*HEADER    MEMBRANE PROTEIN                        19-JUN-09   2KKG              
*TITLE     NMR STRUCTURE OF THE OCTAREPEAT REGION OF PRION PROTEIN               
*TITLE    2 BOUND TO PENTOSAN POLYSULFATE                                        
*COMPND    MOL_ID: 1;                                                            
*COMPND   2 MOLECULE: MAJOR PRION PROTEIN;                                       
*COMPND   3 CHAIN: A;                                                            
*COMPND   4 SYNONYM: PRP, PRP27-30, PRP33-35C;                                   
*COMPND   5 ENGINEERED: YES                                                      
*SOURCE    MOL_ID: 1;                                                            
*SOURCE   2 ORGANISM_SCIENTIFIC: MESOCRICETUS AURATUS;                           
*SOURCE   3 ORGANISM_COMMON: GOLDEN HAMSTERS;                                    
*SOURCE   4 GENE: PRNP, PRP;                                                     
*SOURCE   5 EXPRESSION_SYSTEM: ESCHERICHIA COLI;                                 
*SOURCE   6 EXPRESSION_SYSTEM_VECTOR_TYPE: PLASMID;                              
*SOURCE   7 EXPRESSION_SYSTEM_VECTOR: PET-41                                     
*KEYWDS    PRION PROTEIN, OCTAPEPTIDE REPEATS, PENTOSAN POLYSULFATE,             
*KEYWDS   2 NMR, SULFATED GLYCANS, CELL MEMBRANE, DISULFIDE BOND,                
*KEYWDS   3 GLYCOPROTEIN, GOLGI APPARATUS, GPI-ANCHOR, LIPOPROTEIN,              
*KEYWDS   4 MEMBRANE, PRION, MEMBRANE PROTEIN                                    
*EXPDTA    NMR, 20 STRUCTURES                                                    
*AUTHOR    L.M.TAUBNER, B.CAUGHEY, V.COPIE                                       
*REVDAT   1   10-NOV-09 2KKG    0                                                


!NOE table for 4mer
!02/09/09

!G58 HN
assign (resid 58 and name HN) (resid 57 and name HB#) 3.0 1.2 0.5
assign (resid 58 and name HN) (resid 58 and name HA#) 3.0 1.2 0.5
assign (resid 58 and name HN) (resid 57 and name HA) 2.5 0.7 0.5
assign (resid 58 and name HN) (resid 57 and name HD1) 4.5 2.7 0.5
assign (resid 58 and name HN) (resid 57 and name HE3) 4.5 2.7 0.5

!Q59 HN
assign (resid 59 and name HN) (resid 59 and name HB#) 3.0 1.2 0.5
assign (resid 59 and name HN) (resid 59 and name HG#) 4.0 2.2 0.5
assign (resid 59 and name HN) (resid 57 and name HB#) 4.0 2.2 0.5
assign (resid 59 and name HN) (resid 60 and name HD#) 4.0 2.2 0.5
assign (resid 59 and name HN) (resid 58 and name HA#) 2.5 0.7 0.5
assign (resid 59 and name HN) (resid 59 and name HA) 3.0 1.2 0.5
assign (resid 59 and name HN) (resid 57 and name HE3) 4.5 2.7 0.5
assign (resid 59 and name HN) (resid 57 and name HD1) 4.5 2.7 0.5

!Q59 HA
assign (resid 59 and name HA) (resid 59 and name HB#) 3.0 1.2 0.5
assign (resid 59 and name HA) (resid 59 and name HG#) 4.0 2.2 0.5
assign (resid 59 and name HA) (resid 60 and name HD#) 2.5 0.7 0.5
assign (resid 59 and name HA) (resid 58 and name HA#) 4.0 2.2 0.5

!Q59 HG
assign (resid 59 and name HG#) (resid 59 and name HB#) 3.0 1.2 0.5
assign (resid 59 and name HG#) (resid 60 and name HD#) 4.0 2.2 0.5
assign (resid 59 and name HG#) (resid 61 and name HB#) 4.5 2.7 0.5
assign (resid 59 and name HG#) (resid 58 and name HA#) 4.0 2.2 0.5

!Q59 HB
assign (resid 59 and name HB#) (resid 60 and name HD#) 4.5 2.7 0.5

!P60 HA 
assign (resid 60 and name HA) (resid 59 and name HG#) 4.5 2.7 0.5
assign (resid 60 and name HA) (resid 61 and name HB#) 4.5 2.7 0.5
assign (resid 60 and name HA) (resid 64 and name HA#) 4.5 2.7 0.5
assign (resid 60 and name HA) (resid 59 and name HA) 4.0 2.2 0.5

!P60 HB
assign (resid 60 and name HB#) (resid 59 and name HG#) 4.5 2.7 0.5
assign (resid 60 and name HB#) (resid 59 and name HA) 4.5 2.7 0.5

!P60 HG
assign (resid 60 and name HG#) (resid 59 and name HG#) 4.5 2.7 0.5
assign (resid 60 and name HG#) (resid 59 and name HA) 4.0 2.2 0.5

!H61 HN
assign (resid 61 and name HN) (resid 60 and name HG#) 4.5 2.7 0.5
assign (resid 61 and name HN) (resid 60 and name HB#) 4.0 2.2 0.5
assign (resid 61 and name HN) (resid 61 and name HB#) 3.0 1.2 0.5
assign (resid 61 and name HN) (resid 60 and name HD#) 4.5 2.7 0.5
assign (resid 61 and name HN) (resid 62 and name HA#) 4.5 2.7 0.5
assign (resid 61 and name HN) (resid 60 and name HA) 2.5 0.7 0.5
assign (resid 61 and name HN) (resid 61 and name HA) 2.5 0.7 0.5
assign (resid 61 and name HN) (resid 61 and name HD2) 4.5 2.7 0.5

!H61 HA 
assign (resid 61 and name HA) (resid 60 and name HG#) 4.5 2.7 0.5
assign (resid 61 and name HA) (resid 60 and name HB#) 4.0 2.2 0.5
assign (resid 61 and name HA) (resid 62 and name HA#) 4.0 2.2 0.5

!H61 HB
assign (resid 61 and name HB#) (resid 61 and name HA) 3.0 1.2 0.5

!G62 HN
assign (resid 62 and name HN) (resid 61 and name HB#) 3.0 1.2 0.5
assign (resid 62 and name HN) (resid 62 and name HA#) 2.5 0.7 0.5
assign (resid 62 and name HN) (resid 61 and name HA) 3.0 1.2 0.5
assign (resid 62 and name HN) (resid 60 and name HG#) 4.5 2.7 0.5

!W65 HN
assign (resid 65 and name HN) (resid 60 and name HG#) 4.5 2.7 0.5
assign (resid 65 and name HN) (resid 67 and name HG#) 4.5 2.7 0.5
assign (resid 65 and name HN) (resid 65 and name HB#) 3.0 1.2 0.5
assign (resid 65 and name HN) (resid 64 and name HA#) 2.5 0.7 0.5
assign (resid 65 and name HN) (resid 65 and name HA) 2.5 0.7 0.5
assign (resid 65 and name HN) (resid 65 and name HD1) 3.0 1.2 0.5
assign (resid 65 and name HN) (resid 65 and name HE3) 4.5 2.7 0.5

!W65 HA
assign (resid 65 and name HA) (resid 67 and name HG#) 4.5 2.7 0.5
assign (resid 65 and name HA) (resid 66 and name HA#) 4.0 2.2 0.5
assign (resid 65 and name HA) (resid 60 and name HA) 4.5 2.7 0.5

!W65 HB
assign (resid 65 and name HB#) (resid 67 and name HG#) 4.5 2.7 0.5

!W65 HE1
assign (resid 65 and name HE1) (resid 67 and name HB#) 4.5 2.7 0.5
assign (resid 65 and name HE1) (resid 67 and name HG#) 4.5 2.7 0.5
assign (resid 65 and name HE1) (resid 65 and name HB#) 4.0 2.2 0.5
assign (resid 65 and name HE1) (resid 60 and name HD#) 4.5 2.7 0.5
assign (resid 65 and name HE1) (resid 64 and name HA#) 3.0 1.2 0.5
assign (resid 65 and name HE1) (resid 60 and name HA) 4.5 2.7 0.5
assign (resid 65 and name HE1) (resid 65 and name HD1) 3.0 1.2 0.5
assign (resid 65 and name HE1) (resid 65 and name HN) 4.5 2.7 0.5

!G66 HN
assign (resid 66 and name HN) (resid 67 and name HB#) 4.5 2.7 0.5
assign (resid 66 and name HN) (resid 67 and name HG#) 4.5 2.7 0.5
assign (resid 66 and name HN) (resid 66 and name HA#) 2.5 0.7 0.5
assign (resid 66 and name HN) (resid 65 and name HA) 3.0 1.2 0.5
assign (resid 66 and name HN) (resid 65 and name HD1) 4.5 2.7 0.5
assign (resid 66 and name HN) (resid 65 and name HE3) 4.5 2.7 0.5
assign (resid 66 and name HN) (resid 65 and name HN) 3.0 1.2 0.5

!Q67 HN
assign (resid 67 and name HN) (resid 67 and name HB#) 3.0 1.2 0.5
assign (resid 67 and name HN) (resid 67 and name HG#) 4.0 2.2 0.5
assign (resid 67 and name HN) (resid 65 and name HB#) 4.0 2.2 0.5
assign (resid 67 and name HN) (resid 68 and name HD#) 4.0 2.2 0.5
assign (resid 67 and name HN) (resid 66 and name HA#) 2.5 0.7 0.5
assign (resid 67 and name HN) (resid 67 and name HA) 3.0 1.2 0.5
assign (resid 67 and name HN) (resid 65 and name HE3) 4.5 2.7 0.5
assign (resid 67 and name HN) (resid 65 and name HD1) 4.5 2.7 0.5
assign (resid 67 and name HN) (resid 66 and name HN) 3.0 1.2 0.5

!Q67 HA
assign (resid 67 and name HA) (resid 67 and name HB#) 3.0 1.2 0.5
assign (resid 67 and name HA) (resid 67 and name HG#) 4.0 2.2 0.5
assign (resid 67 and name HA) (resid 68 and name HD#) 3.0 1.2 0.5
assign (resid 67 and name HA) (resid 66 and name HA#) 4.0 2.2 0.5

!Q67 HG
assign (resid 67 and name HG#) (resid 68 and name HD#) 4.0 2.2 0.5
assign (resid 67 and name HG#) (resid 69 and name HB#) 4.5 2.7 0.5
assign (resid 67 and name HG#) (resid 66 and name HA#) 4.0 2.2 0.5

!Q67 HB
assign (resid 67 and name HB#) (resid 68 and name HD#) 4.5 2.7 0.5

!P68 HA 
assign (resid 68 and name HA) (resid 67 and name HG#) 4.5 2.7 0.5
assign (resid 68 and name HA) (resid 69 and name HB#) 4.5 2.7 0.5
assign (resid 68 and name HA) (resid 72 and name HA#) 4.5 2.7 0.5
assign (resid 68 and name HA) (resid 67 and name HA) 4.0 2.2 0.5

!P68 HB
assign (resid 68 and name HB#) (resid 67 and name HG#) 4.5 2.7 0.5
assign (resid 68 and name HB#) (resid 67 and name HA) 4.5 2.7 0.5

!P68 HG
assign (resid 68 and name HG#) (resid 67 and name HG#) 4.5 2.7 0.5
assign (resid 68 and name HG#) (resid 67 and name HA) 4.0 2.2 0.5

!H69 HN
assign (resid 69 and name HN) (resid 68 and name HG#) 4.5 2.7 0.5
assign (resid 69 and name HN) (resid 68 and name HB#) 4.0 2.2 0.5
assign (resid 69 and name HN) (resid 69 and name HB#) 3.0 1.2 0.5
assign (resid 69 and name HN) (resid 68 and name HD#) 4.5 2.7 0.5
assign (resid 69 and name HN) (resid 70 and name HA#) 4.5 2.7 0.5
assign (resid 69 and name HN) (resid 68 and name HA) 2.5 0.7 0.5
assign (resid 69 and name HN) (resid 69 and name HA) 2.5 0.7 0.5
assign (resid 69 and name HN) (resid 69 and name HD2) 4.5 2.7 0.5

!H69 HA 
assign (resid 69 and name HA) (resid 68 and name HG#) 4.5 2.7 0.5
assign (resid 69 and name HA) (resid 68 and name HB#) 4.0 2.2 0.5
assign (resid 69 and name HA) (resid 70 and name HA#) 4.0 2.2 0.5

!H69 HB
assign (resid 69 and name HB#) (resid 69 and name HA) 3.0 1.2 0.5

!G70 HN
assign (resid 70 and name HN) (resid 69 and name HB#) 3.0 1.2 0.5
assign (resid 70 and name HN) (resid 70 and name HA#) 2.5 0.7 0.5
assign (resid 70 and name HN) (resid 69 and name HA) 3.0 1.2 0.5
assign (resid 70 and name HN) (resid 68 and name HG#) 4.5 2.7 0.5

!W73 HN 
assign (resid 73 and name HN) (resid 68 and name HG#) 4.5 2.7 0.5
assign (resid 73 and name HN) (resid 75 and name HG#) 4.5 2.7 0.5
assign (resid 73 and name HN) (resid 73 and name HB#) 3.0 1.2 0.5
assign (resid 73 and name HN) (resid 72 and name HA#) 2.5 0.7 0.5
assign (resid 73 and name HN) (resid 73 and name HA) 2.5 0.7 0.5
assign (resid 73 and name HN) (resid 73 and name HD1) 3.0 1.2 0.5
assign (resid 73 and name HN) (resid 73 and name HE3) 4.5 2.7 0.5

!W73 HA 
assign (resid 73 and name HA) (resid 75 and name HG#) 4.5 2.7 0.5
assign (resid 73 and name HA) (resid 74 and name HA#) 4.0 2.2 0.5
assign (resid 73 and name HA) (resid 68 and name HA) 4.5 2.7 0.5

!W73 HB 
assign (resid 73 and name HB#) (resid 75 and name HG#) 4.5 2.7 0.5

!W73 HE1 
assign (resid 73 and name HE1) (resid 75 and name HB#) 4.5 2.7 0.5
assign (resid 73 and name HE1) (resid 75 and name HG#) 4.5 2.7 0.5
assign (resid 73 and name HE1) (resid 73 and name HB#) 4.0 2.2 0.5
assign (resid 73 and name HE1) (resid 68 and name HD#) 4.5 2.7 0.5
assign (resid 73 and name HE1) (resid 72 and name HA#) 3.0 1.2 0.5
assign (resid 73 and name HE1) (resid 68 and name HA) 4.5 2.7 0.5
assign (resid 73 and name HE1) (resid 73 and name HD1) 3.0 1.2 0.5
assign (resid 73 and name HE1) (resid 73 and name HN) 4.5 2.7 0.5

!G74 HN
assign (resid 74 and name HN) (resid 75 and name HB#) 4.5 2.7 0.5
assign (resid 74 and name HN) (resid 75 and name HG#) 4.5 2.7 0.5
assign (resid 74 and name HN) (resid 74 and name HA#) 2.5 0.7 0.5
assign (resid 74 and name HN) (resid 73 and name HA) 3.0 1.2 0.5
assign (resid 74 and name HN) (resid 73 and name HD1) 4.5 2.7 0.5
assign (resid 74 and name HN) (resid 73 and name HE3) 4.5 2.7 0.5
assign (resid 74 and name HN) (resid 73 and name HN) 3.0 1.2 0.5

!Q75 HN
assign (resid 75 and name HN) (resid 75 and name HB#) 3.0 1.2 0.5
assign (resid 75 and name HN) (resid 75 and name HG#) 4.0 2.2 0.5
assign (resid 75 and name HN) (resid 73 and name HB#) 4.0 2.2 0.5
assign (resid 75 and name HN) (resid 76 and name HD#) 4.0 2.2 0.5
assign (resid 75 and name HN) (resid 74 and name HA#) 2.5 0.7 0.5
assign (resid 75 and name HN) (resid 75 and name HA) 3.0 1.2 0.5
assign (resid 75 and name HN) (resid 73 and name HE3) 4.5 2.7 0.5
assign (resid 75 and name HN) (resid 73 and name HD1) 4.5 2.7 0.5
assign (resid 75 and name HN) (resid 74 and name HN) 3.0 1.2 0.5

!Q75 HA
assign (resid 75 and name HA) (resid 75 and name HB#) 3.0 1.2 0.5
assign (resid 75 and name HA) (resid 75 and name HG#) 4.0 2.2 0.5
assign (resid 75 and name HA) (resid 76 and name HD#) 3.0 1.2 0.5
assign (resid 75 and name HA) (resid 74 and name HA#) 4.0 2.2 0.5

