS  50  -8.703   8.071  11.393
  373    H    ARG  51           H        ARG  51  -4.356   7.678   4.989
  374    HA   ARG  51           HA       ARG  51  -2.871   8.349   7.432
  375   1HB   ARG  51          2HB       ARG  51  -2.464   6.304   5.278
  376   2HB   ARG  51          1HB       ARG  51  -1.108   6.821   6.271
  377   1HG   ARG  51          2HG       ARG  51  -3.681   5.720   7.378
  378   2HG   ARG  51          1HG       ARG  51  -2.238   4.753   7.062
  379   1HD   ARG  51          2HD       ARG  51  -1.589   5.264   9.130
  380   2HD   ARG  51          1HD       ARG  51  -1.294   6.897   8.536
  381    HE   ARG  51           HE       ARG  51  -3.915   6.956   9.161
  382   1HH1  ARG  51          1HH1      ARG  51  -1.088   5.931  10.933
  383   2HH1  ARG  51          2HH1      ARG  51  -1.756   6.341  12.478
  384   1HH2  ARG  51          1HH2      ARG  51  -4.792   7.496  11.191
  385   2HH2  ARG  51          2HH2      ARG  51  -3.858   7.229  12.624
  386    H    CYS  52           H        CYS  52  -3.008   8.951   3.988
  387    HA   CYS  52           HA       CYS  52  -0.764  10.837   4.307
  388   1HB   CYS  52          2HB       CYS  52  -1.078   8.664   2.443
  389   2HB   CYS  52          1HB       CYS  52  -0.959  10.190   1.574
  390    H    ALA  53           H        ALA  53  -3.920  10.241   2.891
  391    HA   ALA  53           HA       ALA  53  -3.981  12.836   1.601
  392   1HB   ALA  53          1HB       ALA  53  -5.162  10.492   0.977
  393   2HB   ALA  53          2HB       ALA  53  -5.730  12.064   0.415
  394   3HB   ALA  53          3HB       ALA  53  -6.484  11.303   1.816
  395    H    LYS  54           H        LYS  54  -5.077  11.367   4.557
  396    HA   LYS  54           HA       LYS  54  -6.566  13.813   5.221
  397   1HB   LYS  54          2HB       LYS  54  -7.547  11.354   5.349
  398   2HB   LYS  54          1HB       LYS  54  -6.741  11.362   6.911
  399   1HG   LYS  54          2HG       LYS  54  -8.479  13.670   6.242
  400   2HG   LYS  54          1HG       LYS  54  -9.253  12.129   6.617
  401   1HD   LYS  54          2HD       LYS  54  -7.370  12.342   8.598
  402   2HD   LYS  54          1HD       LYS  54  -7.872  14.019   8.372
  403   1HE   LYS  54          2HE       LYS  54 -10.255  13.187   8.530
  404   2HE   LYS  54          1HE       LYS  54  -9.587  11.644   9.063
  405   1HZ   LYS  54          1HZ       LYS  54  -8.335  13.334  10.699
  406   2HZ   LYS  54          2HZ       LYS  54  -9.800  12.580  11.078
  407   3HZ   LYS  54          3HZ       LYS  54  -9.794  14.163  10.484
  408    H    ALA  55           H        ALA  55  -3.931  11.740   6.177
  409    HA   ALA  55           HA       ALA  55  -3.505  13.090   8.695
  410   1HB   ALA  55          1HB       ALA  55  -2.125  11.391   9.197
  411   2HB   ALA  55          2HB       ALA  55  -1.321  11.442   7.628
  412   3HB   ALA  55          3HB       ALA  55  -2.866  10.609   7.802
  Start of MODEL   14
    1   1H    ILE   1          1H        ILE   1   4.473  14.328   4.605
    2   2H    ILE   1          2H        ILE   1   5.431  14.364   3.181
    3   3H    ILE   1          3H        ILE   1   6.176  14.485   4.723
    4    HA   ILE   1           HA       ILE   1   5.819  12.318   5.232
    5    HB   ILE   1           HB       ILE   1   3.436  12.284   4.599
    6   1HG1  ILE   1          2HG1      ILE   1   3.501   9.906   3.556
    7   2HG1  ILE   1          1HG1      ILE   1   5.249  10.063   3.692
    8   1HG2  ILE   1          1HG2      ILE   1   3.677  13.317   2.384
    9   2HG2  ILE   1          2HG2      ILE   1   2.750  11.817   2.322
   10   3HG2  ILE   1          3HG2      ILE   1   4.433  11.839   1.788
   11   1HD1  ILE   1          1HD1      ILE   1   4.535   8.914   5.612
   12   2HD1  ILE   1          2HD1      ILE   1   3.214  10.048   5.893
   13   3HD1  ILE   1          3HD1      ILE   1   4.883  10.561   6.137
   14    H    ASP   2           H        ASP   2   7.206  10.736   4.558
   15    HA   ASP   2           HA       ASP   2   8.531  11.210   1.974
   16   1HB   ASP   2          2HB       ASP   2   9.649   9.679   4.326
   17   2HB   ASP   2          1HB       ASP   2  10.520  10.252   2.907
   18    H    THR   3           H        THR   3   7.185   8.717   4.073
   19    HA   THR   3           HA       THR   3   7.828   6.459   2.574
   20    HB   THR   3           HB       THR   3   5.330   6.942   4.209
   21    HG1  THR   3           HG1      THR   3   6.526   6.631   5.905
   22   1HG2  THR   3          1HG2      THR   3   6.602   4.279   4.024
   23   2HG2  THR   3          2HG2      THR   3   5.630   4.821   2.656
   24   3HG2  THR   3          3HG2      THR   3   4.912   4.719   4.263
   25    H    CYS   4           H        CYS   4   5.427   8.910   2.035
   26    HA   CYS   4           HA       CYS   4   3.797   7.439   0.228
   27   1HB   CYS   4          2HB       CYS   4   3.752   9.990   1.433
   28   2HB   CYS   4          1HB       CYS   4   3.725  10.267  -0.305
   29    H    ARG   5           H        ARG   5   6.923   8.660  -0.086
   30    HA   ARG   5           HA       ARG   5   6.701   9.146  -2.951
   31   1HB   ARG   5          2HB       ARG   5   9.038   9.407  -1.054
   32   2HB   ARG   5          1HB       ARG   5   9.103   9.781  -2.771
   33   1HG   ARG   5          2HG       ARG   5   7.743  11.650  -2.546
   34   2HG   ARG   5          1HG       ARG   5   7.101  11.113  -0.993
   35   1HD   ARG   5          2HD       ARG   5   9.799  11.307  -0.508
   36   2HD   ARG   5          1HD       ARG   5   9.502  12.658  -1.601
   37    HE   ARG   5           HE       ARG   5   7.620  12.470   0.569
   38   1HH1  ARG   5          1HH1      ARG   5  10.711  13.732  -0.448
   39   2HH1  ARG   5          2HH1      ARG   5  10.716  15.007   0.723
   40   1HH2  ARG   5          1HH2      ARG   5   7.625  14.147   2.110
   41   2HH2  ARG   5          2HH2      ARG   5   8.965  15.243   2.176
   42    H    LEU   6           H        LEU   6   7.668   6.655  -0.766
   43    HA   LEU   6           HA       LEU   6   9.036   5.213  -2.927
   44   1HB   LEU   6          2HB       LEU   6   9.510   3.611  -0.884
   45   2HB   LEU   6          1HB       LEU   6  10.483   5.038  -1.181
   46    HG   LEU   6           HG       LEU   6   8.126   5.273   0.636
   47   1HD1  LEU   6          1HD1      LEU   6   8.972   3.453   1.733
   48   2HD1  LEU   6          2HD1      LEU   6   9.932   4.738   2.466
   49   3HD1  LEU   6          3HD1      LEU   6  10.621   3.747   1.181
   50   1HD2  LEU   6          1HD2      LEU   6  10.876   6.513   0.612
   51   2HD2  LEU   6          2HD2      LEU   6   9.567   6.917   1.722
   52   3HD2  LEU   6          3HD2      LEU   6   9.401   7.260   0.000
   53    HA   PRO   7           HA       PRO   7   5.513   2.535  -3.262
   54   1HB   PRO   7          2HB       PRO   7   6.520   0.691  -4.911
   55   2HB   PRO   7          1HB       PRO   7   6.260   2.355  -5.451
   56   1HG   PRO   7          2HG       PRO   7   8.794   1.012  -4.603
   57   2HG   PRO   7          1HG       PRO   7   8.518   2.135  -5.945
   58   1HD   PRO   7          2HD       PRO   7   9.572   2.847  -3.493
   59   2HD   PRO   7          1HD       PRO   7   8.768   3.969  -4.609
   60    H    SER   8           H        SER   8   4.782   0.390  -2.748
   61    HA   SER   8           HA       SER   8   6.530  -0.979  -0.815
   62   1HB   SER   8          2HB       SER   8   3.921  -0.005  -0.514
   63   2HB   SER   8          1HB       SER   8   3.745  -1.755  -0.641
   64    HG   SER   8           HG       SER   8   5.392  -1.891   1.013
   65    H    ASP   9           H        ASP   9   6.552  -3.274  -0.757
   66    HA   ASP   9           HA       ASP   9   6.039  -4.462  -3.382
   67   1HB   ASP   9          2HB       ASP   9   8.293  -4.600  -2.093
   68   2HB   ASP   9          1HB       ASP   9   7.485  -5.841  -1.139
   69    H    ARG  10           H        ARG  10   4.793  -6.284  -3.682
   70    HA   ARG  10           HA       ARG  10   2.827  -6.793  -1.602
   71   1HB   ARG  10          2HB       ARG  10   1.610  -7.991  -3.362
   72   2HB   ARG  10          1HB       ARG  10   2.036  -6.364  -3.867
   73   1HG   ARG  10          2HG       ARG  10   4.083  -7.467  -4.966
   74   2HG   ARG  10          1HG       ARG  10   3.187  -8.974  -4.769
   75   1HD   ARG  10          2HD       ARG  10   1.999  -6.552  -6.093
   76   2HD   ARG  10          1HD       ARG  10   2.927  -7.758  -6.986
   77    HE   ARG  10           HE       ARG  10   0.845  -8.924  -5.424
   78   1HH1  ARG  10          1HH1      ARG  10   1.523  -7.282  -8.429
   79   2HH1  ARG  10          2HH1      ARG  10   0.173  -7.976  -9.262
   80   1HH2  ARG  10          1HH2      ARG  10  -0.937  -9.845  -6.528
   81   2HH2  ARG  10          2HH2      ARG  10  -1.221  -9.431  -8.185
   82    HN2  GLY  11           H        GLY  11   5.782  -8.038  -2.304
   83   1HA   GLY  11          2HA       GLY  11   6.817 -10.053  -1.910
   84   2HA   GLY  11          1HA       GLY  11   5.663 -10.176  -0.592
   85    H    ARG  12           H        ARG  12   6.503 -11.236  -3.777
   86    HA   ARG  12           HA       ARG  12   4.138 -12.542  -4.512
   87   1HB   ARG  12          2HB       ARG  12   6.708 -12.271  -5.564
   88   2HB   ARG  12          1HB       ARG  12   6.513 -14.002  -5.328
   89   1HG   ARG  12          2HG       ARG  12   5.519 -13.990  -7.319
   90   2HG   ARG  12          1HG       ARG  12   4.131 -13.297  -6.478
   91   1HD   ARG  12          2HD       ARG  12   4.432 -11.266  -7.395
   92   2HD   ARG  12          1HD       ARG  12   6.188 -11.353  -7.253
   93    HE   ARG  12           HE       ARG  12   5.503 -13.113  -9.260
   94   1HH1  ARG  12          1HH1      ARG  12   5.148  -9.693  -8.665
   95   2HH1  ARG  12          2HH1      ARG  12   5.193  -9.269 -10.344
   96   1HH2  ARG  12          1HH2      ARG  12   5.564 -12.558 -11.467
   97   2HH2  ARG  12          2HH2      ARG  12   5.430 -10.896 -11.934
   98    H    CYS  13           H        CYS  13   6.370 -13.252  -2.036
   99    HA   CYS  13           HA       CYS  13   6.590 -15.882  -1.691
  100   1HB   CYS  13          2HB       CYS  13   5.937 -15.347   0.841
  101   2HB   CYS  13          1HB       CYS  13   7.442 -14.790   0.121
  102    H    LYS  14           H        LYS  14   3.935 -14.622   0.277
  103    HA   LYS  14           HA       LYS  14   2.314 -16.902  -0.630
  104   1HB   LYS  14          2HB       LYS  14   2.581 -15.523   2.014
  105   2HB   LYS  14          1HB       LYS  14   1.085 -16.356   1.619
  106   1HG   LYS  14          2HG       LYS  14   2.248 -17.996   2.719
  107   2HG   LYS  14          1HG       LYS  14   2.666 -18.342   1.040
  108   1HD   LYS  14          2HD       LYS  14   4.623 -16.598   1.671
  109   2HD   LYS  14          1HD       LYS  14   4.344 -17.336   3.248
  110   1HE   LYS  14          2HE       LYS  14   5.207 -19.317   2.613
  111   2HE   LYS  14          1HE       LYS  14   4.486 -19.227   1.006
  112   1HZ   LYS  14          1HZ       LYS  14   6.648 -18.977   0.442
  113   2HZ   LYS  14          2HZ       LYS  14   7.093 -18.301   1.928
  114   3HZ   LYS  14          3HZ       LYS  14   6.317 -17.349   0.766
  115    H    ALA  15           H        ALA  15   2.284 -14.638  -2.212
  116    HA   ALA  15           HA       ALA  15   0.481 -12.633  -1.728
  117   1HB   ALA  15          1HB       ALA  15   0.308 -13.847  -4.417
  118   2HB   ALA  15          2HB       ALA  15   1.911 -13.355  -3.873
  119   3HB   ALA  15          3HB       ALA  15   0.603 -12.175  -3.940
  120    H    SER  16           H        SER  16  -1.401 -12.999  -0.689
  121    HA   SER  16           HA       SER  16  -3.443 -14.503  -2.122
  122   1HB   SER  16          2HB       SER  16  -2.188 -15.910  -0.282
  123   2HB   SER  16          1HB       SER  16  -3.249 -15.027   0.813
  124    HG   SER  16           HG       SER  16  -4.867 -16.192   0.155
  125    H    PHE  17           H        PHE  17  -2.581 -12.082   0.244
  126    HA   PHE  17           HA       PHE  17  -5.409 -11.339   0.518
  127   1HB   PHE  17          2HB       PHE  17  -3.037 -10.496   2.196
  128   2HB   PHE  17          1HB       PHE  17  -4.713 -10.047   2.486
  129    HD1  PHE  17           HD1      PHE  17  -6.363 -11.830   3.093
  130    HD2  PHE  17           HD2      PHE  17  -2.167 -12.534   2.970
  131    HE1  PHE  17           HE1      PHE  17  -6.665 -13.843   4.474
  132    HE2  PHE  17           HE2      PHE  17  -2.461 -14.550   4.350
  133    HZ   PHE  17           HZ       PHE  17  -4.712 -15.207   5.104
  134    H    GLU  18           H        GLU  18  -6.106  -9.699  -0.669
  135    HA   GLU  18           HA       GLU  18  -4.336  -8.052  -2.171
  136   1HB   GLU  18          2HB       GLU  18  -7.302  -8.155  -1.770
  137   2HB   GLU  18          1HB       GLU  18  -6.583  -6.761  -2.566
  138   1HG   GLU  18          2HG       GLU  18  -5.425  -8.542  -4.058
  139   2HG   GLU  18          1HG       GLU  18  -6.706  -9.601  -3.469
  140    H    ARG  19           H        ARG  19  -3.486  -6.121  -1.706
  141    HA   ARG  19           HA       ARG  19  -4.579  -4.603   0.558
  142   1HB   ARG  19          2HB       ARG  19  -1.649  -5.154   0.063
  143   2HB   ARG  19          1HB       ARG  19  -2.286  -4.086   1.307
  144   1HG   ARG  19          2HG       ARG  19  -2.827  -7.043   1.123
  145   2HG   ARG  19          1HG       ARG  19  -1.637  -6.285   2.185
  146   1HD   ARG  19          2HD       ARG  19  -3.196  -5.768   3.689
  147   2HD   ARG  19          1HD       ARG  19  -4.234  -5.047   2.460
  148    HE   ARG  19           HE       ARG  19  -4.629  -7.677   2.075
  149   1HH1  ARG  19          1HH1      ARG  19  -4.697  -5.701   4.951
  150   2HH1  ARG  19          2HH1      ARG  19  -5.888  -6.676   5.745
  151   1HH2  ARG  19          1HH2      ARG  19  -6.205  -8.956   3.117
  152   2HH2  ARG  19          2HH2      ARG  19  -6.741  -8.523   4.705
  153    H    TRP  20           H        TRP  20  -3.412  -2.348   0.620
  154    HA   TRP  20           HA       TRP  20  -3.320  -1.335  -2.147
  155   1HB   TRP  20          2HB       TRP  20  -4.439  -0.029   0.336
  156   2HB   TRP  20          1HB       TRP  20  -4.205   0.812  -1.193
  157    HD1  TRP  20           HD1      TRP  20  -6.312  -2.012   0.355
  158    HE1  TRP  20           HE1      TRP  20  -8.443  -2.296  -1.055
  159    HE3  TRP  20           HE3      TRP  20  -5.202   1.223  -3.440
  160    HZ2  TRP  20           HZ2      TRP  20  -9.509  -1.285  -3.459
  161    HZ3  TRP  20           HZ3      TRP  20  -6.831   1.507  -5.260
  162    HH2  TRP  20           HH2      TRP  20  -8.942   0.278  -5.270
  163    H    TYR  21           H        TYR  21  -2.128   0.713  -2.410
  164    HA   TYR  21           HA       TYR  21  -0.068   1.307  -0.444
  165   1HB   TYR  21          2HB       TYR  21   1.639   1.122  -2.460
  166   2HB   TYR  21          1HB       TYR  21   1.251  -0.295  -1.485
  167    HD1  TYR  21           HD1      TYR  21  -0.615  -1.818  -2.331
  168    HD2  TYR  21           HD2      TYR  21   1.307   1.078  -4.775
  169    HE1  TYR  21           HE1      TYR  21  -1.439  -2.962  -4.324
  170    HE2  TYR  21           HE2      TYR  21   0.487  -0.071  -6.789
  171    HH   TYR  21           HH       TYR  21  -0.354  -2.221  -7.488
  172    H    PHE  22           H        PHE  22   1.346   3.157  -1.286
  173    HA   PHE  22           HA       PHE  22  -0.419   5.037  -2.682
  174   1HB   PHE  22          2HB       PHE  22   1.043   5.322  -0.362
  175   2HB   PHE  22          1HB       PHE  22   2.044   6.143  -1.555
  176    HD1  PHE  22           HD1      PHE  22   0.998   7.958  -2.959
  177    HD2  PHE  22           HD2      PHE  22  -0.872   6.336   0.500
  178    HE1  PHE  22           HE1      PHE  22  -0.452   9.941  -2.820
  179    HE2  PHE  22           HE2      PHE  22  -2.325   8.314   0.646
  180    HZ   PHE  22           HZ       PHE  22  -2.118  10.120  -1.015
  181    H    ASN  23           H        ASN  23  -0.084   4.640  -4.825
  182    HA   ASN  23           HA       ASN  23   2.598   4.427  -5.891
  183   1HB   ASN  23          2HB       ASN  23   0.567   3.146  -6.756
  184   2HB   ASN  23          1HB       ASN  23   0.043   4.664  -7.479
  185   1HD2  ASN  23          1HD2      ASN  23   1.107   5.467  -9.250
  186   2HD2  ASN  23          2HD2      ASN  23   2.281   4.559 -10.134
  187    HN2  GLY  24           H        GLY  24   2.918   6.684  -4.843
  188   1HA   GLY  24          2HA       GLY  24   3.660   8.804  -5.419
  189   2HA   GLY  24          1HA       GLY  24   2.964   8.579  -7.017
  190    H    ARG  25           H        ARG  25   0.672   8.927  -7.281
  191    HA   ARG  25           HA       ARG  25  -0.407  10.784  -5.263
  192   1HB   ARG  25          2HB       ARG  25  -1.740  11.694  -7.261
  193   2HB   ARG  25          1HB       ARG  25  -0.029  12.089  -7.169
  194   1HG   ARG  25          2HG       ARG  25  -0.594   9.638  -8.654
  195   2HG   ARG  25          1HG       ARG  25  -1.308  11.090  -9.358
  196   1HD   ARG  25          2HD       ARG  25   0.675  11.838 -10.054
  197   2HD   ARG  25          1HD       ARG  25   1.424  11.530  -8.487
  198    HE   ARG  25           HE       ARG  25   2.238   9.548  -9.299
  199   1HH1  ARG  25          1HH1      ARG  25  -0.212  10.747 -11.477
  200   2HH1  ARG  25          2HH1      ARG  25   0.120   9.567 -12.700
  201   1HH2  ARG  25          1HH2      ARG  25   2.676   7.996 -10.907
  202   2HH2  ARG  25          2HH2      ARG  25   1.758   8.004 -12.377
  203    H    THR  26           H        THR  26  -1.069   8.044  -7.328
  204    HA   THR  26           HA       THR  26  -3.813   7.914  -6.282
  205    HB   THR  26           HB       THR  26  -2.873   6.080  -8.434
  206    HG1  THR  26           HG1      THR  26  -2.711   7.596  -9.893
  207   1HG2  THR  26          1HG2      THR  26  -5.377   6.930  -7.376
  208   2HG2  THR  26          2HG2      THR  26  -5.039   5.694  -8.588
  209   3HG2  THR  26          3HG2      THR  26  -5.281   7.370  -9.082
  210    H    CYS  27           H        CYS  27  -4.584   6.081  -5.263
  211    HA   CYS  27           HA       CYS  27  -2.532   4.390  -4.076
  212   1HB   CYS  27          2HB       CYS  27  -5.400   4.988  -3.437
  213   2HB   CYS  27          1HB       CYS  27  -4.641   3.542  -2.779
  214    H    ALA  28           H        ALA  28  -1.964   2.683  -5.237
  215    HA   ALA  28           HA       ALA  28  -3.908   1.291  -6.889
  216   1HB   ALA  28          1HB       ALA  28  -1.669  -0.112  -7.299
  217   2HB   ALA  28          2HB       ALA  28  -0.963   1.415  -6.765
  218   3HB   ALA  28          3HB       ALA  28  -2.045   1.381  -8.157
  219    H    LYS  29           H        LYS  29  -3.476  -1.259  -6.875
  220    HA   LYS  29           HA       LYS  29  -3.288  -2.233  -4.130
  221   1HB   LYS  29          2HB       LYS  29  -5.405  -3.422  -4.264
  222   2HB   LYS  29          1HB       LYS  29  -5.660  -1.696  -4.484
  223   1HG   LYS  29          2HG       LYS  29  -5.932  -1.972  -6.847
  224   2HG   LYS  29          1HG       LYS  29  -5.477  -3.674  -6.744
  225   1HD   LYS  29          2HD       LYS  29  -7.476  -3.906  -5.150
  226   2HD   LYS  29          1HD       LYS  29  -7.982  -2.334  -5.773
  227   1HE   LYS  29          2HE       LYS  29  -7.912  -3.265  -8.063
  228   2HE   LYS  29          1HE       LYS  29  -7.508  -4.841  -7.383
  229   1HZ   LYS  29          1HZ       LYS  29  -9.962  -3.361  -6.635
  230   2HZ   LYS  29          2HZ       LYS  29  -9.601  -4.988  -6.347
  231   3HZ   LYS  29          3HZ       LYS  29  -9.915  -4.458  -7.923
  232    H    PHE  30           H        PHE  30  -2.913  -4.448  -3.920
  233    HA   PHE  30           HA       PHE  30  -2.685  -6.164  -6.206
  234   1HB   PHE  30          2HB       PHE  30  -0.221  -6.614  -5.787
  235   2HB   PHE  30          1HB       PHE  30  -0.604  -5.098  -6.585
  236    HD1  PHE  30           HD2      PHE  30  -1.192  -5.315  -2.991
  237    HD2  PHE  30           HD1      PHE  30   1.642  -4.309  -6.003
  238    HE1  PHE  30           HE2      PHE  30   0.146  -4.112  -1.323
  239    HE2  PHE  30           HE1      PHE  30   2.986  -3.105  -4.335
  240    HZ   PHE  30           HZ       PHE  30   2.239  -3.005  -1.992
  241    H    ILE  31           H        ILE  31  -1.488  -8.302  -5.422
  242    HA   ILE  31           HA       ILE  31  -2.850  -9.029  -2.953
  243    HB   ILE  31           HB       ILE  31  -1.334 -10.769  -4.898
  244   1HG1  ILE  31          2HG1      ILE  31  -4.209 -11.162  -4.732
  245   2HG1  ILE  31          1HG1      ILE  31  -3.809  -9.517  -5.216
  246   1HG2  ILE  31          1HG2      ILE  31  -1.411 -11.720  -2.652
  247   2HG2  ILE  31          2HG2      ILE  31  -2.427 -12.640  -3.763
  248   3HG2  ILE  31          3HG2      ILE  31  -3.164 -11.518  -2.620
  249   1HD1  ILE  31          1HD1      ILE  31  -3.257 -10.172  -7.252
  250   2HD1  ILE  31          2HD1      ILE  31  -3.939 -11.745  -6.842
  251   3HD1  ILE  31          3HD1      ILE  31  -2.213 -11.451  -6.635
  252    H    TYR  32           H        TYR  32  -1.792  -8.599  -1.154
  253    HA   TYR  32           HA       TYR  32   1.107  -8.666  -1.057
  254   1HB   TYR  32          2HB       TYR  32  -0.022  -6.801   0.005
  255   2HB   TYR  32          1HB       TYR  32  -0.984  -7.898   0.988
  256    HD1  TYR  32           HD2      TYR  32   2.582  -7.011   0.318
  257    HD2  TYR  32           HD1      TYR  32  -0.298  -8.349   3.148
  258    HE1  TYR  32           HE2      TYR  32   4.279  -6.894   2.093
  259    HE2  TYR  32           HE1      TYR  32   1.391  -8.233   4.931
  260    HH   TYR  32           HH       TYR  32   4.717  -7.848   4.290
  261    HN2  GLY  33           H        GLY  33   2.003 -10.604  -0.840
  262   1HA   GLY  33          2HA       GLY  33   0.695 -12.769   0.525
  263   2HA   GLY  33          1HA       GLY  33   2.309 -12.798  -0.172
  264    HN2  GLY  34           H        GLY  34   3.016 -10.325   1.386
  265   1HA   GLY  34          2HA       GLY  34   2.923 -10.088   3.942
  266   2HA   GLY  34          1HA       GLY  34   3.551 -11.726   3.920
  267    H    CYS  35           H        CYS  35   4.965 -10.378   1.302
  268    HA   CYS  35           HA       CYS  35   7.281  -9.505   2.903
  269   1HB   CYS  35          2HB       CYS  35   7.418 -10.504   0.062
  270   2HB   CYS  35          1HB       CYS  35   8.734 -10.313   1.210
  271    HN2  GLY  36           H        GLY  36   6.420  -7.356   3.014
  272   1HA   GLY  36          2HA       GLY  36   6.325  -5.901   0.471
  273   2HA   GLY  36          1HA       GLY  36   5.724  -5.311   2.012
  274    HN2  GLY  37           H        GLY  37   7.781  -5.500   3.698
  275   1HA   GLY  37          2HA       GLY  37   9.739  -4.497   4.339
  276   2HA   GLY  37          1HA       GLY  37  10.312  -4.793   2.703
  277    H    ASN  38           H        ASN  38   7.618  -2.765   3.820
  278    HA   ASN  38           HA       ASN  38   9.015  -0.319   3.507
  279   1HB   ASN  38          2HB       ASN  38   8.545  -1.314   1.088
  280   2HB   ASN  38          1HB       ASN  38   6.964  -0.591   1.363
  281   1HD2  ASN  38          1HD2      ASN  38  10.418   0.151   1.524
  282   2HD2  ASN  38          2HD2      ASN  38  10.265   1.796   1.017
  283    HN2  GLY  39           H        GLY  39   7.734   1.520   3.928
  284   1HA   GLY  39          2HA       GLY  39   5.405   0.925   5.560
  285   2HA   GLY  39          1HA       GLY  39   6.237   2.467   5.451
  286    H    ASN  40           H        ASN  40   5.768   1.446   2.353
  287    HA   ASN  40           HA       ASN  40   3.562   3.296   1.990
  288   1HB   ASN  40          2HB       ASN  40   5.459   3.502   0.509
  289   2HB   ASN  40          1HB       ASN  40   5.337   1.810   0.043
  290   1HD2  ASN  40          1HD2      ASN  40   4.281   4.994  -0.535
  291   2HD2  ASN  40          2HD2      ASN  40   3.191   4.641  -1.827
  292    H    LYS  41           H        LYS  41   3.700   0.101   2.733
  293    HA   LYS  41           HA       LYS  41   1.540  -0.728   0.948
  294   1HB   LYS  41          2HB       LYS  41   1.845  -2.945   2.195
  295   2HB   LYS  41          1HB       LYS  41   3.144  -2.430   1.132
  296   1HG   LYS  41          2HG       LYS  41   4.613  -2.287   2.809
  297   2HG   LYS  41          1HG       LYS  41   3.453  -1.500   3.882
  298   1HD   LYS  41          2HD       LYS  41   2.671  -3.495   4.719
  299   2HD   LYS  41          1HD       LYS  41   3.113  -4.399   3.269
  300   1HE   LYS  41          2HE       LYS  41   4.842  -5.134   4.489
  301   2HE   LYS  41          1HE       LYS  41   5.547  -3.549   4.171
  302   1HZ   LYS  41          1HZ       LYS  41   5.224  -2.889   6.281
  303   2HZ   LYS  41          2HZ       LYS  41   5.185  -4.547   6.613
  304   3HZ   LYS  41          3HZ       LYS  41   3.739  -3.686   6.436
  305    H    PHE  42           H        PHE  42  -0.482  -0.352   1.538
  306    HA   PHE  42           HA       PHE  42  -1.140  -0.334   4.408
  307   1HB   PHE  42          2HB       PHE  42  -2.605   1.100   2.184
  308   2HB   PHE  42          1HB       PHE  42  -2.936   1.221   3.909
  309    HD1  PHE  42           HD2      PHE  42  -1.210   2.267   5.403
  310    HD2  PHE  42           HD1      PHE  42  -0.993   2.457   1.157
  311    HE1  PHE  42           HE2      PHE  42   0.356   4.157   5.572
  312    HE2  PHE  42           HE1      PHE  42   0.575   4.346   1.318
  313    HZ   PHE  42           HZ       PHE  42   1.250   5.200   3.528
  314    HA   PRO  43           HA       PRO  43  -3.905  -3.707   3.793
  315   1HB   PRO  43          2HB       PRO  43  -5.882  -2.473   5.575
  316   2HB   PRO  43          1HB       PRO  43  -4.916  -3.930   5.813
  317   1HG   PRO  43          2HG       PRO  43  -4.466  -1.669   7.207
  318   2HG   PRO  43          1HG       PRO  43  -3.156  -2.773   6.746
  319   1HD   PRO  43          2HD       PRO  43  -3.982  -0.179   5.492
  320   2HD   PRO  43          1HD       PRO  43  -2.351  -0.807   5.816
  321    H    THR  44           H        THR  44  -5.880  -0.751   4.150
  322    HA   THR  44           HA       THR  44  -7.419  -1.607   1.790
  323    HB   THR  44           HB       THR  44  -9.225  -0.082   2.877
  324    HG1  THR  44           HG1      THR  44  -9.047  -0.080   5.165
  325   1HG2  THR  44          1HG2      THR  44 -10.078  -2.138   2.984