!Q75 HG
assign (resid 75 and name HG#) (resid 75 and name HB#) 3.0 1.2 0.5
assign (resid 75 and name HG#) (resid 76 and name HD#) 4.0 2.2 0.5
assign (resid 75 and name HG#) (resid 77 and name HB#) 4.5 2.7 0.5
assign (resid 75 and name HG#) (resid 74 and name HA#) 4.0 2.2 0.5

!Q75 HB
assign (resid 75 and name HB#) (resid 76 and name HD#) 4.5 2.7 0.5

!P76 HA
assign (resid 76 and name HA) (resid 75 and name HG#) 4.5 2.7 0.5
assign (resid 76 and name HA) (resid 77 and name HB#) 4.5 2.7 0.5
assign (resid 76 and name HA) (resid 80 and name HA#) 4.5 2.7 0.5
assign (resid 76 and name HA) (resid 75 and name HA) 4.0 2.2 0.5

!P76 HB
assign (resid 76 and name HB#) (resid 75 and name HG#) 4.5 2.7 0.5
assign (resid 76 and name HB#) (resid 75 and name HA) 4.5 2.7 0.5

!P76 HG
assign (resid 76 and name HG#) (resid 75 and name HG#) 4.5 2.7 0.5
assign (resid 76 and name HG#) (resid 75 and name HA) 4.0 2.2 0.5

!H77 HN
assign (resid 77 and name HN) (resid 76 and name HG#) 4.5 2.7 0.5
assign (resid 77 and name HN) (resid 76 and name HB#) 4.0 2.2 0.5
assign (resid 77 and name HN) (resid 77 and name HB#) 3.0 1.2 0.5
assign (resid 77 and name HN) (resid 76 and name HD#) 4.5 2.7 0.5
assign (resid 77 and name HN) (resid 78 and name HA#) 4.5 2.7 0.5
assign (resid 77 and name HN) (resid 76 and name HA) 2.5 0.7 0.5
assign (resid 77 and name HN) (resid 77 and name HA) 2.5 0.7 0.5
assign (resid 77 and name HN) (resid 77 and name HD2) 4.5 2.7 0.5

!H77 
assign (resid 77 and name HA) (resid 76 and name HG#) 4.5 2.7 0.5
assign (resid 77 and name HA) (resid 76 and name HB#) 4.0 2.2 0.5
assign (resid 77 and name HA) (resid 78 and name HA#) 4.0 2.2 0.5

!H77 HB
assign (resid 77 and name HB#) (resid 77 and name HA) 3.0 1.2 0.5

!G78 HN
assign (resid 78 and name HN) (resid 77 and name HB#) 3.0 1.2 0.5
assign (resid 78 and name HN) (resid 78 and name HA#) 2.5 0.7 0.5
assign (resid 78 and name HN) (resid 77 and name HA) 3.0 1.2 0.5
assign (resid 78 and name HN) (resid 76 and name HG#) 4.5 2.7 0.5

!G79

!G80

!W81 HN
assign (resid 81 and name HN) (resid 76 and name HG#) 4.5 2.7 0.5
assign (resid 81 and name HN) (resid 83 and name HG#) 4.5 2.7 0.5
assign (resid 81 and name HN) (resid 81 and name HB#) 3.0 1.2 0.5
assign (resid 81 and name HN) (resid 80 and name HA#) 2.5 0.7 0.5
assign (resid 81 and name HN) (resid 81 and name HA) 2.5 0.7 0.5
assign (resid 81 and name HN) (resid 81 and name HD1) 3.0 1.2 0.5
assign (resid 81 and name HN) (resid 81 and name HE3) 4.5 2.7 0.5

!W81 HA 
assign (resid 81 and name HA) (resid 83 and name HG#) 4.5 2.7 0.5
assign (resid 81 and name HA) (resid 82 and name HA#) 4.0 2.2 0.5
assign (resid 81 and name HA) (resid 76 and name HA) 4.5 2.7 0.5

!W81 HB 
assign (resid 81 and name HN) (resid 83 and name HG#) 4.5 2.7 0.5

!W81 HE1 
assign (resid 81 and name HE1) (resid 83 and name HB#) 4.5 2.7 0.5
assign (resid 81 and name HE1) (resid 83 and name HG#) 4.5 2.7 0.5
assign (resid 81 and name HE1) (resid 81 and name HB#) 4.0 2.2 0.5
assign (resid 81 and name HE1) (resid 76 and name HD#) 4.5 2.7 0.5
assign (resid 81 and name HE1) (resid 80 and name HA#) 3.0 1.2 0.5
assign (resid 81 and name HE1) (resid 76 and name HA) 4.5 2.7 0.5
assign (resid 81 and name HE1) (resid 81 and name HD1) 3.0 1.2 0.5
assign (resid 81 and name HE1) (resid 81 and name HN) 4.5 2.7 0.5

!G82 HN
assign (resid 82 and name HN) (resid 83 and name HB#) 4.5 2.7 0.5
assign (resid 82 and name HN) (resid 83 and name HG#) 4.5 2.7 0.5
assign (resid 82 and name HN) (resid 82 and name HA#) 2.5 0.7 0.5
assign (resid 82 and name HN) (resid 81 and name HA) 3.0 1.2 0.5
assign (resid 82 and name HN) (resid 81 and name HD1) 4.5 2.7 0.5
assign (resid 82 and name HN) (resid 81 and name HE3) 4.5 2.7 0.5
assign (resid 82 and name HN) (resid 81 and name HN) 3.0 1.2 0.5

!Q83 HN
assign (resid 83 and name HN) (resid 83 and name HB#) 3.0 1.2 0.5
assign (resid 83 and name HN) (resid 83 and name HG#) 4.0 2.2 0.5
assign (resid 83 and name HN) (resid 81 and name HB#) 4.0 2.2 0.5
assign (resid 83 and name HN) (resid 84 and name HD#) 4.0 2.2 0.5
assign (resid 83 and name HN) (resid 82 and name HA#) 2.5 0.7 0.5
assign (resid 83 and name HN) (resid 83 and name HA) 3.0 1.2 0.5
assign (resid 83 and name HN) (resid 81 and name HE3) 4.5 2.7 0.5
assign (resid 83 and name HN) (resid 81 and name HD1) 4.5 2.7 0.5
assign (resid 83 and name HN) (resid 82 and name HN) 3.0 1.2 0.5

!Q83 HA
assign (resid 83 and name HA) (resid 83 and name HB#) 3.0 1.2 0.5
assign (resid 83 and name HA) (resid 83 and name HG#) 4.0 2.2 0.5
assign (resid 83 and name HA) (resid 84 and name HD#) 3.0 1.2 0.5
assign (resid 83 and name HA) (resid 82 and name HA#) 4.0 2.2 0.5

!Q83 HB
assign (resid 83 and name HB#) (resid 84 and name HD#) 4.5 2.7 0.5

!P84 HA
assign (resid 84 and name HA) (resid 83 and name HG#) 4.5 2.7 0.5
assign (resid 84 and name HA) (resid 85 and name HB#) 4.5 2.7 0.5
assign (resid 84 and name HA) (resid 88 and name HA#) 4.5 2.7 0.5
assign (resid 84 and name HA) (resid 83 and name HA) 4.0 2.2 0.5

!P84 HB
assign (resid 84 and name HB#) (resid 83 and name HG#) 4.5 2.7 0.5
assign (resid 84 and name HB#) (resid 83 and name HA) 4.5 2.7 0.5

!P84 HG
assign (resid 84 and name HG#) (resid 83 and name HG#) 4.5 2.7 0.5
assign (resid 84 and name HG#) (resid 83 and name HA) 4.0 2.2 0.5

!H85 HN
assign (resid 85 and name HN) (resid 84 and name HG#) 4.5 2.7 0.5
assign (resid 85 and name HN) (resid 84 and name HB#) 4.0 2.2 0.5
assign (resid 85 and name HN) (resid 85 and name HB#) 3.0 1.2 0.5
assign (resid 85 and name HN) (resid 84 and name HD#) 4.5 2.7 0.5
assign (resid 85 and name HN) (resid 86 and name HA#) 4.5 2.7 0.5
assign (resid 85 and name HN) (resid 84 and name HA) 2.5 0.7 0.5
assign (resid 85 and name HN) (resid 85 and name HA) 2.5 0.7 0.5
assign (resid 85 and name HN) (resid 85 and name HD2) 4.5 2.7 0.5

!H85 HA 
assign (resid 85 and name HA) (resid 84 and name HG#) 4.5 2.7 0.5
assign (resid 85 and name HA) (resid 84 and name HB#) 4.0 2.2 0.5
assign (resid 85 and name HA) (resid 86 and name HA#) 4.0 2.2 0.5

!H85 HB
assign (resid 85 and name HB#) (resid 85 and name HA) 3.0 1.2 0.5

!G86 HN
assign (resid 86 and name HN) (resid 85 and name HB#) 3.0 1.2 0.5
assign (resid 86 and name HN) (resid 86 and name HA#) 2.5 0.7 0.5
assign (resid 86 and name HN) (resid 85 and name HA) 3.0 1.2 0.5
assign (resid 86 and name HN) (resid 84 and name HG#) 4.5 2.7 0.5

!G87

!G88

!W89 HN
assign (resid 89 and name HN) (resid 84 and name HG#) 4.5 2.7 0.5
assign (resid 89 and name HN) (resid 91 and name HG#) 4.5 2.7 0.5
assign (resid 89 and name HN) (resid 89 and name HB#) 3.0 1.2 0.5
assign (resid 89 and name HN) (resid 88 and name HA#) 2.5 0.7 0.5
assign (resid 89 and name HN) (resid 89 and name HA) 2.5 0.7 0.5
assign (resid 89 and name HN) (resid 89 and name HD1) 3.0 1.2 0.5
assign (resid 89 and name HN) (resid 89 and name HE3) 4.5 2.7 0.5

!W89 HA 
assign (resid 89 and name HA) (resid 91 and name HG#) 4.5 2.7 0.5
assign (resid 89 and name HA) (resid 90 and name HA#) 4.0 2.2 0.5
assign (resid 89 and name HA) (resid 84 and name HA) 4.5 2.7 0.5

!W89 HB 
assign (resid 89 and name HB#) (resid 91 and name HG#) 4.5 2.7 0.5

!W89 HE1 
assign (resid 89 and name HE1) (resid 91 and name HB#) 4.5 2.7 0.5
assign (resid 89 and name HE1) (resid 91 and name HG#) 4.5 2.7 0.5
assign (resid 89 and name HE1) (resid 89 and name HB#) 4.0 2.2 0.5
assign (resid 89 and name HE1) (resid 84 and name HD#) 4.5 2.7 0.5
assign (resid 89 and name HE1) (resid 88 and name HA#) 3.0 1.2 0.5
assign (resid 89 and name HE1) (resid 84 and name HA) 4.5 2.7 0.5
assign (resid 89 and name HE1) (resid 89 and name HD1) 3.0 1.2 0.5
assign (resid 89 and name HE1) (resid 89 and name HN) 4.5 2.7 0.5

!G90 HN
assign (resid 90 and name HN) (resid 91 and name HB#) 4.5 2.7 0.5
assign (resid 90 and name HN) (resid 91 and name HG#) 4.5 2.7 0.5
assign (resid 90 and name HN) (resid 90 and name HA#) 2.5 0.7 0.5
assign (resid 90 and name HN) (resid 89 and name HA) 3.0 1.2 0.5
assign (resid 90 and name HN) (resid 89 and name HD1) 4.5 2.7 0.5
assign (resid 90 and name HN) (resid 89 and name HE3) 4.5 2.7 0.5
assign (resid 90 and name HN) (resid 89 and name HN) 3.0 1.2 0.5

!Q91 HN
assign (resid 91 and name HN) (resid 91 and name HB#) 3.0 1.2 0.5
assign (resid 91 and name HN) (resid 91 and name HG#) 4.0 2.2 0.5
assign (resid 91 and name HN) (resid 89 and name HB#) 4.0 2.2 0.5
assign (resid 91 and name HN) (resid 90 and name HA#) 2.5 0.7 0.5
assign (resid 91 and name HN) (resid 91 and name HA) 3.0 1.2 0.5
assign (resid 91 and name HN) (resid 89 and name HE3) 4.5 2.7 0.5
assign (resid 91 and name HN) (resid 89 and name HD1) 4.5 2.7 0.5
assign (resid 91 and name HN) (resid 90 and name HN) 3.0 1.2 0.5

!Q91 HA
assign (resid 91 and name HA) (resid 91 and name HB#) 3.0 1.2 0.5
assign (resid 91 and name HA) (resid 91 and name HG#) 4.0 2.2 0.5
assign (resid 91 and name HA) (resid 90 and name HA#) 4.0 2.2 0.5

!Q91 HG
assign (resid 91 and name HG#) (resid 91 and name HB#) 3.0 1.2 0.5
assign (resid 91 and name HG#) (resid 90 and name HA#) 4.0 2.2 0.5

  Entry H atom name         Submitted Coord H atom name
  Start of MODEL    1
    1    H    TRP  57           H        TRP  57  12.380   1.066 -17.634
    2    HA   TRP  57           HA       TRP  57  12.661  -0.842 -16.530
    3   1HB   TRP  57          HB2       TRP  57  14.748  -1.371 -15.279
    4   2HB   TRP  57          HB3       TRP  57  15.030  -1.068 -16.988
    5    HD1  TRP  57           HD1      TRP  57  14.572   2.119 -15.092
    6    HE1  TRP  57           HE1      TRP  57  16.850   3.247 -14.709
    7    HE3  TRP  57           HE3      TRP  57  17.628  -1.745 -16.457
    8    HZ2  TRP  57           HZ2      TRP  57  19.584   2.588 -14.953
    9    HZ3  TRP  57           HZ3      TRP  57  20.065  -1.413 -16.353
   10    HH2  TRP  57           HH2      TRP  57  21.021   0.710 -15.617
   11    H    GLY  58           H        GLY  58  13.308  -1.283 -13.965
   12   1HA   GLY  58          HA2       GLY  58  12.836   0.985 -12.275
   13   2HA   GLY  58          HA3       GLY  58  11.400  -0.007 -12.472
   14    H    GLN  59           H        GLN  59  14.636  -1.335 -12.473
   15    HA   GLN  59           HA       GLN  59  13.985  -3.172 -10.396
   16   1HB   GLN  59          HB2       GLN  59  16.244  -3.991 -10.649
   17   2HB   GLN  59          HB3       GLN  59  15.564  -3.682 -12.241
   18   1HG   GLN  59          HG2       GLN  59  16.738  -1.404 -12.070
   19   2HG   GLN  59          HG3       GLN  59  17.656  -2.141 -10.758
   20   1HE2  GLN  59          HE21      GLN  59  19.590  -2.659 -11.480
   21   2HE2  GLN  59          HE22      GLN  59  19.944  -3.435 -12.982
   22    HA   PRO  60           HA       PRO  60  15.170  -0.949  -6.782
   23   1HB   PRO  60          HB2       PRO  60  16.253  -2.918  -5.247
   24   2HB   PRO  60          HB3       PRO  60  14.516  -2.760  -5.534
   25   1HG   PRO  60          HG2       PRO  60  16.500  -4.564  -6.864
   26   2HG   PRO  60          HG3       PRO  60  14.859  -4.928  -6.301
   27   1HD   PRO  60          HD2       PRO  60  15.420  -4.449  -8.899
   28   2HD   PRO  60          HD3       PRO  60  13.873  -3.984  -8.162
   29    H    HIS  61           H        HIS  61  16.937  -0.047  -5.681
   30    HA   HIS  61           HA       HIS  61  19.507  -0.424  -7.044
   31   1HB   HIS  61          HB2       HIS  61  20.077   1.778  -5.900
   32   2HB   HIS  61          HB3       HIS  61  18.833   1.848  -7.144
   33    HD1  HIS  61           HD1      HIS  61  16.437   2.413  -6.396
   34    HD2  HIS  61           HD2      HIS  61  19.181   2.262  -3.279
   35    HE1  HIS  61           HE1      HIS  61  15.264   3.430  -4.419
   36    HE2  HIS  61           HE2      HIS  61  16.913   3.248  -2.522
   37    H    GLY  62           H        GLY  62  17.947  -0.579  -3.921
   38   1HA   GLY  62          HA2       GLY  62  20.476  -1.613  -2.793
   39   2HA   GLY  62          HA3       GLY  62  19.405  -0.566  -1.871
   40    H    GLY  63           H        GLY  63  16.936  -1.694  -2.608
   41   1HA   GLY  63          HA2       GLY  63  16.853  -4.500  -2.297
   42   2HA   GLY  63          HA3       GLY  63  16.676  -3.737  -0.724
   43    H    GLY  64           H        GLY  64  15.226  -4.246  -3.857
   44   1HA   GLY  64          HA2       GLY  64  13.042  -4.108  -4.557
   45   2HA   GLY  64          HA3       GLY  64  12.599  -4.138  -2.856
   46    H    TRP  65           H        TRP  65  10.881  -2.707  -3.855
   47    HA   TRP  65           HA       TRP  65  11.648   0.060  -3.380
   48   1HB   TRP  65          HB2       TRP  65  10.061   0.505  -5.512
   49   2HB   TRP  65          HB3       TRP  65  11.813   0.393  -5.625
   50    HD1  TRP  65           HD1      TRP  65  12.652  -2.335  -6.107
   51    HE1  TRP  65           HE1      TRP  65  11.687  -3.923  -7.882
   52    HE3  TRP  65           HE3      TRP  65   8.147  -0.043  -6.875
   53    HZ2  TRP  65           HZ2      TRP  65   9.327  -4.168  -9.416
   54    HZ3  TRP  65           HZ3      TRP  65   6.594  -1.018  -8.516
   55    HH2  TRP  65           HH2      TRP  65   7.174  -3.037  -9.760
   56    H    GLY  66           H        GLY  66   8.766  -1.322  -4.891
   57   1HA   GLY  66          HA2       GLY  66   7.229  -0.454  -2.521
   58   2HA   GLY  66          HA3       GLY  66   6.619  -0.333  -4.164
   59    H    GLN  67           H        GLN  67   8.419  -3.163  -3.558
   60    HA   GLN  67           HA       GLN  67   6.059  -4.788  -3.862
   61   1HB   GLN  67          HB2       GLN  67   7.591  -6.658  -3.989
   62   2HB   GLN  67          HB3       GLN  67   8.198  -5.342  -4.983
   63   1HG   GLN  67          HG2       GLN  67   9.730  -4.719  -3.145
   64   2HG   GLN  67          HG3       GLN  67   9.173  -6.132  -2.249
   65   1HE2  GLN  67          HE21      GLN  67  10.333  -7.900  -2.467
   66   2HE2  GLN  67          HE22      GLN  67  11.399  -8.267  -3.776
   67    HA   PRO  68           HA       PRO  68   5.237  -5.727   0.362
   68   1HB   PRO  68          HB2       PRO  68   4.549  -8.364   0.223
   69   2HB   PRO  68          HB3       PRO  68   3.490  -7.051  -0.302
   70   1HG   PRO  68          HG2       PRO  68   5.266  -8.822  -1.936
   71   2HG   PRO  68          HG3       PRO  68   3.609  -8.282  -2.270
   72   1HD   PRO  68          HD2       PRO  68   5.752  -7.144  -3.446
   73   2HD   PRO  68          HD3       PRO  68   4.302  -6.210  -3.022
   74    H    HIS  69           H        HIS  69   5.971  -6.933   2.208
   75    HA   HIS  69           HA       HIS  69   8.651  -8.072   1.806
   76   1HB   HIS  69          HB2       HIS  69   8.971  -7.554   4.242
   77   2HB   HIS  69          HB3       HIS  69   8.725  -6.140   3.225
   78    HD1  HIS  69           HD1      HIS  69   6.522  -4.820   3.539
   79    HD2  HIS  69           HD2      HIS  69   6.946  -8.060   6.106
   80    HE1  HIS  69           HE1      HIS  69   4.746  -4.524   5.294
   81    HE2  HIS  69           HE2      HIS  69   5.079  -6.448   6.886
   82    H    GLY  70           H        GLY  70   5.493  -8.656   3.185
   83   1HA   GLY  70          HA2       GLY  70   6.312 -11.443   3.682
   84   2HA   GLY  70          HA3       GLY  70   5.410 -10.559   4.904
   85    H    GLY  71           H        GLY  71   4.783 -10.113   1.502
   86   1HA   GLY  71          HA2       GLY  71   3.148 -11.323   0.215
   87   2HA   GLY  71          HA3       GLY  71   2.382 -11.805   1.722
   88    H    GLY  72           H        GLY  72   2.692  -9.318  -0.680
   89   1HA   GLY  72          HA2       GLY  72   1.398  -7.482  -1.157
   90   2HA   GLY  72          HA3       GLY  72   0.131  -8.280  -0.235
   91    H    TRP  73           H        TRP  73  -0.278  -5.896   0.177
   92    HA   TRP  73           HA       TRP  73   0.879  -5.238   2.765
   93   1HB   TRP  73          HB2       TRP  73   0.887  -2.745   1.737
   94   2HB   TRP  73          HB3       TRP  73   2.307  -3.785   1.749
   95    HD1  TRP  73           HD1      TRP  73   2.435  -5.391  -0.658
   96    HE1  TRP  73           HE1      TRP  73   2.160  -4.531  -3.064
   97    HE3  TRP  73           HE3      TRP  73  -0.057  -1.036   0.320
   98    HZ2  TRP  73           HZ2      TRP  73   1.042  -2.295  -4.378
   99    HZ3  TRP  73           HZ3      TRP  73  -0.691   0.408  -1.568
  100    HH2  TRP  73           HH2      TRP  73  -0.152  -0.208  -3.867
  101    H    GLY  74           H        GLY  74  -1.002  -3.279   0.500
  102   1HA   GLY  74          HA2       GLY  74  -3.209  -3.314   2.462
  103   2HA   GLY  74          HA3       GLY  74  -2.818  -1.933   1.448
  104    H    GLN  75           H        GLN  75  -2.529  -4.906  -0.171
  105    HA   GLN  75           HA       GLN  75  -4.999  -4.343  -1.637
  106   1HB   GLN  75          HB2       GLN  75  -4.091  -5.735  -3.396
  107   2HB   GLN  75          HB3       GLN  75  -2.880  -4.558  -2.904
  108   1HG   GLN  75          HG2       GLN  75  -1.891  -6.356  -1.446
  109   2HG   GLN  75          HG3       GLN  75  -2.975  -7.489  -2.253
  110   1HE2  GLN  75          HE21      GLN  75  -0.262  -7.831  -2.346
  111   2HE2  GLN  75          HE22      GLN  75   0.306  -7.545  -3.952
  112    HA   PRO  76           HA       PRO  76  -7.190  -7.804  -0.014
  113   1HB   PRO  76          HB2       PRO  76  -8.565  -8.667  -2.202
  114   2HB   PRO  76          HB3       PRO  76  -8.993  -7.210  -1.299
  115   1HG   PRO  76          HG2       PRO  76  -7.443  -7.476  -3.845
  116   2HG   PRO  76          HG3       PRO  76  -8.701  -6.299  -3.417
  117   1HD   PRO  76          HD2       PRO  76  -6.072  -5.690  -3.339
  118   2HD   PRO  76          HD3       PRO  76  -7.238  -4.993  -2.196
  119    H    HIS  77           H        HIS  77  -7.058 -10.009   0.207
  120    HA   HIS  77           HA       HIS  77  -4.980 -11.318  -1.384
  121   1HB   HIS  77          HB2       HIS  77  -5.014 -11.271   1.198
  122   2HB   HIS  77          HB3       HIS  77  -6.289 -12.477   1.066
  123    HD1  HIS  77           HD1      HIS  77  -4.735 -14.226   2.215
  124    HD2  HIS  77           HD2      HIS  77  -3.321 -12.780  -1.416
  125    HE1  HIS  77           HE1      HIS  77  -2.880 -15.786   1.546
  126    HE2  HIS  77           HE2      HIS  77  -1.983 -14.842  -0.611
  127    H    GLY  78           H        GLY  78  -8.386 -11.483  -0.633
  128   1HA   GLY  78          HA2       GLY  78  -8.619 -13.858  -2.374
  129   2HA   GLY  78          HA3       GLY  78  -9.750 -13.460  -1.089
  130    H    GLY  79           H        GLY  79  -9.688 -10.579  -1.848
  131   1HA   GLY  79          HA2       GLY  79 -10.509 -10.218  -4.507
  132   2HA   GLY  79          HA3       GLY  79 -11.935 -10.568  -3.541
  133    H    GLY  80           H        GLY  80 -11.637  -9.254  -1.260
  134   1HA   GLY  80          HA2       GLY  80 -10.809  -6.509  -1.866
  135   2HA   GLY  80          HA3       GLY  80 -12.498  -6.781  -1.462
  136    H    TRP  81           H        TRP  81 -12.145  -5.332   0.320
  137    HA   TRP  81           HA       TRP  81 -11.232  -6.757   2.687
  138   1HB   TRP  81          HB2       TRP  81 -10.170  -4.353   3.298
  139   2HB   TRP  81          HB3       TRP  81  -9.240  -5.661   2.576
  140    HD1  TRP  81           HD1      TRP  81  -9.311  -5.527  -0.309
  141    HE1  TRP  81           HE1      TRP  81  -8.897  -3.437  -1.742
  142    HE3  TRP  81           HE3      TRP  81 -10.235  -1.941   3.213
  143    HZ2  TRP  81           HZ2      TRP  81  -8.944  -0.630  -1.422
  144    HZ3  TRP  81           HZ3      TRP  81 -10.026   0.425   2.569
  145    HH2  TRP  81           HH2      TRP  81  -9.394   1.065   0.299
  146    H    GLY  82           H        GLY  82 -11.938  -3.338   2.114
  147   1HA   GLY  82          HA2       GLY  82 -14.167  -3.574   4.025
  148   2HA   GLY  82          HA3       GLY  82 -13.262  -2.101   3.708
  149    H    GLN  83           H        GLN  83 -13.408  -2.841   0.741
  150    HA   GLN  83           HA       GLN  83 -15.563  -1.186   0.068
  151   1HB   GLN  83          HB2       GLN  83 -15.148  -1.827  -2.224
  152   2HB   GLN  83          HB3       GLN  83 -13.610  -1.636  -1.395
  153   1HG   GLN  83          HG2       GLN  83 -13.665  -4.153  -1.046
  154   2HG   GLN  83          HG3       GLN  83 -14.980  -4.172  -2.221
  155   1HE2  GLN  83          HE21      GLN  83 -14.516  -4.063  -4.337
  156   2HE2  GLN  83          HE22      GLN  83 -12.924  -3.892  -4.988
  157    HA   PRO  84           HA       PRO  84 -19.111  -3.796   0.180
  158   1HB   PRO  84          HB2       PRO  84 -20.553  -2.868  -1.930
  159   2HB   PRO  84          HB3       PRO  84 -20.379  -1.977  -0.413
  160   1HG   PRO  84          HG2       PRO  84 -18.908  -1.625  -2.997
  161   2HG   PRO  84          HG3       PRO  84 -19.573  -0.390  -1.909
  162   1HD   PRO  84          HD2       PRO  84 -16.947  -1.033  -1.937
  163   2HD   PRO  84          HD3       PRO  84 -17.785  -0.529  -0.456
  164    H    HIS  85           H        HIS  85 -19.737  -5.754  -0.564
  165    HA   HIS  85           HA       HIS  85 -18.377  -6.779  -2.937
  166   1HB   HIS  85          HB2       HIS  85 -19.637  -8.021  -0.527
  167   2HB   HIS  85          HB3       HIS  85 -19.504  -8.977  -2.000
  168    HD1  HIS  85           HD1      HIS  85 -17.767 -10.576  -1.000
  169    HD2  HIS  85           HD2      HIS  85 -16.583  -6.594  -0.974
  170    HE1  HIS  85           HE1      HIS  85 -15.316 -10.607  -0.437
  171    HE2  HIS  85           HE2      HIS  85 -14.641  -8.182  -0.343
  172    H    GLY  86           H        GLY  86 -21.573  -6.071  -1.715
  173   1HA   GLY  86          HA2       GLY  86 -22.676  -6.881  -4.335
  174   2HA   GLY  86          HA3       GLY  86 -23.546  -7.145  -2.832
  175    H    GLY  87           H        GLY  87 -22.999  -4.680  -1.578
  176   1HA   GLY  87          HA2       GLY  87 -23.561  -2.446  -3.209
  177   2HA   GLY  87          HA3       GLY  87 -25.070  -3.090  -2.579
  178    H    GLY  88           H        GLY  88 -22.186  -1.333  -1.867
  179   1HA   GLY  88          HA2       GLY  88 -21.573  -0.058  -0.059
  180   2HA   GLY  88          HA3       GLY  88 -23.281  -0.034   0.360
  181    H    TRP  89           H        TRP  89 -22.172   0.020   2.542
  182    HA   TRP  89           HA       TRP  89 -22.181  -2.686   3.609
  183   1HB   TRP  89          HB2       TRP  89 -20.087  -1.761   5.036
  184   2HB   TRP  89          HB3       TRP  89 -19.905  -2.712   3.566
  185    HD1  TRP  89           HD1      TRP  89 -19.781  -1.014   1.231
  186    HE1  TRP  89           HE1      TRP  89 -18.319   1.080   0.955
  187    HE3  TRP  89           HE3      TRP  89 -18.941   0.040   6.162
  188    HZ2  TRP  89           HZ2      TRP  89 -16.977   2.935   2.609
  189    HZ3  TRP  89           HZ3      TRP  89 -17.555   1.992   6.730
  190    HH2  TRP  89           HH2      TRP  89 -16.594   3.408   4.989
  191    H    GLY  90           H        GLY  90 -21.054   0.371   4.987
  192   1HA   GLY  90          HA2       GLY  90 -23.454   0.421   6.695
  193   2HA   GLY  90          HA3       GLY  90 -21.856   0.539   7.415
  194    H    GLN  91           H        GLN  91 -22.242   2.035   4.350
  195    HA   GLN  91           HA       GLN  91 -21.520   4.575   5.277
  196   1HB   GLN  91          HB2       GLN  91 -22.378   5.330   2.988
  197   2HB   GLN  91          HB3       GLN  91 -21.090   4.134   3.009