  326   2HG2  THR  44          2HG2      THR  44  -9.548  -2.102   4.667
  327   3HG2  THR  44          3HG2      THR  44  -8.534  -2.860   3.439
  328    H    GLN  45           H        GLN  45  -8.573   0.298   0.721
  329    HA   GLN  45           HA       GLN  45  -6.606   2.147  -0.153
  330   1HB   GLN  45          2HB       GLN  45  -8.653   1.215  -1.427
  331   2HB   GLN  45          1HB       GLN  45  -9.558   2.485  -0.616
  332   1HG   GLN  45          2HG       GLN  45  -7.492   3.912  -1.597
  333   2HG   GLN  45          1HG       GLN  45  -7.623   2.649  -2.819
  334   1HE2  GLN  45          1HE2      GLN  45  -9.108   2.869  -4.348
  335   2HE2  GLN  45          2HE2      GLN  45 -10.395   4.021  -4.341
  336    H    GLU  46           H        GLU  46  -9.095   2.240   2.271
  337    HA   GLU  46           HA       GLU  46  -9.197   5.072   2.561
  338   1HB   GLU  46          2HB       GLU  46 -10.804   3.122   3.408
  339   2HB   GLU  46          1HB       GLU  46  -9.829   3.288   4.861
  340   1HG   GLU  46          2HG       GLU  46 -10.447   5.889   4.245
  341   2HG   GLU  46          1HG       GLU  46 -11.911   5.015   3.794
  342    H    ALA  47           H        ALA  47  -7.117   2.569   3.767
  343    HA   ALA  47           HA       ALA  47  -6.044   3.968   5.985
  344   1HB   ALA  47          1HB       ALA  47  -4.142   2.303   5.714
  345   2HB   ALA  47          2HB       ALA  47  -5.058   1.642   4.359
  346   3HB   ALA  47          3HB       ALA  47  -5.753   1.634   5.981
  347    H    CYS  48           H        CYS  48  -4.819   3.482   2.671
  348    HA   CYS  48           HA       CYS  48  -2.485   4.996   2.962
  349   1HB   CYS  48          2HB       CYS  48  -2.338   4.994   0.567
  350   2HB   CYS  48          1HB       CYS  48  -3.000   3.442   1.063
  351    H    MET  49           H        MET  49  -5.741   5.953   1.962
  352    HA   MET  49           HA       MET  49  -5.001   8.674   1.446
  353   1HB   MET  49          2HB       MET  49  -7.106   7.142   0.698
  354   2HB   MET  49          1HB       MET  49  -7.836   8.052   2.013
  355   1HG   MET  49          2HG       MET  49  -6.315   9.773   0.266
  356   2HG   MET  49          1HG       MET  49  -7.530   8.857  -0.627
  357   1HE   MET  49          1HE       MET  49 -10.678  10.362  -0.087
  358   2HE   MET  49          2HE       MET  49 -10.466   8.992   1.003
  359   3HE   MET  49          3HE       MET  49  -9.715   8.973  -0.593
  360    H    LYS  50           H        LYS  50  -6.003   6.877   4.232
  361    HA   LYS  50           HA       LYS  50  -6.681   9.272   5.735
  362   1HB   LYS  50          2HB       LYS  50  -7.991   7.178   5.997
  363   2HB   LYS  50          1HB       LYS  50  -6.561   6.397   6.658
  364   1HG   LYS  50          2HG       LYS  50  -6.562   8.152   8.455
  365   2HG   LYS  50          1HG       LYS  50  -8.140   8.660   7.849
  366   1HD   LYS  50          2HD       LYS  50  -9.183   6.921   8.802
  367   2HD   LYS  50          1HD       LYS  50  -7.940   5.780   8.284
  368   1HE   LYS  50          2HE       LYS  50  -6.497   6.717  10.138
  369   2HE   LYS  50          1HE       LYS  50  -7.940   7.546  10.721
  370   1HZ   LYS  50          1HZ       LYS  50  -8.162   5.658  11.901
  371   2HZ   LYS  50          2HZ       LYS  50  -7.254   4.724  10.822
  372   3HZ   LYS  50          3HZ       LYS  50  -8.873   5.076  10.481
  373    H    ARG  51           H        ARG  51  -3.894   7.460   5.057
  374    HA   ARG  51           HA       ARG  51  -2.578   8.407   7.512
  375   1HB   ARG  51          2HB       ARG  51  -1.748   6.227   5.591
  376   2HB   ARG  51          1HB       ARG  51  -0.830   6.727   7.006
  377   1HG   ARG  51          2HG       ARG  51  -3.623   6.007   7.540
  378   2HG   ARG  51          1HG       ARG  51  -2.605   4.687   6.960
  379   1HD   ARG  51          2HD       ARG  51  -2.261   4.542   9.227
  380   2HD   ARG  51          1HD       ARG  51  -0.928   5.592   8.750
  381    HE   ARG  51           HE       ARG  51  -2.911   7.333   9.354
  382   1HH1  ARG  51          1HH1      ARG  51  -1.461   4.663  11.072
  383   2HH1  ARG  51          2HH1      ARG  51  -1.741   5.354  12.634
  384   1HH2  ARG  51          1HH2      ARG  51  -3.280   8.243  11.410
  385   2HH2  ARG  51          2HH2      ARG  51  -2.774   7.386  12.826
  386    H    CYS  52           H        CYS  52  -2.697   8.835   4.100
  387    HA   CYS  52           HA       CYS  52  -0.223  10.433   4.229
  388   1HB   CYS  52          2HB       CYS  52  -1.051   8.398   2.367
  389   2HB   CYS  52          1HB       CYS  52  -0.808   9.923   1.523
  390    H    ALA  53           H        ALA  53  -3.548  10.310   3.086
  391    HA   ALA  53           HA       ALA  53  -3.391  12.950   1.915
  392   1HB   ALA  53          1HB       ALA  53  -4.961  10.797   1.391
  393   2HB   ALA  53          2HB       ALA  53  -5.317  12.446   0.879
  394   3HB   ALA  53          3HB       ALA  53  -6.055  11.799   2.344
  395    H    LYS  54           H        LYS  54  -4.308  11.520   4.938
  396    HA   LYS  54           HA       LYS  54  -5.556  14.014   5.822
  397   1HB   LYS  54          2HB       LYS  54  -5.740  11.189   6.631
  398   2HB   LYS  54          1HB       LYS  54  -5.736  12.336   7.964
  399   1HG   LYS  54          2HG       LYS  54  -7.741  13.259   7.361
  400   2HG   LYS  54          1HG       LYS  54  -7.549  12.836   5.659
  401   1HD   LYS  54          2HD       LYS  54  -7.611  10.408   7.082
  402   2HD   LYS  54          1HD       LYS  54  -8.907  11.406   7.745
  403   1HE   LYS  54          2HE       LYS  54  -9.576  11.853   5.328
  404   2HE   LYS  54          1HE       LYS  54  -8.490  10.532   4.898
  405   1HZ   LYS  54          1HZ       LYS  54  -9.929   9.387   6.821
  406   2HZ   LYS  54          2HZ       LYS  54 -10.341   9.314   5.182
  407   3HZ   LYS  54          3HZ       LYS  54 -11.087  10.448   6.190
  408    H    ALA  55           H        ALA  55  -2.831  11.890   6.483
  409    HA   ALA  55           HA       ALA  55  -1.833  13.814   8.471
  410   1HB   ALA  55          1HB       ALA  55  -0.858  12.115   9.592
  411   2HB   ALA  55          2HB       ALA  55  -0.424  11.247   8.119
  412   3HB   ALA  55          3HB       ALA  55  -2.069  11.150   8.748
  Start of MODEL   15
    1   1H    ILE   1          1H        ILE   1   6.175  14.542   2.096
    2   2H    ILE   1          2H        ILE   1   6.510  14.665   3.774
    3   3H    ILE   1          3H        ILE   1   4.889  14.732   3.214
    4    HA   ILE   1           HA       ILE   1   5.810  12.601   4.233
    5    HB   ILE   1           HB       ILE   1   3.590  12.870   3.190
    6   1HG1  ILE   1          2HG1      ILE   1   3.447  10.445   2.302
    7   2HG1  ILE   1          1HG1      ILE   1   5.161  10.350   2.694
    8   1HG2  ILE   1          1HG2      ILE   1   3.294  12.227   0.820
    9   2HG2  ILE   1          2HG2      ILE   1   5.048  12.197   0.639
   10   3HG2  ILE   1          3HG2      ILE   1   4.227  13.710   1.024
   11   1HD1  ILE   1          1HD1      ILE   1   3.232   9.651   4.391
   12   2HD1  ILE   1          2HD1      ILE   1   3.377  11.357   4.816
   13   3HD1  ILE   1          3HD1      ILE   1   4.785  10.301   4.917
   14    H    ASP   2           H        ASP   2   7.048  10.810   3.892
   15    HA   ASP   2           HA       ASP   2   8.803  10.883   1.529
   16   1HB   ASP   2          2HB       ASP   2  10.311   9.418   2.993
   17   2HB   ASP   2          1HB       ASP   2  10.166  11.115   3.441
   18    H    THR   3           H        THR   3   6.908   8.761   3.623
   19    HA   THR   3           HA       THR   3   7.434   6.309   2.454
   20    HB   THR   3           HB       THR   3   4.792   7.277   3.559
   21    HG1  THR   3           HG1      THR   3   6.392   7.510   5.093
   22   1HG2  THR   3          1HG2      THR   3   5.458   4.783   2.419
   23   2HG2  THR   3          2HG2      THR   3   3.979   5.250   3.258
   24   3HG2  THR   3          3HG2      THR   3   5.328   4.561   4.163
   25    H    CYS   4           H        CYS   4   5.166   8.815   1.444
   26    HA   CYS   4           HA       CYS   4   3.825   7.373  -0.545
   27   1HB   CYS   4          2HB       CYS   4   3.907  10.061   0.389
   28   2HB   CYS   4          1HB       CYS   4   4.065  10.096  -1.364
   29    H    ARG   5           H        ARG   5   7.037   8.569  -0.467
   30    HA   ARG   5           HA       ARG   5   7.308   8.608  -3.362
   31   1HB   ARG   5          2HB       ARG   5   9.329   9.086  -1.165
   32   2HB   ARG   5          1HB       ARG   5   9.660   9.246  -2.885
   33   1HG   ARG   5          2HG       ARG   5   8.111  11.069  -3.073
   34   2HG   ARG   5          1HG       ARG   5   7.586  10.846  -1.403
   35   1HD   ARG   5          2HD       ARG   5  10.388  11.125  -1.340
   36   2HD   ARG   5          1HD       ARG   5   9.783  12.375  -2.424
   37    HE   ARG   5           HE       ARG   5   8.335  12.196   0.051
   38   1HH1  ARG   5          1HH1      ARG   5  11.110  13.587  -1.544
   39   2HH1  ARG   5          2HH1      ARG   5  11.228  14.921  -0.447
   40   1HH2  ARG   5          1HH2      ARG   5   8.490  13.950   1.495
   41   2HH2  ARG   5          2HH2      ARG   5   9.741  15.127   1.278
   42    H    LEU   6           H        LEU   6   8.280   6.637  -0.608
   43    HA   LEU   6           HA       LEU   6   9.733   4.800  -2.338
   44   1HB   LEU   6          2HB       LEU   6  10.047   3.549  -0.125
   45   2HB   LEU   6          1HB       LEU   6  10.860   5.089  -0.325
   46    HG   LEU   6           HG       LEU   6   8.221   5.349   0.906
   47   1HD1  LEU   6          1HD1      LEU   6   8.352   3.605   2.291
   48   2HD1  LEU   6          2HD1      LEU   6   9.635   4.502   3.102
   49   3HD1  LEU   6          3HD1      LEU   6  10.038   3.292   1.884
   50   1HD2  LEU   6          1HD2      LEU   6  10.069   7.069   0.716
   51   2HD2  LEU   6          2HD2      LEU   6  10.919   6.156   1.963
   52   3HD2  LEU   6          3HD2      LEU   6   9.346   6.875   2.312
   53    HA   PRO   7           HA       PRO   7   5.840   2.554  -2.827
   54   1HB   PRO   7          2HB       PRO   7   6.792   0.767  -4.644
   55   2HB   PRO   7          1HB       PRO   7   6.292   2.407  -5.071
   56   1HG   PRO   7          2HG       PRO   7   9.043   1.333  -4.582
   57   2HG   PRO   7          1HG       PRO   7   8.481   2.433  -5.856
   58   1HD   PRO   7          2HD       PRO   7   9.779   3.316  -3.658
   59   2HD   PRO   7          1HD       PRO   7   8.513   4.271  -4.458
   60    H    SER   8           H        SER   8   5.092   0.461  -2.299
   61    HA   SER   8           HA       SER   8   6.979  -1.094  -0.656
   62   1HB   SER   8          2HB       SER   8   4.746   0.032   0.251
   63   2HB   SER   8          1HB       SER   8   4.026  -1.442  -0.392
   64    HG   SER   8           HG       SER   8   5.259  -2.645   0.982
   65    H    ASP   9           H        ASP   9   6.964  -3.368  -0.780
   66    HA   ASP   9           HA       ASP   9   6.040  -4.380  -3.362
   67   1HB   ASP   9          2HB       ASP   9   8.202  -5.058  -1.488
   68   2HB   ASP   9          1HB       ASP   9   7.391  -6.458  -2.183
   69    H    ARG  10           H        ARG  10   4.679  -6.162  -3.581
   70    HA   ARG  10           HA       ARG  10   2.956  -6.632  -1.283
   71   1HB   ARG  10          2HB       ARG  10   1.461  -7.715  -2.901
   72   2HB   ARG  10          1HB       ARG  10   1.900  -6.092  -3.406
   73   1HG   ARG  10          2HG       ARG  10   3.556  -7.025  -4.950
   74   2HG   ARG  10          1HG       ARG  10   3.079  -8.653  -4.459
   75   1HD   ARG  10          2HD       ARG  10   0.697  -7.377  -5.120
   76   2HD   ARG  10          1HD       ARG  10   1.842  -6.860  -6.358
   77    HE   ARG  10           HE       ARG  10   1.863  -9.686  -5.840
   78   1HH1  ARG  10          1HH1      ARG  10   0.395  -7.119  -7.696
   79   2HH1  ARG  10          2HH1      ARG  10  -0.119  -8.167  -8.974
   80   1HH2  ARG  10          1HH2      ARG  10   1.185 -11.066  -7.523
   81   2HH2  ARG  10          2HH2      ARG  10   0.327 -10.407  -8.876
   82    HN2  GLY  11           H        GLY  11   5.738  -7.976  -2.342
   83   1HA   GLY  11          2HA       GLY  11   6.755 -10.006  -2.035
   84   2HA   GLY  11          1HA       GLY  11   5.636 -10.190  -0.693
   85    H    ARG  12           H        ARG  12   6.485 -11.225  -3.836
   86    HA   ARG  12           HA       ARG  12   4.016 -12.446  -4.555
   87   1HB   ARG  12          2HB       ARG  12   6.106 -11.871  -6.018
   88   2HB   ARG  12          1HB       ARG  12   6.669 -13.459  -5.515
   89   1HG   ARG  12          2HG       ARG  12   5.184 -14.546  -6.809
   90   2HG   ARG  12          1HG       ARG  12   3.912 -13.353  -6.540
   91   1HD   ARG  12          2HD       ARG  12   4.648 -13.386  -8.875
   92   2HD   ARG  12          1HD       ARG  12   4.977 -11.834  -8.110
   93    HE   ARG  12           HE       ARG  12   6.950 -13.855  -8.882
   94   1HH1  ARG  12          1HH1      ARG  12   6.263 -10.687  -7.569
   95   2HH1  ARG  12          2HH1      ARG  12   7.891 -10.130  -7.748
   96   1HH2  ARG  12          1HH2      ARG  12   9.084 -13.113  -9.113
   97   2HH2  ARG  12          2HH2      ARG  12   9.490 -11.502  -8.622
   98    H    CYS  13           H        CYS  13   6.281 -13.180  -2.188
   99    HA   CYS  13           HA       CYS  13   6.706 -15.821  -2.050
  100   1HB   CYS  13          2HB       CYS  13   6.045 -15.494   0.524
  101   2HB   CYS  13          1HB       CYS  13   7.520 -14.832  -0.168
  102    H    LYS  14           H        LYS  14   3.958 -14.763  -0.068
  103    HA   LYS  14           HA       LYS  14   2.507 -17.148  -0.999
  104   1HB   LYS  14          2HB       LYS  14   2.649 -15.754   1.644
  105   2HB   LYS  14          1HB       LYS  14   1.194 -16.648   1.226
  106   1HG   LYS  14          2HG       LYS  14   3.975 -17.802   1.244
  107   2HG   LYS  14          1HG       LYS  14   2.797 -17.968   2.548
  108   1HD   LYS  14          2HD       LYS  14   1.245 -18.942   0.747
  109   2HD   LYS  14          1HD       LYS  14   2.706 -19.109  -0.227
  110   1HE   LYS  14          2HE       LYS  14   2.614 -21.166   0.798
  111   2HE   LYS  14          1HE       LYS  14   3.649 -20.273   1.911
  112   1HZ   LYS  14          1HZ       LYS  14   1.641 -19.807   3.250
  113   2HZ   LYS  14          2HZ       LYS  14   2.012 -21.455   3.159
  114   3HZ   LYS  14          3HZ       LYS  14   0.749 -20.821   2.230
  115    H    ALA  15           H        ALA  15   2.293 -15.054  -2.673
  116    HA   ALA  15           HA       ALA  15   0.421 -13.086  -2.265
  117   1HB   ALA  15          1HB       ALA  15  -0.082 -13.867  -4.861
  118   2HB   ALA  15          2HB       ALA  15   1.560 -14.443  -4.569
  119   3HB   ALA  15          3HB       ALA  15   1.169 -12.739  -4.336
  120    H    SER  16           H        SER  16  -1.434 -13.469  -1.183
  121    HA   SER  16           HA       SER  16  -3.487 -14.989  -2.535
  122   1HB   SER  16          2HB       SER  16  -2.008 -16.284  -0.547
  123   2HB   SER  16          1HB       SER  16  -3.501 -15.798   0.256
  124    HG   SER  16           HG       SER  16  -4.555 -16.755  -1.681
  125    H    PHE  17           H        PHE  17  -2.886 -12.206  -1.644
  126    HA   PHE  17           HA       PHE  17  -5.511 -11.614  -0.600
  127   1HB   PHE  17          2HB       PHE  17  -3.133 -10.600   0.957
  128   2HB   PHE  17          1HB       PHE  17  -4.837 -10.455   1.374
  129    HD1  PHE  17           HD1      PHE  17  -1.959 -12.724   1.221
  130    HD2  PHE  17           HD2      PHE  17  -6.016 -12.258   2.418
  131    HE1  PHE  17           HE1      PHE  17  -1.801 -14.788   2.550
  132    HE2  PHE  17           HE2      PHE  17  -5.865 -14.321   3.750
  133    HZ   PHE  17           HZ       PHE  17  -3.754 -15.589   3.817
  134    H    GLU  18           H        GLU  18  -5.828  -9.194  -0.437
  135    HA   GLU  18           HA       GLU  18  -4.168  -7.823  -2.449
  136   1HB   GLU  18          2HB       GLU  18  -7.145  -7.551  -1.986
  137   2HB   GLU  18          1HB       GLU  18  -6.207  -6.564  -3.100
  138   1HG   GLU  18          2HG       GLU  18  -5.580  -9.132  -3.860
  139   2HG   GLU  18          1HG       GLU  18  -7.285  -9.241  -3.428
  140    H    ARG  19           H        ARG  19  -3.162  -6.060  -1.729
  141    HA   ARG  19           HA       ARG  19  -4.229  -4.752   0.692
  142   1HB   ARG  19          2HB       ARG  19  -1.516  -5.639  -0.036
  143   2HB   ARG  19          1HB       ARG  19  -1.600  -4.033   0.667
  144   1HG   ARG  19          2HG       ARG  19  -1.193  -5.948   2.260
  145   2HG   ARG  19          1HG       ARG  19  -2.497  -4.840   2.681
  146   1HD   ARG  19          2HD       ARG  19  -4.087  -6.463   1.621
  147   2HD   ARG  19          1HD       ARG  19  -2.741  -7.588   1.468
  148    HE   ARG  19           HE       ARG  19  -4.159  -6.870   3.884
  149   1HH1  ARG  19          1HH1      ARG  19  -1.284  -8.307   2.525
  150   2HH1  ARG  19          2HH1      ARG  19  -0.911  -9.212   3.953
  151   1HH2  ARG  19          1HH2      ARG  19  -3.670  -8.059   5.762
  152   2HH2  ARG  19          2HH2      ARG  19  -2.266  -9.072   5.790
  153    H    TRP  20           H        TRP  20  -3.354  -2.460   0.938
  154    HA   TRP  20           HA       TRP  20  -3.548  -1.086  -1.663
  155   1HB   TRP  20          2HB       TRP  20  -4.471  -0.174   1.072
  156   2HB   TRP  20          1HB       TRP  20  -4.495   0.830  -0.374
  157    HD1  TRP  20           HD1      TRP  20  -6.337  -2.042   1.305
  158    HE1  TRP  20           HE1      TRP  20  -8.537  -2.475   0.051
  159    HE3  TRP  20           HE3      TRP  20  -5.584   1.009  -2.727
  160    HZ2  TRP  20           HZ2      TRP  20  -9.788  -1.639  -2.329
  161    HZ3  TRP  20           HZ3      TRP  20  -7.334   1.134  -4.450
  162    HH2  TRP  20           HH2      TRP  20  -9.395  -0.163  -4.255
  163    H    TYR  21           H        TYR  21  -2.203   0.665  -2.060
  164    HA   TYR  21           HA       TYR  21  -0.162   1.350  -0.084
  165   1HB   TYR  21          2HB       TYR  21   1.540   1.139  -2.062
  166   2HB   TYR  21          1HB       TYR  21   1.090  -0.303  -1.156
  167    HD1  TYR  21           HD1      TYR  21  -1.041  -1.554  -2.139
  168    HD2  TYR  21           HD2      TYR  21   1.519   1.003  -4.370
  169    HE1  TYR  21           HE1      TYR  21  -1.816  -2.602  -4.208
  170    HE2  TYR  21           HE2      TYR  21   0.751  -0.047  -6.460
  171    HH   TYR  21           HH       TYR  21  -0.300  -2.133  -7.212
  172    H    PHE  22           H        PHE  22   1.025   3.306  -0.647
  173    HA   PHE  22           HA       PHE  22  -0.689   5.242  -1.895
  174   1HB   PHE  22          2HB       PHE  22   2.180   5.717  -1.091
  175   2HB   PHE  22          1HB       PHE  22   0.871   6.886  -1.191
  176    HD1  PHE  22           HD1      PHE  22   2.259   4.097   0.768
  177    HD2  PHE  22           HD2      PHE  22  -0.624   7.222   0.618
  178    HE1  PHE  22           HE1      PHE  22   1.818   3.799   3.170
  179    HE2  PHE  22           HE2      PHE  22  -1.071   6.930   3.020
  180    HZ   PHE  22           HZ       PHE  22   0.150   5.217   4.298
  181    H    ASN  23           H        ASN  23  -0.254   6.494  -3.737
  182    HA   ASN  23           HA       ASN  23   1.880   5.539  -5.508
  183   1HB   ASN  23          2HB       ASN  23  -0.383   4.452  -6.017
  184   2HB   ASN  23          1HB       ASN  23  -0.907   6.050  -6.541
  185   1HD2  ASN  23          1HD2      ASN  23  -0.685   6.457  -8.610
  186   2HD2  ASN  23          2HD2      ASN  23   0.437   5.703  -9.685
  187    HN2  GLY  24           H        GLY  24   2.534   7.692  -4.370
  188   1HA   GLY  24          2HA       GLY  24   3.240   9.840  -4.845
  189   2HA   GLY  24          1HA       GLY  24   2.383   9.736  -6.377
  190    H    ARG  25           H        ARG  25  -0.131   9.648  -5.993
  191    HA   ARG  25           HA       ARG  25  -0.840  11.644  -3.954
  192   1HB   ARG  25          2HB       ARG  25  -2.523  12.495  -5.710
  193   2HB   ARG  25          1HB       ARG  25  -0.838  12.963  -5.877
  194   1HG   ARG  25          2HG       ARG  25  -1.356  10.505  -7.285
  195   2HG   ARG  25          1HG       ARG  25  -2.466  11.775  -7.800
  196   1HD   ARG  25          2HD       ARG  25  -0.630  13.240  -8.315
  197   2HD   ARG  25          1HD       ARG  25   0.528  12.094  -7.643
  198    HE   ARG  25           HE       ARG  25  -1.040  11.009  -9.789
  199   1HH1  ARG  25          1HH1      ARG  25   1.809  12.862  -8.995
  200   2HH1  ARG  25          2HH1      ARG  25   2.626  12.474 -10.471
  201   1HH2  ARG  25          1HH2      ARG  25   0.032  10.498 -11.731
  202   2HH2  ARG  25          2HH2      ARG  25   1.617  11.132 -12.026
  203    H    THR  26           H        THR  26  -1.952   9.055  -6.088
  204    HA   THR  26           HA       THR  26  -4.300   8.696  -4.353
  205    HB   THR  26           HB       THR  26  -4.000   7.342  -7.009
  206    HG1  THR  26           HG1      THR  26  -4.416   9.113  -8.081
  207   1HG2  THR  26          1HG2      THR  26  -6.016   6.643  -6.383
  208   2HG2  THR  26          2HG2      THR  26  -6.554   8.269  -6.803
  209   3HG2  THR  26          3HG2      THR  26  -6.160   7.875  -5.129
  210    H    CYS  27           H        CYS  27  -5.021   6.336  -4.222
  211    HA   CYS  27           HA       CYS  27  -2.745   4.783  -3.301
  212   1HB   CYS  27          2HB       CYS  27  -5.112   5.173  -2.144
  213   2HB   CYS  27          1HB       CYS  27  -5.533   3.752  -3.094
  214    H    ALA  28           H        ALA  28  -3.015   2.315  -3.635
  215    HA   ALA  28           HA       ALA  28  -3.944   1.655  -6.322
  216   1HB   ALA  28          1HB       ALA  28  -1.107   1.513  -5.395
  217   2HB   ALA  28          2HB       ALA  28  -1.760   2.160  -6.898
  218   3HB   ALA  28          3HB       ALA  28  -1.707   0.418  -6.641
  219    H    LYS  29           H        LYS  29  -3.430  -0.854  -6.680
  220    HA   LYS  29           HA       LYS  29  -3.804  -2.338  -4.193
  221   1HB   LYS  29          2HB       LYS  29  -5.775  -3.512  -5.061
  222   2HB   LYS  29          1HB       LYS  29  -6.071  -1.786  -4.900
  223   1HG   LYS  29          2HG       LYS  29  -6.310  -1.478  -7.123
  224   2HG   LYS  29          1HG       LYS  29  -5.112  -2.708  -7.534
  225   1HD   LYS  29          2HD       LYS  29  -6.662  -4.318  -7.712
  226   2HD   LYS  29          1HD       LYS  29  -7.509  -3.788  -6.257
  227   1HE   LYS  29          2HE       LYS  29  -8.977  -3.549  -8.146
  228   2HE   LYS  29          1HE       LYS  29  -8.517  -1.946  -7.571
  229   1HZ   LYS  29          1HZ       LYS  29  -8.131  -1.637  -9.758
  230   2HZ   LYS  29          2HZ       LYS  29  -7.866  -3.277 -10.076
  231   3HZ   LYS  29          3HZ       LYS  29  -6.637  -2.341  -9.388
  232    H    PHE  30           H        PHE  30  -3.040  -4.389  -4.233
  233    HA   PHE  30           HA       PHE  30  -2.420  -5.717  -6.708
  234   1HB   PHE  30          2HB       PHE  30   0.007  -5.962  -6.157
  235   2HB   PHE  30          1HB       PHE  30  -0.474  -4.340  -6.614
  236    HD1  PHE  30           HD1      PHE  30  -1.567  -5.068  -3.310
  237    HD2  PHE  30           HD2      PHE  30   1.848  -3.926  -5.580
  238    HE1  PHE  30           HE1      PHE  30  -0.519  -4.179  -1.276
  239    HE2  PHE  30           HE2      PHE  30   2.901  -3.033  -3.546
  240    HZ   PHE  30           HZ       PHE  30   1.718  -3.159  -1.390
  241    H    ILE  31           H        ILE  31  -1.064  -7.834  -6.136
  242    HA   ILE  31           HA       ILE  31  -2.640  -9.131  -4.066
  243    HB   ILE  31           HB       ILE  31  -0.650 -10.327  -5.993
  244   1HG1  ILE  31          2HG1      ILE  31  -2.506  -9.325  -7.198
  245   2HG1  ILE  31          1HG1      ILE  31  -2.656 -11.079  -7.238
  246   1HG2  ILE  31          1HG2      ILE  31  -2.777 -11.683  -4.341
  247   2HG2  ILE  31          2HG2      ILE  31  -1.057 -11.658  -3.946
  248   3HG2  ILE  31          3HG2      ILE  31  -1.613 -12.461  -5.415
  249   1HD1  ILE  31          1HD1      ILE  31  -4.157  -9.253  -5.377
  250   2HD1  ILE  31          2HD1      ILE  31  -4.348 -11.002  -5.515
  251   3HD1  ILE  31          3HD1      ILE  31  -4.798  -9.955  -6.862
  252    H    TYR  32           H        TYR  32  -1.896  -8.943  -2.059
  253    HA   TYR  32           HA       TYR  32   0.958  -8.859  -1.528
  254   1HB   TYR  32          2HB       TYR  32  -0.898  -7.411  -0.407
  255   2HB   TYR  32          1HB       TYR  32  -1.152  -8.831   0.601
  256    HD1  TYR  32           HD2      TYR  32   0.570  -9.564   2.169
  257    HD2  TYR  32           HD1      TYR  32   1.099  -6.066  -0.190
  258    HE1  TYR  32           HE2      TYR  32   2.421  -8.865   3.632
  259    HE2  TYR  32           HE1      TYR  32   2.952  -5.357   1.264
  260    HH   TYR  32           HH       TYR  32   4.355  -7.441   3.603
  261    HN2  GLY  33           H        GLY  33   2.126 -10.535  -0.916
  262   1HA   GLY  33          2HA       GLY  33   0.731 -13.034  -0.261
  263   2HA   GLY  33          1HA       GLY  33   2.383 -12.910  -0.847
  264    HN2  GLY  34           H        GLY  34   2.884 -10.662   1.098
  265   1HA   GLY  34          2HA       GLY  34   2.616 -10.843   3.660
  266   2HA   GLY  34          1HA       GLY  34   3.363 -12.412   3.415
  267    H    CYS  35           H        CYS  35   4.832 -10.653   1.135
  268    HA   CYS  35           HA       CYS  35   6.976  -9.842   2.982
  269   1HB   CYS  35          2HB       CYS  35   7.309 -10.499   0.054
  270   2HB   CYS  35          1HB       CYS  35   8.571 -10.300   1.260
  271    HN2  GLY  36           H        GLY  36   6.545  -7.731   3.368
  272   1HA   GLY  36          2HA       GLY  36   6.004  -5.968   1.092
  273   2HA   GLY  36          1HA       GLY  36   5.769  -5.560   2.782
  274    HN2  GLY  37           H        GLY  37   7.934  -5.684   4.070
  275   1HA   GLY  37          2HA       GLY  37  10.046  -4.856   4.420
  276   2HA   GLY  37          1HA       GLY  37  10.355  -5.123   2.711
  277    H    ASN  38           H        ASN  38   7.890  -3.024   4.150
  278    HA   ASN  38           HA       ASN  38   9.359  -0.626   3.817
  279   1HB   ASN  38          2HB       ASN  38   8.638  -1.526   1.407