  198   1HG   GLN  91          HG2       GLN  91 -22.541   2.397   2.407
  199   2HG   GLN  91          HG3       GLN  91 -23.974   3.348   2.794
  200   1HE2  GLN  91          HE21      GLN  91 -24.157   2.253   0.474
  201   2HE2  GLN  91          HE22      GLN  91 -23.819   3.339  -0.826
  Start of MODEL    2
    1    H    TRP  57           H        TRP  57  12.140  -1.100 -17.474
    2    HA   TRP  57           HA       TRP  57  11.023   0.080 -15.685
    3   1HB   TRP  57          HB2       TRP  57  11.175  -2.401 -15.868
    4   2HB   TRP  57          HB3       TRP  57  12.616  -2.358 -14.857
    5    HD1  TRP  57           HD1      TRP  57  11.977  -3.215 -12.537
    6    HE1  TRP  57           HE1      TRP  57  10.023  -2.848 -10.903
    7    HE3  TRP  57           HE3      TRP  57   9.052  -0.186 -15.437
    8    HZ2  TRP  57           HZ2      TRP  57   7.567  -1.457 -10.851
    9    HZ3  TRP  57           HZ3      TRP  57   6.916   0.619 -14.521
   10    HH2  TRP  57           HH2      TRP  57   6.189  -0.004 -12.274
   11    H    GLY  58           H        GLY  58  11.099   0.894 -13.556
   12   1HA   GLY  58          HA2       GLY  58  13.342   2.455 -12.931
   13   2HA   GLY  58          HA3       GLY  58  12.009   2.114 -11.838
   14    H    GLN  59           H        GLN  59  12.300  -0.676 -11.672
   15    HA   GLN  59           HA       GLN  59  13.295  -2.221 -10.350
   16   1HB   GLN  59          HB2       GLN  59  15.528  -2.797 -10.863
   17   2HB   GLN  59          HB3       GLN  59  14.853  -2.135 -12.341
   18   1HG   GLN  59          HG2       GLN  59  16.156  -0.249 -12.257
   19   2HG   GLN  59          HG3       GLN  59  16.365  -0.337 -10.510
   20   1HE2  GLN  59          HE21      GLN  59  17.521  -2.442  -9.821
   21   2HE2  GLN  59          HE22      GLN  59  18.946  -2.824 -10.719
   22    HA   PRO  60           HA       PRO  60  14.382  -0.420  -6.488
   23   1HB   PRO  60          HB2       PRO  60  15.658  -2.458  -5.246
   24   2HB   PRO  60          HB3       PRO  60  13.916  -2.468  -5.548
   25   1HG   PRO  60          HG2       PRO  60  16.112  -3.811  -7.077
   26   2HG   PRO  60          HG3       PRO  60  14.524  -4.446  -6.608
   27   1HD   PRO  60          HD2       PRO  60  15.058  -3.506  -9.099
   28   2HD   PRO  60          HD3       PRO  60  13.450  -3.401  -8.355
   29    H    HIS  61           H        HIS  61  15.989   0.753  -5.560
   30    HA   HIS  61           HA       HIS  61  18.573   0.744  -6.899
   31   1HB   HIS  61          HB2       HIS  61  17.211   2.850  -6.384
   32   2HB   HIS  61          HB3       HIS  61  17.703   2.623  -4.709
   33    HD1  HIS  61           HD1      HIS  61  19.091   4.791  -4.693
   34    HD2  HIS  61           HD2      HIS  61  20.313   2.029  -7.548
   35    HE1  HIS  61           HE1      HIS  61  21.323   5.612  -5.510
   36    HE2  HIS  61           HE2      HIS  61  22.082   3.878  -7.172
   37    H    GLY  62           H        GLY  62  17.158  -0.030  -3.799
   38   1HA   GLY  62          HA2       GLY  62  19.826  -0.915  -2.885
   39   2HA   GLY  62          HA3       GLY  62  18.677  -0.146  -1.799
   40    H    GLY  63           H        GLY  63  16.326  -1.431  -2.625
   41   1HA   GLY  63          HA2       GLY  63  16.568  -4.244  -2.742
   42   2HA   GLY  63          HA3       GLY  63  16.374  -3.747  -1.068
   43    H    GLY  64           H        GLY  64  14.830  -4.208  -4.113
   44   1HA   GLY  64          HA2       GLY  64  12.619  -4.221  -4.728
   45   2HA   GLY  64          HA3       GLY  64  12.262  -4.404  -3.015
   46    H    TRP  65           H        TRP  65  10.361  -3.102  -3.848
   47    HA   TRP  65           HA       TRP  65  10.852  -0.308  -3.209
   48   1HB   TRP  65          HB2       TRP  65   9.153   0.110  -5.259
   49   2HB   TRP  65          HB3       TRP  65  10.903   0.194  -5.428
   50    HD1  TRP  65           HD1      TRP  65  12.016  -2.367  -6.149
   51    HE1  TRP  65           HE1      TRP  65  11.159  -3.932  -7.998
   52    HE3  TRP  65           HE3      TRP  65   7.247  -0.576  -6.573
   53    HZ2  TRP  65           HZ2      TRP  65   8.775  -4.350  -9.454
   54    HZ3  TRP  65           HZ3      TRP  65   5.742  -1.614  -8.221
   55    HH2  TRP  65           HH2      TRP  65   6.491  -3.461  -9.631
   56    H    GLY  66           H        GLY  66   8.098  -1.940  -4.716
   57   1HA   GLY  66          HA2       GLY  66   6.493  -1.198  -2.358
   58   2HA   GLY  66          HA3       GLY  66   5.855  -1.400  -3.982
   59    H    GLN  67           H        GLN  67   7.672  -3.878  -4.166
   60    HA   GLN  67           HA       GLN  67   5.711  -5.797  -3.649
   61   1HB   GLN  67          HB2       GLN  67   7.411  -7.451  -4.100
   62   2HB   GLN  67          HB3       GLN  67   7.628  -6.098  -5.201
   63   1HG   GLN  67          HG2       GLN  67   9.370  -5.237  -3.579
   64   2HG   GLN  67          HG3       GLN  67   9.269  -6.812  -2.793
   65   1HE2  GLN  67          HE21      GLN  67   9.932  -8.661  -3.942
   66   2HE2  GLN  67          HE22      GLN  67  11.002  -8.542  -5.294
   67    HA   PRO  68           HA       PRO  68   5.992  -6.645   0.665
   68   1HB   PRO  68          HB2       PRO  68   5.514  -9.320   0.737
   69   2HB   PRO  68          HB3       PRO  68   4.255  -8.123   0.411
   70   1HG   PRO  68          HG2       PRO  68   5.796  -9.825  -1.508
   71   2HG   PRO  68          HG3       PRO  68   4.067  -9.432  -1.499
   72   1HD   PRO  68          HD2       PRO  68   5.836  -8.187  -3.128
   73   2HD   PRO  68          HD3       PRO  68   4.401  -7.371  -2.474
   74    H    HIS  69           H        HIS  69   7.357  -7.449   2.264
   75    HA   HIS  69           HA       HIS  69   9.932  -8.423   1.285
   76   1HB   HIS  69          HB2       HIS  69  10.707  -7.868   3.612
   77   2HB   HIS  69          HB3       HIS  69  10.097  -6.493   2.697
   78    HD1  HIS  69           HD1      HIS  69   7.865  -5.439   3.486
   79    HD2  HIS  69           HD2      HIS  69   9.209  -8.573   5.861
   80    HE1  HIS  69           HE1      HIS  69   6.485  -5.332   5.585
   81    HE2  HIS  69           HE2      HIS  69   7.375  -7.184   7.042
   82    H    GLY  70           H        GLY  70   7.233  -9.370   3.291
   83   1HA   GLY  70          HA2       GLY  70   8.256 -12.097   3.330
   84   2HA   GLY  70          HA3       GLY  70   8.021 -11.339   4.897
   85    H    GLY  71           H        GLY  71   5.926 -10.614   2.207
   86   1HA   GLY  71          HA2       GLY  71   3.973 -12.536   2.398
   87   2HA   GLY  71          HA3       GLY  71   3.619 -11.413   3.702
   88    H    GLY  72           H        GLY  72   2.443  -9.655   3.251
   89   1HA   GLY  72          HA2       GLY  72   2.156  -8.899   0.407
   90   2HA   GLY  72          HA3       GLY  72   0.774  -8.997   1.488
   91    H    TRP  73           H        TRP  73   0.343  -6.790   0.918
   92    HA   TRP  73           HA       TRP  73   1.742  -4.938   2.673
   93   1HB   TRP  73          HB2       TRP  73   1.527  -3.303   0.533
   94   2HB   TRP  73          HB3       TRP  73   2.989  -4.203   0.920
   95    HD1  TRP  73           HD1      TRP  73   3.009  -6.786  -0.353
   96    HE1  TRP  73           HE1      TRP  73   2.450  -7.280  -2.811
   97    HE3  TRP  73           HE3      TRP  73   0.311  -2.578  -1.426
   98    HZ2  TRP  73           HZ2      TRP  73   1.054  -6.043  -4.934
   99    HZ3  TRP  73           HZ3      TRP  73  -0.599  -2.310  -3.697
  100    HH2  TRP  73           HH2      TRP  73  -0.235  -4.007  -5.413
  101    H    GLY  74           H        GLY  74  -0.454  -4.375  -0.042
  102   1HA   GLY  74          HA2       GLY  74  -2.410  -3.307   1.892
  103   2HA   GLY  74          HA3       GLY  74  -2.227  -2.731   0.242
  104    H    GLN  75           H        GLN  75  -1.894  -5.774  -0.409
  105    HA   GLN  75           HA       GLN  75  -4.441  -6.181  -1.453
  106   1HB   GLN  75          HB2       GLN  75  -3.746  -8.452  -1.902
  107   2HB   GLN  75          HB3       GLN  75  -2.392  -7.369  -2.193
  108   1HG   GLN  75          HG2       GLN  75  -1.564  -7.948   0.102
  109   2HG   GLN  75          HG3       GLN  75  -2.816  -9.189   0.160
  110   1HE2  GLN  75          HE21      GLN  75  -2.142 -11.130  -0.363
  111   2HE2  GLN  75          HE22      GLN  75  -0.857 -11.510  -1.454
  112    HA   PRO  76           HA       PRO  76  -6.953  -7.580   1.885
  113   1HB   PRO  76          HB2       PRO  76  -8.497  -9.464   0.664
  114   2HB   PRO  76          HB3       PRO  76  -8.718  -7.727   0.428
  115   1HG   PRO  76          HG2       PRO  76  -7.302  -9.710  -1.309
  116   2HG   PRO  76          HG3       PRO  76  -8.397  -8.395  -1.775
  117   1HD   PRO  76          HD2       PRO  76  -5.713  -8.174  -1.974
  118   2HD   PRO  76          HD3       PRO  76  -6.750  -6.787  -1.583
  119    H    HIS  77           H        HIS  77  -7.447  -9.403   3.254
  120    HA   HIS  77           HA       HIS  77  -5.445 -11.548   3.019
  121   1HB   HIS  77          HB2       HIS  77  -5.210 -10.108   5.010
  122   2HB   HIS  77          HB3       HIS  77  -6.851 -10.525   5.495
  123    HD1  HIS  77           HD1      HIS  77  -3.417 -11.536   5.950
  124    HD2  HIS  77           HD2      HIS  77  -7.113 -13.431   6.025
  125    HE1  HIS  77           HE1      HIS  77  -3.036 -13.703   7.166
  126    HE2  HIS  77           HE2      HIS  77  -5.305 -14.791   7.279
  127    H    GLY  78           H        GLY  78  -8.835 -10.832   3.450
  128   1HA   GLY  78          HA2       GLY  78  -9.408 -13.702   3.106
  129   2HA   GLY  78          HA3       GLY  78 -10.241 -12.779   4.348
  130    H    GLY  79           H        GLY  79  -9.453 -11.342   1.273
  131   1HA   GLY  79          HA2       GLY  79 -10.893 -11.324  -0.661
  132   2HA   GLY  79          HA3       GLY  79 -12.247 -11.682   0.401
  133    H    GLY  80           H        GLY  80 -10.163  -9.208  -0.871
  134   1HA   GLY  80          HA2       GLY  80 -10.364  -6.922  -0.931
  135   2HA   GLY  80          HA3       GLY  80 -12.080  -7.183  -0.650
  136    H    TRP  81           H        TRP  81 -11.643  -5.052   0.478
  137    HA   TRP  81           HA       TRP  81 -11.318  -5.605   3.318
  138   1HB   TRP  81          HB2       TRP  81  -9.974  -3.268   3.263
  139   2HB   TRP  81          HB3       TRP  81  -9.178  -4.837   3.214
  140    HD1  TRP  81           HD1      TRP  81  -8.845  -5.743   0.482
  141    HE1  TRP  81           HE1      TRP  81  -7.894  -4.362  -1.463
  142    HE3  TRP  81           HE3      TRP  81  -9.607  -1.056   2.374
  143    HZ2  TRP  81           HZ2      TRP  81  -7.506  -1.640  -2.110
  144    HZ3  TRP  81           HZ3      TRP  81  -8.915   0.885   1.028
  145    HH2  TRP  81           HH2      TRP  81  -7.886   0.596  -1.167
  146    H    GLY  82           H        GLY  82 -11.351  -2.549   1.538
  147   1HA   GLY  82          HA2       GLY  82 -13.983  -1.980   2.755
  148   2HA   GLY  82          HA3       GLY  82 -12.728  -0.765   2.575
  149    H    GLN  83           H        GLN  83 -12.976  -2.955  -0.034
  150    HA   GLN  83           HA       GLN  83 -13.881  -0.838  -1.775
  151   1HB   GLN  83          HB2       GLN  83 -13.407  -2.389  -3.585
  152   2HB   GLN  83          HB3       GLN  83 -12.065  -2.368  -2.449
  153   1HG   GLN  83          HG2       GLN  83 -12.976  -4.438  -1.424
  154   2HG   GLN  83          HG3       GLN  83 -14.193  -4.479  -2.700
  155   1HE2  GLN  83          HE21      GLN  83 -10.739  -4.584  -2.055
  156   2HE2  GLN  83          HE22      GLN  83 -10.310  -5.453  -3.485
  157    HA   PRO  84           HA       PRO  84 -18.161  -1.831  -2.038
  158   1HB   PRO  84          HB2       PRO  84 -18.613  -1.574  -4.735
  159   2HB   PRO  84          HB3       PRO  84 -18.483  -0.213  -3.617
  160   1HG   PRO  84          HG2       PRO  84 -16.424  -1.359  -5.458
  161   2HG   PRO  84          HG3       PRO  84 -16.783   0.339  -5.095
  162   1HD   PRO  84          HD2       PRO  84 -14.685  -0.932  -3.993
  163   2HD   PRO  84          HD3       PRO  84 -15.610   0.293  -3.100
  164    H    HIS  85           H        HIS  85 -19.652  -3.434  -2.708
  165    HA   HIS  85           HA       HIS  85 -18.372  -5.848  -3.800
  166   1HB   HIS  85          HB2       HIS  85 -19.593  -5.620  -1.406
  167   2HB   HIS  85          HB3       HIS  85 -20.974  -6.074  -2.397
  168    HD1  HIS  85           HD1      HIS  85 -21.338  -8.477  -1.902
  169    HD2  HIS  85           HD2      HIS  85 -17.323  -7.606  -2.523
  170    HE1  HIS  85           HE1      HIS  85 -20.154 -10.695  -1.850
  171    HE2  HIS  85           HE2      HIS  85 -17.715 -10.134  -2.142
  172    H    GLY  86           H        GLY  86 -21.081  -3.661  -4.091
  173   1HA   GLY  86          HA2       GLY  86 -22.099  -5.243  -6.363
  174   2HA   GLY  86          HA3       GLY  86 -23.047  -4.088  -5.439
  175    H    GLY  87           H        GLY  87 -21.899  -1.795  -5.453
  176   1HA   GLY  87          HA2       GLY  87 -20.532  -1.118  -7.881
  177   2HA   GLY  87          HA3       GLY  87 -22.230  -0.671  -7.926
  178    H    GLY  88           H        GLY  88 -20.350  -0.631  -4.975
  179   1HA   GLY  88          HA2       GLY  88 -19.115   1.584  -4.551
  180   2HA   GLY  88          HA3       GLY  88 -20.682   2.295  -4.911
  181    H    TRP  89           H        TRP  89 -20.377   3.222  -2.742
  182    HA   TRP  89           HA       TRP  89 -21.647   1.516  -0.754
  183   1HB   TRP  89          HB2       TRP  89 -19.869   2.707   0.888
  184   2HB   TRP  89          HB3       TRP  89 -19.616   1.113   0.188
  185    HD1  TRP  89           HD1      TRP  89 -18.248   1.296  -2.354
  186    HE1  TRP  89           HE1      TRP  89 -16.132   2.668  -2.840
  187    HE3  TRP  89           HE3      TRP  89 -18.532   4.614   1.524
  188    HZ2  TRP  89           HZ2      TRP  89 -14.755   4.868  -1.722
  189    HZ3  TRP  89           HZ3      TRP  89 -16.773   6.321   1.745
  190    HH2  TRP  89           HH2      TRP  89 -14.924   6.443   0.155
  191    H    GLY  90           H        GLY  90 -19.972   4.616  -0.450
  192   1HA   GLY  90          HA2       GLY  90 -22.591   5.925  -0.098
  193   2HA   GLY  90          HA3       GLY  90 -21.307   6.168   1.076
  194    H    GLN  91           H        GLN  91 -20.330   5.850  -2.200