  280   2HB   ASN  38          1HB       ASN  38   7.144  -0.699   1.836
  281   1HD2  ASN  38          1HD2      ASN  38  10.646  -0.219   1.719
  282   2HD2  ASN  38          2HD2      ASN  38  10.577   1.449   1.279
  283    HN2  GLY  39           H        GLY  39   7.739   1.311   3.748
  284   1HA   GLY  39          2HA       GLY  39   5.646   0.720   5.739
  285   2HA   GLY  39          1HA       GLY  39   6.520   2.239   5.628
  286    H    ASN  40           H        ASN  40   5.896   1.288   2.530
  287    HA   ASN  40           HA       ASN  40   3.745   3.222   2.305
  288   1HB   ASN  40          2HB       ASN  40   5.419   3.544   0.695
  289   2HB   ASN  40          1HB       ASN  40   5.554   1.826   0.352
  290   1HD2  ASN  40          1HD2      ASN  40   4.243   4.750  -0.616
  291   2HD2  ASN  40          2HD2      ASN  40   3.146   4.157  -1.812
  292    H    LYS  41           H        LYS  41   3.897  -0.098   2.759
  293    HA   LYS  41           HA       LYS  41   1.540  -0.692   1.145
  294   1HB   LYS  41          2HB       LYS  41   1.836  -3.008   1.972
  295   2HB   LYS  41          1HB       LYS  41   3.268  -2.386   1.167
  296   1HG   LYS  41          2HG       LYS  41   4.406  -3.086   2.942
  297   2HG   LYS  41          1HG       LYS  41   3.689  -1.729   3.812
  298   1HD   LYS  41          2HD       LYS  41   1.917  -3.102   4.639
  299   2HD   LYS  41          1HD       LYS  41   2.397  -4.443   3.599
  300   1HE   LYS  41          2HE       LYS  41   3.980  -5.132   5.027
  301   2HE   LYS  41          1HE       LYS  41   4.537  -3.488   5.342
  302   1HZ   LYS  41          1HZ       LYS  41   3.411  -4.889   7.209
  303   2HZ   LYS  41          2HZ       LYS  41   1.978  -4.357   6.485
  304   3HZ   LYS  41          3HZ       LYS  41   3.094  -3.232   7.077
  305    H    PHE  42           H        PHE  42  -0.380  -1.629   2.086
  306    HA   PHE  42           HA       PHE  42  -0.800  -1.504   4.920
  307   1HB   PHE  42          2HB       PHE  42  -1.642   0.737   3.186
  308   2HB   PHE  42          1HB       PHE  42  -2.868   0.142   4.301
  309    HD1  PHE  42           HD2      PHE  42  -1.237  -0.604   6.632
  310    HD2  PHE  42           HD1      PHE  42  -0.982   2.779   4.061
  311    HE1  PHE  42           HE2      PHE  42  -0.213   0.695   8.451
  312    HE2  PHE  42           HE1      PHE  42   0.044   4.084   5.878
  313    HZ   PHE  42           HZ       PHE  42   0.428   3.043   8.076
  314    HA   PRO  43           HA       PRO  43  -3.960  -4.387   3.855
  315   1HB   PRO  43          2HB       PRO  43  -5.613  -4.257   5.961
  316   2HB   PRO  43          1HB       PRO  43  -3.958  -4.859   6.115
  317   1HG   PRO  43          2HG       PRO  43  -5.064  -2.161   6.794
  318   2HG   PRO  43          1HG       PRO  43  -3.925  -3.164   7.709
  319   1HD   PRO  43          2HD       PRO  43  -3.171  -1.069   6.112
  320   2HD   PRO  43          1HD       PRO  43  -2.128  -2.456   6.478
  321    H    THR  44           H        THR  44  -5.338  -1.291   4.993
  322    HA   THR  44           HA       THR  44  -7.508  -1.663   3.033
  323    HB   THR  44           HB       THR  44  -8.585   0.140   4.701
  324    HG1  THR  44           HG1      THR  44  -8.018  -0.409   6.825
  325   1HG2  THR  44          1HG2      THR  44  -9.557  -1.801   6.009
  326   2HG2  THR  44          2HG2      THR  44  -8.575  -2.842   4.980
  327   3HG2  THR  44          3HG2      THR  44  -9.807  -1.803   4.263
  328    H    GLN  45           H        GLN  45  -8.286   0.183   1.934
  329    HA   GLN  45           HA       GLN  45  -6.235   1.996   1.145
  330   1HB   GLN  45          2HB       GLN  45  -8.212   1.063  -0.243
  331   2HB   GLN  45          1HB       GLN  45  -9.147   2.352   0.498
  332   1HG   GLN  45          2HG       GLN  45  -7.297   3.910  -0.357
  333   2HG   GLN  45          1HG       GLN  45  -6.831   2.557  -1.384
  334   1HE2  GLN  45          1HE2      GLN  45  -9.396   1.538  -1.897
  335   2HE2  GLN  45          2HE2      GLN  45 -10.234   2.665  -2.903
  336    H    GLU  46           H        GLU  46  -8.752   2.073   3.505
  337    HA   GLU  46           HA       GLU  46  -9.152   4.840   3.732
  338   1HB   GLU  46          2HB       GLU  46 -10.101   2.565   5.011
  339   2HB   GLU  46          1HB       GLU  46  -9.261   3.438   6.284
  340   1HG   GLU  46          2HG       GLU  46 -11.507   4.145   6.345
  341   2HG   GLU  46          1HG       GLU  46 -10.585   5.466   5.627
  342    H    ALA  47           H        ALA  47  -6.614   2.753   4.892
  343    HA   ALA  47           HA       ALA  47  -5.509   4.697   6.703
  344   1HB   ALA  47          1HB       ALA  47  -4.857   2.686   7.486
  345   2HB   ALA  47          2HB       ALA  47  -3.507   2.917   6.374
  346   3HB   ALA  47          3HB       ALA  47  -4.890   1.935   5.891
  347    H    CYS  48           H        CYS  48  -4.710   3.463   3.474
  348    HA   CYS  48           HA       CYS  48  -2.352   4.991   3.153
  349   1HB   CYS  48          2HB       CYS  48  -2.367   4.292   0.890
  350   2HB   CYS  48          1HB       CYS  48  -3.064   2.958   1.802
  351    H    MET  49           H        MET  49  -5.730   5.608   2.347
  352    HA   MET  49           HA       MET  49  -5.234   8.031   0.937
  353   1HB   MET  49          2HB       MET  49  -7.321   6.473   0.906
  354   2HB   MET  49          1HB       MET  49  -7.836   7.417   2.298
  355   1HG   MET  49          2HG       MET  49  -8.062   9.360   1.062
  356   2HG   MET  49          1HG       MET  49  -7.013   8.778  -0.231
  357   1HE   MET  49          1HE       MET  49  -7.928   8.000  -2.439
  358   2HE   MET  49          2HE       MET  49  -8.650   9.569  -2.084
  359   3HE   MET  49          3HE       MET  49  -9.638   8.278  -2.769
  360    H    LYS  50           H        LYS  50  -6.147   7.273   4.270
  361    HA   LYS  50           HA       LYS  50  -6.386  10.017   5.046
  362   1HB   LYS  50          2HB       LYS  50  -7.599   8.142   6.152
  363   2HB   LYS  50          1HB       LYS  50  -6.065   7.583   6.804
  364   1HG   LYS  50          2HG       LYS  50  -5.830   9.794   7.939
  365   2HG   LYS  50          1HG       LYS  50  -7.472  10.171   7.412
  366   1HD   LYS  50          2HD       LYS  50  -8.277   9.092   9.181
  367   2HD   LYS  50          1HD       LYS  50  -7.523   7.602   8.611
  368   1HE   LYS  50          2HE       LYS  50  -5.868   7.725  10.119
  369   2HE   LYS  50          1HE       LYS  50  -5.663   9.461   9.892
  370   1HZ   LYS  50          1HZ       LYS  50  -8.019   9.349  11.170
  371   2HZ   LYS  50          2HZ       LYS  50  -6.529   9.574  11.939
  372   3HZ   LYS  50          3HZ       LYS  50  -7.217   8.030  11.864
  373    H    ARG  51           H        ARG  51  -3.703   8.150   4.362
  374    HA   ARG  51           HA       ARG  51  -2.037   9.488   6.365
  375   1HB   ARG  51          2HB       ARG  51  -1.862   6.963   4.880
  376   2HB   ARG  51          1HB       ARG  51  -0.341   7.838   4.987
  377   1HG   ARG  51          2HG       ARG  51  -0.067   7.286   7.121
  378   2HG   ARG  51          1HG       ARG  51  -1.717   7.758   7.533
  379   1HD   ARG  51          2HD       ARG  51  -1.636   5.308   5.980
  380   2HD   ARG  51          1HD       ARG  51  -0.696   5.181   7.467
  381    HE   ARG  51           HE       ARG  51  -3.556   5.386   7.231
  382   1HH1  ARG  51          1HH1      ARG  51  -0.809   5.890   9.325
  383   2HH1  ARG  51          2HH1      ARG  51  -1.740   5.775  10.781
  384   1HH2  ARG  51          1HH2      ARG  51  -4.782   5.236   9.145
  385   2HH2  ARG  51          2HH2      ARG  51  -3.995   5.403  10.679
  386    H    CYS  52           H        CYS  52  -2.538   9.269   2.890
  387    HA   CYS  52           HA       CYS  52  -0.573  11.444   2.573
  388   1HB   CYS  52          2HB       CYS  52  -0.240   8.942   1.554
  389   2HB   CYS  52          1HB       CYS  52  -1.029   9.755   0.206
  390    H    ALA  53           H        ALA  53  -3.783  10.386   1.998
  391    HA   ALA  53           HA       ALA  53  -4.210  12.404  -0.075
  392   1HB   ALA  53          1HB       ALA  53  -6.541  10.882   0.828
  393   2HB   ALA  53          2HB       ALA  53  -5.226   9.889   0.197
  394   3HB   ALA  53          3HB       ALA  53  -5.927  11.163  -0.802
  395    H    LYS  54           H        LYS  54  -5.665  11.447   3.039
  396    HA   LYS  54           HA       LYS  54  -7.203  13.827   3.269
  397   1HB   LYS  54          2HB       LYS  54  -7.512  11.501   4.414
  398   2HB   LYS  54          1HB       LYS  54  -6.427  12.156   5.633
  399   1HG   LYS  54          2HG       LYS  54  -8.384  12.785   6.565
  400   2HG   LYS  54          1HG       LYS  54  -8.156  14.177   5.503
  401   1HD   LYS  54          2HD       LYS  54 -10.276  13.653   4.888
  402   2HD   LYS  54          1HD       LYS  54  -9.427  12.549   3.804
  403   1HE   LYS  54          2HE       LYS  54  -9.594  10.954   5.918
  404   2HE   LYS  54          1HE       LYS  54 -10.983  11.981   6.270
  405   1HZ   LYS  54          1HZ       LYS  54 -11.945  11.423   4.168
  406   2HZ   LYS  54          2HZ       LYS  54 -11.535   9.984   4.958
  407   3HZ   LYS  54          3HZ       LYS  54 -10.567  10.561   3.697
  408    H    ALA  55           H        ALA  55  -3.973  12.925   4.197
  409    HA   ALA  55           HA       ALA  55  -3.607  15.137   6.004
  410   1HB   ALA  55          1HB       ALA  55  -2.169  13.523   6.664
  411   2HB   ALA  55          2HB       ALA  55  -1.096  14.324   5.518
  412   3HB   ALA  55          3HB       ALA  55  -1.977  12.875   5.035
  Start of MODEL   16
    1   1H    ILE   1          1H        ILE   1   7.867  13.690   3.277
    2   2H    ILE   1          2H        ILE   1   8.334  13.430   4.908
    3   3H    ILE   1          3H        ILE   1   6.822  14.159   4.552
    4    HA   ILE   1           HA       ILE   1   6.916  11.725   5.210
    5    HB   ILE   1           HB       ILE   1   5.088  11.225   3.520
    6   1HG1  ILE   1          2HG1      ILE   1   4.997  14.081   2.775
    7   2HG1  ILE   1          1HG1      ILE   1   6.288  13.153   2.019
    8   1HG2  ILE   1          1HG2      ILE   1   3.544  12.880   4.511
    9   2HG2  ILE   1          2HG2      ILE   1   4.935  13.746   5.165
   10   3HG2  ILE   1          3HG2      ILE   1   4.584  12.106   5.708
   11   1HD1  ILE   1          1HD1      ILE   1   3.894  13.380   0.934
   12   2HD1  ILE   1          2HD1      ILE   1   3.561  11.999   1.980
   13   3HD1  ILE   1          3HD1      ILE   1   4.852  11.907   0.782
   14    H    ASP   2           H        ASP   2   8.532  10.306   4.844
   15    HA   ASP   2           HA       ASP   2   9.520   9.816   2.167
   16   1HB   ASP   2          2HB       ASP   2  10.981   8.130   3.338
   17   2HB   ASP   2          1HB       ASP   2  11.162   9.787   3.910
   18    H    THR   3           H        THR   3   7.319   8.360   4.437
   19    HA   THR   3           HA       THR   3   7.203   5.753   3.455
   20    HB   THR   3           HB       THR   3   4.699   7.112   4.358
   21    HG1  THR   3           HG1      THR   3   7.005   6.686   5.937
   22   1HG2  THR   3          1HG2      THR   3   5.802   4.656   5.598
   23   2HG2  THR   3          2HG2      THR   3   5.133   4.545   3.969
   24   3HG2  THR   3          3HG2      THR   3   4.129   5.125   5.299
   25    H    CYS   4           H        CYS   4   5.218   8.569   2.556
   26    HA   CYS   4           HA       CYS   4   3.806   7.201   0.504
   27   1HB   CYS   4          2HB       CYS   4   3.682   9.729   1.759
   28   2HB   CYS   4          1HB       CYS   4   3.886  10.037   0.038
   29    H    ARG   5           H        ARG   5   6.974   8.366   0.647
   30    HA   ARG   5           HA       ARG   5   7.171   8.930  -2.199
   31   1HB   ARG   5          2HB       ARG   5   8.991   9.208   0.153
   32   2HB   ARG   5          1HB       ARG   5   9.701   9.106  -1.452
   33   1HG   ARG   5          2HG       ARG   5   8.329  11.026  -2.154
   34   2HG   ARG   5          1HG       ARG   5   7.695  11.146  -0.512
   35   1HD   ARG   5          2HD       ARG   5  10.640  11.232  -1.094
   36   2HD   ARG   5          1HD       ARG   5   9.638  12.681  -1.147
   37    HE   ARG   5           HE       ARG   5   9.069  11.632   1.278
   38   1HH1  ARG   5          1HH1      ARG   5  12.063  12.414  -0.335
   39   2HH1  ARG   5          2HH1      ARG   5  12.908  12.767   1.135
   40   1HH2  ARG   5          1HH2      ARG   5  10.178  12.097   3.213
   41   2HH2  ARG   5          2HH2      ARG   5  11.838  12.587   3.150
   42    H    LEU   6           H        LEU   6   7.923   6.389   0.074
   43    HA   LEU   6           HA       LEU   6   9.410   4.897  -1.946
   44   1HB   LEU   6          2HB       LEU   6   9.993   3.371  -0.195
   45   2HB   LEU   6          1HB       LEU   6  10.246   5.007   0.384
   46    HG   LEU   6           HG       LEU   6   7.773   4.636   1.326
   47   1HD1  LEU   6          1HD1      LEU   6   8.155   2.185   0.279
   48   2HD1  LEU   6          2HD1      LEU   6   7.127   2.507   1.676
   49   3HD1  LEU   6          3HD1      LEU   6   8.777   1.930   1.909
   50   1HD2  LEU   6          1HD2      LEU   6  10.383   3.762   2.545
   51   2HD2  LEU   6          2HD2      LEU   6   8.874   3.855   3.453
   52   3HD2  LEU   6          3HD2      LEU   6   9.559   5.311   2.732
   53    HA   PRO   7           HA       PRO   7   5.680   2.675  -2.989
   54   1HB   PRO   7          2HB       PRO   7   6.737   0.971  -4.780
   55   2HB   PRO   7          1HB       PRO   7   6.537   2.691  -5.134
   56   1HG   PRO   7          2HG       PRO   7   8.994   1.205  -4.290
   57   2HG   PRO   7          1HG       PRO   7   8.816   2.460  -5.531
   58   1HD   PRO   7          2HD       PRO   7   9.765   2.945  -3.012
   59   2HD   PRO   7          1HD       PRO   7   8.932   4.162  -3.999
   60    H    SER   8           H        SER   8   4.816   0.505  -2.863
   61    HA   SER   8           HA       SER   8   6.149  -1.069  -0.791
   62   1HB   SER   8          2HB       SER   8   3.374  -0.546  -1.540
   63   2HB   SER   8          1HB       SER   8   3.690  -2.257  -1.253
   64    HG   SER   8           HG       SER   8   4.691  -1.539   0.766
   65    H    ASP   9           H        ASP   9   5.726  -3.523  -0.989
   66    HA   ASP   9           HA       ASP   9   5.780  -4.530  -3.705
   67   1HB   ASP   9          2HB       ASP   9   8.190  -4.498  -1.923
   68   2HB   ASP   9          1HB       ASP   9   7.958  -5.831  -3.050
   69    H    ARG  10           H        ARG  10   4.938  -6.528  -3.834
   70    HA   ARG  10           HA       ARG  10   4.075  -7.790  -1.359
   71   1HB   ARG  10          2HB       ARG  10   2.774  -9.278  -2.897
   72   2HB   ARG  10          1HB       ARG  10   2.380  -7.569  -3.027
   73   1HG   ARG  10          2HG       ARG  10   4.442  -8.125  -4.891
   74   2HG   ARG  10          1HG       ARG  10   3.197  -9.365  -5.064
   75   1HD   ARG  10          2HD       ARG  10   2.166  -6.639  -4.767
   76   2HD   ARG  10          1HD       ARG  10   3.125  -6.897  -6.220
   77    HE   ARG  10           HE       ARG  10   0.753  -8.496  -5.505
   78   1HH1  ARG  10          1HH1      ARG  10   2.793  -6.948  -7.891
   79   2HH1  ARG  10          2HH1      ARG  10   1.815  -7.446  -9.227
   80   1HH2  ARG  10          1HH2      ARG  10  -0.527  -9.151  -7.289
   81   2HH2  ARG  10          2HH2      ARG  10  -0.059  -8.687  -8.888
   82    HN2  GLY  11           H        GLY  11   6.811  -7.951  -3.145
   83   1HA   GLY  11          2HA       GLY  11   8.446  -9.525  -3.499
   84   2HA   GLY  11          1HA       GLY  11   7.949 -10.113  -1.923
   85    H    ARG  12           H        ARG  12   8.571 -12.224  -2.683
   86    HA   ARG  12           HA       ARG  12   6.892 -13.405  -4.756
   87   1HB   ARG  12          2HB       ARG  12   9.539 -13.794  -3.985
   88   2HB   ARG  12          1HB       ARG  12   8.710 -15.232  -3.406
   89   1HG   ARG  12          2HG       ARG  12   8.195 -14.325  -6.190
   90   2HG   ARG  12          1HG       ARG  12   9.729 -15.117  -5.821
   91   1HD   ARG  12          2HD       ARG  12   8.291 -16.922  -4.696
   92   2HD   ARG  12          1HD       ARG  12   6.943 -16.202  -5.574
   93    HE   ARG  12           HE       ARG  12   8.914 -16.649  -7.447
   94   1HH1  ARG  12          1HH1      ARG  12   7.046 -18.585  -5.226
   95   2HH1  ARG  12          2HH1      ARG  12   7.085 -19.997  -6.228
   96   1HH2  ARG  12          1HH2      ARG  12   8.967 -18.505  -8.766
   97   2HH2  ARG  12          2HH2      ARG  12   8.177 -19.952  -8.237
   98    H    CYS  13           H        CYS  13   7.750 -13.971  -1.357
   99    HA   CYS  13           HA       CYS  13   6.619 -16.015  -0.333
  100   1HB   CYS  13          2HB       CYS  13   5.387 -13.431   0.609
  101   2HB   CYS  13          1HB       CYS  13   5.790 -14.856   1.559
  102    H    LYS  14           H        LYS  14   4.893 -17.288  -0.503
  103    HA   LYS  14           HA       LYS  14   3.002 -17.363  -2.323
  104   1HB   LYS  14          2HB       LYS  14   2.388 -17.927   0.580
  105   2HB   LYS  14          1HB       LYS  14   1.519 -18.574  -0.803
  106   1HG   LYS  14          2HG       LYS  14   4.361 -19.150  -0.006
  107   2HG   LYS  14          1HG       LYS  14   2.990 -20.260   0.025
  108   1HD   LYS  14          2HD       LYS  14   2.925 -19.543  -2.560
  109   2HD   LYS  14          1HD       LYS  14   4.650 -19.345  -2.246
  110   1HE   LYS  14          2HE       LYS  14   4.703 -21.651  -1.344
  111   2HE   LYS  14          1HE       LYS  14   3.007 -21.833  -1.792
  112   1HZ   LYS  14          1HZ       LYS  14   5.049 -21.080  -3.790
  113   2HZ   LYS  14          2HZ       LYS  14   3.519 -21.753  -4.046
  114   3HZ   LYS  14          3HZ       LYS  14   4.761 -22.701  -3.399
  115    H    ALA  15           H        ALA  15   2.687 -15.064  -2.821
  116    HA   ALA  15           HA       ALA  15   1.149 -13.355  -1.197
  117   1HB   ALA  15          1HB       ALA  15   1.226 -11.860  -2.929
  118   2HB   ALA  15          2HB       ALA  15   1.048 -13.111  -4.161
  119   3HB   ALA  15          3HB       ALA  15   2.593 -12.899  -3.336
  120    H    SER  16           H        SER  16  -0.933 -13.348  -0.712
  121    HA   SER  16           HA       SER  16  -2.944 -14.131  -2.610
  122   1HB   SER  16          2HB       SER  16  -3.897 -15.961  -1.368
  123   2HB   SER  16          1HB       SER  16  -2.191 -16.318  -1.632
  124    HG   SER  16           HG       SER  16  -1.877 -15.379   0.529
  125    H    PHE  17           H        PHE  17  -2.134 -11.830  -0.888
  126    HA   PHE  17           HA       PHE  17  -4.767 -11.387   0.338
  127   1HB   PHE  17          2HB       PHE  17  -2.083 -10.788   1.594
  128   2HB   PHE  17          1HB       PHE  17  -3.603 -10.123   2.183
  129    HD1  PHE  17           HD1      PHE  17  -5.483 -11.993   2.553
  130    HD2  PHE  17           HD2      PHE  17  -1.281 -12.655   2.645
  131    HE1  PHE  17           HE1      PHE  17  -5.834 -14.006   3.924
  132    HE2  PHE  17           HE2      PHE  17  -1.623 -14.669   4.014
  133    HZ   PHE  17           HZ       PHE  17  -3.903 -15.348   4.656
  134    H    GLU  18           H        GLU  18  -5.573  -9.940  -1.073
  135    HA   GLU  18           HA       GLU  18  -4.010  -7.972  -2.393
  136   1HB   GLU  18          2HB       GLU  18  -6.184  -7.070  -3.148
  137   2HB   GLU  18          1HB       GLU  18  -6.044  -8.803  -3.408
  138   1HG   GLU  18          2HG       GLU  18  -7.204  -8.771  -0.975
  139   2HG   GLU  18          1HG       GLU  18  -7.863  -7.289  -1.668
  140    H    ARG  19           H        ARG  19  -3.790  -5.796  -2.030
  141    HA   ARG  19           HA       ARG  19  -5.140  -4.537   0.205
  142   1HB   ARG  19          2HB       ARG  19  -2.132  -4.845   0.158
  143   2HB   ARG  19          1HB       ARG  19  -3.021  -3.818   1.274
  144   1HG   ARG  19          2HG       ARG  19  -4.270  -6.035   1.861
  145   2HG   ARG  19          1HG       ARG  19  -2.829  -6.788   1.175
  146   1HD   ARG  19          2HD       ARG  19  -1.586  -6.270   2.959
  147   2HD   ARG  19          1HD       ARG  19  -2.204  -4.618   3.012
  148    HE   ARG  19           HE       ARG  19  -4.265  -6.063   3.985
  149   1HH1  ARG  19          1HH1      ARG  19  -0.870  -5.941   4.790
  150   2HH1  ARG  19          2HH1      ARG  19  -1.123  -6.351   6.453
  151   1HH2  ARG  19          1HH2      ARG  19  -4.597  -6.600   6.174
  152   2HH2  ARG  19          2HH2      ARG  19  -3.237  -6.725   7.238
  153    H    TRP  20           H        TRP  20  -4.215  -2.193   0.450
  154    HA   TRP  20           HA       TRP  20  -3.977  -1.100  -2.273
  155   1HB   TRP  20          2HB       TRP  20  -4.999   0.190   0.267
  156   2HB   TRP  20          1HB       TRP  20  -4.858   1.006  -1.287
  157    HD1  TRP  20           HD1      TRP  20  -6.960  -1.622   0.535
  158    HE1  TRP  20           HE1      TRP  20  -9.133  -1.996  -0.784
  159    HE3  TRP  20           HE3      TRP  20  -5.869   1.144  -3.625
  160    HZ2  TRP  20           HZ2      TRP  20 -10.241  -1.223  -3.254
  161    HZ3  TRP  20           HZ3      TRP  20  -7.543   1.272  -5.423
  162    HH2  TRP  20           HH2      TRP  20  -9.685   0.113  -5.241
  163    H    TYR  21           H        TYR  21  -2.534   0.613  -2.691
  164    HA   TYR  21           HA       TYR  21  -0.554   1.269  -0.644
  165   1HB   TYR  21          2HB       TYR  21   1.244   0.880  -2.497
  166   2HB   TYR  21          1HB       TYR  21   0.654  -0.500  -1.575
  167    HD1  TYR  21           HD2      TYR  21  -1.518  -1.619  -2.656
  168    HD2  TYR  21           HD1      TYR  21   1.399   0.612  -4.795
  169    HE1  TYR  21           HE2      TYR  21  -2.214  -2.711  -4.722
  170    HE2  TYR  21           HE1      TYR  21   0.703  -0.483  -6.888
  171    HH   TYR  21           HH       TYR  21  -1.111  -1.657  -7.835
  172    H    PHE  22           H        PHE  22   0.622   3.192  -1.085
  173    HA   PHE  22           HA       PHE  22  -0.844   5.035  -2.759
  174   1HB   PHE  22          2HB       PHE  22   0.532   5.297  -0.385
  175   2HB   PHE  22          1HB       PHE  22   1.620   6.050  -1.548
  176    HD1  PHE  22           HD1      PHE  22   0.446   7.714  -3.221
  177    HD2  PHE  22           HD2      PHE  22  -1.104   6.584   0.577
  178    HE1  PHE  22           HE1      PHE  22  -0.921   9.759  -3.176
  179    HE2  PHE  22           HE2      PHE  22  -2.474   8.625   0.629
  180    HZ   PHE  22           HZ       PHE  22  -2.385  10.217  -1.249
  181    H    ASN  23           H        ASN  23  -0.409   5.332  -4.824
  182    HA   ASN  23           HA       ASN  23   2.329   4.832  -5.784
  183   1HB   ASN  23          2HB       ASN  23   0.595   3.357  -6.753
  184   2HB   ASN  23          1HB       ASN  23  -0.259   4.775  -7.352
  185   1HD2  ASN  23          1HD2      ASN  23   0.725   6.043  -8.985
  186   2HD2  ASN  23          2HD2      ASN  23   1.908   5.358 -10.041
  187    HN2  GLY  24           H        GLY  24   2.937   6.991  -5.143
  188   1HA   GLY  24          2HA       GLY  24   3.591   9.084  -5.894
  189   2HA   GLY  24          1HA       GLY  24   2.538   8.880  -7.286
  190    H    ARG  25           H        ARG  25   0.269   9.315  -7.028
  191    HA   ARG  25           HA       ARG  25  -0.312  11.092  -4.750
  192   1HB   ARG  25          2HB       ARG  25   0.038  12.164  -7.077
  193   2HB   ARG  25          1HB       ARG  25  -1.534  11.479  -7.467
  194   1HG   ARG  25          2HG       ARG  25  -1.709  13.807  -6.761
  195   2HG   ARG  25          1HG       ARG  25  -2.555  12.726  -5.652
  196   1HD   ARG  25          2HD       ARG  25  -1.305  13.402  -3.941
  197   2HD   ARG  25          1HD       ARG  25   0.181  13.069  -4.828
  198    HE   ARG  25           HE       ARG  25   0.352  15.300  -5.321
  199   1HH1  ARG  25          1HH1      ARG  25  -2.866  14.643  -4.144
  200   2HH1  ARG  25          2HH1      ARG  25  -3.303  16.314  -4.035
  201   1HH2  ARG  25          1HH2      ARG  25  -0.220  17.500  -5.178
  202   2HH2  ARG  25          2HH2      ARG  25  -1.801  17.937  -4.622
  203    H    THR  26           H        THR  26  -1.459   8.594  -6.897
  204    HA   THR  26           HA       THR  26  -4.018   8.533  -5.446
  205    HB   THR  26           HB       THR  26  -4.226   8.796  -7.877
  206    HG1  THR  26           HG1      THR  26  -5.946   7.682  -7.468
  207   1HG2  THR  26          1HG2      THR  26  -2.140   7.562  -8.486
  208   2HG2  THR  26          2HG2      THR  26  -3.565   7.143  -9.438
  209   3HG2  THR  26          3HG2      THR  26  -3.011   6.064  -8.156
  210    H    CYS  27           H        CYS  27  -4.956   6.225  -5.353
  211    HA   CYS  27           HA       CYS  27  -2.968   4.566  -4.024
  212   1HB   CYS  27          2HB       CYS  27  -5.956   4.154  -4.231
  213   2HB   CYS  27          1HB       CYS  27  -4.853   3.317  -3.146
  214    H    ALA  28           H        ALA  28  -3.421   2.101  -4.303
  215    HA   ALA  28           HA       ALA  28  -4.033   1.364  -7.047
  216   1HB   ALA  28          1HB       ALA  28  -1.839   0.112  -7.209
  217   2HB   ALA  28          2HB       ALA  28  -1.301   1.090  -5.843
  218   3HB   ALA  28          3HB       ALA  28  -1.761   1.867  -7.356
  219    H    LYS  29           H        LYS  29  -3.574  -1.159  -7.267
  220    HA   LYS  29           HA       LYS  29  -4.215  -2.528  -4.763
  221   1HB   LYS  29          2HB       LYS  29  -6.071  -2.063  -6.970
  222   2HB   LYS  29          1HB       LYS  29  -5.923  -3.763  -6.546
  223   1HG   LYS  29          2HG       LYS  29  -6.146  -2.373  -4.119
  224   2HG   LYS  29          1HG       LYS  29  -7.344  -1.671  -5.205
  225   1HD   LYS  29          2HD       LYS  29  -8.668  -3.433  -4.912
  226   2HD   LYS  29          1HD       LYS  29  -7.403  -4.504  -5.513
  227   1HE   LYS  29          2HE       LYS  29  -7.056  -5.315  -3.475
  228   2HE   LYS  29          1HE       LYS  29  -6.796  -3.696  -2.829
  229   1HZ   LYS  29          1HZ       LYS  29  -9.559  -4.436  -3.342
  230   2HZ   LYS  29          2HZ       LYS  29  -8.890  -3.577  -2.048
  231   3HZ   LYS  29          3HZ       LYS  29  -8.799  -5.264  -2.078
  232    H    PHE  30           H        PHE  30  -3.438  -4.542  -4.599