  195    HA   GLN  91           HA       GLN  91 -19.494   8.633  -2.219
  196   1HB   GLN  91          HB2       GLN  91 -18.338   7.936  -4.362
  197   2HB   GLN  91          HB3       GLN  91 -17.800   7.120  -2.901
  198   1HG   GLN  91          HG2       GLN  91 -18.960   5.139  -3.470
  199   2HG   GLN  91          HG3       GLN  91 -19.841   5.947  -4.766
  200   1HE2  GLN  91          HE21      GLN  91 -17.782   3.650  -4.472
  201   2HE2  GLN  91          HE22      GLN  91 -16.685   3.949  -5.772
  Start of MODEL    3
    1    H    TRP  57           H        TRP  57  15.956   5.728 -13.942
    2    HA   TRP  57           HA       TRP  57  13.684   5.406 -12.973
    3   1HB   TRP  57          HB2       TRP  57  13.124   3.483 -14.414
    4   2HB   TRP  57          HB3       TRP  57  14.420   2.551 -13.669
    5    HD1  TRP  57           HD1      TRP  57  13.346   0.804 -12.147
    6    HE1  TRP  57           HE1      TRP  57  11.450   0.783 -10.406
    7    HE3  TRP  57           HE3      TRP  57  11.719   5.625 -12.660
    8    HZ2  TRP  57           HZ2      TRP  57   9.521   2.575  -9.386
    9    HZ3  TRP  57           HZ3      TRP  57   9.844   6.391 -11.264
   10    HH2  TRP  57           HH2      TRP  57   8.767   4.896  -9.662
   11    H    GLY  58           H        GLY  58  13.663   4.909 -10.737
   12   1HA   GLY  58          HA2       GLY  58  16.133   5.172  -9.431
   13   2HA   GLY  58          HA3       GLY  58  14.618   4.730  -8.658
   14    H    GLN  59           H        GLN  59  14.015   2.327  -9.688
   15    HA   GLN  59           HA       GLN  59  14.367   0.117  -9.351
   16   1HB   GLN  59          HB2       GLN  59  16.238  -0.850 -10.423
   17   2HB   GLN  59          HB3       GLN  59  15.863   0.604 -11.332
   18   1HG   GLN  59          HG2       GLN  59  17.765   1.688 -10.649
   19   2HG   GLN  59          HG3       GLN  59  17.914   0.734  -9.174
   20   1HE2  GLN  59          HE21      GLN  59  20.184   0.757 -10.082
   21   2HE2  GLN  59          HE22      GLN  59  20.614  -0.557 -11.118
   22    HA   PRO  60           HA       PRO  60  16.031  -0.541  -5.333
   23   1HB   PRO  60          HB2       PRO  60  16.421  -3.215  -5.306
   24   2HB   PRO  60          HB3       PRO  60  14.808  -2.493  -5.306
   25   1HG   PRO  60          HG2       PRO  60  16.365  -3.654  -7.582
   26   2HG   PRO  60          HG3       PRO  60  14.644  -3.839  -7.193
   27   1HD   PRO  60          HD2       PRO  60  15.566  -2.114  -9.087
   28   2HD   PRO  60          HD3       PRO  60  14.083  -1.830  -8.156
   29    H    HIS  61           H        HIS  61  17.946  -0.715  -4.216
   30    HA   HIS  61           HA       HIS  61  20.353  -0.839  -5.844
   31   1HB   HIS  61          HB2       HIS  61  20.077   0.998  -4.223
   32   2HB   HIS  61          HB3       HIS  61  20.010  -0.175  -2.911
   33    HD1  HIS  61           HD1      HIS  61  22.113   1.192  -1.975
   34    HD2  HIS  61           HD2      HIS  61  22.751  -0.976  -5.462
   35    HE1  HIS  61           HE1      HIS  61  24.611   1.013  -2.209
   36    HE2  HIS  61           HE2      HIS  61  24.971  -0.377  -4.278
   37    H    GLY  62           H        GLY  62  18.700  -2.681  -3.380
   38   1HA   GLY  62          HA2       GLY  62  20.306  -4.991  -3.943
   39   2HA   GLY  62          HA3       GLY  62  20.651  -4.308  -2.361
   40    H    GLY  63           H        GLY  63  17.474  -4.221  -3.840
   41   1HA   GLY  63          HA2       GLY  63  16.436  -6.582  -2.707
   42   2HA   GLY  63          HA3       GLY  63  16.171  -5.255  -1.585
   43    H    GLY  64           H        GLY  64  14.730  -3.600  -2.125
   44   1HA   GLY  64          HA2       GLY  64  13.345  -3.700  -4.677
   45   2HA   GLY  64          HA3       GLY  64  12.375  -4.158  -3.283
   46    H    TRP  65           H        TRP  65  11.020  -2.351  -3.819
   47    HA   TRP  65           HA       TRP  65  11.937   0.093  -2.532
   48   1HB   TRP  65          HB2       TRP  65  10.652   1.247  -4.605
   49   2HB   TRP  65          HB3       TRP  65  12.392   0.994  -4.571
   50    HD1  TRP  65           HD1      TRP  65  13.096  -1.571  -5.701
   51    HE1  TRP  65           HE1      TRP  65  12.243  -2.537  -7.922
   52    HE3  TRP  65           HE3      TRP  65   8.872   1.257  -6.238
   53    HZ2  TRP  65           HZ2      TRP  65  10.067  -2.144  -9.682
   54    HZ3  TRP  65           HZ3      TRP  65   7.461   0.901  -8.222
   55    HH2  TRP  65           HH2      TRP  65   8.048  -0.766  -9.907
   56    H    GLY  66           H        GLY  66   9.165  -0.562  -4.628
   57   1HA   GLY  66          HA2       GLY  66   7.411   0.017  -2.330
   58   2HA   GLY  66          HA3       GLY  66   6.986   0.295  -4.012
   59    H    GLN  67           H        GLN  67   8.277  -2.413  -4.620
   60    HA   GLN  67           HA       GLN  67   5.922  -3.924  -4.690
   61   1HB   GLN  67          HB2       GLN  67   7.314  -5.775  -5.410
   62   2HB   GLN  67          HB3       GLN  67   7.855  -4.292  -6.184
   63   1HG   GLN  67          HG2       GLN  67   9.587  -4.140  -4.333
   64   2HG   GLN  67          HG3       GLN  67   9.154  -5.805  -3.946
   65   1HE2  GLN  67          HE21      GLN  67   9.717  -3.968  -6.934
   66   2HE2  GLN  67          HE22      GLN  67  10.839  -5.091  -7.615
   67    HA   PRO  68           HA       PRO  68   5.518  -5.754  -0.707
   68   1HB   PRO  68          HB2       PRO  68   4.750  -8.304  -1.355
   69   2HB   PRO  68          HB3       PRO  68   3.671  -6.907  -1.402
   70   1HG   PRO  68          HG2       PRO  68   5.142  -8.241  -3.636
   71   2HG   PRO  68          HG3       PRO  68   3.482  -7.616  -3.602
   72   1HD   PRO  68          HD2       PRO  68   5.494  -6.256  -4.766
   73   2HD   PRO  68          HD3       PRO  68   4.166  -5.431  -3.924
   74    H    HIS  69           H        HIS  69   6.519  -7.158   0.772
   75    HA   HIS  69           HA       HIS  69   9.008  -8.370  -0.222
   76   1HB   HIS  69          HB2       HIS  69   9.038  -6.478   1.530
   77   2HB   HIS  69          HB3       HIS  69   8.444  -7.692   2.658
   78    HD1  HIS  69           HD1      HIS  69  10.742  -7.266   3.939
   79    HD2  HIS  69           HD2      HIS  69  11.062  -9.052   0.202
   80    HE1  HIS  69           HE1      HIS  69  13.058  -8.240   3.857
   81    HE2  HIS  69           HE2      HIS  69  13.260  -9.240   1.553
   82    H    GLY  70           H        GLY  70   6.086  -8.948   1.600
   83   1HA   GLY  70          HA2       GLY  70   6.946 -11.729   2.079
   84   2HA   GLY  70          HA3       GLY  70   5.697 -10.892   2.990
   85    H    GLY  71           H        GLY  71   3.871 -10.030   1.432
   86   1HA   GLY  71          HA2       GLY  71   3.316 -11.697  -0.844
   87   2HA   GLY  71          HA3       GLY  71   2.365 -12.137   0.566
   88    H    GLY  72           H        GLY  72   3.327  -8.836  -0.070
   89   1HA   GLY  72          HA2       GLY  72   1.701  -7.537  -1.577
   90   2HA   GLY  72          HA3       GLY  72   0.484  -8.183  -0.485
   91    H    TRP  73           H        TRP  73   0.001  -5.876  -0.190
   92    HA   TRP  73           HA       TRP  73   1.479  -4.839   2.095
   93   1HB   TRP  73          HB2       TRP  73   1.117  -2.494   0.808
   94   2HB   TRP  73          HB3       TRP  73   2.606  -3.428   0.710
   95    HD1  TRP  73           HD1      TRP  73   2.504  -5.309  -1.491
   96    HE1  TRP  73           HE1      TRP  73   1.799  -4.777  -3.901
   97    HE3  TRP  73           HE3      TRP  73  -0.170  -1.039  -0.624
   98    HZ2  TRP  73           HZ2      TRP  73   0.310  -2.800  -5.265
   99    HZ3  TRP  73           HZ3      TRP  73  -1.202   0.114  -2.537
  100    HH2  TRP  73           HH2      TRP  73  -0.965  -0.750  -4.809
  101    H    GLY  74           H        GLY  74  -0.886  -3.304  -0.040
  102   1HA   GLY  74          HA2       GLY  74  -2.770  -3.273   2.237
  103   2HA   GLY  74          HA3       GLY  74  -2.629  -1.964   1.072
  104    H    GLN  75           H        GLN  75  -2.363  -5.054  -0.325
  105    HA   GLN  75           HA       GLN  75  -4.986  -4.733  -1.548
  106   1HB   GLN  75          HB2       GLN  75  -4.255  -6.407  -3.141
  107   2HB   GLN  75          HB3       GLN  75  -3.005  -5.183  -2.964
  108   1HG   GLN  75          HG2       GLN  75  -1.856  -6.725  -1.358
  109   2HG   GLN  75          HG3       GLN  75  -3.029  -7.959  -1.817
  110   1HE2  GLN  75          HE21      GLN  75  -1.061  -5.553  -3.537
  111   2HE2  GLN  75          HE22      GLN  75  -0.409  -6.662  -4.691
  112    HA   PRO  76           HA       PRO  76  -7.052  -7.839   0.791
  113   1HB   PRO  76          HB2       PRO  76  -8.573  -9.056  -1.126
  114   2HB   PRO  76          HB3       PRO  76  -8.955  -7.480  -0.427
  115   1HG   PRO  76          HG2       PRO  76  -7.602  -8.127  -3.016
  116   2HG   PRO  76          HG3       PRO  76  -8.834  -6.897  -2.672
  117   1HD   PRO  76          HD2       PRO  76  -6.220  -6.278  -2.900
  118   2HD   PRO  76          HD3       PRO  76  -7.295  -5.426  -1.771
  119    H    HIS  77           H        HIS  77  -7.000 -10.023   1.317
  120    HA   HIS  77           HA       HIS  77  -5.005 -11.589  -0.156
  121   1HB   HIS  77          HB2       HIS  77  -4.738 -11.143   2.326
  122   2HB   HIS  77          HB3       HIS  77  -6.133 -12.187   2.581
  123    HD1  HIS  77           HD1      HIS  77  -4.031 -13.399   3.989
  124    HD2  HIS  77           HD2      HIS  77  -4.144 -13.787  -0.147
  125    HE1  HIS  77           HE1      HIS  77  -2.590 -15.391   3.460
  126    HE2  HIS  77           HE2      HIS  77  -2.743 -15.659   0.960
  127    H    GLY  78           H        GLY  78  -8.344 -11.581   0.869
  128   1HA   GLY  78          HA2       GLY  78  -8.711 -14.240  -0.356
  129   2HA   GLY  78          HA3       GLY  78  -9.783 -13.533   0.844
  130    H    GLY  79           H        GLY  79  -9.669 -10.890  -0.529
  131   1HA   GLY  79          HA2       GLY  79 -10.465 -10.920  -3.161
  132   2HA   GLY  79          HA3       GLY  79 -11.916 -11.307  -2.248
  133    H    GLY  80           H        GLY  80 -11.122  -9.641   0.036
  134   1HA   GLY  80          HA2       GLY  80 -10.860  -6.949  -0.961
  135   2HA   GLY  80          HA3       GLY  80 -12.490  -7.338  -0.430
  136    H    TRP  81           H        TRP  81 -12.118  -5.595   1.111
  137    HA   TRP  81           HA       TRP  81 -11.020  -6.650   3.594
  138   1HB   TRP  81          HB2       TRP  81 -10.098  -4.125   3.837
  139   2HB   TRP  81          HB3       TRP  81  -9.113  -5.458   3.245
  140    HD1  TRP  81           HD1      TRP  81  -9.333  -5.713   0.370
  141    HE1  TRP  81           HE1      TRP  81  -9.110  -3.810  -1.338
  142    HE3  TRP  81           HE3      TRP  81 -10.300  -1.750   3.450
  143    HZ2  TRP  81           HZ2      TRP  81  -9.309  -0.991  -1.377
  144    HZ3  TRP  81           HZ3      TRP  81 -10.261   0.518   2.498
  145    HH2  TRP  81           HH2      TRP  81  -9.775   0.888   0.135
  146    H    GLY  82           H        GLY  82 -11.952  -3.366   2.671
  147   1HA   GLY  82          HA2       GLY  82 -14.213  -3.586   4.560
  148   2HA   GLY  82          HA3       GLY  82 -13.273  -2.118   4.337
  149    H    GLN  83           H        GLN  83 -13.839  -3.798   1.437
  150    HA   GLN  83           HA       GLN  83 -15.644  -1.709   0.551
  151   1HB   GLN  83          HB2       GLN  83 -15.302  -2.608  -1.672
  152   2HB   GLN  83          HB3       GLN  83 -13.750  -2.446  -0.863
  153   1HG   GLN  83          HG2       GLN  83 -13.914  -4.885  -0.287
  154   2HG   GLN  83          HG3       GLN  83 -15.313  -4.963  -1.357
  155   1HE2  GLN  83          HE21      GLN  83 -14.461  -6.263  -2.900
  156   2HE2  GLN  83          HE22      GLN  83 -13.127  -5.823  -3.906
  157    HA   PRO  84           HA       PRO  84 -19.421  -3.950   0.894
  158   1HB   PRO  84          HB2       PRO  84 -20.728  -3.181  -1.377
  159   2HB   PRO  84          HB3       PRO  84 -20.542  -2.144   0.042
  160   1HG   PRO  84          HG2       PRO  84 -18.966  -2.179  -2.502
  161   2HG   PRO  84          HG3       PRO  84 -19.564  -0.791  -1.574
  162   1HD   PRO  84          HD2       PRO  84 -16.999  -1.607  -1.434
  163   2HD   PRO  84          HD3       PRO  84 -17.845  -0.917  -0.035
  164    H    HIS  85           H        HIS  85 -20.632  -5.708   0.042
  165    HA   HIS  85           HA       HIS  85 -19.105  -7.325  -1.864
  166   1HB   HIS  85          HB2       HIS  85 -20.073  -8.020   0.556
  167   2HB   HIS  85          HB3       HIS  85 -21.435  -8.494  -0.453
  168    HD1  HIS  85           HD1      HIS  85 -20.652 -10.098  -2.580
  169    HD2  HIS  85           HD2      HIS  85 -18.184  -9.940   0.760
  170    HE1  HIS  85           HE1      HIS  85 -19.196 -12.143  -2.723
  171    HE2  HIS  85           HE2      HIS  85 -17.770 -12.071  -0.647
  172    H    GLY  86           H        GLY  86 -22.210  -5.799  -1.389
  173   1HA   GLY  86          HA2       GLY  86 -23.093  -6.855  -4.002
  174   2HA   GLY  86          HA3       GLY  86 -24.183  -6.359  -2.716
  175    H    GLY  87           H        GLY  87 -22.502  -3.967  -2.139
  176   1HA   GLY  87          HA2       GLY  87 -22.144  -2.286  -4.298
  177   2HA   GLY  87          HA3       GLY  87 -23.850  -2.169  -3.895
  178    H    GLY  88           H        GLY  88 -23.399  -2.566  -1.032
  179   1HA   GLY  88          HA2       GLY  88 -21.686  -0.393  -0.186
  180   2HA   GLY  88          HA3       GLY  88 -23.404  -0.046  -0.056
  181    H    TRP  89           H        TRP  89 -22.933   0.183   2.235
  182    HA   TRP  89           HA       TRP  89 -23.301  -2.353   3.615
  183   1HB   TRP  89          HB2       TRP  89 -21.569  -1.246   5.365
  184   2HB   TRP  89          HB3       TRP  89 -21.084  -2.397   4.124
  185    HD1  TRP  89           HD1      TRP  89 -20.350  -1.049   1.677
  186    HE1  TRP  89           HE1      TRP  89 -18.785   0.976   1.472
  187    HE3  TRP  89           HE3      TRP  89 -20.647   0.690   6.474
  188    HZ2  TRP  89           HZ2      TRP  89 -17.795   3.041   3.127
  189    HZ3  TRP  89           HZ3      TRP  89 -19.358   2.696   7.083
  190    HH2  TRP  89           HH2      TRP  89 -17.961   3.846   5.442