  233    HA   PHE  30           HA       PHE  30  -2.781  -6.199  -6.813
  234   1HB   PHE  30          2HB       PHE  30  -0.353  -6.244  -6.551
  235   2HB   PHE  30          1HB       PHE  30  -0.898  -4.634  -6.993
  236    HD1  PHE  30           HD1      PHE  30  -1.773  -4.888  -3.660
  237    HD2  PHE  30           HD2      PHE  30   1.677  -4.580  -6.133
  238    HE1  PHE  30           HE1      PHE  30  -0.510  -3.960  -1.772
  239    HE2  PHE  30           HE2      PHE  30   2.945  -3.646  -4.246
  240    HZ   PHE  30           HZ       PHE  30   1.853  -3.335  -2.063
  241    H    ILE  31           H        ILE  31  -1.341  -8.134  -5.943
  242    HA   ILE  31           HA       ILE  31  -2.635  -8.953  -3.471
  243    HB   ILE  31           HB       ILE  31  -2.518 -10.353  -5.655
  244   1HG1  ILE  31          2HG1      ILE  31  -1.759 -12.115  -3.431
  245   2HG1  ILE  31          1HG1      ILE  31  -3.007 -10.940  -3.033
  246   1HG2  ILE  31          1HG2      ILE  31  -0.009 -10.183  -5.786
  247   2HG2  ILE  31          2HG2      ILE  31  -0.679 -11.805  -5.949
  248   3HG2  ILE  31          3HG2      ILE  31   0.052 -11.301  -4.427
  249   1HD1  ILE  31          1HD1      ILE  31  -4.322 -12.621  -3.779
  250   2HD1  ILE  31          2HD1      ILE  31  -3.091 -13.251  -4.873
  251   3HD1  ILE  31          3HD1      ILE  31  -4.019 -11.820  -5.320
  252    H    TYR  32           H        TYR  32  -1.622  -8.441  -1.662
  253    HA   TYR  32           HA       TYR  32   1.277  -8.247  -1.592
  254   1HB   TYR  32          2HB       TYR  32  -0.053  -6.476  -0.537
  255   2HB   TYR  32          1HB       TYR  32  -0.782  -7.659   0.544
  256    HD1  TYR  32           HD2      TYR  32   2.624  -6.496  -0.481
  257    HD2  TYR  32           HD1      TYR  32   0.096  -7.828   2.671
  258    HE1  TYR  32           HE2      TYR  32   4.450  -6.138   1.126
  259    HE2  TYR  32           HE1      TYR  32   1.915  -7.473   4.287
  260    HH   TYR  32           HH       TYR  32   3.955  -6.229   4.523
  261    HN2  GLY  33           H        GLY  33   2.540  -9.860  -0.996
  262   1HA   GLY  33          2HA       GLY  33   1.365 -12.209   0.265
  263   2HA   GLY  33          1HA       GLY  33   2.992 -12.081  -0.388
  264    HN2  GLY  34           H        GLY  34   3.829  -9.770   1.003
  265   1HA   GLY  34          2HA       GLY  34   3.572  -9.292   3.556
  266   2HA   GLY  34          1HA       GLY  34   4.149 -10.946   3.672
  267    H    CYS  35           H        CYS  35   5.813 -10.287   1.148
  268    HA   CYS  35           HA       CYS  35   8.007  -9.007   2.634
  269   1HB   CYS  35          2HB       CYS  35   9.406 -10.174   0.750
  270   2HB   CYS  35          1HB       CYS  35   8.843 -11.101   2.134
  271    HN2  GLY  36           H        GLY  36   8.397  -6.989   2.067
  272   1HA   GLY  36          2HA       GLY  36   9.342  -5.664   0.167
  273   2HA   GLY  36          1HA       GLY  36   7.945  -6.210  -0.748
  274    HN2  GLY  37           H        GLY  37   6.680  -5.789   2.196
  275   1HA   GLY  37          2HA       GLY  37   5.890  -3.025   1.566
  276   2HA   GLY  37          1HA       GLY  37   4.931  -4.167   2.495
  277    H    ASN  38           H        ASN  38   5.381  -1.607   3.411
  278    HA   ASN  38           HA       ASN  38   6.586  -2.159   5.955
  279   1HB   ASN  38          2HB       ASN  38   8.048   0.031   5.636
  280   2HB   ASN  38          1HB       ASN  38   8.663  -1.553   5.181
  281   1HD2  ASN  38          1HD2      ASN  38  10.003  -0.968   3.568
  282   2HD2  ASN  38          2HD2      ASN  38   9.494  -0.207   2.103
  283    HN2  GLY  39           H        GLY  39   6.197   0.908   4.198
  284   1HA   GLY  39          2HA       GLY  39   4.015   1.586   6.067
  285   2HA   GLY  39          1HA       GLY  39   5.274   2.736   5.644
  286    H    ASN  40           H        ASN  40   4.883   1.196   2.847
  287    HA   ASN  40           HA       ASN  40   3.081   3.240   1.827
  288   1HB   ASN  40          2HB       ASN  40   5.230   2.774   0.681
  289   2HB   ASN  40          1HB       ASN  40   4.670   1.142   0.333
  290   1HD2  ASN  40          1HD2      ASN  40   4.486   4.469  -0.510
  291   2HD2  ASN  40          2HD2      ASN  40   3.495   4.284  -1.913
  292    H    LYS  41           H        LYS  41   3.080  -0.135   2.571
  293    HA   LYS  41           HA       LYS  41   0.775  -0.735   0.931
  294   1HB   LYS  41          2HB       LYS  41   0.901  -2.964   2.050
  295   2HB   LYS  41          1HB       LYS  41   2.377  -2.496   1.218
  296   1HG   LYS  41          2HG       LYS  41   3.580  -2.447   3.110
  297   2HG   LYS  41          1HG       LYS  41   2.266  -1.740   4.051
  298   1HD   LYS  41          2HD       LYS  41   1.962  -4.554   3.151
  299   2HD   LYS  41          1HD       LYS  41   3.113  -4.228   4.448
  300   1HE   LYS  41          2HE       LYS  41   1.095  -2.828   5.412
  301   2HE   LYS  41          1HE       LYS  41   0.151  -3.927   4.407
  302   1HZ   LYS  41          1HZ       LYS  41   0.957  -5.780   5.585
  303   2HZ   LYS  41          2HZ       LYS  41   0.536  -4.646   6.767
  304   3HZ   LYS  41          3HZ       LYS  41   2.161  -4.882   6.362
  305    H    PHE  42           H        PHE  42  -1.306  -1.011   1.613
  306    HA   PHE  42           HA       PHE  42  -1.920  -0.653   4.447
  307   1HB   PHE  42          2HB       PHE  42  -3.425   0.923   2.368
  308   2HB   PHE  42          1HB       PHE  42  -3.434   1.133   4.116
  309    HD1  PHE  42           HD2      PHE  42  -0.949   1.578   5.086
  310    HD2  PHE  42           HD1      PHE  42  -2.315   2.519   1.167
  311    HE1  PHE  42           HE2      PHE  42   0.808   3.289   4.889
  312    HE2  PHE  42           HE1      PHE  42  -0.561   4.233   0.963
  313    HZ   PHE  42           HZ       PHE  42   1.003   4.619   2.826
  314    HA   PRO  43           HA       PRO  43  -4.640  -4.067   3.660
  315   1HB   PRO  43          2HB       PRO  43  -6.327  -2.785   5.753
  316   2HB   PRO  43          1HB       PRO  43  -5.720  -4.442   5.654
  317   1HG   PRO  43          2HG       PRO  43  -4.626  -2.698   7.339
  318   2HG   PRO  43          1HG       PRO  43  -3.622  -3.864   6.456
  319   1HD   PRO  43          2HD       PRO  43  -4.014  -0.944   5.966
  320   2HD   PRO  43          1HD       PRO  43  -2.549  -1.933   5.793
  321    H    THR  44           H        THR  44  -6.452  -1.087   4.469
  322    HA   THR  44           HA       THR  44  -8.167  -1.629   2.134
  323    HB   THR  44           HB       THR  44  -9.877  -0.231   3.410
  324    HG1  THR  44           HG1      THR  44  -8.192  -0.857   5.599
  325   1HG2  THR  44          1HG2      THR  44 -10.804  -2.043   4.448
  326   2HG2  THR  44          2HG2      THR  44  -9.252  -2.652   5.019
  327   3HG2  THR  44          3HG2      THR  44  -9.699  -2.831   3.323
  328    H    GLN  45           H        GLN  45  -8.988   0.183   0.963
  329    HA   GLN  45           HA       GLN  45  -7.053   2.128   0.364
  330   1HB   GLN  45          2HB       GLN  45  -9.117   1.213  -0.999
  331   2HB   GLN  45          1HB       GLN  45  -9.936   2.593  -0.279
  332   1HG   GLN  45          2HG       GLN  45  -7.984   3.980  -1.180
  333   2HG   GLN  45          1HG       GLN  45  -7.613   2.568  -2.168
  334   1HE2  GLN  45          1HE2      GLN  45 -10.216   1.709  -2.692
  335   2HE2  GLN  45          2HE2      GLN  45 -10.980   2.867  -3.722
  336    H    GLU  46           H        GLU  46  -9.672   2.083   2.648
  337    HA   GLU  46           HA       GLU  46 -10.151   4.771   3.070
  338   1HB   GLU  46          2HB       GLU  46 -11.104   2.575   4.210
  339   2HB   GLU  46          1HB       GLU  46  -9.925   2.984   5.448
  340   1HG   GLU  46          2HG       GLU  46 -11.703   4.106   6.276
  341   2HG   GLU  46          1HG       GLU  46 -11.063   5.363   5.218
  342    H    ALA  47           H        ALA  47  -7.516   2.765   4.276
  343    HA   ALA  47           HA       ALA  47  -6.391   4.797   5.942
  344   1HB   ALA  47          1HB       ALA  47  -5.880   2.590   6.568
  345   2HB   ALA  47          2HB       ALA  47  -4.378   3.234   5.904
  346   3HB   ALA  47          3HB       ALA  47  -5.380   2.154   4.935
  347    H    CYS  48           H        CYS  48  -5.922   3.710   2.637
  348    HA   CYS  48           HA       CYS  48  -3.528   4.958   2.003
  349   1HB   CYS  48          2HB       CYS  48  -4.727   3.411   0.499
  350   2HB   CYS  48          1HB       CYS  48  -5.958   4.640   0.226
  351    H    MET  49           H        MET  49  -6.803   6.268   1.467
  352    HA   MET  49           HA       MET  49  -6.002   8.819   0.663
  353   1HB   MET  49          2HB       MET  49  -8.553   8.052   2.090
  354   2HB   MET  49          1HB       MET  49  -8.296   9.516   1.152
  355   1HG   MET  49          2HG       MET  49  -8.657   8.482  -0.791
  356   2HG   MET  49          1HG       MET  49  -7.723   7.063  -0.322
  357   1HE   MET  49          1HE       MET  49 -11.448   8.738   0.172
  358   2HE   MET  49          2HE       MET  49 -12.117   7.392  -0.749
  359   3HE   MET  49          3HE       MET  49 -10.798   8.351  -1.421
  360    H    LYS  50           H        LYS  50  -6.941   7.641   3.882
  361    HA   LYS  50           HA       LYS  50  -6.588  10.111   5.204
  362   1HB   LYS  50          2HB       LYS  50  -7.901   8.203   6.106
  363   2HB   LYS  50          1HB       LYS  50  -6.398   7.331   6.373
  364   1HG   LYS  50          2HG       LYS  50  -5.671   9.018   7.957
  365   2HG   LYS  50          1HG       LYS  50  -7.136   9.954   7.655
  366   1HD   LYS  50          2HD       LYS  50  -7.338   8.665   9.715
  367   2HD   LYS  50          1HD       LYS  50  -8.492   8.099   8.505
  368   1HE   LYS  50          2HE       LYS  50  -7.319   6.135   8.121
  369   2HE   LYS  50          1HE       LYS  50  -5.812   6.795   8.755
  370   1HZ   LYS  50          1HZ       LYS  50  -6.626   6.628  10.960
  371   2HZ   LYS  50          2HZ       LYS  50  -6.938   5.140  10.217
  372   3HZ   LYS  50          3HZ       LYS  50  -8.193   6.254  10.439
  373    H    ARG  51           H        ARG  51  -4.325   7.914   3.944
  374    HA   ARG  51           HA       ARG  51  -2.226   8.324   5.823
  375   1HB   ARG  51          2HB       ARG  51  -2.659   6.613   3.700
  376   2HB   ARG  51          1HB       ARG  51  -1.384   7.666   3.101
  377   1HG   ARG  51          2HG       ARG  51  -1.068   6.552   5.829
  378   2HG   ARG  51          1HG       ARG  51  -0.874   5.453   4.461
  379   1HD   ARG  51          2HD       ARG  51   1.281   6.309   4.944
  380   2HD   ARG  51          1HD       ARG  51   0.729   7.129   3.486
  381    HE   ARG  51           HE       ARG  51   0.491   9.111   4.704
  382   1HH1  ARG  51          1HH1      ARG  51   1.584   6.492   6.745
  383   2HH1  ARG  51          2HH1      ARG  51   2.114   7.542   8.014
  384   1HH2  ARG  51          1HH2      ARG  51   1.187  10.484   6.377
  385   2HH2  ARG  51          2HH2      ARG  51   1.888   9.805   7.808
  386    H    CYS  52           H        CYS  52  -2.494   9.429   2.430
  387    HA   CYS  52           HA       CYS  52  -1.077  11.882   3.250
  388   1HB   CYS  52          2HB       CYS  52  -0.710  10.530   0.578
  389   2HB   CYS  52          1HB       CYS  52   0.216  11.872   1.240
  390    H    ALA  53           H        ALA  53  -3.880  10.640   1.894
  391    HA   ALA  53           HA       ALA  53  -4.354  12.858   0.086
  392   1HB   ALA  53          1HB       ALA  53  -5.148  10.376  -0.150
  393   2HB   ALA  53          2HB       ALA  53  -6.173  11.700  -0.700
  394   3HB   ALA  53          3HB       ALA  53  -6.492  10.926   0.851
  395    H    LYS  54           H        LYS  54  -5.077  11.960   3.356
  396    HA   LYS  54           HA       LYS  54  -6.936  14.226   3.592
  397   1HB   LYS  54          2HB       LYS  54  -7.414  11.726   4.382
  398   2HB   LYS  54          1HB       LYS  54  -6.576  12.288   5.822
  399   1HG   LYS  54          2HG       LYS  54  -8.256  14.298   5.624
  400   2HG   LYS  54          1HG       LYS  54  -9.201  13.125   4.706
  401   1HD   LYS  54          2HD       LYS  54  -9.978  12.445   6.692
  402   2HD   LYS  54          1HD       LYS  54  -8.405  11.675   6.899
  403   1HE   LYS  54          2HE       LYS  54  -8.472  12.898   8.820
  404   2HE   LYS  54          1HE       LYS  54  -7.742  14.092   7.748
  405   1HZ   LYS  54          1HZ       LYS  54  -9.639  14.898   9.150
  406   2HZ   LYS  54          2HZ       LYS  54 -10.663  13.930   8.216
  407   3HZ   LYS  54          3HZ       LYS  54  -9.797  15.190   7.491
  408    H    ALA  55           H        ALA  55  -3.919  12.897   4.726
  409    HA   ALA  55           HA       ALA  55  -3.595  15.068   6.660
  410   1HB   ALA  55          1HB       ALA  55  -2.983  12.997   7.591
  411   2HB   ALA  55          2HB       ALA  55  -1.459  13.800   7.213
  412   3HB   ALA  55          3HB       ALA  55  -2.071  12.528   6.156
  Start of MODEL   17
    1   1H    ILE   1          1H        ILE   1   4.042  12.560   3.224
    2   2H    ILE   1          2H        ILE   1   3.684  14.096   2.547
    3   3H    ILE   1          3H        ILE   1   5.266  13.756   3.119
    4    HA   ILE   1           HA       ILE   1   4.061  12.115   1.035
    5    HB   ILE   1           HB       ILE   1   3.846  14.546   0.408
    6   1HG1  ILE   1          2HG1      ILE   1   4.671  14.234  -1.842
    7   2HG1  ILE   1          1HG1      ILE   1   5.794  12.991  -1.308
    8   1HG2  ILE   1          1HG2      ILE   1   5.815  15.817  -0.136
    9   2HG2  ILE   1          2HG2      ILE   1   6.857  14.469   0.319
   10   3HG2  ILE   1          3HG2      ILE   1   5.905  15.301   1.548
   11   1HD1  ILE   1          1HD1      ILE   1   4.117  11.422  -1.026
   12   2HD1  ILE   1          2HD1      ILE   1   3.617  12.291  -2.477
   13   3HD1  ILE   1          3HD1      ILE   1   2.851  12.647  -0.928
   14    H    ASP   2           H        ASP   2   5.902  11.648   3.257
   15    HA   ASP   2           HA       ASP   2   8.453  11.295   1.846
   16   1HB   ASP   2          2HB       ASP   2   7.906  10.934   4.794
   17   2HB   ASP   2          1HB       ASP   2   9.478  11.023   4.006
   18    H    THR   3           H        THR   3   6.150   9.540   3.900
   19    HA   THR   3           HA       THR   3   7.390   7.002   3.203
   20    HB   THR   3           HB       THR   3   5.053   7.661   5.002
   21    HG1  THR   3           HG1      THR   3   7.234   8.284   5.659
   22   1HG2  THR   3          1HG2      THR   3   6.064   5.093   4.063
   23   2HG2  THR   3          2HG2      THR   3   4.536   5.501   4.844
   24   3HG2  THR   3          3HG2      THR   3   5.981   5.236   5.820
   25    H    CYS   4           H        CYS   4   4.712   8.964   2.273
   26    HA   CYS   4           HA       CYS   4   3.169   6.850   1.096
   27   1HB   CYS   4          2HB       CYS   4   2.914   9.777   0.435
   28   2HB   CYS   4          1HB       CYS   4   1.669   8.533   0.388
   29    H    ARG   5           H        ARG   5   5.945   8.575   0.160
   30    HA   ARG   5           HA       ARG   5   5.429   8.226  -2.694
   31   1HB   ARG   5          2HB       ARG   5   7.454   9.510  -3.050
   32   2HB   ARG   5          1HB       ARG   5   6.410  10.346  -1.910
   33   1HG   ARG   5          2HG       ARG   5   7.773   9.515  -0.058
   34   2HG   ARG   5          1HG       ARG   5   8.830   8.697  -1.209
   35   1HD   ARG   5          2HD       ARG   5   9.554  10.762  -2.135
   36   2HD   ARG   5          1HD       ARG   5   8.310  11.660  -1.267
   37    HE   ARG   5           HE       ARG   5   9.814  10.446   0.679
   38   1HH1  ARG   5          1HH1      ARG   5  10.443  12.666  -1.939
   39   2HH1  ARG   5          2HH1      ARG   5  11.770  13.435  -1.134
   40   1HH2  ARG   5          1HH2      ARG   5  11.559  11.455   1.739
   41   2HH2  ARG   5          2HH2      ARG   5  12.405  12.747   0.954
   42    H    LEU   6           H        LEU   6   6.515   6.274  -0.292
   43    HA   LEU   6           HA       LEU   6   8.755   5.100  -1.703
   44   1HB   LEU   6          2HB       LEU   6   7.435   3.794   0.635
   45   2HB   LEU   6          1HB       LEU   6   9.129   3.810   0.183
   46    HG   LEU   6           HG       LEU   6   7.568   6.037   1.481
   47   1HD1  LEU   6          1HD1      LEU   6   9.775   4.207   2.359
   48   2HD1  LEU   6          2HD1      LEU   6   8.213   4.502   3.122
   49   3HD1  LEU   6          3HD1      LEU   6   9.463   5.745   3.164
   50   1HD2  LEU   6          1HD2      LEU   6  10.104   6.072  -0.036
   51   2HD2  LEU   6          2HD2      LEU   6  10.087   6.944   1.496
   52   3HD2  LEU   6          3HD2      LEU   6   8.924   7.354   0.236
   53    HA   PRO   7           HA       PRO   7   6.255   2.068  -3.769
   54   1HB   PRO   7          2HB       PRO   7   8.179   0.555  -4.814
   55   2HB   PRO   7          1HB       PRO   7   7.991   2.243  -5.307
   56   1HG   PRO   7          2HG       PRO   7   9.969   1.024  -3.431
   57   2HG   PRO   7          1HG       PRO   7  10.204   2.309  -4.626
   58   1HD   PRO   7          2HD       PRO   7   9.792   2.686  -1.891
   59   2HD   PRO   7          1HD       PRO   7   9.597   3.925  -3.145
   60    H    SER   8           H        SER   8   5.093   0.721  -2.480
   61    HA   SER   8           HA       SER   8   6.405  -1.121  -0.670
   62   1HB   SER   8          2HB       SER   8   3.736  -0.015  -0.976
   63   2HB   SER   8          1HB       SER   8   3.684  -1.758  -0.726
   64    HG   SER   8           HG       SER   8   4.850  -1.490   1.169
   65    H    ASP   9           H        ASP   9   6.583  -3.303  -0.903
   66    HA   ASP   9           HA       ASP   9   6.005  -4.364  -3.564
   67   1HB   ASP   9          2HB       ASP   9   8.261  -4.592  -2.223
   68   2HB   ASP   9          1HB       ASP   9   7.425  -5.932  -1.444
   69    H    ARG  10           H        ARG  10   4.852  -6.320  -3.876
   70    HA   ARG  10           HA       ARG  10   2.804  -6.752  -1.862
   71   1HB   ARG  10          2HB       ARG  10   1.761  -8.159  -3.640
   72   2HB   ARG  10          1HB       ARG  10   2.011  -6.485  -4.103
   73   1HG   ARG  10          2HG       ARG  10   3.121  -7.151  -5.893
   74   2HG   ARG  10          1HG       ARG  10   4.326  -7.918  -4.857
   75   1HD   ARG  10          2HD       ARG  10   3.562  -9.636  -6.242
   76   2HD   ARG  10          1HD       ARG  10   2.708  -9.884  -4.722
   77    HE   ARG  10           HE       ARG  10   0.810  -8.678  -5.835
   78   1HH1  ARG  10          1HH1      ARG  10   3.175 -10.472  -7.691
   79   2HH1  ARG  10          2HH1      ARG  10   2.096 -10.775  -9.008
   80   1HH2  ARG  10          1HH2      ARG  10  -0.609  -9.095  -7.598
   81   2HH2  ARG  10          2HH2      ARG  10  -0.037  -9.997  -8.956
   82    HN2  GLY  11           H        GLY  11   5.795  -8.056  -2.561
   83   1HA   GLY  11          2HA       GLY  11   6.860  -9.977  -1.911
   84   2HA   GLY  11          1HA       GLY  11   5.619 -10.084  -0.673
   85    H    ARG  12           H        ARG  12   6.903 -11.493  -3.452
   86    HA   ARG  12           HA       ARG  12   4.570 -12.833  -4.396
   87   1HB   ARG  12          2HB       ARG  12   7.518 -13.321  -4.804
   88   2HB   ARG  12          1HB       ARG  12   6.277 -14.318  -5.551
   89   1HG   ARG  12          2HG       ARG  12   5.351 -12.114  -6.484
   90   2HG   ARG  12          1HG       ARG  12   6.920 -11.438  -6.047
   91   1HD   ARG  12          2HD       ARG  12   7.526 -12.114  -8.102
   92   2HD   ARG  12          1HD       ARG  12   7.673 -13.698  -7.340
   93    HE   ARG  12           HE       ARG  12   5.075 -13.601  -8.112
   94   1HH1  ARG  12          1HH1      ARG  12   8.103 -13.103  -9.773
   95   2HH1  ARG  12          2HH1      ARG  12   7.501 -13.658 -11.299
   96   1HH2  ARG  12          1HH2      ARG  12   4.281 -14.332 -10.118
   97   2HH2  ARG  12          2HH2      ARG  12   5.330 -14.354 -11.496
   98    H    CYS  13           H        CYS  13   6.341 -13.187  -1.590
   99    HA   CYS  13           HA       CYS  13   6.726 -15.834  -1.114
  100   1HB   CYS  13          2HB       CYS  13   5.438 -14.000   0.914
  101   2HB   CYS  13          1HB       CYS  13   6.482 -15.379   1.227
  102    H    LYS  14           H        LYS  14   3.795 -14.415   0.310
  103    HA   LYS  14           HA       LYS  14   2.354 -16.858  -0.474
  104   1HB   LYS  14          2HB       LYS  14   2.380 -15.221   1.989
  105   2HB   LYS  14          1HB       LYS  14   0.801 -15.800   1.479
  106   1HG   LYS  14          2HG       LYS  14   1.760 -17.351   3.041
  107   2HG   LYS  14          1HG       LYS  14   1.686 -18.101   1.445
  108   1HD   LYS  14          2HD       LYS  14   3.832 -18.640   1.846
  109   2HD   LYS  14          1HD       LYS  14   4.157 -16.967   1.387
  110   1HE   LYS  14          2HE       LYS  14   5.183 -16.868   3.385
  111   2HE   LYS  14          1HE       LYS  14   3.546 -16.666   4.008
  112   1HZ   LYS  14          1HZ       LYS  14   5.274 -19.042   4.062
  113   2HZ   LYS  14          2HZ       LYS  14   3.595 -19.249   4.049
  114   3HZ   LYS  14          3HZ       LYS  14   4.328 -18.373   5.297
  115    H    ALA  15           H        ALA  15   2.633 -14.695  -2.272
  116    HA   ALA  15           HA       ALA  15   0.763 -12.737  -2.393
  117   1HB   ALA  15          1HB       ALA  15   2.532 -13.678  -4.151
  118   2HB   ALA  15          2HB       ALA  15   1.237 -12.567  -4.600
  119   3HB   ALA  15          3HB       ALA  15   1.054 -14.297  -4.888
  120    H    SER  16           H        SER  16  -1.230 -13.092  -1.530
  121    HA   SER  16           HA       SER  16  -3.185 -14.338  -3.186
  122   1HB   SER  16          2HB       SER  16  -2.957 -15.619  -0.476
  123   2HB   SER  16          1HB       SER  16  -3.839 -16.181  -1.894
  124    HG   SER  16           HG       SER  16  -1.567 -17.049  -1.202
  125    H    PHE  17           H        PHE  17  -2.506 -11.827  -1.531
  126    HA   PHE  17           HA       PHE  17  -5.237 -11.440  -0.573
  127   1HB   PHE  17          2HB       PHE  17  -2.762 -11.018   1.103
  128   2HB   PHE  17          1HB       PHE  17  -4.306 -10.258   1.477
  129    HD1  PHE  17           HD1      PHE  17  -6.294 -11.733   1.943
  130    HD2  PHE  17           HD2      PHE  17  -2.314 -13.226   1.734
  131    HE1  PHE  17           HE1      PHE  17  -6.990 -13.749   3.170
  132    HE2  PHE  17           HE2      PHE  17  -3.003 -15.244   2.960
  133    HZ   PHE  17           HZ       PHE  17  -5.343 -15.509   3.680
  134    H    GLU  18           H        GLU  18  -5.950  -9.745  -1.683
  135    HA   GLU  18           HA       GLU  18  -4.228  -7.862  -2.924
  136   1HB   GLU  18          2HB       GLU  18  -7.216  -7.848  -2.492
  137   2HB   GLU  18          1HB       GLU  18  -6.361  -6.658  -3.462
  138   1HG   GLU  18          2HG       GLU  18  -5.947  -9.526  -4.095
  139   2HG   GLU  18          1HG       GLU  18  -7.490  -8.791  -4.528
  140    H    ARG  19           H        ARG  19  -3.642  -5.831  -2.367
  141    HA   ARG  19           HA       ARG  19  -4.792  -4.599   0.018
  142   1HB   ARG  19          2HB       ARG  19  -1.968  -5.527  -0.266
  143   2HB   ARG  19          1HB       ARG  19  -2.276  -4.034   0.612
  144   1HG   ARG  19          2HG       ARG  19  -4.095  -5.651   1.768
  145   2HG   ARG  19          1HG       ARG  19  -2.842  -6.823   1.356
  146   1HD   ARG  19          2HD       ARG  19  -1.193  -5.574   2.573
  147   2HD   ARG  19          1HD       ARG  19  -2.328  -4.254   2.845
  148    HE   ARG  19           HE       ARG  19  -3.570  -6.355   3.993
  149   1HH1  ARG  19          1HH1      ARG  19  -0.339  -5.067   4.295
  150   2HH1  ARG  19          2HH1      ARG  19  -0.157  -5.574   5.940
  151   1HH2  ARG  19          1HH2      ARG  19  -3.331  -7.021   6.158
  152   2HH2  ARG  19          2HH2      ARG  19  -1.855  -6.683   6.998
  153    H    TRP  20           H        TRP  20  -3.652  -2.356   0.345
  154    HA   TRP  20           HA       TRP  20  -3.414  -1.110  -2.316
  155   1HB   TRP  20          2HB       TRP  20  -4.600  -0.014   0.237
  156   2HB   TRP  20          1HB       TRP  20  -4.283   0.968  -1.190
  157    HD1  TRP  20           HD1      TRP  20  -6.602  -1.798   0.085
  158    HE1  TRP  20           HE1      TRP  20  -8.641  -1.945  -1.472
  159    HE3  TRP  20           HE3      TRP  20  -5.065   1.428  -3.573
  160    HZ2  TRP  20           HZ2      TRP  20  -9.487  -0.845  -3.920
  161    HZ3  TRP  20           HZ3      TRP  20  -6.553   1.824  -5.492
  162    HH2  TRP  20           HH2      TRP  20  -8.719   0.709  -5.662
  163    H    TYR  21           H        TYR  21  -1.927   0.557  -2.609
  164    HA   TYR  21           HA       TYR  21  -0.032   1.133  -0.458
  165   1HB   TYR  21          2HB       TYR  21   1.828   0.772  -2.267
  166   2HB   TYR  21          1HB       TYR  21   1.198  -0.618  -1.387
  167    HD1  TYR  21           HD1      TYR  21  -0.919  -1.735  -2.538
  168    HD2  TYR  21           HD2      TYR  21   2.010   0.581  -4.571
  169    HE1  TYR  21           HE1      TYR  21  -1.574  -2.777  -4.648
  170    HE2  TYR  21           HE2      TYR  21   1.359  -0.464  -6.702
  171    HH   TYR  21           HH       TYR  21  -0.344  -1.656  -7.725
  172    H    PHE  22           H        PHE  22   0.772   3.181  -0.556
  173    HA   PHE  22           HA       PHE  22  -0.451   5.002  -2.380
  174   1HB   PHE  22          2HB       PHE  22   0.643   5.231   0.125
  175   2HB   PHE  22          1HB       PHE  22   1.857   6.016  -0.879
  176    HD1  PHE  22           HD1      PHE  22   1.240   7.972  -2.258
  177    HD2  PHE  22           HD2      PHE  22  -1.462   6.232   0.530
  178    HE1  PHE  22           HE1      PHE  22  -0.136  10.009  -2.327
  179    HE2  PHE  22           HE2      PHE  22  -2.842   8.265   0.468
  180    HZ   PHE  22           HZ       PHE  22  -2.182  10.158  -0.964
  181    H    ASN  23           H        ASN  23   0.155   5.126  -4.434
  182    HA   ASN  23           HA       ASN  23   3.019   4.922  -5.079
  183   1HB   ASN  23          2HB       ASN  23   1.374   3.282  -6.128
  184   2HB   ASN  23          1HB       ASN  23   0.737   4.651  -7.034
  185   1HD2  ASN  23          1HD2      ASN  23   2.356   5.894  -8.297
  186   2HD2  ASN  23          2HD2      ASN  23   3.612   5.004  -9.084
  187    HN2  GLY  24           H        GLY  24   3.326   7.152  -4.465
  188   1HA   GLY  24          2HA       GLY  24   3.892   9.248  -5.332
  189   2HA   GLY  24          1HA       GLY  24   2.852   8.932  -6.711
  190    H    ARG  25           H        ARG  25   0.587   9.269  -6.498
  191    HA   ARG  25           HA       ARG  25  -0.207  10.868  -4.163
  192   1HB   ARG  25          2HB       ARG  25  -1.515  12.328  -5.739
  193   2HB   ARG  25          1HB       ARG  25   0.232  12.490  -5.847
  194   1HG   ARG  25          2HG       ARG  25  -1.217  10.629  -7.681
  195   2HG   ARG  25          1HG       ARG  25  -1.180  12.362  -8.011
  196   1HD   ARG  25          2HD       ARG  25   1.433  11.266  -7.326
  197   2HD   ARG  25          1HD       ARG  25   0.729  10.531  -8.766
  198    HE   ARG  25           HE       ARG  25   1.777  13.172  -8.528
  199   1HH1  ARG  25          1HH1      ARG  25  -0.641  11.260 -10.164
  200   2HH1  ARG  25          2HH1      ARG  25  -0.715  12.307 -11.542
  201   1HH2  ARG  25          1HH2      ARG  25   1.681  14.549 -10.339
  202   2HH2  ARG  25          2HH2      ARG  25   0.604  14.173 -11.642
  203    H    THR  26           H        THR  26  -0.812   8.142  -5.888
  204    HA   THR  26           HA       THR  26  -3.635   8.147  -5.070
  205    HB   THR  26           HB       THR  26  -2.578   6.897  -7.612
  206    HG1  THR  26           HG1      THR  26  -2.709   9.257  -7.562
  207   1HG2  THR  26          1HG2      THR  26  -5.332   7.106  -6.450
  208   2HG2  THR  26          2HG2      THR  26  -4.472   5.667  -6.999
  209   3HG2  THR  26          3HG2      THR  26  -5.046   6.852  -8.173
  210    H    CYS  27           H        CYS  27  -4.530   5.934  -4.817
  211    HA   CYS  27           HA       CYS  27  -2.509   4.207  -3.595
  212   1HB   CYS  27          2HB       CYS  27  -5.524   4.205  -3.344
  213   2HB   CYS  27          1HB       CYS  27  -4.447   3.090  -2.511
  214    H    ALA  28           H        ALA  28  -1.775   2.537  -4.677
  215    HA   ALA  28           HA       ALA  28  -3.203   1.535  -7.000
  216   1HB   ALA  28          1HB       ALA  28  -1.034   0.107  -7.149
  217   2HB   ALA  28          2HB       ALA  28  -0.419   1.273  -5.977
  218   3HB   ALA  28          3HB       ALA  28  -0.996   1.823  -7.549
  219    H    LYS  29           H        LYS  29  -2.855  -1.014  -7.292
  220    HA   LYS  29           HA       LYS  29  -3.490  -2.397  -4.795
  221   1HB   LYS  29          2HB       LYS  29  -5.622  -1.612  -5.851
  222   2HB   LYS  29          1HB       LYS  29  -5.246  -2.625  -7.240
  223   1HG   LYS  29          2HG       LYS  29  -5.802  -4.530  -6.175
  224   2HG   LYS  29          1HG       LYS  29  -5.199  -3.964  -4.615
  225   1HD   LYS  29          2HD       LYS  29  -7.217  -3.221  -3.988
  226   2HD   LYS  29          1HD       LYS  29  -7.519  -2.469  -5.555
  227   1HE   LYS  29          2HE       LYS  29  -8.720  -4.212  -6.289
  228   2HE   LYS  29          1HE       LYS  29  -7.592  -5.390  -5.618
  229   1HZ   LYS  29          1HZ       LYS  29 -10.054  -5.007  -4.688
  230   2HZ   LYS  29          2HZ       LYS  29  -9.203  -3.947  -3.683
  231   3HZ   LYS  29          3HZ       LYS  29  -8.780  -5.583  -3.736
  232    H    PHE  30           H        PHE  30  -2.884  -4.498  -4.715
  233    HA   PHE  30           HA       PHE  30  -2.262  -6.032  -7.055
  234   1HB   PHE  30          2HB       PHE  30   0.143  -6.396  -6.413
  235   2HB   PHE  30          1HB       PHE  30  -0.218  -4.803  -7.058
  236    HD1  PHE  30           HD1      PHE  30  -1.344  -5.252  -3.672
  237    HD2  PHE  30           HD2      PHE  30   2.039  -4.274  -6.062
  238    HE1  PHE  30           HE1      PHE  30  -0.266  -4.233  -1.718
  239    HE2  PHE  30           HE2      PHE  30   3.121  -3.247  -4.108
  240    HZ   PHE  30           HZ       PHE  30   1.970  -3.226  -1.932
  241    H    ILE  31           H        ILE  31  -1.046  -8.158  -6.266
  242    HA   ILE  31           HA       ILE  31  -2.662  -9.142  -4.049
  243    HB   ILE  31           HB       ILE  31  -0.892 -10.586  -6.028
  244   1HG1  ILE  31          2HG1      ILE  31  -3.476 -11.593  -6.149
  245   2HG1  ILE  31          1HG1      ILE  31  -3.717  -9.864  -5.911
  246   1HG2  ILE  31          1HG2      ILE  31  -0.756 -11.762  -3.924
  247   2HG2  ILE  31          2HG2      ILE  31  -1.779 -12.674  -5.036
  248   3HG2  ILE  31          3HG2      ILE  31  -2.511 -11.717  -3.748
  249   1HD1  ILE  31          1HD1      ILE  31  -2.653  -9.322  -7.895
  250   2HD1  ILE  31          2HD1      ILE  31  -3.578 -10.769  -8.297
  251   3HD1  ILE  31          3HD1      ILE  31  -1.843 -10.886  -8.000
  252    H    TYR  32           H        TYR  32  -1.793  -8.552  -2.160
  253    HA   TYR  32           HA       TYR  32   1.072  -8.675  -1.742
  254   1HB   TYR  32          2HB       TYR  32  -0.096  -6.761  -0.837
  255   2HB   TYR  32          1HB       TYR  32  -1.206  -7.803   0.044
  256    HD1  TYR  32           HD1      TYR  32   2.524  -7.744  -0.254
  257    HD2  TYR  32           HD2      TYR  32  -0.864  -7.560   2.310
  258    HE1  TYR  32           HE1      TYR  32   4.015  -7.667   1.698
  259    HE2  TYR  32           HE2      TYR  32   0.617  -7.482   4.271
  260    HH   TYR  32           HH       TYR  32   3.192  -8.364   4.668
  261    HN2  GLY  33           H        GLY  33   1.953 -10.554  -1.291
  262   1HA   GLY  33          2HA       GLY  33   0.455 -12.706  -0.091
  263   2HA   GLY  33          1HA       GLY  33   2.147 -12.746  -0.567
  264    HN2  GLY  34           H        GLY  34   2.686 -10.265   1.008
  265   1HA   GLY  34          2HA       GLY  34   2.241  -9.985   3.538
  266   2HA   GLY  34          1HA       GLY  34   2.899 -11.611   3.614
  267    H    CYS  35           H        CYS  35   4.622 -10.358   1.182
  268    HA   CYS  35           HA       CYS  35   6.698  -9.357   3.015
  269   1HB   CYS  35          2HB       CYS  35   7.079 -10.644   0.304
  270   2HB   CYS  35          1HB       CYS  35   8.354 -10.143   1.408
  271    HN2  GLY  36           H        GLY  36   6.221  -7.179   2.980
  272   1HA   GLY  36          2HA       GLY  36   6.189  -5.860   0.352
  273   2HA   GLY  36          1HA       GLY  36   5.596  -5.157   1.848
  274    HN2  GLY  37           H        GLY  37   7.555  -5.276   3.595
  275   1HA   GLY  37          2HA       GLY  37   9.689  -4.584   4.163
  276   2HA   GLY  37          1HA       GLY  37  10.125  -4.647   2.464
  277    H    ASN  38           H        ASN  38   7.342  -2.804   3.427
  278    HA   ASN  38           HA       ASN  38   8.880  -0.326   3.478
  279   1HB   ASN  38          2HB       ASN  38   7.901  -1.075   1.097
  280   2HB   ASN  38          1HB       ASN  38   6.466  -0.290   1.748
  281   1HD2  ASN  38          1HD2      ASN  38   9.417   0.147   0.212
  282   2HD2  ASN  38          2HD2      ASN  38   9.505   1.870   0.316
  283    HN2  GLY  39           H        GLY  39   7.176   1.575   3.723
  284   1HA   GLY  39          2HA       GLY  39   5.300   0.700   5.830
  285   2HA   GLY  39          1HA       GLY  39   6.158   2.233   5.854
  286    H    ASN  40           H        ASN  40   5.297   1.747   2.712
  287    HA   ASN  40           HA       ASN  40   3.044   3.573   2.991
  288   1HB   ASN  40          2HB       ASN  40   3.353   4.138   0.736
  289   2HB   ASN  40          1HB       ASN  40   4.985   3.877   1.339
  290   1HD2  ASN  40          1HD2      ASN  40   2.705   3.050  -0.990
  291   2HD2  ASN  40          2HD2      ASN  40   3.565   1.748  -1.732
  292    H    LYS  41           H        LYS  41   3.348   0.305   3.010
  293    HA   LYS  41           HA       LYS  41   1.258  -0.441   1.208
  294   1HB   LYS  41          2HB       LYS  41   1.385  -2.639   2.375
  295   2HB   LYS  41          1HB       LYS  41   2.937  -2.071   1.776
  296   1HG   LYS  41          2HG       LYS  41   3.688  -1.518   3.932
  297   2HG   LYS  41          1HG       LYS  41   2.064  -1.633   4.612
  298   1HD   LYS  41          2HD       LYS  41   2.110  -3.918   4.692
  299   2HD   LYS  41          1HD       LYS  41   3.206  -4.052   3.315
  300   1HE   LYS  41          2HE       LYS  41   4.547  -4.682   5.096
  301   2HE   LYS  41          1HE       LYS  41   4.946  -2.976   4.895
  302   1HZ   LYS  41          1HZ       LYS  41   4.298  -4.056   7.228
  303   2HZ   LYS  41          2HZ       LYS  41   2.759  -3.573   6.716
  304   3HZ   LYS  41          3HZ       LYS  41   4.001  -2.434   6.851
  305    H    PHE  42           H        PHE  42  -0.787  -1.411   1.866
  306    HA   PHE  42           HA       PHE  42  -1.823  -0.900   4.492
  307   1HB   PHE  42          2HB       PHE  42  -2.601   0.857   2.179
  308   2HB   PHE  42          1HB       PHE  42  -3.720   0.560   3.507
  309    HD1  PHE  42           HD1      PHE  42  -2.528   0.836   5.912
  310    HD2  PHE  42           HD2      PHE  42  -1.363   2.773   2.307
  311    HE1  PHE  42           HE1      PHE  42  -1.445   2.616   7.222
  312    HE2  PHE  42           HE2      PHE  42  -0.278   4.556   3.610
  313    HZ   PHE  42           HZ       PHE  42  -0.317   4.478   6.071
  314    HA   PRO  43           HA       PRO  43  -4.448  -4.206   3.222
  315   1HB   PRO  43          2HB       PRO  43  -6.459  -3.998   5.010
  316   2HB   PRO  43          1HB       PRO  43  -4.836  -4.527   5.468
  317   1HG   PRO  43          2HG       PRO  43  -6.107  -1.835   5.771
  318   2HG   PRO  43          1HG       PRO  43  -5.093  -2.730   6.917
  319   1HD   PRO  43          2HD       PRO  43  -4.153  -0.713   5.339
  320   2HD   PRO  43          1HD       PRO  43  -3.145  -2.058   5.908
  321    H    THR  44           H        THR  44  -6.263  -1.205   3.910
  322    HA   THR  44           HA       THR  44  -7.922  -1.791   1.545
  323    HB   THR  44           HB       THR  44  -9.668  -0.353   2.777
  324    HG1  THR  44           HG1      THR  44  -7.972  -1.060   4.936
  325   1HG2  THR  44          1HG2      THR  44  -9.911  -2.467   4.500
  326   2HG2  THR  44          2HG2      THR  44  -9.001  -3.154   3.154
  327   3HG2  THR  44          3HG2      THR  44 -10.561  -2.384   2.862
  328    H    GLN  45           H        GLN  45  -9.003   0.251   0.683
  329    HA   GLN  45           HA       GLN  45  -6.942   2.131   0.045
  330   1HB   GLN  45          2HB       GLN  45  -8.747   3.240  -1.293
  331   2HB   GLN  45          1HB       GLN  45  -8.493   1.544  -1.684
  332   1HG   GLN  45          2HG       GLN  45 -10.467   0.886  -0.606
  333   2HG   GLN  45          1HG       GLN  45 -10.617   2.426   0.239
  334   1HE2  GLN  45          1HE2      GLN  45  -9.893   1.861  -3.163
  335   2HE2  GLN  45          2HE2      GLN  45 -11.306   2.640  -3.781
  336    H    GLU  46           H        GLU  46  -9.649   2.046   2.234
  337    HA   GLU  46           HA       GLU  46  -9.868   4.819   2.719
  338   1HB   GLU  46          2HB       GLU  46 -11.337   2.681   3.438
  339   2HB   GLU  46          1HB       GLU  46 -10.460   2.947   4.939
  340   1HG   GLU  46          2HG       GLU  46 -11.247   5.452   4.463
  341   2HG   GLU  46          1HG       GLU  46 -12.542   4.585   3.639
  342    H    ALA  47           H        ALA  47  -7.595   2.442   3.761
  343    HA   ALA  47           HA       ALA  47  -6.691   3.878   6.079
  344   1HB   ALA  47          1HB       ALA  47  -5.644   1.492   4.586
  345   2HB   ALA  47          2HB       ALA  47  -6.393   1.550   6.181
  346   3HB   ALA  47          3HB       ALA  47  -4.775   2.210   5.942
  347    H    CYS  48           H        CYS  48  -5.296   3.237   2.853
  348    HA   CYS  48           HA       CYS  48  -2.991   4.777   3.170
  349   1HB   CYS  48          2HB       CYS  48  -2.828   4.776   0.738
  350   2HB   CYS  48          1HB       CYS  48  -3.327   3.190   1.314
  351    H    MET  49           H        MET  49  -6.239   5.703   2.173
  352    HA   MET  49           HA       MET  49  -5.528   8.373   1.447
  353   1HB   MET  49          2HB       MET  49  -8.114   6.925   1.903
  354   2HB   MET  49          1HB       MET  49  -8.104   8.674   1.726
  355   1HG   MET  49          2HG       MET  49  -6.687   8.100  -0.421
  356   2HG   MET  49          1HG       MET  49  -7.526   6.558  -0.272
  357   1HE   MET  49          1HE       MET  49  -9.028  10.273  -2.185
  358   2HE   MET  49          2HE       MET  49  -7.398   9.642  -1.954
  359   3HE   MET  49          3HE       MET  49  -8.183  10.550  -0.662
  360    H    LYS  50           H        LYS  50  -6.480   6.790   4.404
  361    HA   LYS  50           HA       LYS  50  -6.896   9.317   5.783
  362   1HB   LYS  50          2HB       LYS  50  -8.379   7.421   6.267
  363   2HB   LYS  50          1HB       LYS  50  -7.000   6.479   6.815
  364   1HG   LYS  50          2HG       LYS  50  -6.826   8.757   8.339
  365   2HG   LYS  50          1HG       LYS  50  -8.565   8.492   8.214
  366   1HD   LYS  50          2HD       LYS  50  -6.673   6.276   8.945
  367   2HD   LYS  50          1HD       LYS  50  -7.330   7.376  10.159
  368   1HE   LYS  50          2HE       LYS  50  -9.561   6.637   8.741
  369   2HE   LYS  50          1HE       LYS  50  -8.600   5.159   8.747
  370   1HZ   LYS  50          1HZ       LYS  50  -9.699   4.919  10.702
  371   2HZ   LYS  50          2HZ       LYS  50  -9.838   6.582  10.981
  372   3HZ   LYS  50          3HZ       LYS  50  -8.369   5.795  11.275
  373    H    ARG  51           H        ARG  51  -4.381   6.991   5.314
  374    HA   ARG  51           HA       ARG  51  -2.876   7.995   7.601
  375   1HB   ARG  51          2HB       ARG  51  -3.096   5.486   6.534
  376   2HB   ARG  51          1HB       ARG  51  -1.573   6.034   5.848
  377   1HG   ARG  51          2HG       ARG  51  -2.283   5.897   8.770
  378   2HG   ARG  51          1HG       ARG  51  -1.159   4.851   7.900
  379   1HD   ARG  51          2HD       ARG  51  -0.846   7.831   8.239
  380   2HD   ARG  51          1HD       ARG  51  -0.025   6.614   9.213
  381    HE   ARG  51           HE       ARG  51   0.506   7.281   6.423
  382   1HH1  ARG  51          1HH1      ARG  51   1.202   5.234   9.171
  383   2HH1  ARG  51          2HH1      ARG  51   2.706   4.672   8.525
  384   1HH2  ARG  51          1HH2      ARG  51   2.483   6.535   5.578
  385   2HH2  ARG  51          2HH2      ARG  51   3.433   5.410   6.490
  386    H    CYS  52           H        CYS  52  -3.285   8.865   4.418
  387    HA   CYS  52           HA       CYS  52  -0.683  10.218   4.425
  388   1HB   CYS  52          2HB       CYS  52  -1.783   8.440   2.290
  389   2HB   CYS  52          1HB       CYS  52  -0.754   9.794   1.840
  390    H    ALA  53           H        ALA  53  -3.959  10.064   3.090
  391    HA   ALA  53           HA       ALA  53  -3.737  12.738   1.993
  392   1HB   ALA  53          1HB       ALA  53  -6.392  11.475   2.116
  393   2HB   ALA  53          2HB       ALA  53  -5.168  10.587   1.210
  394   3HB   ALA  53          3HB       ALA  53  -5.560  12.247   0.767
  395    H    LYS  54           H        LYS  54  -5.322  11.117   4.698
  396    HA   LYS  54           HA       LYS  54  -6.716  13.481   5.537
  397   1HB   LYS  54          2HB       LYS  54  -7.579  11.204   5.987
  398   2HB   LYS  54          1HB       LYS  54  -6.214  10.919   7.058
  399   1HG   LYS  54          2HG       LYS  54  -7.809  13.320   7.644
  400   2HG   LYS  54          1HG       LYS  54  -8.625  11.774   7.885
  401   1HD   LYS  54          2HD       LYS  54  -7.414  11.300   9.708
  402   2HD   LYS  54          1HD       LYS  54  -5.908  11.808   8.943
  403   1HE   LYS  54          2HE       LYS  54  -5.995  13.862   9.851
  404   2HE   LYS  54          1HE       LYS  54  -7.735  14.002   9.608
  405   1HZ   LYS  54          1HZ       LYS  54  -6.263  13.104  11.927
  406   2HZ   LYS  54          2HZ       LYS  54  -7.606  12.152  11.540
  407   3HZ   LYS  54          3HZ       LYS  54  -7.797  13.808  11.825
  408    H    ALA  55           H        ALA  55  -3.655  11.973   6.238
  409    HA   ALA  55           HA       ALA  55  -3.160  13.851   8.433
  410   1HB   ALA  55          1HB       ALA  55  -0.999  12.437   8.602
  411   2HB   ALA  55          2HB       ALA  55  -1.857  11.303   7.561
  412   3HB   ALA  55          3HB       ALA  55  -2.527  11.735   9.134
  Start of MODEL   18
    1   1H    ILE   1          1H        ILE   1   5.349  12.331   4.242
    2   2H    ILE   1          2H        ILE   1   7.060  12.195   4.255
    3   3H    ILE   1          3H        ILE   1   6.091  10.833   3.866
    4    HA   ILE   1           HA       ILE   1   5.216  12.169   1.981
    5    HB   ILE   1           HB       ILE   1   6.037  14.340   2.782
    6   1HG1  ILE   1          2HG1      ILE   1   5.704  13.727   0.300
    7   2HG1  ILE   1          1HG1      ILE   1   6.574  15.209   0.675
    8   1HG2  ILE   1          1HG2      ILE   1   8.061  14.397   3.699
    9   2HG2  ILE   1          2HG2      ILE   1   8.689  14.472   2.053
   10   3HG2  ILE   1          3HG2      ILE   1   8.566  12.920   2.881
   11   1HD1  ILE   1          1HD1      ILE   1   8.289  14.516  -0.531
   12   2HD1  ILE   1          2HD1      ILE   1   7.396  13.050  -0.936
   13   3HD1  ILE   1          3HD1      ILE   1   8.451  13.078   0.476
   14    H    ASP   2           H        ASP   2   8.223  10.944   3.224
   15    HA   ASP   2           HA       ASP   2   9.208  10.170   0.613
   16   1HB   ASP   2          2HB       ASP   2  10.237  10.020   3.411
   17   2HB   ASP   2          1HB       ASP   2  10.908   8.917   2.213
   18    H    THR   3           H        THR   3   7.370   8.783   3.202
   19    HA   THR   3           HA       THR   3   7.779   6.057   2.324
   20    HB   THR   3           HB       THR   3   5.822   7.148   4.352
   21    HG1  THR   3           HG1      THR   3   7.953   7.582   4.965
   22   1HG2  THR   3          1HG2      THR   3   6.846   4.472   4.775
   23   2HG2  THR   3          2HG2      THR   3   5.906   4.615   3.290
   24   3HG2  THR   3          3HG2      THR   3   5.191   5.078   4.835
   25    H    CYS   4           H        CYS   4   5.290   8.535   2.115
   26    HA   CYS   4           HA       CYS   4   3.326   6.841   0.929
   27   1HB   CYS   4          2HB       CYS   4   3.618   9.759   1.436
   28   2HB   CYS   4          1HB       CYS   4   2.462   9.260   0.205
   29    H    ARG   5           H        ARG   5   6.205   8.027  -0.282
   30    HA   ARG   5           HA       ARG   5   5.172   8.005  -3.037
   31   1HB   ARG   5          2HB       ARG   5   7.060   9.392  -3.667
   32   2HB   ARG   5          1HB       ARG   5   6.169  10.151  -2.355
   33   1HG   ARG   5          2HG       ARG   5   8.162  10.417  -1.397
   34   2HG   ARG   5          1HG       ARG   5   8.050   8.700  -1.006
   35   1HD   ARG   5          2HD       ARG   5   9.007   8.614  -3.551
   36   2HD   ARG   5          1HD       ARG   5   9.754  10.094  -2.950
   37    HE   ARG   5           HE       ARG   5  10.216   8.273  -0.981
   38   1HH1  ARG   5          1HH1      ARG   5  10.846   8.361  -4.412
   39   2HH1  ARG   5          2HH1      ARG   5  12.262   7.371  -4.304
   40   1HH2  ARG   5          1HH2      ARG   5  12.079   6.970  -0.837
   41   2HH2  ARG   5          2HH2      ARG   5  12.963   6.582  -2.274
   42    H    LEU   6           H        LEU   6   7.107   6.305  -0.809
   43    HA   LEU   6           HA       LEU   6   8.884   5.164  -2.771
   44   1HB   LEU   6          2HB       LEU   6   9.856   3.932  -1.017
   45   2HB   LEU   6          1HB       LEU   6   9.464   5.498  -0.337
   46    HG   LEU   6           HG       LEU   6   7.318   4.348   0.537
   47   1HD1  LEU   6          1HD1      LEU   6   8.273   1.836   1.028
   48   2HD1  LEU   6          2HD1      LEU   6   8.774   2.103  -0.642
   49   3HD1  LEU   6          3HD1      LEU   6   7.074   2.246  -0.199
   50   1HD2  LEU   6          1HD2      LEU   6   9.719   3.240   1.881
   51   2HD2  LEU   6          2HD2      LEU   6   8.341   4.109   2.556
   52   3HD2  LEU   6          3HD2      LEU   6   9.607   4.991   1.705
   53    HA   PRO   7           HA       PRO   7   6.134   1.913  -3.991
   54   1HB   PRO   7          2HB       PRO   7   7.834   0.396  -5.398
   55   2HB   PRO   7          1HB       PRO   7   7.359   2.007  -5.954
   56   1HG   PRO   7          2HG       PRO   7   9.868   1.142  -4.575
   57   2HG   PRO   7          1HG       PRO   7   9.667   2.265  -5.931
   58   1HD   PRO   7          2HD       PRO   7  10.000   3.038  -3.309
   59   2HD   PRO   7          1HD       PRO   7   9.210   4.029  -4.552
   60    H    SER   8           H        SER   8   5.362   0.290  -2.807
   61    HA   SER   8           HA       SER   8   7.147  -1.191  -1.040
   62   1HB   SER   8          2HB       SER   8   4.350  -0.422  -0.999
   63   2HB   SER   8          1HB       SER   8   4.538  -2.146  -0.683
   64    HG   SER   8           HG       SER   8   6.125  -0.226   0.644
   65    H    ASP   9           H        ASP   9   7.333  -3.445  -1.043
   66    HA   ASP   9           HA       ASP   9   6.869  -4.665  -3.644
   67   1HB   ASP   9          2HB       ASP   9   8.668  -5.163  -1.357
   68   2HB   ASP   9          1HB       ASP   9   8.095  -6.607  -2.188
   69    H    ARG  10           H        ARG  10   5.772  -6.633  -3.944
   70    HA   ARG  10           HA       ARG  10   3.569  -7.017  -2.086
   71   1HB   ARG  10          2HB       ARG  10   4.126  -8.123  -4.836
   72   2HB   ARG  10          1HB       ARG  10   2.713  -8.547  -3.884
   73   1HG   ARG  10          2HG       ARG  10   1.703  -6.548  -4.229
   74   2HG   ARG  10          1HG       ARG  10   3.231  -5.667  -4.315
   75   1HD   ARG  10          2HD       ARG  10   2.146  -5.702  -6.491
   76   2HD   ARG  10          1HD       ARG  10   3.649  -6.619  -6.531
   77    HE   ARG  10           HE       ARG  10   1.650  -8.443  -5.978
   78   1HH1  ARG  10          1HH1      ARG  10   2.434  -6.221  -8.555
   79   2HH1  ARG  10          2HH1      ARG  10   1.725  -7.203  -9.791
   80   1HH2  ARG  10          1HH2      ARG  10   0.725  -9.744  -7.613
   81   2HH2  ARG  10          2HH2      ARG  10   0.753  -9.202  -9.257
   82    HN2  GLY  11           H        GLY  11   6.547  -8.545  -2.896
   83   1HA   GLY  11          2HA       GLY  11   7.537 -10.464  -2.120
   84   2HA   GLY  11          1HA       GLY  11   6.384 -10.389  -0.797
   85    H    ARG  12           H        ARG  12   7.385 -12.130  -3.481
   86    HA   ARG  12           HA       ARG  12   4.875 -13.324  -4.174
   87   1HB   ARG  12          2HB       ARG  12   7.730 -14.078  -4.796
   88   2HB   ARG  12          1HB       ARG  12   6.344 -14.975  -5.399
   89   1HG   ARG  12          2HG       ARG  12   5.755 -12.373  -6.081
   90   2HG   ARG  12          1HG       ARG  12   7.499 -12.478  -6.327
   91   1HD   ARG  12          2HD       ARG  12   7.306 -14.062  -7.978
   92   2HD   ARG  12          1HD       ARG  12   5.773 -14.675  -7.358
   93    HE   ARG  12           HE       ARG  12   5.150 -12.179  -8.195
   94   1HH1  ARG  12          1HH1      ARG  12   6.740 -14.884  -9.722
   95   2HH1  ARG  12          2HH1      ARG  12   6.194 -14.468 -11.313
   96   1HH2  ARG  12          1HH2      ARG  12   4.432 -11.630 -10.285
   97   2HH2  ARG  12          2HH2      ARG  12   4.884 -12.621 -11.633
   98    H    CYS  13           H        CYS  13   6.731 -13.607  -1.455
   99    HA   CYS  13           HA       CYS  13   6.996 -16.280  -0.886
  100   1HB   CYS  13          2HB       CYS  13   6.049 -14.241   1.132
  101   2HB   CYS  13          1HB       CYS  13   6.994 -15.693   1.436
  102    H    LYS  14           H        LYS  14   4.290 -14.422   0.500
  103    HA   LYS  14           HA       LYS  14   2.613 -16.819   0.175
  104   1HB   LYS  14          2HB       LYS  14   2.789 -14.729   2.294
  105   2HB   LYS  14          1HB       LYS  14   1.220 -15.459   1.981
  106   1HG   LYS  14          2HG       LYS  14   1.939 -16.904   3.558
  107   2HG   LYS  14          1HG       LYS  14   2.678 -17.684   2.157
  108   1HD   LYS  14          2HD       LYS  14   4.780 -17.096   2.771
  109   2HD   LYS  14          1HD       LYS  14   4.262 -15.555   3.459
  110   1HE   LYS  14          2HE       LYS  14   3.121 -17.183   5.226
  111   2HE   LYS  14          1HE       LYS  14   4.431 -18.242   4.708
  112   1HZ   LYS  14          1HZ       LYS  14   5.009 -15.458   5.468
  113   2HZ   LYS  14          2HZ       LYS  14   6.024 -16.810   5.513
  114   3HZ   LYS  14          3HZ       LYS  14   4.803 -16.631   6.670
  115    H    ALA  15           H        ALA  15   2.967 -15.019  -1.975
  116    HA   ALA  15           HA       ALA  15   1.160 -12.973  -2.283
  117   1HB   ALA  15          1HB       ALA  15   1.076 -13.827  -4.745
  118   2HB   ALA  15          2HB       ALA  15   2.322 -14.946  -4.192
  119   3HB   ALA  15          3HB       ALA  15   2.583 -13.205  -4.071
  120    H    SER  16           H        SER  16  -0.810 -13.272  -1.313
  121    HA   SER  16           HA       SER  16  -2.827 -14.531  -2.854
  122   1HB   SER  16          2HB       SER  16  -1.737 -16.000  -0.499
  123   2HB   SER  16          1HB       SER  16  -3.482 -16.031  -0.753
  124    HG   SER  16           HG       SER  16  -2.244 -17.743  -1.808
  125    H    PHE  17           H        PHE  17  -2.249 -11.962  -1.622
  126    HA   PHE  17           HA       PHE  17  -4.831 -11.529  -0.403
  127   1HB   PHE  17          2HB       PHE  17  -2.278 -11.057   1.141
  128   2HB   PHE  17          1HB       PHE  17  -3.826 -10.344   1.582
  129    HD1  PHE  17           HD1      PHE  17  -5.683 -11.790   2.322
  130    HD2  PHE  17           HD2      PHE  17  -1.781 -13.328   1.608
  131    HE1  PHE  17           HE1      PHE  17  -6.252 -13.814   3.600
  132    HE2  PHE  17           HE2      PHE  17  -2.342 -15.356   2.884
  133    HZ   PHE  17           HZ       PHE  17  -4.580 -15.601   3.882
  134    H    GLU  18           H        GLU  18  -5.611  -9.757  -1.314
  135    HA   GLU  18           HA       GLU  18  -3.930  -7.938  -2.751
  136   1HB   GLU  18          2HB       GLU  18  -6.069  -6.720  -3.181
  137   2HB   GLU  18          1HB       GLU  18  -6.106  -8.415  -3.646
  138   1HG   GLU  18          2HG       GLU  18  -7.006  -8.360  -1.008
  139   2HG   GLU  18          1HG       GLU  18  -7.772  -6.981  -1.792