  191    H    GLY  90           H        GLY  90 -22.412   0.854   4.815
  192   1HA   GLY  90          HA2       GLY  90 -25.146   1.155   5.873
  193   2HA   GLY  90          HA3       GLY  90 -23.760   1.355   6.935
  194    H    GLN  91           H        GLN  91 -23.333   2.428   3.706
  195    HA   GLN  91           HA       GLN  91 -22.760   5.065   4.448
  196   1HB   GLN  91          HB2       GLN  91 -22.999   5.510   1.940
  197   2HB   GLN  91          HB3       GLN  91 -21.802   4.319   2.434
  198   1HG   GLN  91          HG2       GLN  91 -23.128   2.525   1.720
  199   2HG   GLN  91          HG3       GLN  91 -24.574   3.529   1.611
  200   1HE2  GLN  91          HE21      GLN  91 -24.045   2.029  -0.502
  201   2HE2  GLN  91          HE22      GLN  91 -23.422   2.967  -1.813
  Start of MODEL    4
    1    H    TRP  57           H        TRP  57  12.781   5.791  -8.598
    2    HA   TRP  57           HA       TRP  57  14.679   5.525  -9.837
    3   1HB   TRP  57          HB2       TRP  57  16.056   5.253  -7.683
    4   2HB   TRP  57          HB3       TRP  57  15.716   3.532  -7.824
    5    HD1  TRP  57           HD1      TRP  57  16.515   5.742 -10.866
    6    HE1  TRP  57           HE1      TRP  57  18.721   4.920 -11.908
    7    HE3  TRP  57           HE3      TRP  57  17.843   2.286  -7.339
    8    HZ2  TRP  57           HZ2      TRP  57  20.754   3.054 -11.315
    9    HZ3  TRP  57           HZ3      TRP  57  19.933   1.025  -7.651
   10    HH2  TRP  57           HH2      TRP  57  21.357   1.401  -9.599
   11    H    GLY  58           H        GLY  58  15.177   3.751 -11.301
   12   1HA   GLY  58          HA2       GLY  58  12.960   2.131 -11.852
   13   2HA   GLY  58          HA3       GLY  58  14.556   1.938 -12.561
   14    H    GLN  59           H        GLN  59  16.172   0.766 -11.219
   15    HA   GLN  59           HA       GLN  59  14.920  -1.602 -10.098
   16   1HB   GLN  59          HB2       GLN  59  17.132  -2.590 -10.176
   17   2HB   GLN  59          HB3       GLN  59  16.784  -1.805 -11.711
   18   1HG   GLN  59          HG2       GLN  59  18.061   0.197 -10.770
   19   2HG   GLN  59          HG3       GLN  59  18.640  -0.919  -9.534
   20   1HE2  GLN  59          HE21      GLN  59  18.827   0.044 -12.835
   21   2HE2  GLN  59          HE22      GLN  59  20.136  -0.989 -13.289
   22    HA   PRO  60           HA       PRO  60  15.473  -0.640  -5.837
   23   1HB   PRO  60          HB2       PRO  60  16.248  -3.065  -4.827
   24   2HB   PRO  60          HB3       PRO  60  14.582  -2.666  -5.258
   25   1HG   PRO  60          HG2       PRO  60  16.628  -4.192  -6.815
   26   2HG   PRO  60          HG3       PRO  60  14.898  -4.525  -6.608
   27   1HD   PRO  60          HD2       PRO  60  15.876  -3.385  -8.845
   28   2HD   PRO  60          HD3       PRO  60  14.279  -2.962  -8.195
   29    H    HIS  61           H        HIS  61  17.033  -0.138  -4.306
   30    HA   HIS  61           HA       HIS  61  19.804  -0.403  -5.238
   31   1HB   HIS  61          HB2       HIS  61  18.707   1.879  -4.744
   32   2HB   HIS  61          HB3       HIS  61  18.883   1.442  -3.047
   33    HD1  HIS  61           HD1      HIS  61  20.540   3.454  -2.779
   34    HD2  HIS  61           HD2      HIS  61  21.826   0.464  -5.363
   35    HE1  HIS  61           HE1      HIS  61  22.991   3.885  -3.138
   36    HE2  HIS  61           HE2      HIS  61  23.767   2.011  -4.635
   37    H    GLY  62           H        GLY  62  17.859  -2.113  -3.335
   38   1HA   GLY  62          HA2       GLY  62  19.341  -3.833  -2.114
   39   2HA   GLY  62          HA3       GLY  62  19.798  -2.439  -1.147
   40    H    GLY  63           H        GLY  63  16.611  -3.363  -2.418
   41   1HA   GLY  63          HA2       GLY  63  15.436  -4.608  -0.330
   42   2HA   GLY  63          HA3       GLY  63  15.446  -2.932   0.196
   43    H    GLY  64           H        GLY  64  14.949  -4.242  -3.066
   44   1HA   GLY  64          HA2       GLY  64  13.216  -3.965  -4.549
   45   2HA   GLY  64          HA3       GLY  64  12.170  -4.132  -3.146
   46    H    TRP  65           H        TRP  65  10.737  -2.641  -4.176
   47    HA   TRP  65           HA       TRP  65  11.401   0.121  -3.541
   48   1HB   TRP  65          HB2       TRP  65  10.172   0.586  -5.900
   49   2HB   TRP  65          HB3       TRP  65  11.921   0.500  -5.723
   50    HD1  TRP  65           HD1      TRP  65  12.883  -2.190  -6.112
   51    HE1  TRP  65           HE1      TRP  65  12.249  -3.770  -8.034
   52    HE3  TRP  65           HE3      TRP  65   8.498   0.009  -7.545
   53    HZ2  TRP  65           HZ2      TRP  65  10.164  -4.046  -9.921
   54    HZ3  TRP  65           HZ3      TRP  65   7.245  -0.974  -9.420
   55    HH2  TRP  65           HH2      TRP  65   8.062  -2.959 -10.582
   56    H    GLY  66           H        GLY  66   8.819  -1.277  -5.511
   57   1HA   GLY  66          HA2       GLY  66   6.889  -0.284  -3.514
   58   2HA   GLY  66          HA3       GLY  66   6.553  -0.458  -5.230
   59    H    GLN  67           H        GLN  67   8.082  -3.129  -5.033
   60    HA   GLN  67           HA       GLN  67   5.852  -4.804  -4.904
   61   1HB   GLN  67          HB2       GLN  67   7.417  -6.650  -4.972
   62   2HB   GLN  67          HB3       GLN  67   7.975  -5.373  -6.044
   63   1HG   GLN  67          HG2       GLN  67   9.452  -4.622  -4.115
   64   2HG   GLN  67          HG3       GLN  67   9.062  -6.169  -3.367
   65   1HE2  GLN  67          HE21      GLN  67  10.763  -4.563  -5.916
   66   2HE2  GLN  67          HE22      GLN  67  11.682  -5.926  -6.447
   67    HA   PRO  68           HA       PRO  68   5.125  -5.555  -0.625
   68   1HB   PRO  68          HB2       PRO  68   4.485  -8.209  -0.631
   69   2HB   PRO  68          HB3       PRO  68   3.391  -6.941  -1.191
   70   1HG   PRO  68          HG2       PRO  68   5.166  -8.751  -2.781
   71   2HG   PRO  68          HG3       PRO  68   3.494  -8.258  -3.104
   72   1HD   PRO  68          HD2       PRO  68   5.588  -7.134  -4.375
   73   2HD   PRO  68          HD3       PRO  68   4.132  -6.207  -3.961
   74    H    HIS  69           H        HIS  69   5.953  -6.587   1.259
   75    HA   HIS  69           HA       HIS  69   8.610  -7.780   0.848
   76   1HB   HIS  69          HB2       HIS  69   9.022  -7.043   3.227
   77   2HB   HIS  69          HB3       HIS  69   8.799  -5.737   2.068
   78    HD1  HIS  69           HD1      HIS  69   7.275  -3.962   2.847
   79    HD2  HIS  69           HD2      HIS  69   6.408  -7.619   4.618
   80    HE1  HIS  69           HE1      HIS  69   5.399  -3.501   4.457
   81    HE2  HIS  69           HE2      HIS  69   4.833  -5.745   5.452
   82    H    GLY  70           H        GLY  70   5.515  -8.186   2.416
   83   1HA   GLY  70          HA2       GLY  70   6.366 -10.898   3.218
   84   2HA   GLY  70          HA3       GLY  70   5.416  -9.888   4.298
   85    H    GLY  71           H        GLY  71   4.870  -9.900   0.851
   86   1HA   GLY  71          HA2       GLY  71   3.283 -11.226  -0.338
   87   2HA   GLY  71          HA3       GLY  71   2.542 -11.657   1.194
   88    H    GLY  72           H        GLY  72   2.655  -9.369  -1.393
   89   1HA   GLY  72          HA2       GLY  72   1.235  -7.670  -1.997
   90   2HA   GLY  72          HA3       GLY  72   0.051  -8.433  -0.944
   91    H    TRP  73           H        TRP  73  -0.501  -6.070  -0.720
   92    HA   TRP  73           HA       TRP  73   0.735  -5.082   1.721
   93   1HB   TRP  73          HB2       TRP  73   0.539  -2.710   0.458
   94   2HB   TRP  73          HB3       TRP  73   2.020  -3.660   0.494
   95    HD1  TRP  73           HD1      TRP  73   2.156  -5.472  -1.752
   96    HE1  TRP  73           HE1      TRP  73   1.707  -4.877  -4.211
   97    HE3  TRP  73           HE3      TRP  73  -0.603  -1.224  -1.063
   98    HZ2  TRP  73           HZ2      TRP  73   0.366  -2.865  -5.672
   99    HZ3  TRP  73           HZ3      TRP  73  -1.429  -0.021  -3.045
  100    HH2  TRP  73           HH2      TRP  73  -0.953  -0.826  -5.301
  101    H    GLY  74           H        GLY  74  -1.381  -3.523  -0.648
  102   1HA   GLY  74          HA2       GLY  74  -3.424  -3.296   1.461
  103   2HA   GLY  74          HA3       GLY  74  -3.270  -2.220   0.081
  104    H    GLN  75           H        GLN  75  -2.794  -4.704  -1.627
  105    HA   GLN  75           HA       GLN  75  -5.435  -4.985  -2.562
  106   1HB   GLN  75          HB2       GLN  75  -4.552  -6.662  -4.066
  107   2HB   GLN  75          HB3       GLN  75  -3.413  -5.328  -3.954
  108   1HG   GLN  75          HG2       GLN  75  -2.199  -6.722  -2.207
  109   2HG   GLN  75          HG3       GLN  75  -3.200  -8.067  -2.756
  110   1HE2  GLN  75          HE21      GLN  75  -3.092  -8.597  -5.054
  111   2HE2  GLN  75          HE22      GLN  75  -1.595  -8.382  -5.890
  112    HA   PRO  76           HA       PRO  76  -7.166  -8.149  -0.031
  113   1HB   PRO  76          HB2       PRO  76  -8.650  -9.554  -1.830
  114   2HB   PRO  76          HB3       PRO  76  -9.116  -7.961  -1.226
  115   1HG   PRO  76          HG2       PRO  76  -7.769  -8.692  -3.797
  116   2HG   PRO  76          HG3       PRO  76  -9.082  -7.532  -3.510
  117   1HD   PRO  76          HD2       PRO  76  -6.517  -6.752  -3.828
  118   2HD   PRO  76          HD3       PRO  76  -7.640  -5.895  -2.753
  119    H    HIS  77           H        HIS  77  -6.676 -10.158   0.698
  120    HA   HIS  77           HA       HIS  77  -4.728 -11.687  -0.856
  121   1HB   HIS  77          HB2       HIS  77  -4.662 -10.969   1.739
  122   2HB   HIS  77          HB3       HIS  77  -5.449 -12.536   1.892
  123    HD1  HIS  77           HD1      HIS  77  -4.035 -14.478   0.383
  124    HD2  HIS  77           HD2      HIS  77  -1.984 -11.200   1.906
  125    HE1  HIS  77           HE1      HIS  77  -1.615 -15.160   0.427
  126    HE2  HIS  77           HE2      HIS  77  -0.384 -13.130   1.270
  127    H    GLY  78           H        GLY  78  -7.954 -11.905   0.469
  128   1HA   GLY  78          HA2       GLY  78  -8.211 -14.571  -0.782
  129   2HA   GLY  78          HA3       GLY  78  -8.991 -14.169   0.740
  130    H    GLY  79           H        GLY  79  -9.912 -11.591   0.118
  131   1HA   GLY  79          HA2       GLY  79 -11.322 -11.459  -2.324
  132   2HA   GLY  79          HA3       GLY  79 -12.366 -12.157  -1.094
  133    H    GLY  80           H        GLY  80 -10.794  -9.289  -2.238
  134   1HA   GLY  80          HA2       GLY  80 -11.154  -7.070  -1.772
  135   2HA   GLY  80          HA3       GLY  80 -12.666  -7.571  -1.028
  136    H    TRP  81           H        TRP  81 -11.984  -5.659   0.340
  137    HA   TRP  81           HA       TRP  81 -10.726  -6.693   2.749
  138   1HB   TRP  81          HB2       TRP  81  -9.543  -4.274   2.772
  139   2HB   TRP  81          HB3       TRP  81  -8.759  -5.718   2.141
  140    HD1  TRP  81           HD1      TRP  81  -9.279  -6.045  -0.681
  141    HE1  TRP  81           HE1      TRP  81  -9.070  -4.229  -2.485
  142    HE3  TRP  81           HE3      TRP  81  -9.597  -1.906   2.302
  143    HZ2  TRP  81           HZ2      TRP  81  -9.035  -1.408  -2.628
  144    HZ3  TRP  81           HZ3      TRP  81  -9.466   0.315   1.252
  145    HH2  TRP  81           HH2      TRP  81  -9.189   0.557  -1.162
  146    H    GLY  82           H        GLY  82 -11.494  -3.410   1.669
  147   1HA   GLY  82          HA2       GLY  82 -13.381  -3.212   3.924
  148   2HA   GLY  82          HA3       GLY  82 -12.530  -1.855   3.202
  149    H    GLN  83           H        GLN  83 -13.145  -3.078   0.479
  150    HA   GLN  83           HA       GLN  83 -15.388  -1.514  -0.124
  151   1HB   GLN  83          HB2       GLN  83 -15.339  -2.560  -2.310
  152   2HB   GLN  83          HB3       GLN  83 -13.696  -2.225  -1.782
  153   1HG   GLN  83          HG2       GLN  83 -13.665  -4.651  -0.969
  154   2HG   GLN  83          HG3       GLN  83 -15.107  -4.860  -1.963
  155   1HE2  GLN  83          HE21      GLN  83 -11.839  -5.151  -1.924
  156   2HE2  GLN  83          HE22      GLN  83 -11.518  -5.084  -3.621
  157    HA   PRO  84           HA       PRO  84 -18.888  -3.948   0.980
  158   1HB   PRO  84          HB2       PRO  84 -20.575  -3.468  -1.119
  159   2HB   PRO  84          HB3       PRO  84 -20.273  -2.311   0.181
  160   1HG   PRO  84          HG2       PRO  84 -19.087  -2.434  -2.563
  161   2HG   PRO  84          HG3       PRO  84 -19.652  -1.023  -1.649
  162   1HD   PRO  84          HD2       PRO  84 -17.038  -1.639  -1.849
  163   2HD   PRO  84          HD3       PRO  84 -17.723  -0.913  -0.380
  164    H    HIS  85           H        HIS  85 -19.967  -5.892   0.548
  165    HA   HIS  85           HA       HIS  85 -18.716  -7.511  -1.553
  166   1HB   HIS  85          HB2       HIS  85 -20.350  -8.414   0.828
  167   2HB   HIS  85          HB3       HIS  85 -19.461  -9.452  -0.281
  168    HD1  HIS  85           HD1      HIS  85 -19.029  -7.240   2.673
  169    HD2  HIS  85           HD2      HIS  85 -16.653  -9.445   0.073
  170    HE1  HIS  85           HE1      HIS  85 -16.764  -7.347   3.759
  171    HE2  HIS  85           HE2      HIS  85 -15.320  -8.612   2.127
  172    H    GLY  86           H        GLY  86 -21.794  -6.316  -0.407
  173   1HA   GLY  86          HA2       GLY  86 -23.105  -7.625  -2.710
  174   2HA   GLY  86          HA3       GLY  86 -23.923  -7.273  -1.195
  175    H    GLY  87           H        GLY  87 -22.676  -4.627  -0.941
  176   1HA   GLY  87          HA2       GLY  87 -23.409  -3.097  -3.254
  177   2HA   GLY  87          HA3       GLY  87 -24.622  -3.009  -1.985
  178    H    GLY  88           H        GLY  88 -23.690  -2.468   0.243
  179   1HA   GLY  88          HA2       GLY  88 -21.431  -0.589  -0.005
  180   2HA   GLY  88          HA3       GLY  88 -22.944  -0.056   0.714
  181    H    TRP  89           H        TRP  89 -22.044   0.404   2.704
  182    HA   TRP  89           HA       TRP  89 -21.769  -1.841   4.485
  183   1HB   TRP  89          HB2       TRP  89 -19.469  -0.750   5.267
  184   2HB   TRP  89          HB3       TRP  89 -19.525  -1.991   4.018
  185    HD1  TRP  89           HD1      TRP  89 -19.445  -1.044   1.417
  186    HE1  TRP  89           HE1      TRP  89 -18.181   0.977   0.461
  187    HE3  TRP  89           HE3      TRP  89 -18.638   1.515   5.758