  140    H    ARG  19           H        ARG  19  -3.464  -5.799  -2.295
  141    HA   ARG  19           HA       ARG  19  -4.391  -4.641   0.205
  142   1HB   ARG  19          2HB       ARG  19  -1.523  -5.346  -0.362
  143   2HB   ARG  19          1HB       ARG  19  -1.939  -4.038   0.737
  144   1HG   ARG  19          2HG       ARG  19  -3.500  -6.013   1.712
  145   2HG   ARG  19          1HG       ARG  19  -2.136  -6.947   1.094
  146   1HD   ARG  19          2HD       ARG  19  -0.670  -6.056   2.593
  147   2HD   ARG  19          1HD       ARG  19  -1.526  -4.517   2.680
  148    HE   ARG  19           HE       ARG  19  -3.245  -6.215   3.871
  149   1HH1  ARG  19          1HH1      ARG  19   0.159  -5.599   4.337
  150   2HH1  ARG  19          2HH1      ARG  19   0.128  -6.001   6.022
  151   1HH2  ARG  19          1HH2      ARG  19  -3.287  -6.742   6.085
  152   2HH2  ARG  19          2HH2      ARG  19  -1.828  -6.649   7.014
  153    H    TRP  20           H        TRP  20  -3.720  -2.357   0.432
  154    HA   TRP  20           HA       TRP  20  -3.570  -1.089  -2.214
  155   1HB   TRP  20          2HB       TRP  20  -4.623  -0.082   0.433
  156   2HB   TRP  20          1HB       TRP  20  -4.452   0.934  -0.992
  157    HD1  TRP  20           HD1      TRP  20  -6.620  -1.831   0.469
  158    HE1  TRP  20           HE1      TRP  20  -8.728  -2.092  -0.976
  159    HE3  TRP  20           HE3      TRP  20  -5.324   1.229  -3.417
  160    HZ2  TRP  20           HZ2      TRP  20  -9.713  -1.133  -3.433
  161    HZ3  TRP  20           HZ3      TRP  20  -6.911   1.502  -5.278
  162    HH2  TRP  20           HH2      TRP  20  -9.061   0.344  -5.285
  163    H    TYR  21           H        TYR  21  -2.133   0.592  -2.624
  164    HA   TYR  21           HA       TYR  21  -0.138   1.222  -0.572
  165   1HB   TYR  21          2HB       TYR  21   1.594   1.010  -2.536
  166   2HB   TYR  21          1HB       TYR  21   1.111  -0.425  -1.635
  167    HD1  TYR  21           HD2      TYR  21  -1.053  -1.615  -2.636
  168    HD2  TYR  21           HD1      TYR  21   1.617   0.845  -4.848
  169    HE1  TYR  21           HE2      TYR  21  -1.811  -2.668  -4.706
  170    HE2  TYR  21           HE1      TYR  21   0.856  -0.206  -6.940
  171    HH   TYR  21           HH       TYR  21  -0.231  -2.285  -7.682
  172    H    PHE  22           H        PHE  22   1.027   3.177  -0.967
  173    HA   PHE  22           HA       PHE  22  -0.529   5.081  -2.519
  174   1HB   PHE  22          2HB       PHE  22   0.834   5.226  -0.097
  175   2HB   PHE  22          1HB       PHE  22   1.830   6.165  -1.204
  176    HD1  PHE  22           HD2      PHE  22   0.399   7.792  -2.772
  177    HD2  PHE  22           HD1      PHE  22  -0.803   6.342   1.045
  178    HE1  PHE  22           HE2      PHE  22  -1.137   9.699  -2.535
  179    HE2  PHE  22           HE1      PHE  22  -2.341   8.245   1.287
  180    HZ   PHE  22           HZ       PHE  22  -2.510   9.927  -0.503
  181    H    ASN  23           H        ASN  23  -0.027   5.591  -4.536
  182    HA   ASN  23           HA       ASN  23   2.788   5.373  -5.379
  183   1HB   ASN  23          2HB       ASN  23   1.923   4.844  -7.659
  184   2HB   ASN  23          1HB       ASN  23   1.531   3.619  -6.457
  185   1HD2  ASN  23          1HD2      ASN  23   0.338   5.383  -8.953
  186   2HD2  ASN  23          2HD2      ASN  23  -1.350   5.278  -8.602
  187    HN2  GLY  24           H        GLY  24   3.257   7.532  -5.011
  188   1HA   GLY  24          2HA       GLY  24   3.621   9.654  -5.875
  189   2HA   GLY  24          1HA       GLY  24   2.411   9.327  -7.107
  190    H    ARG  25           H        ARG  25   0.191   9.606  -6.583
  191    HA   ARG  25           HA       ARG  25  -0.299  11.235  -4.183
  192   1HB   ARG  25          2HB       ARG  25  -1.953  12.527  -5.657
  193   2HB   ARG  25          1HB       ARG  25  -0.240  12.865  -5.861
  194   1HG   ARG  25          2HG       ARG  25  -1.148  10.741  -7.613
  195   2HG   ARG  25          1HG       ARG  25  -2.047  12.240  -7.853
  196   1HD   ARG  25          2HD       ARG  25   0.936  12.297  -7.666
  197   2HD   ARG  25          1HD       ARG  25   0.159  11.818  -9.175
  198    HE   ARG  25           HE       ARG  25  -1.083  14.135  -8.567
  199   1HH1  ARG  25          1HH1      ARG  25   2.282  13.241  -8.792
  200   2HH1  ARG  25          2HH1      ARG  25   2.800  14.820  -9.274
  201   1HH2  ARG  25          1HH2      ARG  25  -0.404  16.215  -9.202
  202   2HH2  ARG  25          2HH2      ARG  25   1.275  16.510  -9.507
  203    H    THR  26           H        THR  26  -1.402   8.786  -6.370
  204    HA   THR  26           HA       THR  26  -3.919   8.568  -4.854
  205    HB   THR  26           HB       THR  26  -4.408   8.934  -7.165
  206    HG1  THR  26           HG1      THR  26  -5.542   7.073  -7.619
  207   1HG2  THR  26          1HG2      THR  26  -2.605   6.622  -7.839
  208   2HG2  THR  26          2HG2      THR  26  -2.245   8.323  -8.135
  209   3HG2  THR  26          3HG2      THR  26  -3.594   7.549  -8.968
  210    H    CYS  27           H        CYS  27  -4.758   6.201  -4.911
  211    HA   CYS  27           HA       CYS  27  -2.608   4.558  -3.813
  212   1HB   CYS  27          2HB       CYS  27  -5.164   5.059  -2.925
  213   2HB   CYS  27          1HB       CYS  27  -5.323   3.470  -3.669
  214    H    ALA  28           H        ALA  28  -3.039   2.100  -4.151
  215    HA   ALA  28           HA       ALA  28  -3.909   1.456  -6.848
  216   1HB   ALA  28          1HB       ALA  28  -1.661   0.222  -7.176
  217   2HB   ALA  28          2HB       ALA  28  -1.061   1.346  -5.955
  218   3HB   ALA  28          3HB       ALA  28  -1.740   1.959  -7.462
  219    H    LYS  29           H        LYS  29  -3.388  -1.047  -7.214
  220    HA   LYS  29           HA       LYS  29  -3.769  -2.519  -4.715
  221   1HB   LYS  29          2HB       LYS  29  -5.688  -3.747  -5.631
  222   2HB   LYS  29          1HB       LYS  29  -6.024  -2.029  -5.480
  223   1HG   LYS  29          2HG       LYS  29  -6.259  -1.743  -7.697
  224   2HG   LYS  29          1HG       LYS  29  -4.975  -2.887  -8.090
  225   1HD   LYS  29          2HD       LYS  29  -6.409  -4.603  -8.305
  226   2HD   LYS  29          1HD       LYS  29  -7.343  -4.120  -6.887
  227   1HE   LYS  29          2HE       LYS  29  -8.161  -2.192  -8.451
  228   2HE   LYS  29          1HE       LYS  29  -7.641  -3.280  -9.738
  229   1HZ   LYS  29          1HZ       LYS  29  -9.311  -4.425  -7.641
  230   2HZ   LYS  29          2HZ       LYS  29  -9.299  -4.733  -9.304
  231   3HZ   LYS  29          3HZ       LYS  29 -10.066  -3.348  -8.706
  232    H    PHE  30           H        PHE  30  -2.890  -4.508  -4.689
  233    HA   PHE  30           HA       PHE  30  -2.201  -5.892  -7.128
  234   1HB   PHE  30          2HB       PHE  30   0.224  -6.082  -6.459
  235   2HB   PHE  30          1HB       PHE  30  -0.273  -4.501  -7.045
  236    HD1  PHE  30           HD2      PHE  30  -1.401  -5.192  -3.702
  237    HD2  PHE  30           HD1      PHE  30   1.915  -3.808  -5.983
  238    HE1  PHE  30           HE2      PHE  30  -0.454  -4.158  -1.688
  239    HE2  PHE  30           HE1      PHE  30   2.867  -2.771  -3.968
  240    HZ   PHE  30           HZ       PHE  30   1.683  -2.945  -1.817
  241    H    ILE  31           H        ILE  31  -0.812  -7.945  -6.477
  242    HA   ILE  31           HA       ILE  31  -2.323  -9.222  -4.338
  243    HB   ILE  31           HB       ILE  31  -0.316 -10.431  -6.239
  244   1HG1  ILE  31          2HG1      ILE  31  -2.261  -9.469  -7.416
  245   2HG1  ILE  31          1HG1      ILE  31  -2.232 -11.227  -7.522
  246   1HG2  ILE  31          1HG2      ILE  31  -1.248 -11.483  -3.905
  247   2HG2  ILE  31          2HG2      ILE  31  -0.675 -12.426  -5.280
  248   3HG2  ILE  31          3HG2      ILE  31  -2.401 -12.125  -5.076
  249   1HD1  ILE  31          1HD1      ILE  31  -3.933 -11.392  -5.822
  250   2HD1  ILE  31          2HD1      ILE  31  -4.479 -10.331  -7.120
  251   3HD1  ILE  31          3HD1      ILE  31  -3.915  -9.643  -5.597
  252    H    TYR  32           H        TYR  32  -1.456  -8.508  -2.437
  253    HA   TYR  32           HA       TYR  32   1.419  -8.553  -2.034
  254   1HB   TYR  32          2HB       TYR  32   0.125  -6.671  -1.159
  255   2HB   TYR  32          1HB       TYR  32  -0.840  -7.770  -0.181
  256    HD1  TYR  32           HD1      TYR  32   2.516  -6.297  -0.603
  257    HD2  TYR  32           HD2      TYR  32  -0.043  -8.577   1.915
  258    HE1  TYR  32           HE1      TYR  32   4.122  -6.049   1.242
  259    HE2  TYR  32           HE2      TYR  32   1.555  -8.335   3.768
  260    HH   TYR  32           HH       TYR  32   3.886  -7.863   4.142
  261    HN2  GLY  33           H        GLY  33   2.445 -10.287  -1.361
  262   1HA   GLY  33          2HA       GLY  33   0.966 -12.500  -0.186
  263   2HA   GLY  33          1HA       GLY  33   2.643 -12.528  -0.709
  264    HN2  GLY  34           H        GLY  34   3.609 -10.315   0.749
  265   1HA   GLY  34          2HA       GLY  34   3.142  -9.861   3.307
  266   2HA   GLY  34          1HA       GLY  34   3.655 -11.534   3.408
  267    H    CYS  35           H        CYS  35   5.469 -10.550   0.944
  268    HA   CYS  35           HA       CYS  35   7.631  -9.656   2.730
  269   1HB   CYS  35          2HB       CYS  35   7.808 -11.136   0.097
  270   2HB   CYS  35          1HB       CYS  35   9.188 -10.586   1.038
  271    HN2  GLY  36           H        GLY  36   7.663  -7.490   2.641
  272   1HA   GLY  36          2HA       GLY  36   8.833  -5.792   1.186
  273   2HA   GLY  36          1HA       GLY  36   7.648  -6.237  -0.032
  274    HN2  GLY  37           H        GLY  37   7.200  -5.693   3.447
  275   1HA   GLY  37          2HA       GLY  37   5.427  -3.435   2.745
  276   2HA   GLY  37          1HA       GLY  37   4.995  -4.620   3.968
  277    H    ASN  38           H        ASN  38   6.196  -1.589   3.506
  278    HA   ASN  38           HA       ASN  38   7.532  -1.614   6.131
  279   1HB   ASN  38          2HB       ASN  38   8.612   0.589   5.059
  280   2HB   ASN  38          1HB       ASN  38   9.333  -1.004   4.868
  281   1HD2  ASN  38          1HD2      ASN  38  10.302  -0.651   2.933
  282   2HD2  ASN  38          2HD2      ASN  38   9.440  -0.360   1.464
  283    HN2  GLY  39           H        GLY  39   6.620   1.150   4.105
  284   1HA   GLY  39          2HA       GLY  39   4.563   1.846   6.098
  285   2HA   GLY  39          1HA       GLY  39   5.789   3.020   5.648
  286    H    ASN  40           H        ASN  40   5.166   1.297   2.906
  287    HA   ASN  40           HA       ASN  40   3.345   3.376   1.946
  288   1HB   ASN  40          2HB       ASN  40   5.472   3.003   0.724
  289   2HB   ASN  40          1HB       ASN  40   4.953   1.357   0.367
  290   1HD2  ASN  40          1HD2      ASN  40   3.570   4.624   0.189
  291   2HD2  ASN  40          2HD2      ASN  40   2.948   4.455  -1.413
  292    H    LYS  41           H        LYS  41   3.583  -0.069   2.443
  293    HA   LYS  41           HA       LYS  41   1.312  -0.794   0.891
  294   1HB   LYS  41          2HB       LYS  41   1.488  -2.958   1.963
  295   2HB   LYS  41          1HB       LYS  41   3.092  -2.389   1.519
  296   1HG   LYS  41          2HG       LYS  41   3.767  -2.677   3.603
  297   2HG   LYS  41          1HG       LYS  41   2.574  -1.500   4.155
  298   1HD   LYS  41          2HD       LYS  41   0.923  -3.215   4.440
  299   2HD   LYS  41          1HD       LYS  41   1.970  -4.416   3.681
  300   1HE   LYS  41          2HE       LYS  41   2.095  -4.778   6.022
  301   2HE   LYS  41          1HE       LYS  41   3.609  -4.010   5.543
  302   1HZ   LYS  41          1HZ       LYS  41   2.572  -3.104   7.604
  303   2HZ   LYS  41          2HZ       LYS  41   1.304  -2.512   6.655
  304   3HZ   LYS  41          3HZ       LYS  41   2.877  -1.945   6.409
  305    H    PHE  42           H        PHE  42  -0.714  -1.614   1.713
  306    HA   PHE  42           HA       PHE  42  -1.536  -0.937   4.388
  307   1HB   PHE  42          2HB       PHE  42  -2.694   0.560   2.026
  308   2HB   PHE  42          1HB       PHE  42  -3.372   0.576   3.650
  309    HD1  PHE  42           HD2      PHE  42  -2.022   1.549   5.522
  310    HD2  PHE  42           HD1      PHE  42  -0.911   1.969   1.435
  311    HE1  PHE  42           HE2      PHE  42  -0.554   3.431   6.118
  312    HE2  PHE  42           HE1      PHE  42   0.560   3.851   2.024
  313    HZ   PHE  42           HZ       PHE  42   0.739   4.585   4.368
  314    HA   PRO  43           HA       PRO  43  -4.236  -4.314   3.480
  315   1HB   PRO  43          2HB       PRO  43  -6.032  -4.073   5.479
  316   2HB   PRO  43          1HB       PRO  43  -4.364  -4.582   5.765
  317   1HG   PRO  43          2HG       PRO  43  -5.612  -1.890   6.144
  318   2HG   PRO  43          1HG       PRO  43  -4.472  -2.753   7.191
  319   1HD   PRO  43          2HD       PRO  43  -3.724  -0.771   5.471
  320   2HD   PRO  43          1HD       PRO  43  -2.651  -2.099   5.957
  321    H    THR  44           H        THR  44  -5.959  -1.289   4.287
  322    HA   THR  44           HA       THR  44  -7.838  -1.904   2.103
  323    HB   THR  44           HB       THR  44  -9.385  -0.376   3.668
  324    HG1  THR  44           HG1      THR  44  -7.709  -0.284   5.281
  325   1HG2  THR  44          1HG2      THR  44 -10.646  -2.192   3.884
  326   2HG2  THR  44          2HG2      THR  44  -9.383  -3.077   4.739
  327   3HG2  THR  44          3HG2      THR  44  -9.385  -3.025   2.976
  328    H    GLN  45           H        GLN  45  -8.955   0.030   1.236
  329    HA   GLN  45           HA       GLN  45  -7.051   2.036   0.557
  330   1HB   GLN  45          2HB       GLN  45  -8.842   3.009  -0.781
  331   2HB   GLN  45          1HB       GLN  45  -8.770   1.269  -1.023
  332   1HG   GLN  45          2HG       GLN  45 -11.030   1.648  -0.838
  333   2HG   GLN  45          1HG       GLN  45 -10.594   1.179   0.805
  334   1HE2  GLN  45          1HE2      GLN  45 -10.497   4.180  -1.096
  335   2HE2  GLN  45          2HE2      GLN  45 -11.301   5.153   0.084
  336    H    GLU  46           H        GLU  46  -9.630   1.796   2.889
  337    HA   GLU  46           HA       GLU  46 -10.118   4.482   3.420
  338   1HB   GLU  46          2HB       GLU  46 -10.782   1.995   4.588
  339   2HB   GLU  46          1HB       GLU  46 -10.115   2.988   5.877
  340   1HG   GLU  46          2HG       GLU  46 -11.718   4.757   5.331
  341   2HG   GLU  46          1HG       GLU  46 -12.397   3.738   4.063
  342    H    ALA  47           H        ALA  47  -7.588   2.350   4.672
  343    HA   ALA  47           HA       ALA  47  -6.484   4.316   6.432
  344   1HB   ALA  47          1HB       ALA  47  -4.740   2.126   5.513
  345   2HB   ALA  47          2HB       ALA  47  -6.250   1.635   6.279
  346   3HB   ALA  47          3HB       ALA  47  -5.118   2.670   7.148
  347    H    CYS  48           H        CYS  48  -6.067   3.470   3.090
  348    HA   CYS  48           HA       CYS  48  -3.542   4.492   2.554
  349   1HB   CYS  48          2HB       CYS  48  -4.935   3.216   0.944
  350   2HB   CYS  48          1HB       CYS  48  -5.975   4.623   0.760
  351    H    MET  49           H        MET  49  -6.674   6.182   2.282
  352    HA   MET  49           HA       MET  49  -5.340   8.726   1.949
  353   1HB   MET  49          2HB       MET  49  -8.239   7.910   2.062
  354   2HB   MET  49          1HB       MET  49  -7.737   9.593   1.971
  355   1HG   MET  49          2HG       MET  49  -6.322   8.432  -0.071
  356   2HG   MET  49          1HG       MET  49  -7.850   7.555  -0.103
  357   1HE   MET  49          1HE       MET  49 -10.435   9.230  -0.538
  358   2HE   MET  49          2HE       MET  49 -10.162  10.832   0.147
  359   3HE   MET  49          3HE       MET  49  -9.728   9.394   1.070
  360    H    LYS  50           H        LYS  50  -6.876   6.927   4.503
  361    HA   LYS  50           HA       LYS  50  -7.263   9.120   6.275
  362   1HB   LYS  50          2HB       LYS  50  -8.490   6.974   6.452
  363   2HB   LYS  50          1HB       LYS  50  -6.995   6.182   6.928
  364   1HG   LYS  50          2HG       LYS  50  -7.652   6.586   9.016
  365   2HG   LYS  50          1HG       LYS  50  -7.146   8.248   8.713
  366   1HD   LYS  50          2HD       LYS  50  -9.714   8.078   7.643
  367   2HD   LYS  50          1HD       LYS  50  -9.796   7.175   9.157
  368   1HE   LYS  50          2HE       LYS  50  -8.880   9.082  10.360
  369   2HE   LYS  50          1HE       LYS  50  -8.731   9.982   8.851
  370   1HZ   LYS  50          1HZ       LYS  50 -11.251   9.545   8.675
  371   2HZ   LYS  50          2HZ       LYS  50 -10.704  10.758   9.719
  372   3HZ   LYS  50          3HZ       LYS  50 -11.166   9.253  10.339
  373    H    ARG  51           H        ARG  51  -4.469   7.478   5.273
  374    HA   ARG  51           HA       ARG  51  -3.039   8.161   7.738
  375   1HB   ARG  51          2HB       ARG  51  -2.520   6.244   5.504
  376   2HB   ARG  51          1HB       ARG  51  -1.162   6.852   6.440
  377   1HG   ARG  51          2HG       ARG  51  -3.427   5.866   8.029
  378   2HG   ARG  51          1HG       ARG  51  -2.588   4.647   7.067
  379   1HD   ARG  51          2HD       ARG  51  -1.438   4.633   9.092
  380   2HD   ARG  51          1HD       ARG  51  -0.436   5.646   8.053
  381    HE   ARG  51           HE       ARG  51  -2.175   7.346   9.372
  382   1HH1  ARG  51          1HH1      ARG  51   0.357   5.105  10.230
  383   2HH1  ARG  51          2HH1      ARG  51   0.813   5.971  11.658
  384   1HH2  ARG  51          1HH2      ARG  51  -1.577   8.489  11.249
  385   2HH2  ARG  51          2HH2      ARG  51  -0.284   7.893  12.237
  386    H    CYS  52           H        CYS  52  -3.001   8.744   4.245
  387    HA   CYS  52           HA       CYS  52  -0.909  10.770   4.675
  388   1HB   CYS  52          2HB       CYS  52  -1.001   8.735   2.825
  389   2HB   CYS  52          1HB       CYS  52  -1.554  10.123   1.894
  390    H    ALA  53           H        ALA  53  -4.149  10.264   3.446
  391    HA   ALA  53           HA       ALA  53  -4.339  12.968   2.417
  392   1HB   ALA  53          1HB       ALA  53  -6.797  11.369   2.702
  393   2HB   ALA  53          2HB       ALA  53  -5.548  10.687   1.660
  394   3HB   ALA  53          3HB       ALA  53  -6.194  12.294   1.327
  395    H    LYS  54           H        LYS  54  -5.126  11.233   5.319
  396    HA   LYS  54           HA       LYS  54  -6.700  13.500   6.308
  397   1HB   LYS  54          2HB       LYS  54  -6.411  10.650   7.233
  398   2HB   LYS  54          1HB       LYS  54  -7.134  11.883   8.256
  399   1HG   LYS  54          2HG       LYS  54  -8.131  11.334   5.480
  400   2HG   LYS  54          1HG       LYS  54  -8.707  10.437   6.887
  401   1HD   LYS  54          2HD       LYS  54  -9.743  12.287   7.807
  402   2HD   LYS  54          1HD       LYS  54  -8.714  13.424   6.933
  403   1HE   LYS  54          2HE       LYS  54 -10.047  13.433   5.120
  404   2HE   LYS  54          1HE       LYS  54 -10.374  11.703   5.229
  405   1HZ   LYS  54          1HZ       LYS  54 -11.709  12.597   7.350
  406   2HZ   LYS  54          2HZ       LYS  54 -12.404  12.429   5.817
  407   3HZ   LYS  54          3HZ       LYS  54 -11.854  13.942   6.334
  408    H    ALA  55           H        ALA  55  -4.216  11.274   7.585
  409    HA   ALA  55           HA       ALA  55  -3.462  12.879   9.750
  410   1HB   ALA  55          1HB       ALA  55  -1.354  11.210   8.539
  411   2HB   ALA  55          2HB       ALA  55  -2.848  10.379   8.970
  412   3HB   ALA  55          3HB       ALA  55  -1.947  11.267  10.199
  Start of MODEL   19
    1   1H    ILE   1          1H        ILE   1   3.278  13.304   2.277
    2   2H    ILE   1          2H        ILE   1   4.799  13.535   3.037
    3   3H    ILE   1          3H        ILE   1   4.118  11.963   2.934
    4    HA   ILE   1           HA       ILE   1   4.181  12.250   0.478
    5    HB   ILE   1           HB       ILE   1   4.547  14.674   0.475
    6   1HG1  ILE   1          2HG1      ILE   1   6.326  14.736  -1.212
    7   2HG1  ILE   1          1HG1      ILE   1   6.885  13.148  -0.698
    8   1HG2  ILE   1          1HG2      ILE   1   5.903  15.462   2.067
    9   2HG2  ILE   1          2HG2      ILE   1   7.209  15.091   0.942
   10   3HG2  ILE   1          3HG2      ILE   1   6.781  13.939   2.206
   11   1HD1  ILE   1          1HD1      ILE   1   4.161  13.703  -1.842
   12   2HD1  ILE   1          2HD1      ILE   1   4.861  12.127  -1.473
   13   3HD1  ILE   1          3HD1      ILE   1   5.541  13.114  -2.768
   14    H    ASP   2           H        ASP   2   6.207  12.109   3.270
   15    HA   ASP   2           HA       ASP   2   8.566  11.074   2.224
   16   1HB   ASP   2          2HB       ASP   2   7.329  11.295   4.817
   17   2HB   ASP   2          1HB       ASP   2   8.099   9.719   4.659
   18    H    THR   3           H        THR   3   6.349   8.961   4.009
   19    HA   THR   3           HA       THR   3   7.186   6.579   2.901
   20    HB   THR   3           HB       THR   3   4.350   7.136   3.769
   21    HG1  THR   3           HG1      THR   3   6.551   6.447   5.414
   22   1HG2  THR   3          1HG2      THR   3   4.140   4.957   3.371
   23   2HG2  THR   3          2HG2      THR   3   5.101   4.744   4.836
   24   3HG2  THR   3          3HG2      THR   3   5.882   4.712   3.255
   25    H    CYS   4           H        CYS   4   5.062   8.967   1.555
   26    HA   CYS   4           HA       CYS   4   3.785   7.330  -0.370
   27   1HB   CYS   4          2HB       CYS   4   3.753  10.076   0.402
   28   2HB   CYS   4          1HB       CYS   4   3.981  10.002  -1.341
   29    H    ARG   5           H        ARG   5   6.999   8.331  -0.151
   30    HA   ARG   5           HA       ARG   5   7.407   8.418  -3.033
   31   1HB   ARG   5          2HB       ARG   5   9.596   9.199  -2.592
   32   2HB   ARG   5          1HB       ARG   5   8.554  10.009  -1.431
   33   1HG   ARG   5          2HG       ARG   5   9.306   7.819  -0.017
   34   2HG   ARG   5          1HG       ARG   5  10.739   8.104  -1.004
   35   1HD   ARG   5          2HD       ARG   5  11.068  10.241  -0.121
   36   2HD   ARG   5          1HD       ARG   5   9.417  10.342   0.488
   37    HE   ARG   5           HE       ARG   5  10.094   9.274   2.396
   38   1HH1  ARG   5          1HH1      ARG   5  12.537   8.846  -0.060
   39   2HH1  ARG   5          2HH1      ARG   5  13.676   8.121   1.023
   40   1HH2  ARG   5          1HH2      ARG   5  11.592   8.320   3.822
   41   2HH2  ARG   5          2HH2      ARG   5  13.139   7.820   3.226
   42    H    LEU   6           H        LEU   6   7.943   6.272  -0.317
   43    HA   LEU   6           HA       LEU   6   9.525   4.461  -1.965
   44   1HB   LEU   6          2HB       LEU   6   9.456   3.064   0.208
   45   2HB   LEU   6          1HB       LEU   6  10.441   4.512   0.150
   46    HG   LEU   6           HG       LEU   6   7.672   4.810   1.186
   47   1HD1  LEU   6          1HD1      LEU   6   8.492   2.707   2.210
   48   2HD1  LEU   6          2HD1      LEU   6   8.239   4.008   3.374
   49   3HD1  LEU   6          3HD1      LEU   6   9.872   3.599   2.849
   50   1HD2  LEU   6          1HD2      LEU   6   8.614   6.803   1.531
   51   2HD2  LEU   6          2HD2      LEU   6  10.243   6.176   1.294
   52   3HD2  LEU   6          3HD2      LEU   6   9.466   6.038   2.871
   53    HA   PRO   7           HA       PRO   7   5.698   2.334  -2.994
   54   1HB   PRO   7          2HB       PRO   7   6.755   0.629  -4.796
   55   2HB   PRO   7          1HB       PRO   7   6.476   2.335  -5.166
   56   1HG   PRO   7          2HG       PRO   7   9.016   0.959  -4.379
   57   2HG   PRO   7          1HG       PRO   7   8.750   2.180  -5.637
   58   1HD   PRO   7          2HD       PRO   7   9.769   2.768  -3.181
   59   2HD   PRO   7          1HD       PRO   7   8.814   3.919  -4.136
   60    H    SER   8           H        SER   8   4.817   0.260  -2.626
   61    HA   SER   8           HA       SER   8   6.413  -1.382  -0.791
   62   1HB   SER   8          2HB       SER   8   3.492  -0.847  -1.100
   63   2HB   SER   8          1HB       SER   8   3.988  -2.404  -0.439
   64    HG   SER   8           HG       SER   8   5.074  -1.328   1.202
   65    H    ASP   9           H        ASP   9   6.852  -3.493  -1.175
   66    HA   ASP   9           HA       ASP   9   6.303  -4.477  -3.860
   67   1HB   ASP   9          2HB       ASP   9   8.313  -5.008  -1.777
   68   2HB   ASP   9          1HB       ASP   9   7.775  -6.442  -2.647
   69    H    ARG  10           H        ARG  10   5.355  -6.515  -4.281
   70    HA   ARG  10           HA       ARG  10   3.281  -7.201  -2.382
   71   1HB   ARG  10          2HB       ARG  10   3.866  -8.091  -5.199
   72   2HB   ARG  10          1HB       ARG  10   2.545  -8.745  -4.244
   73   1HG   ARG  10          2HG       ARG  10   1.327  -6.811  -4.348
   74   2HG   ARG  10          1HG       ARG  10   2.755  -5.795  -4.550
   75   1HD   ARG  10          2HD       ARG  10   1.565  -5.816  -6.623
   76   2HD   ARG  10          1HD       ARG  10   3.036  -6.766  -6.827
   77    HE   ARG  10           HE       ARG  10   1.206  -8.632  -6.158
   78   1HH1  ARG  10          1HH1      ARG  10   1.246  -6.108  -8.571
   79   2HH1  ARG  10          2HH1      ARG  10   0.265  -6.990  -9.693
   80   1HH2  ARG  10          1HH2      ARG  10  -0.077  -9.798  -7.643
   81   2HH2  ARG  10          2HH2      ARG  10  -0.485  -9.083  -9.167
   82    HN2  GLY  11           H        GLY  11   6.376  -8.400  -3.253
   83   1HA   GLY  11          2HA       GLY  11   7.539 -10.272  -2.606
   84   2HA   GLY  11          1HA       GLY  11   6.443 -10.318  -1.234
   85    H    ARG  12           H        ARG  12   7.335 -11.762  -4.194
   86    HA   ARG  12           HA       ARG  12   4.993 -13.149  -4.862
   87   1HB   ARG  12          2HB       ARG  12   7.500 -12.945  -5.927
   88   2HB   ARG  12          1HB       ARG  12   7.510 -14.597  -5.329
   89   1HG   ARG  12          2HG       ARG  12   5.332 -14.919  -6.578
   90   2HG   ARG  12          1HG       ARG  12   5.665 -13.368  -7.351
   91   1HD   ARG  12          2HD       ARG  12   6.441 -15.183  -8.757
   92   2HD   ARG  12          1HD       ARG  12   7.811 -14.248  -8.158
   93    HE   ARG  12           HE       ARG  12   7.152 -16.565  -6.570
   94   1HH1  ARG  12          1HH1      ARG  12   9.019 -15.340  -9.254
   95   2HH1  ARG  12          2HH1      ARG  12  10.202 -16.602  -9.167
   96   1HH2  ARG  12          1HH2      ARG  12   8.706 -18.224  -6.457
   97   2HH2  ARG  12          2HH2      ARG  12  10.024 -18.240  -7.581
   98    H    CYS  13           H        CYS  13   7.098 -13.535  -2.210
   99    HA   CYS  13           HA       CYS  13   7.309 -16.104  -1.548
  100   1HB   CYS  13          2HB       CYS  13   6.519 -15.288   0.869
  101   2HB   CYS  13          1HB       CYS  13   8.062 -14.816   0.172
  102    H    LYS  14           H        LYS  14   4.553 -14.670   0.143
  103    HA   LYS  14           HA       LYS  14   3.003 -17.062  -0.582
  104   1HB   LYS  14          2HB       LYS  14   2.553 -15.281   1.811
  105   2HB   LYS  14          1HB       LYS  14   1.851 -16.865   1.509
  106   1HG   LYS  14          2HG       LYS  14   4.807 -16.673   1.636
  107   2HG   LYS  14          1HG       LYS  14   3.902 -16.514   3.142
  108   1HD   LYS  14          2HD       LYS  14   4.386 -18.809   2.949
  109   2HD   LYS  14          1HD       LYS  14   2.697 -18.649   2.466
  110   1HE   LYS  14          2HE       LYS  14   3.113 -19.311   0.363
  111   2HE   LYS  14          1HE       LYS  14   4.598 -18.366   0.260
  112   1HZ   LYS  14          1HZ       LYS  14   5.085 -20.706   0.099
  113   2HZ   LYS  14          2HZ       LYS  14   4.296 -21.018   1.562
  114   3HZ   LYS  14          3HZ       LYS  14   5.719 -20.103   1.547
  115    H    ALA  15           H        ALA  15   2.754 -15.426  -2.556
  116    HA   ALA  15           HA       ALA  15   1.004 -13.254  -2.377
  117   1HB   ALA  15          1HB       ALA  15   0.922 -13.279  -4.692
  118   2HB   ALA  15          2HB       ALA  15   1.036 -15.036  -4.778
  119   3HB   ALA  15          3HB       ALA  15   2.456 -14.081  -4.354
  120    H    SER  16           H        SER  16  -0.849 -13.530  -1.208
  121    HA   SER  16           HA       SER  16  -2.983 -14.982  -2.454
  122   1HB   SER  16          2HB       SER  16  -1.576 -16.619  -0.930
  123   2HB   SER  16          1HB       SER  16  -2.509 -15.861   0.362
  124    HG   SER  16           HG       SER  16  -4.135 -17.036  -0.223
  125    H    PHE  17           H        PHE  17  -2.312 -12.246  -1.507
  126    HA   PHE  17           HA       PHE  17  -4.845 -11.736  -0.186
  127   1HB   PHE  17          2HB       PHE  17  -2.198 -10.970   1.052
  128   2HB   PHE  17          1HB       PHE  17  -3.733 -10.248   1.522
  129    HD1  PHE  17           HD1      PHE  17  -5.611 -12.262   1.845
  130    HD2  PHE  17           HD2      PHE  17  -1.421 -12.504   2.552
  131    HE1  PHE  17           HE1      PHE  17  -5.990 -14.101   3.435
  132    HE2  PHE  17           HE2      PHE  17  -1.792 -14.344   4.143
  133    HZ   PHE  17           HZ       PHE  17  -4.079 -15.145   4.585
  134    H    GLU  18           H        GLU  18  -5.173  -9.293   0.054
  135    HA   GLU  18           HA       GLU  18  -3.883  -7.889  -2.192
  136   1HB   GLU  18          2HB       GLU  18  -6.590  -8.626  -1.981
  137   2HB   GLU  18          1HB       GLU  18  -6.545  -6.897  -1.667
  138   1HG   GLU  18          2HG       GLU  18  -5.796  -6.394  -3.773
  139   2HG   GLU  18          1HG       GLU  18  -5.056  -7.977  -4.006
  140    H    ARG  19           H        ARG  19  -3.378  -5.734  -1.889
  141    HA   ARG  19           HA       ARG  19  -4.150  -4.471   0.633
  142   1HB   ARG  19          2HB       ARG  19  -1.298  -4.932  -0.241
  143   2HB   ARG  19          1HB       ARG  19  -1.755  -3.772   0.997
  144   1HG   ARG  19          2HG       ARG  19  -2.731  -6.542   1.337
  145   2HG   ARG  19          1HG       ARG  19  -1.003  -6.262   1.553
  146   1HD   ARG  19          2HD       ARG  19  -1.304  -4.968   3.408
  147   2HD   ARG  19          1HD       ARG  19  -2.882  -4.388   2.880
  148    HE   ARG  19           HE       ARG  19  -3.869  -6.188   3.917
  149   1HH1  ARG  19          1HH1      ARG  19  -0.412  -6.666   3.805
  150   2HH1  ARG  19          2HH1      ARG  19  -0.439  -8.018   4.886
  151   1HH2  ARG  19          1HH2      ARG  19  -3.905  -7.969   5.337
  152   2HH2  ARG  19          2HH2      ARG  19  -2.420  -8.759   5.755
  153    H    TRP  20           H        TRP  20  -3.834  -2.184   0.681
  154    HA   TRP  20           HA       TRP  20  -3.837  -1.001  -2.006
  155   1HB   TRP  20          2HB       TRP  20  -4.876   0.040   0.638
  156   2HB   TRP  20          1HB       TRP  20  -4.870   0.976  -0.853
  157    HD1  TRP  20           HD1      TRP  20  -6.644  -1.955   0.835
  158    HE1  TRP  20           HE1      TRP  20  -8.799  -2.478  -0.464
  159    HE3  TRP  20           HE3      TRP  20  -5.941   1.130  -3.184
  160    HZ2  TRP  20           HZ2      TRP  20 -10.036  -1.693  -2.865
  161    HZ3  TRP  20           HZ3      TRP  20  -7.664   1.182  -4.940
  162    HH2  TRP  20           HH2      TRP  20  -9.669  -0.202  -4.783
  163    H    TYR  21           H        TYR  21  -2.620   0.871  -2.456
  164    HA   TYR  21           HA       TYR  21  -0.616   1.715  -0.508
  165   1HB   TYR  21          2HB       TYR  21   1.110   1.510  -2.464
  166   2HB   TYR  21          1HB       TYR  21   0.716   0.081  -1.511
  167    HD1  TYR  21           HD1      TYR  21  -1.291  -1.344  -2.447
  168    HD2  TYR  21           HD2      TYR  21   1.045   1.336  -4.779
  169    HE1  TYR  21           HE1      TYR  21  -2.006  -2.503  -4.479
  170    HE2  TYR  21           HE2      TYR  21   0.333   0.177  -6.829
  171    HH   TYR  21           HH       TYR  21  -0.569  -2.310  -7.341
  172    H    PHE  22           H        PHE  22   0.216   3.786  -0.899
  173    HA   PHE  22           HA       PHE  22  -1.295   5.305  -2.908
  174   1HB   PHE  22          2HB       PHE  22  -0.241   7.278  -1.484
  175   2HB   PHE  22          1HB       PHE  22  -1.701   6.447  -0.964
  176    HD1  PHE  22           HD1      PHE  22   1.978   6.527  -0.500
  177    HD2  PHE  22           HD2      PHE  22  -1.793   5.387   1.105
  178    HE1  PHE  22           HE1      PHE  22   3.060   5.981   1.640
  179    HE2  PHE  22           HE2      PHE  22  -0.719   4.839   3.249
  180    HZ   PHE  22           HZ       PHE  22   1.710   5.137   3.519
  181    H    ASN  23           H        ASN  23  -0.293   5.753  -4.730
  182    HA   ASN  23           HA       ASN  23   2.636   5.872  -4.765
  183   1HB   ASN  23          2HB       ASN  23   1.184   4.387  -6.350
  184   2HB   ASN  23          1HB       ASN  23   0.923   5.891  -7.230
  185   1HD2  ASN  23          1HD2      ASN  23   2.951   7.112  -7.748
  186   2HD2  ASN  23          2HD2      ASN  23   4.310   6.186  -8.275
  187    HN2  GLY  24           H        GLY  24   3.019   7.949  -4.035
  188   1HA   GLY  24          2HA       GLY  24   3.540  10.165  -4.481
  189   2HA   GLY  24          1HA       GLY  24   2.664  10.034  -5.999
  190    H    ARG  25           H        ARG  25   0.162   9.329  -5.195
  191    HA   ARG  25           HA       ARG  25  -0.843  10.854  -3.033
  192   1HB   ARG  25          2HB       ARG  25  -2.112  12.513  -4.442
  193   2HB   ARG  25          1HB       ARG  25  -0.378  12.788  -4.344
  194   1HG   ARG  25          2HG       ARG  25  -0.464  11.281  -6.559
  195   2HG   ARG  25          1HG       ARG  25  -2.055  12.040  -6.649
  196   1HD   ARG  25          2HD       ARG  25  -0.105  14.006  -5.932
  197   2HD   ARG  25          1HD       ARG  25   0.445  13.136  -7.363
  198    HE   ARG  25           HE       ARG  25  -1.225  14.132  -8.568
  199   1HH1  ARG  25          1HH1      ARG  25  -1.916  14.507  -5.167
  200   2HH1  ARG  25          2HH1      ARG  25  -3.252  15.577  -5.429
  201   1HH2  ARG  25          1HH2      ARG  25  -2.982  15.536  -8.913
  202   2HH2  ARG  25          2HH2      ARG  25  -3.859  16.161  -7.556
  203    H    THR  26           H        THR  26  -1.386   9.209  -6.083
  204    HA   THR  26           HA       THR  26  -4.195   8.777  -5.539
  205    HB   THR  26           HB       THR  26  -3.421   9.094  -7.847
  206    HG1  THR  26           HG1      THR  26  -4.339   6.442  -7.469
  207   1HG2  THR  26          1HG2      THR  26  -1.324   8.179  -8.092
  208   2HG2  THR  26          2HG2      THR  26  -2.347   6.989  -8.896
  209   3HG2  THR  26          3HG2      THR  26  -1.763   6.686  -7.261
  210    H    CYS  27           H        CYS  27  -5.111   6.575  -5.519
  211    HA   CYS  27           HA       CYS  27  -3.439   4.815  -3.876
  212   1HB   CYS  27          2HB       CYS  27  -6.416   5.114  -4.196
  213   2HB   CYS  27          1HB       CYS  27  -5.716   3.685  -3.442
  214    H    ALA  28           H        ALA  28  -3.469   2.531  -4.231
  215    HA   ALA  28           HA       ALA  28  -4.377   1.614  -6.845
  216   1HB   ALA  28          1HB       ALA  28  -2.069   0.482  -7.096
  217   2HB   ALA  28          2HB       ALA  28  -1.524   1.725  -5.969
  218   3HB   ALA  28          3HB       ALA  28  -2.240   2.185  -7.513
  219    H    LYS  29           H        LYS  29  -3.732  -0.880  -7.019
  220    HA   LYS  29           HA       LYS  29  -3.901  -2.201  -4.432
  221   1HB   LYS  29          2HB       LYS  29  -6.250  -1.567  -5.477
  222   2HB   LYS  29          1HB       LYS  29  -5.958  -3.015  -6.430
  223   1HG   LYS  29          2HG       LYS  29  -5.778  -4.350  -4.434
  224   2HG   LYS  29          1HG       LYS  29  -5.915  -2.910  -3.421
  225   1HD   LYS  29          2HD       LYS  29  -8.076  -3.705  -3.367
  226   2HD   LYS  29          1HD       LYS  29  -8.162  -2.573  -4.718
  227   1HE   LYS  29          2HE       LYS  29  -7.761  -4.469  -6.266
  228   2HE   LYS  29          1HE       LYS  29  -7.816  -5.565  -4.886
  229   1HZ   LYS  29          1HZ       LYS  29 -10.037  -3.789  -5.748
  230   2HZ   LYS  29          2HZ       LYS  29 -10.086  -4.896  -4.470
  231   3HZ   LYS  29          3HZ       LYS  29  -9.938  -5.449  -6.062
  232    H    PHE  30           H        PHE  30  -3.250  -4.328  -4.439
  233    HA   PHE  30           HA       PHE  30  -2.802  -5.772  -6.873
  234   1HB   PHE  30          2HB       PHE  30  -0.320  -6.049  -6.417
  235   2HB   PHE  30          1HB       PHE  30  -0.822  -4.503  -7.086
  236    HD1  PHE  30           HD1      PHE  30  -1.577  -4.984  -3.582
  237    HD2  PHE  30           HD2      PHE  30   1.415  -3.707  -6.327
  238    HE1  PHE  30           HE1      PHE  30  -0.408  -3.826  -1.761
  239    HE2  PHE  30           HE2      PHE  30   2.587  -2.542  -4.506
  240    HZ   PHE  30           HZ       PHE  30   1.677  -2.601  -2.220
  241    H    ILE  31           H        ILE  31  -1.422  -7.848  -6.301
  242    HA   ILE  31           HA       ILE  31  -2.752  -8.998  -3.983
  243    HB   ILE  31           HB       ILE  31  -1.002 -10.332  -6.051
  244   1HG1  ILE  31          2HG1      ILE  31  -3.059  -9.337  -7.005
  245   2HG1  ILE  31          1HG1      ILE  31  -3.069 -11.097  -7.083
  246   1HG2  ILE  31          1HG2      ILE  31  -2.930 -11.584  -4.102
  247   2HG2  ILE  31          2HG2      ILE  31  -1.185 -11.500  -3.859
  248   3HG2  ILE  31          3HG2      ILE  31  -1.844 -12.416  -5.214
  249   1HD1  ILE  31          1HD1      ILE  31  -4.896 -11.241  -5.823
  250   2HD1  ILE  31          2HD1      ILE  31  -5.093  -9.518  -6.142
  251   3HD1  ILE  31          3HD1      ILE  31  -4.299 -10.056  -4.663
  252    H    TYR  32           H        TYR  32  -1.740  -8.581  -2.111
  253    HA   TYR  32           HA       TYR  32   1.162  -8.497  -1.988
  254   1HB   TYR  32          2HB       TYR  32  -0.043  -6.774  -0.786
  255   2HB   TYR  32          1HB       TYR  32  -0.967  -7.982   0.100
  256    HD1  TYR  32           HD2      TYR  32   2.636  -7.194  -0.547
  257    HD2  TYR  32           HD1      TYR  32  -0.333  -8.309   2.287
  258    HE1  TYR  32           HE2      TYR  32   4.335  -7.176   1.229
  259    HE2  TYR  32           HE1      TYR  32   1.358  -8.293   4.073
  260    HH   TYR  32           HH       TYR  32   3.736  -8.453   4.359
  261    HN2  GLY  33           H        GLY  33   2.355 -10.198  -1.519
  262   1HA   GLY  33          2HA       GLY  33   1.097 -12.621  -0.522
  263   2HA   GLY  33          1HA       GLY  33   2.748 -12.467  -1.105
  264    HN2  GLY  34           H        GLY  34   3.551 -10.299   0.549
  265   1HA   GLY  34          2HA       GLY  34   3.146 -10.204   3.166
  266   2HA   GLY  34          1HA       GLY  34   3.900 -11.783   3.038
  267    H    CYS  35           H        CYS  35   5.494 -10.513   0.677
  268    HA   CYS  35           HA       CYS  35   7.529  -9.297   2.423
  269   1HB   CYS  35          2HB       CYS  35   8.082 -10.514  -0.276
  270   2HB   CYS  35          1HB       CYS  35   9.219 -10.171   1.022
  271    HN2  GLY  36           H        GLY  36   7.620  -7.165   2.252
  272   1HA   GLY  36          2HA       GLY  36   8.414  -5.376   0.730
  273   2HA   GLY  36          1HA       GLY  36   7.232  -5.974  -0.423
  274    HN2  GLY  37           H        GLY  37   6.751  -5.533   3.050
  275   1HA   GLY  37          2HA       GLY  37   4.882  -3.337   2.418
  276   2HA   GLY  37          1HA       GLY  37   4.427  -4.640   3.503
  277    H    ASN  38           H        ASN  38   5.825  -1.579   3.254
  278    HA   ASN  38           HA       ASN  38   6.882  -1.765   5.996
  279   1HB   ASN  38          2HB       ASN  38   7.924   0.566   5.174
  280   2HB   ASN  38          1HB       ASN  38   8.730  -0.977   4.913
  281   1HD2  ASN  38          1HD2      ASN  38   9.777  -0.586   3.060
  282   2HD2  ASN  38          2HD2      ASN  38   9.015  -0.159   1.569
  283    HN2  GLY  39           H        GLY  39   5.987   1.137   4.166
  284   1HA   GLY  39          2HA       GLY  39   3.758   1.558   6.045
  285   2HA   GLY  39          1HA       GLY  39   4.974   2.809   5.841
  286    H    ASN  40           H        ASN  40   4.661   1.389   2.882
  287    HA   ASN  40           HA       ASN  40   2.995   3.574   1.934
  288   1HB   ASN  40          2HB       ASN  40   5.113   3.098   0.785
  289   2HB   ASN  40          1HB       ASN  40   4.548   1.473   0.406
  290   1HD2  ASN  40          1HD2      ASN  40   3.699   4.880  -0.020
  291   2HD2  ASN  40          2HD2      ASN  40   3.008   4.692  -1.592
  292    H    LYS  41           H        LYS  41   2.799   0.155   2.467
  293    HA   LYS  41           HA       LYS  41   0.338  -0.031   0.894
  294   1HB   LYS  41          2HB       LYS  41   0.526  -2.435   1.162
  295   2HB   LYS  41          1HB       LYS  41   2.049  -1.780   0.577
  296   1HG   LYS  41          2HG       LYS  41   2.925  -3.077   2.182
  297   2HG   LYS  41          1HG       LYS  41   2.496  -1.727   3.233
  298   1HD   LYS  41          2HD       LYS  41   0.195  -2.971   3.382
  299   2HD   LYS  41          1HD       LYS  41   1.152  -4.369   2.887
  300   1HE   LYS  41          2HE       LYS  41   1.544  -4.613   5.082
  301   2HE   LYS  41          1HE       LYS  41   2.713  -3.313   4.850
  302   1HZ   LYS  41          1HZ       LYS  41   0.483  -1.915   5.248
  303   2HZ   LYS  41          2HZ       LYS  41   1.535  -2.364   6.494
  304   3HZ   LYS  41          3HZ       LYS  41   0.142  -3.275   6.196
  305    H    PHE  42           H        PHE  42  -1.517  -1.169   1.842
  306    HA   PHE  42           HA       PHE  42  -1.731  -1.261   4.719
  307   1HB   PHE  42          2HB       PHE  42  -3.017   0.899   3.092
  308   2HB   PHE  42          1HB       PHE  42  -3.875   0.254   4.488
  309    HD1  PHE  42           HD1      PHE  42  -2.821   0.403   6.746
  310    HD2  PHE  42           HD2      PHE  42  -1.223   2.402   3.346
  311    HE1  PHE  42           HE1      PHE  42  -1.527   1.881   8.228
  312    HE2  PHE  42           HE2      PHE  42   0.074   3.882   4.821
  313    HZ   PHE  42           HZ       PHE  42  -0.076   3.622   7.265
  314    HA   PRO  43           HA       PRO  43  -4.674  -4.382   3.699
  315   1HB   PRO  43          2HB       PRO  43  -6.251  -4.414   5.891
  316   2HB   PRO  43          1HB       PRO  43  -4.578  -4.982   5.919
  317   1HG   PRO  43          2HG       PRO  43  -5.699  -2.352   6.805
  318   2HG   PRO  43          1HG       PRO  43  -4.493  -3.380   7.601
  319   1HD   PRO  43          2HD       PRO  43  -3.834  -1.190   6.129
  320   2HD   PRO  43          1HD       PRO  43  -2.778  -2.610   6.276
  321    H    THR  44           H        THR  44  -5.858  -1.191   4.511
  322    HA   THR  44           HA       THR  44  -8.234  -1.721   2.860
  323    HB   THR  44           HB       THR  44  -9.401  -0.031   4.435
  324    HG1  THR  44           HG1      THR  44  -7.309  -0.946   6.114
  325   1HG2  THR  44          1HG2      THR  44 -10.319  -1.701   5.742
  326   2HG2  THR  44          2HG2      THR  44  -8.816  -2.623   5.797
  327   3HG2  THR  44          3HG2      THR  44  -9.765  -2.572   4.311
  328    H    GLN  45           H        GLN  45  -8.945  -0.047   1.569
  329    HA   GLN  45           HA       GLN  45  -7.001   1.804   0.695
  330   1HB   GLN  45          2HB       GLN  45  -9.025   0.795  -0.573
  331   2HB   GLN  45          1HB       GLN  45  -9.938   2.116   0.142
  332   1HG   GLN  45          2HG       GLN  45  -8.428   3.727  -0.902
  333   2HG   GLN  45          1HG       GLN  45  -7.516   2.401  -1.621
  334   1HE2  GLN  45          1HE2      GLN  45  -8.362   4.144  -3.360
  335   2HE2  GLN  45          2HE2      GLN  45  -9.744   3.592  -4.238
  336    H    GLU  46           H        GLU  46  -9.481   1.963   3.110
  337    HA   GLU  46           HA       GLU  46  -9.938   4.698   3.286
  338   1HB   GLU  46          2HB       GLU  46 -10.592   4.295   5.599
  339   2HB   GLU  46          1HB       GLU  46 -11.200   3.014   4.560
  340   1HG   GLU  46          2HG       GLU  46  -9.053   1.755   5.265
  341   2HG   GLU  46          1HG       GLU  46  -9.008   2.923   6.586
  342    H    ALA  47           H        ALA  47  -7.266   2.762   4.486
  343    HA   ALA  47           HA       ALA  47  -6.078   4.930   5.962
  344   1HB   ALA  47          1HB       ALA  47  -5.188   2.148   5.267
  345   2HB   ALA  47          2HB       ALA  47  -5.609   2.813   6.845
  346   3HB   ALA  47          3HB       ALA  47  -4.109   3.299   6.055
  347    H    CYS  48           H        CYS  48  -5.809   3.554   2.765
  348    HA   CYS  48           HA       CYS  48  -3.356   4.544   1.936
  349   1HB   CYS  48          2HB       CYS  48  -4.653   3.011   0.567
  350   2HB   CYS  48          1HB       CYS  48  -5.913   4.220   0.351
  351    H    MET  49           H        MET  49  -6.533   6.122   1.839
  352    HA   MET  49           HA       MET  49  -5.403   8.587   0.839
  353   1HB   MET  49          2HB       MET  49  -8.139   7.579   1.455
  354   2HB   MET  49          1HB       MET  49  -7.889   9.318   1.433
  355   1HG   MET  49          2HG       MET  49  -6.653   8.365  -0.881
  356   2HG   MET  49          1HG       MET  49  -8.170   7.476  -0.754
  357   1HE   MET  49          1HE       MET  49  -9.054   8.257  -2.814
  358   2HE   MET  49          2HE       MET  49  -7.930   9.500  -3.363
  359   3HE   MET  49          3HE       MET  49  -9.644   9.876  -3.187
  360    H    LYS  50           H        LYS  50  -6.598   7.312   3.886
  361    HA   LYS  50           HA       LYS  50  -6.672   9.728   5.321
  362   1HB   LYS  50          2HB       LYS  50  -7.722   7.576   6.031
  363   2HB   LYS  50          1HB       LYS  50  -6.117   6.969   6.419
  364   1HG   LYS  50          2HG       LYS  50  -5.918   8.992   7.964
  365   2HG   LYS  50          1HG       LYS  50  -7.662   9.159   7.760
  366   1HD   LYS  50          2HD       LYS  50  -7.797   7.755   9.506
  367   2HD   LYS  50          1HD       LYS  50  -7.414   6.499   8.325
  368   1HE   LYS  50          2HE       LYS  50  -5.080   7.900   9.417
  369   2HE   LYS  50          1HE       LYS  50  -6.004   6.985  10.607
  370   1HZ   LYS  50          1HZ       LYS  50  -5.083   5.829   8.037
  371   2HZ   LYS  50          2HZ       LYS  50  -5.707   5.005   9.376
  372   3HZ   LYS  50          3HZ       LYS  50  -4.184   5.734   9.468
  373    H    ARG  51           H        ARG  51  -3.998   7.970   4.150
  374    HA   ARG  51           HA       ARG  51  -2.222   9.090   6.190
  375   1HB   ARG  51          2HB       ARG  51  -2.271   6.615   4.937
  376   2HB   ARG  51          1HB       ARG  51  -0.933   7.450   4.162
  377   1HG   ARG  51          2HG       ARG  51   0.169   6.507   5.908
  378   2HG   ARG  51          1HG       ARG  51  -0.307   8.032   6.659
  379   1HD   ARG  51          2HD       ARG  51  -2.306   5.897   6.867
  380   2HD   ARG  51          1HD       ARG  51  -0.788   5.556   7.696
  381    HE   ARG  51           HE       ARG  51  -2.766   7.512   8.427
  382   1HH1  ARG  51          1HH1      ARG  51   0.592   6.595   8.690
  383   2HH1  ARG  51          2HH1      ARG  51   0.847   7.480  10.156
  384   1HH2  ARG  51          1HH2      ARG  51  -2.430   8.676  10.354
  385   2HH2  ARG  51          2HH2      ARG  51  -0.868   8.661  11.102
  386    H    CYS  52           H        CYS  52  -2.529   8.938   2.633
  387    HA   CYS  52           HA       CYS  52  -0.648  11.200   2.487
  388   1HB   CYS  52          2HB       CYS  52  -1.199   8.889   0.705
  389   2HB   CYS  52          1HB       CYS  52  -0.762  10.410  -0.066
  390    H    ALA  53           H        ALA  53  -3.910  10.241   1.784
  391    HA   ALA  53           HA       ALA  53  -4.380  12.517   0.048
  392   1HB   ALA  53          1HB       ALA  53  -5.463  10.226  -0.218
  393   2HB   ALA  53          2HB       ALA  53  -6.509  11.637  -0.359
  394   3HB   ALA  53          3HB       ALA  53  -6.502  10.692   1.129
  395    H    LYS  54           H        LYS  54  -4.608  11.772   3.401
  396    HA   LYS  54           HA       LYS  54  -6.297  14.130   3.860
  397   1HB   LYS  54          2HB       LYS  54  -5.940  11.565   5.258
  398   2HB   LYS  54          1HB       LYS  54  -6.033  12.967   6.316
  399   1HG   LYS  54          2HG       LYS  54  -8.095  13.320   4.479
  400   2HG   LYS  54          1HG       LYS  54  -8.125  11.601   4.879
  401   1HD   LYS  54          2HD       LYS  54  -8.820  11.980   6.986
  402   2HD   LYS  54          1HD       LYS  54  -7.770  13.385   7.183
  403   1HE   LYS  54          2HE       LYS  54  -9.654  14.586   7.098
  404   2HE   LYS  54          1HE       LYS  54  -9.611  14.278   5.363
  405   1HZ   LYS  54          1HZ       LYS  54 -11.172  12.592   5.544
  406   2HZ   LYS  54          2HZ       LYS  54 -11.745  13.744   6.642
  407   3HZ   LYS  54          3HZ       LYS  54 -10.920  12.379   7.203
  408    H    ALA  55           H        ALA  55  -3.262  12.600   4.841
  409    HA   ALA  55           HA       ALA  55  -2.413  14.527   6.681
  410   1HB   ALA  55          1HB       ALA  55  -0.260  13.562   6.513
  411   2HB   ALA  55          2HB       ALA  55  -0.572  12.970   4.882
  412   3HB   ALA  55          3HB       ALA  55  -1.407  12.247   6.257
  Start of MODEL   20
    1   1H    ILE   1          1H        ILE   1   7.688  14.197   5.013
    2   2H    ILE   1          2H        ILE   1   7.230  14.151   3.359
    3   3H    ILE   1          3H        ILE   1   8.845  13.787   3.815
    4    HA   ILE   1           HA       ILE   1   7.924  11.935   5.145
    5    HB   ILE   1           HB       ILE   1   5.537  13.038   4.757
    6   1HG1  ILE   1          2HG1      ILE   1   6.162  11.067   6.182
    7   2HG1  ILE   1          1HG1      ILE   1   4.543  10.994   5.493
    8   1HG2  ILE   1          1HG2      ILE   1   4.229  11.934   3.064
    9   2HG2  ILE   1          2HG2      ILE   1   5.628  10.992   2.549
   10   3HG2  ILE   1          3HG2      ILE   1   5.606  12.739   2.309
   11   1HD1  ILE   1          1HD1      ILE   1   6.537   9.052   5.369
   12   2HD1  ILE   1          2HD1      ILE   1   6.430   9.726   3.742
   13   3HD1  ILE   1          3HD1      ILE   1   4.991   9.063   4.520
   14    H    ASP   2           H        ASP   2   8.928  10.219   4.317
   15    HA   ASP   2           HA       ASP   2   9.410  10.152   1.430
   16   1HB   ASP   2          2HB       ASP   2  11.337  10.046   3.019
   17   2HB   ASP   2          1HB       ASP   2  10.722   8.500   3.595
   18    H    THR   3           H        THR   3   7.899   8.327   3.995
   19    HA   THR   3           HA       THR   3   7.628   5.829   2.885
   20    HB   THR   3           HB       THR   3   5.302   7.115   4.277
   21    HG1  THR   3           HG1      THR   3   6.414   6.781   6.236
   22   1HG2  THR   3          1HG2      THR   3   5.973   4.745   5.525
   23   2HG2  THR   3          2HG2      THR   3   6.212   4.416   3.808
   24   3HG2  THR   3          3HG2      THR   3   4.652   5.004   4.385
   25    H    CYS   4           H        CYS   4   5.558   8.660   2.314
   26    HA   CYS   4           HA       CYS   4   3.808   7.296   0.525
   27   1HB   CYS   4          2HB       CYS   4   4.144  10.045   1.523
   28   2HB   CYS   4          1HB       CYS   4   3.479   9.932  -0.102
   29    H    ARG   5           H        ARG   5   6.978   8.286   0.147
   30    HA   ARG   5           HA       ARG   5   6.672   8.793  -2.723
   31   1HB   ARG   5          2HB       ARG   5   9.060   9.172  -0.910
   32   2HB   ARG   5          1HB       ARG   5   9.032   9.536  -2.630
   33   1HG   ARG   5          2HG       ARG   5   7.195  11.162  -2.181
   34   2HG   ARG   5          1HG       ARG   5   7.445  10.879  -0.458
   35   1HD   ARG   5          2HD       ARG   5   9.922  11.461  -1.861
   36   2HD   ARG   5          1HD       ARG   5   8.739  12.759  -2.019
   37    HE   ARG   5           HE       ARG   5   8.940  11.894   0.674
   38   1HH1  ARG   5          1HH1      ARG   5  10.599  13.783  -1.746
   39   2HH1  ARG   5          2HH1      ARG   5  11.397  14.793  -0.589
   40   1HH2  ARG   5          1HH2      ARG   5   9.991  13.220   2.198
   41   2HH2  ARG   5          2HH2      ARG   5  11.053  14.474   1.651
   42    H    LEU   6           H        LEU   6   7.779   6.422  -0.462
   43    HA   LEU   6           HA       LEU   6   9.324   4.994  -2.469
   44   1HB   LEU   6          2HB       LEU   6  10.013   3.537  -0.734
   45   2HB   LEU   6          1HB       LEU   6  10.051   5.160  -0.073
   46    HG   LEU   6           HG       LEU   6   7.625   4.505   0.767