  188    HZ2  TRP  89           HZ2      TRP  89 -16.987   3.352   1.426
  189    HZ3  TRP  89           HZ3      TRP  89 -17.425   3.655   5.660
  190    HH2  TRP  89           HH2      TRP  89 -16.619   4.554   3.538
  191    H    GLY  90           H        GLY  90 -23.305   0.726   4.066
  192   1HA   GLY  90          HA2       GLY  90 -24.465   1.812   5.858
  193   2HA   GLY  90          HA3       GLY  90 -22.998   1.707   6.820
  194    H    GLN  91           H        GLN  91 -21.632   2.579   4.127
  195    HA   GLN  91           HA       GLN  91 -21.230   5.256   4.839
  196   1HB   GLN  91          HB2       GLN  91 -20.303   5.443   2.464
  197   2HB   GLN  91          HB3       GLN  91 -19.554   4.258   3.523
  198   1HG   GLN  91          HG2       GLN  91 -20.435   2.472   2.378
  199   2HG   GLN  91          HG3       GLN  91 -21.775   3.414   1.728
  200   1HE2  GLN  91          HE21      GLN  91 -20.544   1.870  -0.011
  201   2HE2  GLN  91          HE22      GLN  91 -19.516   2.774  -1.066
  Start of MODEL    5
    1    H    TRP  57           H        TRP  57  17.458   1.468  -4.506
    2    HA   TRP  57           HA       TRP  57  18.175   2.342  -6.440
    3   1HB   TRP  57          HB2       TRP  57  20.248   1.694  -7.537
    4   2HB   TRP  57          HB3       TRP  57  20.570   2.071  -5.849
    5    HD1  TRP  57           HD1      TRP  57  20.275  -0.458  -4.291
    6    HE1  TRP  57           HE1      TRP  57  21.614  -2.599  -4.785
    7    HE3  TRP  57           HE3      TRP  57  21.522   0.471  -9.161
    8    HZ2  TRP  57           HZ2      TRP  57  23.014  -3.743  -6.953
    9    HZ3  TRP  57           HZ3      TRP  57  22.864  -1.198 -10.373
   10    HH2  TRP  57           HH2      TRP  57  23.593  -3.261  -9.290
   11    H    GLY  58           H        GLY  58  19.038   0.758  -8.661
   12   1HA   GLY  58          HA2       GLY  58  16.742  -0.335  -9.611
   13   2HA   GLY  58          HA3       GLY  58  18.332  -0.890 -10.110
   14    H    GLN  59           H        GLN  59  19.340  -2.585  -8.723
   15    HA   GLN  59           HA       GLN  59  17.290  -4.533  -7.979
   16   1HB   GLN  59          HB2       GLN  59  19.012  -6.210  -8.188
   17   2HB   GLN  59          HB3       GLN  59  19.051  -5.177  -9.610
   18   1HG   GLN  59          HG2       GLN  59  20.978  -4.015  -8.784
   19   2HG   GLN  59          HG3       GLN  59  20.890  -4.877  -7.248
   20   1HE2  GLN  59          HE21      GLN  59  21.118  -5.511 -10.730
   21   2HE2  GLN  59          HE22      GLN  59  22.216  -6.838 -10.592
   22    HA   PRO  60           HA       PRO  60  18.007  -4.258  -3.643
   23   1HB   PRO  60          HB2       PRO  60  17.840  -6.874  -2.882
   24   2HB   PRO  60          HB3       PRO  60  16.435  -5.889  -3.301
   25   1HG   PRO  60          HG2       PRO  60  17.922  -7.876  -4.972
   26   2HG   PRO  60          HG3       PRO  60  16.173  -7.626  -4.822
   27   1HD   PRO  60          HD2       PRO  60  17.581  -6.679  -6.918
   28   2HD   PRO  60          HD3       PRO  60  16.184  -5.809  -6.251
   29    H    HIS  61           H        HIS  61  19.585  -4.501  -2.062
   30    HA   HIS  61           HA       HIS  61  22.117  -5.644  -3.019
   31   1HB   HIS  61          HB2       HIS  61  21.985  -3.189  -2.394
   32   2HB   HIS  61          HB3       HIS  61  21.755  -3.710  -0.729
   33    HD1  HIS  61           HD1      HIS  61  24.025  -2.416  -0.242
   34    HD2  HIS  61           HD2      HIS  61  24.358  -5.783  -2.655
   35    HE1  HIS  61           HE1      HIS  61  26.474  -2.988  -0.263
   36    HE2  HIS  61           HE2      HIS  61  26.639  -5.079  -1.658
   37    H    GLY  62           H        GLY  62  19.777  -5.738  -0.425
   38   1HA   GLY  62          HA2       GLY  62  21.301  -7.970   0.772
   39   2HA   GLY  62          HA3       GLY  62  20.450  -6.786   1.753
   40    H    GLY  63           H        GLY  63  18.088  -6.580   0.228
   41   1HA   GLY  63          HA2       GLY  63  16.924  -9.084  -0.363
   42   2HA   GLY  63          HA3       GLY  63  16.559  -8.656   1.302
   43    H    GLY  64           H        GLY  64  16.030  -7.878  -2.054
   44   1HA   GLY  64          HA2       GLY  64  14.387  -6.658  -3.096
   45   2HA   GLY  64          HA3       GLY  64  13.444  -6.888  -1.630
   46    H    TRP  65           H        TRP  65  12.697  -4.695  -2.362
   47    HA   TRP  65           HA       TRP  65  14.170  -2.684  -0.866
   48   1HB   TRP  65          HB2       TRP  65  13.570  -1.141  -2.990
   49   2HB   TRP  65          HB3       TRP  65  15.125  -1.940  -2.793
   50    HD1  TRP  65           HD1      TRP  65  15.133  -4.554  -4.006
   51    HE1  TRP  65           HE1      TRP  65  14.276  -5.146  -6.355
   52    HE3  TRP  65           HE3      TRP  65  12.057  -0.544  -4.777
   53    HZ2  TRP  65           HZ2      TRP  65  12.529  -4.054  -8.287
   54    HZ3  TRP  65           HZ3      TRP  65  10.830  -0.393  -6.905
   55    HH2  TRP  65           HH2      TRP  65  11.064  -2.112  -8.623
   56    H    GLY  66           H        GLY  66  11.588  -2.447  -3.275
   57   1HA   GLY  66          HA2       GLY  66   9.841  -1.378  -1.152
   58   2HA   GLY  66          HA3       GLY  66   9.731  -0.939  -2.850
   59    H    GLN  67           H        GLN  67  10.198  -3.925  -3.438
   60    HA   GLN  67           HA       GLN  67   7.536  -4.615  -3.917
   61   1HB   GLN  67          HB2       GLN  67   8.367  -6.826  -4.479
   62   2HB   GLN  67          HB3       GLN  67   9.461  -5.602  -5.107
   63   1HG   GLN  67          HG2       GLN  67  10.807  -5.986  -2.961
   64   2HG   GLN  67          HG3       GLN  67   9.850  -7.458  -2.792
   65   1HE2  GLN  67          HE21      GLN  67  11.732  -8.707  -3.007
   66   2HE2  GLN  67          HE22      GLN  67  12.478  -8.957  -4.545
   67    HA   PRO  68           HA       PRO  68   5.916  -6.170  -0.130
   68   1HB   PRO  68          HB2       PRO  68   4.529  -8.373  -1.003
   69   2HB   PRO  68          HB3       PRO  68   3.950  -6.713  -1.151
   70   1HG   PRO  68          HG2       PRO  68   5.278  -8.443  -3.192
   71   2HG   PRO  68          HG3       PRO  68   3.912  -7.326  -3.383
   72   1HD   PRO  68          HD2       PRO  68   6.406  -6.673  -4.159
   73   2HD   PRO  68          HD3       PRO  68   5.284  -5.467  -3.491
   74    H    HIS  69           H        HIS  69   6.073  -7.876   1.402
   75    HA   HIS  69           HA       HIS  69   8.148  -9.867   0.758
   76   1HB   HIS  69          HB2       HIS  69   8.577  -9.822   3.280
   77   2HB   HIS  69          HB3       HIS  69   9.121  -8.431   2.350
   78    HD1  HIS  69           HD1      HIS  69   7.431  -6.300   2.450
   79    HD2  HIS  69           HD2      HIS  69   6.966  -9.208   5.382
   80    HE1  HIS  69           HE1      HIS  69   6.104  -5.201   4.281
   81    HE2  HIS  69           HE2      HIS  69   5.908  -6.953   6.081
   82    H    GLY  70           H        GLY  70   7.104 -11.714   0.390
   83   1HA   GLY  70          HA2       GLY  70   6.145 -13.706   1.227
   84   2HA   GLY  70          HA3       GLY  70   5.423 -12.779   2.534
   85    H    GLY  71           H        GLY  71   4.456 -10.738   0.549
   86   1HA   GLY  71          HA2       GLY  71   2.678 -12.038  -1.250
   87   2HA   GLY  71          HA3       GLY  71   1.848 -11.622   0.241
   88    H    GLY  72           H        GLY  72   1.441  -9.464   0.734
   89   1HA   GLY  72          HA2       GLY  72   2.166  -7.506  -1.353
   90   2HA   GLY  72          HA3       GLY  72   0.502  -7.657  -0.809
   91    H    TRP  73           H        TRP  73   0.334  -5.590  -0.023
   92    HA   TRP  73           HA       TRP  73   1.778  -5.088   2.480
   93   1HB   TRP  73          HB2       TRP  73   1.480  -2.547   1.485
   94   2HB   TRP  73          HB3       TRP  73   2.969  -3.484   1.429
   95    HD1  TRP  73           HD1      TRP  73   2.907  -5.220  -0.946
   96    HE1  TRP  73           HE1      TRP  73   2.500  -4.412  -3.345
   97    HE3  TRP  73           HE3      TRP  73   0.559  -0.805   0.093
   98    HZ2  TRP  73           HZ2      TRP  73   1.338  -2.180  -4.638
   99    HZ3  TRP  73           HZ3      TRP  73  -0.168   0.612  -1.783
  100    HH2  TRP  73           HH2      TRP  73   0.215  -0.062  -4.098
  101    H    GLY  74           H        GLY  74  -0.480  -3.110   0.613
  102   1HA   GLY  74          HA2       GLY  74  -2.347  -3.259   2.896
  103   2HA   GLY  74          HA3       GLY  74  -2.166  -1.852   1.860
  104    H    GLN  75           H        GLN  75  -1.959  -4.181  -0.320
  105    HA   GLN  75           HA       GLN  75  -4.495  -3.785  -1.415
  106   1HB   GLN  75          HB2       GLN  75  -3.932  -5.519  -2.992
  107   2HB   GLN  75          HB3       GLN  75  -2.491  -4.566  -2.669
  108   1HG   GLN  75          HG2       GLN  75  -1.751  -6.313  -1.076
  109   2HG   GLN  75          HG3       GLN  75  -3.145  -7.283  -1.552
  110   1HE2  GLN  75          HE21      GLN  75   0.026  -6.290  -2.333
  111   2HE2  GLN  75          HE22      GLN  75   0.191  -7.180  -3.806
  112    HA   PRO  76           HA       PRO  76  -7.146  -6.574   0.741
  113   1HB   PRO  76          HB2       PRO  76  -8.854  -7.340  -1.218
  114   2HB   PRO  76          HB3       PRO  76  -8.885  -5.728  -0.498
  115   1HG   PRO  76          HG2       PRO  76  -7.671  -6.630  -3.078
  116   2HG   PRO  76          HG3       PRO  76  -8.605  -5.162  -2.731
  117   1HD   PRO  76          HD2       PRO  76  -5.898  -5.172  -2.903
  118   2HD   PRO  76          HD3       PRO  76  -6.788  -4.065  -1.839
  119    H    HIS  77           H        HIS  77  -7.124  -8.677   1.316
  120    HA   HIS  77           HA       HIS  77  -5.862 -10.571  -0.547
  121   1HB   HIS  77          HB2       HIS  77  -6.162 -10.983   2.421
  122   2HB   HIS  77          HB3       HIS  77  -5.073 -11.805   1.309
  123    HD1  HIS  77           HD1      HIS  77  -2.828 -10.715   0.845
  124    HD2  HIS  77           HD2      HIS  77  -5.345  -8.354   3.158
  125    HE1  HIS  77           HE1      HIS  77  -1.396  -8.825   1.682
  126    HE2  HIS  77           HE2      HIS  77  -2.920  -7.457   3.149
  127    H    GLY  78           H        GLY  78  -7.405 -11.602  -1.638
  128   1HA   GLY  78          HA2       GLY  78  -8.892 -13.493  -1.631
  129   2HA   GLY  78          HA3       GLY  78  -9.499 -12.955  -0.072
  130    H    GLY  79           H        GLY  79  -9.710 -10.155  -0.927
  131   1HA   GLY  79          HA2       GLY  79 -11.078  -9.465  -3.104
  132   2HA   GLY  79          HA3       GLY  79 -12.295 -10.401  -2.250
  133    H    GLY  80           H        GLY  80 -10.482  -7.440  -2.338
  134   1HA   GLY  80          HA2       GLY  80 -10.719  -5.447  -1.215
  135   2HA   GLY  80          HA3       GLY  80 -12.418  -5.885  -1.119
  136    H    TRP  81           H        TRP  81 -12.340  -4.703   0.910
  137    HA   TRP  81           HA       TRP  81 -11.554  -6.469   3.114
  138   1HB   TRP  81          HB2       TRP  81 -11.116  -4.028   4.245
  139   2HB   TRP  81          HB3       TRP  81  -9.852  -5.047   3.566
  140    HD1  TRP  81           HD1      TRP  81  -9.643  -4.519   0.682
  141    HE1  TRP  81           HE1      TRP  81  -9.321  -2.201  -0.368
  142    HE3  TRP  81           HE3      TRP  81 -11.375  -1.650   4.537
  143    HZ2  TRP  81           HZ2      TRP  81  -9.741   0.503   0.346
  144    HZ3  TRP  81           HZ3      TRP  81 -11.379   0.797   4.274
  145    HH2  TRP  81           HH2      TRP  81 -10.579   1.849   2.222
  146    H    GLY  82           H        GLY  82 -12.855  -3.181   3.063
  147   1HA   GLY  82          HA2       GLY  82 -15.216  -4.193   4.509
  148   2HA   GLY  82          HA3       GLY  82 -14.583  -2.559   4.635
  149    H    GLN  83           H        GLN  83 -14.209  -2.668   1.589
  150    HA   GLN  83           HA       GLN  83 -16.529  -1.265   0.899
  151   1HB   GLN  83          HB2       GLN  83 -15.723  -1.349  -1.379
  152   2HB   GLN  83          HB3       GLN  83 -14.362  -1.092  -0.297
  153   1HG   GLN  83          HG2       GLN  83 -13.987  -3.599  -0.420
  154   2HG   GLN  83          HG3       GLN  83 -15.126  -3.592  -1.766
  155   1HE2  GLN  83          HE21      GLN  83 -14.094  -3.695  -3.617
  156   2HE2  GLN  83          HE22      GLN  83 -12.632  -2.867  -4.022
  157    HA   PRO  84           HA       PRO  84 -19.535  -4.349  -0.032
  158   1HB   PRO  84          HB2       PRO  84 -20.828  -3.245  -2.156
  159   2HB   PRO  84          HB3       PRO  84 -21.025  -2.667  -0.499
  160   1HG   PRO  84          HG2       PRO  84 -19.309  -1.575  -2.695
  161   2HG   PRO  84          HG3       PRO  84 -20.328  -0.705  -1.533
  162   1HD   PRO  84          HD2       PRO  84 -17.653  -0.912  -1.231
  163   2HD   PRO  84          HD3       PRO  84 -18.761  -0.866   0.155
  164    H    HIS  85           H        HIS  85 -19.720  -6.182  -1.215
  165    HA   HIS  85           HA       HIS  85 -17.886  -6.498  -3.468
  166   1HB   HIS  85          HB2       HIS  85 -18.176  -8.099  -1.377
  167   2HB   HIS  85          HB3       HIS  85 -19.468  -8.775  -2.362
  168    HD1  HIS  85           HD1      HIS  85 -17.505 -10.802  -1.985
  169    HD2  HIS  85           HD2      HIS  85 -16.865  -7.839  -4.828
  170    HE1  HIS  85           HE1      HIS  85 -15.796 -11.748  -3.570
  171    HE2  HIS  85           HE2      HIS  85 -15.490  -9.971  -5.329
  172    H    GLY  86           H        GLY  86 -21.292  -6.535  -2.688
  173   1HA   GLY  86          HA2       GLY  86 -21.876  -7.034  -5.543
  174   2HA   GLY  86          HA3       GLY  86 -22.917  -7.590  -4.242
  175    H    GLY  87           H        GLY  87 -22.898  -5.281  -2.637
  176   1HA   GLY  87          HA2       GLY  87 -23.452  -2.899  -4.011
  177   2HA   GLY  87          HA3       GLY  87 -24.957  -3.788  -3.837
  178    H    GLY  88           H        GLY  88 -22.531  -1.914  -2.239
  179   1HA   GLY  88          HA2       GLY  88 -22.482  -0.912  -0.175
  180   2HA   GLY  88          HA3       GLY  88 -24.229  -1.112  -0.161
  181    H    TRP  89           H        TRP  89 -23.647  -1.332   2.200
  182    HA   TRP  89           HA       TRP  89 -23.540  -4.166   2.837
  183   1HB   TRP  89          HB2       TRP  89 -21.925  -3.322   4.820