   47   1HD1  LEU   6          1HD1      LEU   6   8.733   1.848   1.257
   48   2HD1  LEU   6          2HD1      LEU   6   8.311   2.145  -0.429
   49   3HD1  LEU   6          3HD1      LEU   6   7.093   2.335   0.831
   50   1HD2  LEU   6          1HD2      LEU   6  10.091   3.447   2.137
   51   2HD2  LEU   6          2HD2      LEU   6   8.581   3.962   2.889
   52   3HD2  LEU   6          3HD2      LEU   6   9.628   5.150   2.113
   53    HA   PRO   7           HA       PRO   7   5.756   2.604  -3.675
   54   1HB   PRO   7          2HB       PRO   7   7.015   0.832  -5.281
   55   2HB   PRO   7          1HB       PRO   7   6.732   2.510  -5.761
   56   1HG   PRO   7          2HG       PRO   7   9.217   1.243  -4.675
   57   2HG   PRO   7          1HG       PRO   7   9.042   2.401  -6.006
   58   1HD   PRO   7          2HD       PRO   7   9.818   3.130  -3.506
   59   2HD   PRO   7          1HD       PRO   7   8.909   4.205  -4.587
   60    H    SER   8           H        SER   8   4.742   0.940  -2.728
   61    HA   SER   8           HA       SER   8   6.264  -0.798  -0.965
   62   1HB   SER   8          2HB       SER   8   3.641   0.303  -0.943
   63   2HB   SER   8          1HB       SER   8   3.480  -1.452  -0.970
   64    HG   SER   8           HG       SER   8   4.202  -1.530   1.001
   65    H    ASP   9           H        ASP   9   6.761  -2.852  -1.371
   66    HA   ASP   9           HA       ASP   9   5.898  -4.020  -3.896
   67   1HB   ASP   9          2HB       ASP   9   8.112  -4.521  -1.967
   68   2HB   ASP   9          1HB       ASP   9   7.549  -5.884  -2.929
   69    H    ARG  10           H        ARG  10   4.664  -5.851  -4.088
   70    HA   ARG  10           HA       ARG  10   3.176  -6.613  -1.711
   71   1HB   ARG  10          2HB       ARG  10   1.727  -7.825  -3.315
   72   2HB   ARG  10          1HB       ARG  10   1.878  -6.115  -3.670
   73   1HG   ARG  10          2HG       ARG  10   3.457  -6.594  -5.442
   74   2HG   ARG  10          1HG       ARG  10   3.396  -8.315  -5.055
   75   1HD   ARG  10          2HD       ARG  10   0.750  -7.233  -5.458
   76   2HD   ARG  10          1HD       ARG  10   1.781  -6.935  -6.858
   77    HE   ARG  10           HE       ARG  10   1.839  -9.636  -5.836
   78   1HH1  ARG  10          1HH1      ARG  10   0.351  -7.416  -8.087
   79   2HH1  ARG  10          2HH1      ARG  10  -0.200  -8.667  -9.147
   80   1HH2  ARG  10          1HH2      ARG  10   1.114 -11.280  -7.236
   81   2HH2  ARG  10          2HH2      ARG  10   0.231 -10.859  -8.665
   82    HN2  GLY  11           H        GLY  11   5.905  -7.709  -3.324
   83   1HA   GLY  11          2HA       GLY  11   7.141  -9.631  -3.187
   84   2HA   GLY  11          1HA       GLY  11   6.279  -9.926  -1.687
   85    H    ARG  12           H        ARG  12   7.164 -11.904  -3.517
   86    HA   ARG  12           HA       ARG  12   4.613 -12.926  -4.573
   87   1HB   ARG  12          2HB       ARG  12   7.130 -12.711  -5.791
   88   2HB   ARG  12          1HB       ARG  12   6.934 -14.422  -5.438
   89   1HG   ARG  12          2HG       ARG  12   4.678 -14.268  -6.562
   90   2HG   ARG  12          1HG       ARG  12   5.168 -12.665  -7.115
   91   1HD   ARG  12          2HD       ARG  12   6.585 -15.266  -7.688
   92   2HD   ARG  12          1HD       ARG  12   5.606 -14.340  -8.825
   93    HE   ARG  12           HE       ARG  12   8.321 -13.815  -8.045
   94   1HH1  ARG  12          1HH1      ARG  12   5.388 -12.407  -9.307
   95   2HH1  ARG  12          2HH1      ARG  12   6.204 -11.091 -10.082
   96   1HH2  ARG  12          1HH2      ARG  12   9.397 -12.085  -9.064
   97   2HH2  ARG  12          2HH2      ARG  12   8.480 -10.908  -9.944
   98    H    CYS  13           H        CYS  13   6.791 -13.267  -2.056
   99    HA   CYS  13           HA       CYS  13   7.177 -15.899  -1.552
  100   1HB   CYS  13          2HB       CYS  13   6.614 -15.177   0.953
  101   2HB   CYS  13          1HB       CYS  13   8.078 -14.654   0.133
  102    H    LYS  14           H        LYS  14   4.516 -14.423   0.275
  103    HA   LYS  14           HA       LYS  14   2.954 -16.862  -0.239
  104   1HB   LYS  14          2HB       LYS  14   3.122 -15.025   2.132
  105   2HB   LYS  14          1HB       LYS  14   1.704 -16.035   1.884
  106   1HG   LYS  14          2HG       LYS  14   2.823 -17.557   3.068
  107   2HG   LYS  14          1HG       LYS  14   3.726 -17.836   1.577
  108   1HD   LYS  14          2HD       LYS  14   5.110 -15.756   2.562
  109   2HD   LYS  14          1HD       LYS  14   4.544 -16.475   4.071
  110   1HE   LYS  14          2HE       LYS  14   5.376 -18.696   2.898
  111   2HE   LYS  14          1HE       LYS  14   6.401 -17.563   2.019
  112   1HZ   LYS  14          1HZ       LYS  14   6.301 -17.256   4.913
  113   2HZ   LYS  14          2HZ       LYS  14   7.607 -17.089   3.852
  114   3HZ   LYS  14          3HZ       LYS  14   7.098 -18.630   4.330
  115    H    ALA  15           H        ALA  15   2.787 -15.088  -2.238
  116    HA   ALA  15           HA       ALA  15   0.920 -13.027  -2.042
  117   1HB   ALA  15          1HB       ALA  15   2.155 -14.571  -4.195
  118   2HB   ALA  15          2HB       ALA  15   1.829 -12.842  -4.080
  119   3HB   ALA  15          3HB       ALA  15   0.553 -13.948  -4.591
  120    H    SER  16           H        SER  16  -0.942 -13.436  -0.958
  121    HA   SER  16           HA       SER  16  -2.955 -14.978  -2.321
  122   1HB   SER  16          2HB       SER  16  -3.478 -16.213  -0.080
  123   2HB   SER  16          1HB       SER  16  -2.219 -16.847  -1.139
  124    HG   SER  16           HG       SER  16  -2.016 -15.938   1.388
  125    H    PHE  17           H        PHE  17  -2.441 -12.211  -1.454
  126    HA   PHE  17           HA       PHE  17  -5.045 -11.703  -0.305
  127   1HB   PHE  17          2HB       PHE  17  -2.554 -10.741   1.116
  128   2HB   PHE  17          1HB       PHE  17  -4.211 -10.339   1.550
  129    HD1  PHE  17           HD2      PHE  17  -5.723 -12.132   2.395
  130    HD2  PHE  17           HD1      PHE  17  -1.550 -12.748   1.830
  131    HE1  PHE  17           HE2      PHE  17  -5.821 -14.114   3.852
  132    HE2  PHE  17           HE1      PHE  17  -1.641 -14.729   3.285
  133    HZ   PHE  17           HZ       PHE  17  -3.779 -15.414   4.299
  134    H    GLU  18           H        GLU  18  -5.578  -9.384  -0.314
  135    HA   GLU  18           HA       GLU  18  -4.045  -7.951  -2.384
  136   1HB   GLU  18          2HB       GLU  18  -6.996  -8.145  -1.871
  137   2HB   GLU  18          1HB       GLU  18  -6.331  -6.749  -2.709
  138   1HG   GLU  18          2HG       GLU  18  -6.041  -7.880  -4.604
  139   2HG   GLU  18          1HG       GLU  18  -5.377  -9.285  -3.772
  140    H    ARG  19           H        ARG  19  -3.401  -5.894  -1.981
  141    HA   ARG  19           HA       ARG  19  -4.421  -4.569   0.429
  142   1HB   ARG  19          2HB       ARG  19  -1.695  -5.542  -0.040
  143   2HB   ARG  19          1HB       ARG  19  -1.767  -3.856   0.450
  144   1HG   ARG  19          2HG       ARG  19  -1.496  -5.279   2.379
  145   2HG   ARG  19          1HG       ARG  19  -3.075  -4.496   2.423
  146   1HD   ARG  19          2HD       ARG  19  -4.185  -6.443   2.226
  147   2HD   ARG  19          1HD       ARG  19  -3.022  -7.105   1.078
  148    HE   ARG  19           HE       ARG  19  -1.646  -7.163   3.383
  149   1HH1  ARG  19          1HH1      ARG  19  -4.852  -8.268   2.551
  150   2HH1  ARG  19          2HH1      ARG  19  -4.847  -9.550   3.715
  151   1HH2  ARG  19          1HH2      ARG  19  -1.639  -8.850   4.912
  152   2HH2  ARG  19          2HH2      ARG  19  -3.024  -9.881   5.055
  153    H    TRP  20           H        TRP  20  -3.640  -2.255   0.543
  154    HA   TRP  20           HA       TRP  20  -3.706  -1.092  -2.161
  155   1HB   TRP  20          2HB       TRP  20  -4.668   0.060   0.466
  156   2HB   TRP  20          1HB       TRP  20  -4.676   0.922  -1.068
  157    HD1  TRP  20           HD1      TRP  20  -6.496  -1.854   0.818
  158    HE1  TRP  20           HE1      TRP  20  -8.699  -2.377  -0.398
  159    HE3  TRP  20           HE3      TRP  20  -5.798   0.979  -3.382
  160    HZ2  TRP  20           HZ2      TRP  20  -9.972  -1.685  -2.811
  161    HZ3  TRP  20           HZ3      TRP  20  -7.562   0.992  -5.097
  162    HH2  TRP  20           HH2      TRP  20  -9.607  -0.313  -4.817
  163    H    TYR  21           H        TYR  21  -2.376   0.661  -2.651
  164    HA   TYR  21           HA       TYR  21  -0.350   1.457  -0.702
  165   1HB   TYR  21          2HB       TYR  21   1.363   1.170  -2.664
  166   2HB   TYR  21          1HB       TYR  21   0.926  -0.229  -1.686
  167    HD1  TYR  21           HD1      TYR  21  -1.185  -1.556  -2.605
  168    HD2  TYR  21           HD2      TYR  21   1.345   0.915  -4.966
  169    HE1  TYR  21           HE1      TYR  21  -1.935  -2.728  -4.618
  170    HE2  TYR  21           HE2      TYR  21   0.599  -0.255  -6.997
  171    HH   TYR  21           HH       TYR  21  -1.157  -1.592  -7.807
  172    H    PHE  22           H        PHE  22  -0.186   3.603  -0.740
  173    HA   PHE  22           HA       PHE  22  -1.399   5.102  -2.883
  174   1HB   PHE  22          2HB       PHE  22  -0.392   7.072  -1.446
  175   2HB   PHE  22          1HB       PHE  22  -1.817   6.195  -0.908
  176    HD1  PHE  22           HD1      PHE  22   1.843   6.491  -0.460
  177    HD2  PHE  22           HD2      PHE  22  -1.823   5.014   1.113
  178    HE1  PHE  22           HE1      PHE  22   2.970   5.962   1.663
  179    HE2  PHE  22           HE2      PHE  22  -0.704   4.484   3.238
  180    HZ   PHE  22           HZ       PHE  22   1.695   4.961   3.515
  181    H    ASN  23           H        ASN  23  -0.394   5.516  -4.707
  182    HA   ASN  23           HA       ASN  23   2.516   5.575  -4.807
  183   1HB   ASN  23          2HB       ASN  23   0.815   4.433  -6.501
  184   2HB   ASN  23          1HB       ASN  23   0.841   6.035  -7.233
  185   1HD2  ASN  23          1HD2      ASN  23   2.188   6.127  -8.863
  186   2HD2  ASN  23          2HD2      ASN  23   3.724   5.344  -8.970
  187    HN2  GLY  24           H        GLY  24   2.630   7.590  -3.578
  188   1HA   GLY  24          2HA       GLY  24   3.243   9.818  -3.636
  189   2HA   GLY  24          1HA       GLY  24   2.837   9.845  -5.345
  190    H    ARG  25           H        ARG  25   0.339   9.567  -5.694
  191    HA   ARG  25           HA       ARG  25  -1.115  11.149  -3.694
  192   1HB   ARG  25          2HB       ARG  25  -2.205  12.343  -5.691
  193   2HB   ARG  25          1HB       ARG  25  -0.581  12.833  -5.227
  194   1HG   ARG  25          2HG       ARG  25  -0.738  10.703  -7.252
  195   2HG   ARG  25          1HG       ARG  25  -1.326  12.290  -7.752
  196   1HD   ARG  25          2HD       ARG  25   0.998  12.922  -6.462
  197   2HD   ARG  25          1HD       ARG  25   1.401  11.373  -7.203
  198    HE   ARG  25           HE       ARG  25   1.524  12.465  -9.191
  199   1HH1  ARG  25          1HH1      ARG  25  -0.629  14.261  -7.115
  200   2HH1  ARG  25          2HH1      ARG  25  -0.890  15.526  -8.269
  201   1HH2  ARG  25          1HH2      ARG  25   1.184  14.126 -10.711
  202   2HH2  ARG  25          2HH2      ARG  25   0.139  15.449 -10.311
  203    H    THR  26           H        THR  26  -1.244   8.952  -6.448
  204    HA   THR  26           HA       THR  26  -4.075   8.428  -5.921
  205    HB   THR  26           HB       THR  26  -2.355   7.331  -8.149
  206    HG1  THR  26           HG1      THR  26  -2.741   9.093  -9.238
  207   1HG2  THR  26          1HG2      THR  26  -5.343   7.562  -7.897
  208   2HG2  THR  26          2HG2      THR  26  -4.402   6.072  -7.825
  209   3HG2  THR  26          3HG2      THR  26  -4.464   7.004  -9.321
  210    H    CYS  27           H        CYS  27  -4.870   6.343  -5.517
  211    HA   CYS  27           HA       CYS  27  -2.986   4.637  -4.098
  212   1HB   CYS  27          2HB       CYS  27  -5.400   5.382  -3.341
  213   2HB   CYS  27          1HB       CYS  27  -5.903   4.010  -4.322
  214    H    ALA  28           H        ALA  28  -3.376   2.205  -4.334
  215    HA   ALA  28           HA       ALA  28  -4.128   1.356  -7.001
  216   1HB   ALA  28          1HB       ALA  28  -1.304   1.318  -6.015
  217   2HB   ALA  28          2HB       ALA  28  -1.937   1.882  -7.561
  218   3HB   ALA  28          3HB       ALA  28  -1.870   0.155  -7.215
  219    H    LYS  29           H        LYS  29  -3.564  -1.153  -7.173
  220    HA   LYS  29           HA       LYS  29  -3.901  -2.483  -4.601
  221   1HB   LYS  29          2HB       LYS  29  -6.153  -1.821  -5.936
  222   2HB   LYS  29          1HB       LYS  29  -5.809  -3.377  -6.680
  223   1HG   LYS  29          2HG       LYS  29  -5.490  -3.996  -4.070
  224   2HG   LYS  29          1HG       LYS  29  -6.722  -2.738  -3.964
  225   1HD   LYS  29          2HD       LYS  29  -7.245  -4.638  -6.104
  226   2HD   LYS  29          1HD       LYS  29  -7.154  -5.411  -4.521
  227   1HE   LYS  29          2HE       LYS  29  -8.722  -2.906  -4.714
  228   2HE   LYS  29          1HE       LYS  29  -9.403  -4.339  -5.483
  229   1HZ   LYS  29          1HZ       LYS  29  -8.510  -4.219  -2.653
  230   2HZ   LYS  29          2HZ       LYS  29  -9.305  -5.507  -3.409
  231   3HZ   LYS  29          3HZ       LYS  29 -10.115  -4.044  -3.159
  232    H    PHE  30           H        PHE  30  -3.167  -4.562  -4.555
  233    HA   PHE  30           HA       PHE  30  -2.634  -6.053  -6.935
  234   1HB   PHE  30          2HB       PHE  30  -0.184  -6.168  -6.657
  235   2HB   PHE  30          1HB       PHE  30  -0.744  -4.562  -7.078
  236    HD1  PHE  30           HD2      PHE  30  -1.535  -5.071  -3.697
  237    HD2  PHE  30           HD1      PHE  30   1.755  -4.275  -6.277
  238    HE1  PHE  30           HE2      PHE  30  -0.284  -4.133  -1.805
  239    HE2  PHE  30           HE1      PHE  30   3.011  -3.333  -4.387
  240    HZ   PHE  30           HZ       PHE  30   1.992  -3.260  -2.147
  241    H    ILE  31           H        ILE  31  -1.161  -8.074  -6.281
  242    HA   ILE  31           HA       ILE  31  -2.534  -9.214  -3.987
  243    HB   ILE  31           HB       ILE  31  -0.654 -10.531  -5.945
  244   1HG1  ILE  31          2HG1      ILE  31  -2.670  -9.628  -7.034
  245   2HG1  ILE  31          1HG1      ILE  31  -2.668 -11.389  -7.033
  246   1HG2  ILE  31          1HG2      ILE  31  -2.216 -12.515  -5.015
  247   2HG2  ILE  31          2HG2      ILE  31  -2.142 -11.484  -3.586
  248   3HG2  ILE  31          3HG2      ILE  31  -0.654 -12.091  -4.313
  249   1HD1  ILE  31          1HD1      ILE  31  -3.997 -10.507  -4.689
  250   2HD1  ILE  31          2HD1      ILE  31  -4.652 -11.390  -6.069
  251   3HD1  ILE  31          3HD1      ILE  31  -4.652  -9.626  -6.070
  252    H    TYR  32           H        TYR  32  -1.632  -8.654  -2.105
  253    HA   TYR  32           HA       TYR  32   1.257  -8.591  -1.779
  254   1HB   TYR  32          2HB       TYR  32  -0.043  -6.793  -0.778
  255   2HB   TYR  32          1HB       TYR  32  -0.999  -7.956   0.133
  256    HD1  TYR  32           HD1      TYR  32  -0.028  -9.125   2.059
  257    HD2  TYR  32           HD2      TYR  32   2.173  -6.169  -0.068
  258    HE1  TYR  32           HE1      TYR  32   1.563  -8.972   3.928
  259    HE2  TYR  32           HE2      TYR  32   3.771  -6.010   1.795
  260    HH   TYR  32           HH       TYR  32   3.356  -6.728   4.641
  261    HN2  GLY  33           H        GLY  33   2.437 -10.151  -0.892
  262   1HA   GLY  33          2HA       GLY  33   1.005 -12.456   0.260
  263   2HA   GLY  33          1HA       GLY  33   2.572 -12.540  -0.530
  264    HN2  GLY  34           H        GLY  34   3.621 -10.172   0.834
  265   1HA   GLY  34          2HA       GLY  34   3.576  -9.913   3.468
  266   2HA   GLY  34          1HA       GLY  34   4.302 -11.505   3.343
  267    H    CYS  35           H        CYS  35   5.541 -10.315   0.699
  268    HA   CYS  35           HA       CYS  35   7.846  -9.145   2.100
  269   1HB   CYS  35          2HB       CYS  35   7.820 -10.392  -0.652
  270   2HB   CYS  35          1HB       CYS  35   9.230  -9.934   0.296
  271    HN2  GLY  36           H        GLY  36   7.965  -7.013   1.973
  272   1HA   GLY  36          2HA       GLY  36   8.526  -5.160   0.465
  273   2HA   GLY  36          1HA       GLY  36   7.243  -5.730  -0.588
  274    HN2  GLY  37           H        GLY  37   6.636  -5.784   2.810
  275   1HA   GLY  37          2HA       GLY  37   4.824  -3.485   2.457
  276   2HA   GLY  37          1HA       GLY  37   4.564  -4.804   3.589
  277    H    ASN  38           H        ASN  38   5.838  -1.692   3.147
  278    HA   ASN  38           HA       ASN  38   7.149  -1.808   5.781
  279   1HB   ASN  38          2HB       ASN  38   8.136   0.484   4.804
  280   2HB   ASN  38          1HB       ASN  38   8.898  -1.075   4.514
  281   1HD2  ASN  38          1HD2      ASN  38   9.757  -0.815   2.554
  282   2HD2  ASN  38          2HD2      ASN  38   8.873  -0.390   1.131
  283    HN2  GLY  39           H        GLY  39   6.128   1.056   3.957
  284   1HA   GLY  39          2HA       GLY  39   4.056   1.547   5.987
  285   2HA   GLY  39          1HA       GLY  39   5.287   2.765   5.702
  286    H    ASN  40           H        ASN  40   4.734   1.362   2.765
  287    HA   ASN  40           HA       ASN  40   3.007   3.574   1.977
  288   1HB   ASN  40          2HB       ASN  40   5.067   3.213   0.700
  289   2HB   ASN  40          1HB       ASN  40   4.542   1.582   0.296
  290   1HD2  ASN  40          1HD2      ASN  40   4.126   4.962  -0.312
  291   2HD2  ASN  40          2HD2      ASN  40   3.139   4.800  -1.720
  292    H    LYS  41           H        LYS  41   2.910   0.144   2.413
  293    HA   LYS  41           HA       LYS  41   0.506  -0.190   0.823
  294   1HB   LYS  41          2HB       LYS  41   0.635  -2.538   1.500
  295   2HB   LYS  41          1HB       LYS  41   2.173  -1.980   0.860
  296   1HG   LYS  41          2HG       LYS  41   3.245  -2.307   2.800
  297   2HG   LYS  41          1HG       LYS  41   1.893  -1.712   3.765
  298   1HD   LYS  41          2HD       LYS  41   0.875  -4.041   2.796
  299   2HD   LYS  41          1HD       LYS  41   2.584  -4.452   2.961
  300   1HE   LYS  41          2HE       LYS  41   1.326  -4.991   4.990
  301   2HE   LYS  41          1HE       LYS  41   2.547  -3.756   5.290
  302   1HZ   LYS  41          1HZ       LYS  41   0.954  -2.112   5.494
  303   2HZ   LYS  41          2HZ       LYS  41   0.200  -3.431   6.238
  304   3HZ   LYS  41          3HZ       LYS  41  -0.229  -2.990   4.663
  305    H    PHE  42           H        PHE  42  -1.400  -1.293   1.815
  306    HA   PHE  42           HA       PHE  42  -1.861  -1.032   4.619
  307   1HB   PHE  42          2HB       PHE  42  -2.620   1.171   2.830
  308   2HB   PHE  42          1HB       PHE  42  -3.935   0.588   3.846
  309    HD1  PHE  42           HD2      PHE  42  -3.561   0.490   6.347
  310    HD2  PHE  42           HD1      PHE  42  -0.962   2.565   3.694
  311    HE1  PHE  42           HE2      PHE  42  -2.679   1.792   8.237
  312    HE2  PHE  42           HE1      PHE  42  -0.073   3.871   5.580
  313    HZ   PHE  42           HZ       PHE  42  -0.932   3.486   7.855
  314    HA   PRO  43           HA       PRO  43  -4.683  -4.277   3.582
  315   1HB   PRO  43          2HB       PRO  43  -6.231  -3.387   5.949
  316   2HB   PRO  43          1HB       PRO  43  -5.533  -4.969   5.589
  317   1HG   PRO  43          2HG       PRO  43  -4.437  -3.371   7.423
  318   2HG   PRO  43          1HG       PRO  43  -3.430  -4.362   6.349
  319   1HD   PRO  43          2HD       PRO  43  -4.036  -1.434   6.217
  320   2HD   PRO  43          1HD       PRO  43  -2.512  -2.288   5.896
  321    H    THR  44           H        THR  44  -6.209  -1.253   4.722
  322    HA   THR  44           HA       THR  44  -8.339  -1.700   2.737
  323    HB   THR  44           HB       THR  44  -9.577   0.020   4.240
  324    HG1  THR  44           HG1      THR  44  -7.664  -0.974   6.080
  325   1HG2  THR  44          1HG2      THR  44  -9.199  -2.489   5.757
  326   2HG2  THR  44          2HG2      THR  44  -9.809  -2.614   4.106
  327   3HG2  THR  44          3HG2      THR  44 -10.679  -1.647   5.298
  328    H    GLN  45           H        GLN  45  -9.050  -0.001   1.455
  329    HA   GLN  45           HA       GLN  45  -7.078   1.810   0.575
  330   1HB   GLN  45          2HB       GLN  45  -8.912   0.945  -0.848
  331   2HB   GLN  45          1HB       GLN  45 -10.061   1.896   0.083
  332   1HG   GLN  45          2HG       GLN  45  -8.395   3.849  -0.621
  333   2HG   GLN  45          1HG       GLN  45  -8.108   2.745  -1.965
  334   1HE2  GLN  45          1HE2      GLN  45 -10.010   2.007  -3.154
  335   2HE2  GLN  45          2HE2      GLN  45 -11.348   3.085  -3.335
  336    H    GLU  46           H        GLU  46  -9.562   2.038   2.989
  337    HA   GLU  46           HA       GLU  46  -9.911   4.792   3.168
  338   1HB   GLU  46          2HB       GLU  46 -11.189   3.012   4.419
  339   2HB   GLU  46          1HB       GLU  46  -9.821   2.897   5.518
  340   1HG   GLU  46          2HG       GLU  46 -10.158   5.069   6.338
  341   2HG   GLU  46          1HG       GLU  46 -11.243   5.488   5.013
  342    H    ALA  47           H        ALA  47  -7.432   2.718   4.597
  343    HA   ALA  47           HA       ALA  47  -6.150   4.810   6.052
  344   1HB   ALA  47          1HB       ALA  47  -5.071   2.123   5.209
  345   2HB   ALA  47          2HB       ALA  47  -5.946   2.460   6.703
  346   3HB   ALA  47          3HB       ALA  47  -4.366   3.192   6.421
  347    H    CYS  48           H        CYS  48  -5.966   3.605   2.806
  348    HA   CYS  48           HA       CYS  48  -3.413   4.648   2.139
  349   1HB   CYS  48          2HB       CYS  48  -4.318   2.899   0.785
  350   2HB   CYS  48          1HB       CYS  48  -5.786   3.814   0.469
  351    H    MET  49           H        MET  49  -6.623   6.018   2.225
  352    HA   MET  49           HA       MET  49  -5.801   8.379   0.743
  353   1HB   MET  49          2HB       MET  49  -8.350   7.212   1.644
  354   2HB   MET  49          1HB       MET  49  -8.290   8.969   1.681
  355   1HG   MET  49          2HG       MET  49  -9.196   8.107  -0.420
  356   2HG   MET  49          1HG       MET  49  -7.721   9.043  -0.660
  357   1HE   MET  49          1HE       MET  49  -9.137   7.467  -2.577
  358   2HE   MET  49          2HE       MET  49  -9.058   5.707  -2.488
  359   3HE   MET  49          3HE       MET  49  -7.884   6.595  -3.461
  360    H    LYS  50           H        LYS  50  -6.955   7.632   4.030
  361    HA   LYS  50           HA       LYS  50  -6.660  10.276   4.994
  362   1HB   LYS  50          2HB       LYS  50  -7.022   9.350   7.189
  363   2HB   LYS  50          1HB       LYS  50  -8.103   8.561   6.048
  364   1HG   LYS  50          2HG       LYS  50  -6.575   6.645   5.949
  365   2HG   LYS  50          1HG       LYS  50  -5.533   7.431   7.135
  366   1HD   LYS  50          2HD       LYS  50  -8.438   6.855   7.665
  367   2HD   LYS  50          1HD       LYS  50  -7.161   5.690   8.019
  368   1HE   LYS  50          2HE       LYS  50  -6.053   7.528   9.367
  369   2HE   LYS  50          1HE       LYS  50  -7.560   8.428   9.198
  370   1HZ   LYS  50          1HZ       LYS  50  -8.598   6.258  10.118
  371   2HZ   LYS  50          2HZ       LYS  50  -7.861   7.345  11.184
  372   3HZ   LYS  50          3HZ       LYS  50  -7.037   5.952  10.695
  373    H    ARG  51           H        ARG  51  -4.294   8.036   4.157
  374    HA   ARG  51           HA       ARG  51  -2.389   9.100   6.117
  375   1HB   ARG  51          2HB       ARG  51  -2.663   6.594   5.746
  376   2HB   ARG  51          1HB       ARG  51  -1.886   6.842   4.189
  377   1HG   ARG  51          2HG       ARG  51   0.061   6.577   5.209
  378   2HG   ARG  51          1HG       ARG  51  -0.225   8.116   6.023
  379   1HD   ARG  51          2HD       ARG  51  -0.755   5.334   7.015
  380   2HD   ARG  51          1HD       ARG  51   0.219   6.602   7.755
  381    HE   ARG  51           HE       ARG  51  -2.384   7.550   7.634
  382   1HH1  ARG  51          1HH1      ARG  51  -0.653   4.943   9.180
  383   2HH1  ARG  51          2HH1      ARG  51  -1.725   4.872  10.539
  384   1HH2  ARG  51          1HH2      ARG  51  -3.794   7.458   9.420
  385   2HH2  ARG  51          2HH2      ARG  51  -3.508   6.300  10.676
  386    H    CYS  52           H        CYS  52  -2.707   8.547   2.608
  387    HA   CYS  52           HA       CYS  52  -0.451  10.373   2.182
  388   1HB   CYS  52          2HB       CYS  52  -0.929   7.955   1.057
  389   2HB   CYS  52          1HB       CYS  52  -1.653   9.015  -0.147
  390    H    ALA  53           H        ALA  53  -3.882  10.061   1.642
  391    HA   ALA  53           HA       ALA  53  -3.972  12.339  -0.150
  392   1HB   ALA  53          1HB       ALA  53  -6.462  11.247   1.031
  393   2HB   ALA  53          2HB       ALA  53  -5.532  10.190  -0.033
  394   3HB   ALA  53          3HB       ALA  53  -6.113  11.747  -0.625
  395    H    LYS  54           H        LYS  54  -4.386  11.671   3.235
  396    HA   LYS  54           HA       LYS  54  -5.543  14.312   3.712
  397   1HB   LYS  54          2HB       LYS  54  -5.381  11.776   5.226
  398   2HB   LYS  54          1HB       LYS  54  -5.282  13.245   6.186
  399   1HG   LYS  54          2HG       LYS  54  -7.393  13.794   4.555
  400   2HG   LYS  54          1HG       LYS  54  -7.559  12.055   4.794
  401   1HD   LYS  54          2HD       LYS  54  -8.109  12.279   6.968
  402   2HD   LYS  54          1HD       LYS  54  -6.952  13.587   7.228
  403   1HE   LYS  54          2HE       LYS  54  -9.292  14.214   5.535
  404   2HE   LYS  54          1HE       LYS  54  -9.615  13.938   7.246
  405   1HZ   LYS  54          1HZ       LYS  54  -9.154  16.145   7.289
  406   2HZ   LYS  54          2HZ       LYS  54  -8.107  16.087   5.962
  407   3HZ   LYS  54          3HZ       LYS  54  -7.576  15.563   7.480
  408    H    ALA  55           H        ALA  55  -2.868  12.352   5.032
  409    HA   ALA  55           HA       ALA  55  -1.555  14.758   5.997
  410   1HB   ALA  55          1HB       ALA  55  -0.844  11.840   6.247
  411   2HB   ALA  55          2HB       ALA  55  -1.552  12.878   7.485
  412   3HB   ALA  55          3HB       ALA  55   0.102  13.158   6.940