  184   2HB   TRP  89          HB3       TRP  89 -21.319  -3.982   3.305
  185    HD1  TRP  89           HD1      TRP  89 -20.906  -1.905   1.345
  186    HE1  TRP  89           HE1      TRP  89 -19.697   0.329   1.728
  187    HE3  TRP  89           HE3      TRP  89 -21.293  -1.642   6.435
  188    HZ2  TRP  89           HZ2      TRP  89 -18.991   1.987   3.904
  189    HZ3  TRP  89           HZ3      TRP  89 -20.321   0.301   7.591
  190    HH2  TRP  89           HH2      TRP  89 -19.194   2.076   6.351
  191    H    GLY  90           H        GLY  90 -23.135  -1.264   4.823
  192   1HA   GLY  90          HA2       GLY  90 -25.643  -1.984   6.206
  193   2HA   GLY  90          HA3       GLY  90 -24.275  -1.203   6.984
  194    H    GLN  91           H        GLN  91 -23.982   0.506   4.477
  195    HA   GLN  91           HA       GLN  91 -25.375   2.756   5.426
  196   1HB   GLN  91          HB2       GLN  91 -24.710   3.802   3.262
  197   2HB   GLN  91          HB3       GLN  91 -23.376   3.042   4.120
  198   1HG   GLN  91          HG2       GLN  91 -22.904   2.111   2.151
  199   2HG   GLN  91          HG3       GLN  91 -24.224   1.007   2.530
  200   1HE2  GLN  91          HE21      GLN  91 -24.951   0.637   0.503
  201   2HE2  GLN  91          HE22      GLN  91 -25.628   1.853  -0.522
  Start of MODEL    6
    1    H    TRP  57           H        TRP  57  12.653   3.418 -16.135
    2    HA   TRP  57           HA       TRP  57  14.355   2.691 -14.599
    3   1HB   TRP  57          HB2       TRP  57  14.453   5.287 -13.856
    4   2HB   TRP  57          HB3       TRP  57  13.414   4.653 -12.584
    5    HD1  TRP  57           HD1      TRP  57  14.935   4.415 -10.531
    6    HE1  TRP  57           HE1      TRP  57  17.217   3.325 -10.053
    7    HE3  TRP  57           HE3      TRP  57  16.208   3.069 -15.296
    8    HZ2  TRP  57           HZ2      TRP  57  19.284   2.062 -11.503
    9    HZ3  TRP  57           HZ3      TRP  57  18.356   1.925 -15.665
   10    HH2  TRP  57           HH2      TRP  57  19.860   1.434 -13.806
   11    H    GLY  58           H        GLY  58  13.682   1.956 -12.204
   12   1HA   GLY  58          HA2       GLY  58  11.145   1.826 -11.251
   13   2HA   GLY  58          HA3       GLY  58  11.135   0.649 -12.555
   14    H    GLN  59           H        GLN  59  13.989  -0.019 -12.070
   15    HA   GLN  59           HA       GLN  59  13.560  -2.147 -10.238
   16   1HB   GLN  59          HB2       GLN  59  15.867  -2.736 -10.647
   17   2HB   GLN  59          HB3       GLN  59  15.117  -2.270 -12.167
   18   1HG   GLN  59          HG2       GLN  59  16.114   0.058 -11.683
   19   2HG   GLN  59          HG3       GLN  59  17.140  -0.797 -10.533
   20   1HE2  GLN  59          HE21      GLN  59  18.655  -2.281 -11.294
   21   2HE2  GLN  59          HE22      GLN  59  19.158  -2.309 -12.946
   22    HA   PRO  60           HA       PRO  60  14.674  -0.344  -6.377
   23   1HB   PRO  60          HB2       PRO  60  15.953  -2.408  -5.149
   24   2HB   PRO  60          HB3       PRO  60  14.202  -2.354  -5.375
   25   1HG   PRO  60          HG2       PRO  60  16.276  -3.796  -6.979
   26   2HG   PRO  60          HG3       PRO  60  14.684  -4.363  -6.440
   27   1HD   PRO  60          HD2       PRO  60  15.130  -3.492  -8.959
   28   2HD   PRO  60          HD3       PRO  60  13.576  -3.257  -8.135
   29    H    HIS  61           H        HIS  61  16.344   0.696  -5.342
   30    HA   HIS  61           HA       HIS  61  18.912   0.660  -6.741
   31   1HB   HIS  61          HB2       HIS  61  17.689   2.820  -6.349
   32   2HB   HIS  61          HB3       HIS  61  17.961   2.598  -4.624
   33    HD1  HIS  61           HD1      HIS  61  19.243   4.969  -4.971
   34    HD2  HIS  61           HD2      HIS  61  21.055   1.600  -6.594
   35    HE1  HIS  61           HE1      HIS  61  21.635   5.626  -5.380
   36    HE2  HIS  61           HE2      HIS  61  22.733   3.544  -6.280
   37    H    GLY  62           H        GLY  62  17.471  -0.030  -3.634
   38   1HA   GLY  62          HA2       GLY  62  20.110  -0.983  -2.705
   39   2HA   GLY  62          HA3       GLY  62  19.004  -0.138  -1.633
   40    H    GLY  63           H        GLY  63  16.594  -1.347  -2.415
   41   1HA   GLY  63          HA2       GLY  63  16.741  -4.177  -2.434
   42   2HA   GLY  63          HA3       GLY  63  16.530  -3.602  -0.786
   43    H    GLY  64           H        GLY  64  15.049  -4.045  -3.886
   44   1HA   GLY  64          HA2       GLY  64  12.854  -3.989  -4.556
   45   2HA   GLY  64          HA3       GLY  64  12.450  -4.183  -2.856
   46    H    TRP  65           H        TRP  65  10.600  -2.824  -3.665
   47    HA   TRP  65           HA       TRP  65  11.158  -0.050  -3.003
   48   1HB   TRP  65          HB2       TRP  65   9.494   0.429  -5.071
   49   2HB   TRP  65          HB3       TRP  65  11.247   0.477  -5.215
   50    HD1  TRP  65           HD1      TRP  65  12.325  -2.079  -5.972
   51    HE1  TRP  65           HE1      TRP  65  11.453  -3.613  -7.841
   52    HE3  TRP  65           HE3      TRP  65   7.576  -0.232  -6.385
   53    HZ2  TRP  65           HZ2      TRP  65   9.067  -3.987  -9.305
   54    HZ3  TRP  65           HZ3      TRP  65   6.062  -1.233  -8.046
   55    HH2  TRP  65           HH2      TRP  65   6.794  -3.072  -9.476
   56    H    GLY  66           H        GLY  66   8.388  -1.619  -4.552
   57   1HA   GLY  66          HA2       GLY  66   6.781  -0.886  -2.186
   58   2HA   GLY  66          HA3       GLY  66   6.152  -0.973  -3.824
   59    H    GLN  67           H        GLN  67   7.979  -3.532  -3.960
   60    HA   GLN  67           HA       GLN  67   5.937  -5.410  -3.738
   61   1HB   GLN  67          HB2       GLN  67   7.638  -7.097  -3.996
   62   2HB   GLN  67          HB3       GLN  67   8.053  -5.723  -5.011
   63   1HG   GLN  67          HG2       GLN  67   9.598  -4.959  -3.201
   64   2HG   GLN  67          HG3       GLN  67   9.281  -6.485  -2.376
   65   1HE2  GLN  67          HE21      GLN  67  10.401  -5.146  -5.449
   66   2HE2  GLN  67          HE22      GLN  67  11.508  -6.424  -5.807
   67    HA   PRO  68           HA       PRO  68   5.618  -6.344   0.557
   68   1HB   PRO  68          HB2       PRO  68   5.000  -8.984   0.505
   69   2HB   PRO  68          HB3       PRO  68   3.861  -7.724   0.020
   70   1HG   PRO  68          HG2       PRO  68   5.580  -9.483  -1.683
   71   2HG   PRO  68          HG3       PRO  68   3.889  -9.005  -1.918
   72   1HD   PRO  68          HD2       PRO  68   5.944  -7.835  -3.247
   73   2HD   PRO  68          HD3       PRO  68   4.458  -6.965  -2.817
   74    H    HIS  69           H        HIS  69   6.701  -7.280   2.303
   75    HA   HIS  69           HA       HIS  69   9.337  -8.364   1.644
   76   1HB   HIS  69          HB2       HIS  69   9.246  -6.398   3.123
   77   2HB   HIS  69          HB3       HIS  69   8.266  -7.306   4.270
   78    HD1  HIS  69           HD1      HIS  69  10.304  -6.671   5.926
   79    HD2  HIS  69           HD2      HIS  69  11.140  -9.420   2.925
   80    HE1  HIS  69           HE1      HIS  69  12.427  -7.815   6.635
   81    HE2  HIS  69           HE2      HIS  69  12.960  -9.414   4.763
   82    H    GLY  70           H        GLY  70   6.344  -9.193   3.232
   83   1HA   GLY  70          HA2       GLY  70   7.230 -11.967   3.389
   84   2HA   GLY  70          HA3       GLY  70   6.782 -11.207   4.909
   85    H    GLY  71           H        GLY  71   5.169 -10.374   1.932
   86   1HA   GLY  71          HA2       GLY  71   3.139 -12.203   1.758
   87   2HA   GLY  71          HA3       GLY  71   2.629 -11.113   3.039
   88    H    GLY  72           H        GLY  72   1.621  -9.274   2.493
   89   1HA   GLY  72          HA2       GLY  72   1.786  -8.420  -0.332
   90   2HA   GLY  72          HA3       GLY  72   0.255  -8.489   0.528
   91    H    TRP  73           H        TRP  73  -0.028  -6.255   0.026
   92    HA   TRP  73           HA       TRP  73   1.196  -4.528   2.021
   93   1HB   TRP  73          HB2       TRP  73   1.323  -2.808  -0.062
   94   2HB   TRP  73          HB3       TRP  73   2.689  -3.773   0.485
   95    HD1  TRP  73           HD1      TRP  73   2.825  -6.298  -0.876
   96    HE1  TRP  73           HE1      TRP  73   2.582  -6.693  -3.403
   97    HE3  TRP  73           HE3      TRP  73   0.379  -1.989  -2.134
   98    HZ2  TRP  73           HZ2      TRP  73   1.503  -5.349  -5.643
   99    HZ3  TRP  73           HZ3      TRP  73  -0.221  -1.620  -4.490
  100    HH2  TRP  73           HH2      TRP  73   0.331  -3.266  -6.208
  101    H    GLY  74           H        GLY  74  -0.585  -3.730  -0.926
  102   1HA   GLY  74          HA2       GLY  74  -2.789  -2.764   0.789
  103   2HA   GLY  74          HA3       GLY  74  -2.307  -1.986  -0.711
  104    H    GLN  75           H        GLN  75  -2.023  -5.169  -1.362
  105    HA   GLN  75           HA       GLN  75  -4.197  -5.283  -3.104
  106   1HB   GLN  75          HB2       GLN  75  -3.671  -7.625  -3.379
  107   2HB   GLN  75          HB3       GLN  75  -2.173  -6.714  -3.252
  108   1HG   GLN  75          HG2       GLN  75  -1.909  -7.404  -0.950
  109   2HG   GLN  75          HG3       GLN  75  -3.459  -8.244  -1.001
  110   1HE2  GLN  75          HE21      GLN  75  -0.164  -8.235  -2.162
  111   2HE2  GLN  75          HE22      GLN  75  -0.120  -9.895  -2.640
  112    HA   PRO  76           HA       PRO  76  -7.700  -6.318  -0.644
  113   1HB   PRO  76          HB2       PRO  76  -9.010  -8.085  -2.262
  114   2HB   PRO  76          HB3       PRO  76  -8.994  -6.340  -2.533
  115   1HG   PRO  76          HG2       PRO  76  -7.345  -8.475  -3.827
  116   2HG   PRO  76          HG3       PRO  76  -8.123  -7.061  -4.561
  117   1HD   PRO  76          HD2       PRO  76  -5.485  -7.122  -3.992
  118   2HD   PRO  76          HD3       PRO  76  -6.441  -5.630  -3.889
  119    H    HIS  77           H        HIS  77  -8.582  -7.915   0.700
  120    HA   HIS  77           HA       HIS  77  -6.881 -10.282   1.013
  121   1HB   HIS  77          HB2       HIS  77  -7.130  -8.806   2.972
  122   2HB   HIS  77          HB3       HIS  77  -8.871  -9.059   2.938
  123    HD1  HIS  77           HD1      HIS  77  -8.613 -10.012   5.391
  124    HD2  HIS  77           HD2      HIS  77  -6.778 -12.252   2.410
  125    HE1  HIS  77           HE1      HIS  77  -8.122 -12.247   6.435
  126    HE2  HIS  77           HE2      HIS  77  -7.093 -13.614   4.586
  127    H    GLY  78           H        GLY  78 -10.164  -9.280   0.381
  128   1HA   GLY  78          HA2       GLY  78 -10.826 -12.021  -0.361
  129   2HA   GLY  78          HA3       GLY  78 -11.803 -11.302   0.910
  130    H    GLY  79           H        GLY  79 -10.533  -9.368  -1.696
  131   1HA   GLY  79          HA2       GLY  79 -12.442  -9.561  -3.647
  132   2HA   GLY  79          HA3       GLY  79 -13.177  -8.528  -2.430
  133    H    GLY  80           H        GLY  80 -12.776  -6.410  -2.530
  134   1HA   GLY  80          HA2       GLY  80 -10.454  -5.535  -4.142
  135   2HA   GLY  80          HA3       GLY  80 -12.025  -4.751  -4.243
  136    H    TRP  81           H        TRP  81 -10.893  -2.782  -3.732
  137    HA   TRP  81           HA       TRP  81 -10.750  -2.360  -0.856
  138   1HB   TRP  81          HB2       TRP  81  -8.571  -0.914  -1.537
  139   2HB   TRP  81          HB3       TRP  81  -8.487  -2.564  -0.930
  140    HD1  TRP  81           HD1      TRP  81  -8.575  -4.485  -3.074
  141    HE1  TRP  81           HE1      TRP  81  -7.204  -4.410  -5.245
  142    HE3  TRP  81           HE3      TRP  81  -7.411   0.492  -3.123
  143    HZ2  TRP  81           HZ2      TRP  81  -5.802  -2.495  -6.777
  144    HZ3  TRP  81           HZ3      TRP  81  -6.048   1.365  -4.976
  145    HH2  TRP  81           HH2      TRP  81  -5.260  -0.099  -6.764
  146    H    GLY  82           H        GLY  82  -9.576  -0.394  -3.551
  147   1HA   GLY  82          HA2       GLY  82 -11.616   1.617  -2.841
  148   2HA   GLY  82          HA3       GLY  82 -10.030   2.000  -3.493
  149    H    GLN  83           H        GLN  83 -10.570  -0.481  -5.319
  150    HA   GLN  83           HA       GLN  83 -11.210   0.923  -7.633
  151   1HB   GLN  83          HB2       GLN  83 -11.431  -1.229  -8.714
  152   2HB   GLN  83          HB3       GLN  83 -10.092  -1.289  -7.577
  153   1HG   GLN  83          HG2       GLN  83 -11.657  -2.355  -5.937
  154   2HG   GLN  83          HG3       GLN  83 -12.837  -2.465  -7.242
  155   1HE2  GLN  83          HE21      GLN  83 -10.244  -3.950  -5.713
  156   2HE2  GLN  83          HE22      GLN  83  -9.945  -5.199  -6.869
  157    HA   PRO  84           HA       PRO  84 -15.589   1.400  -7.648
  158   1HB   PRO  84          HB2       PRO  84 -16.180   1.032 -10.281
  159   2HB   PRO  84          HB3       PRO  84 -15.413   2.495  -9.655
  160   1HG   PRO  84          HG2       PRO  84 -14.165   0.128 -10.995
  161   2HG   PRO  84          HG3       PRO  84 -13.829   1.854 -11.230
  162   1HD   PRO  84          HD2       PRO  84 -12.243   0.271  -9.725
  163   2HD   PRO  84          HD3       PRO  84 -12.510   1.984  -9.339
  164    H    HIS  85           H        HIS  85 -17.651   0.315  -8.271
  165    HA   HIS  85           HA       HIS  85 -17.318  -2.609  -8.190
  166   1HB   HIS  85          HB2       HIS  85 -19.215  -0.738  -6.870
  167   2HB   HIS  85          HB3       HIS  85 -19.848  -2.306  -7.361
  168    HD1  HIS  85           HD1      HIS  85 -19.569  -4.107  -5.690
  169    HD2  HIS  85           HD2      HIS  85 -16.779  -1.073  -5.172
  170    HE1  HIS  85           HE1      HIS  85 -18.283  -4.724  -3.619
  171    HE2  HIS  85           HE2      HIS  85 -16.658  -2.829  -3.277
  172    H    GLY  86           H        GLY  86 -18.929   0.053  -9.783
  173   1HA   GLY  86          HA2       GLY  86 -19.831  -1.835 -11.857
  174   2HA   GLY  86          HA3       GLY  86 -20.954  -0.648 -11.210
  175    H    GLY  87           H        GLY  87 -17.579   0.105 -11.660
  176   1HA   GLY  87          HA2       GLY  87 -16.624   1.097 -13.636
  177   2HA   GLY  87          HA3       GLY  87 -18.239   1.602 -14.110
  178    H    GLY  88           H        GLY  88 -15.405   2.397 -12.328
  179   1HA   GLY  88          HA2       GLY  88 -14.724   4.337 -11.307
  180   2HA   GLY  88          HA3       GLY  88 -15.949   5.141 -12.279
  181    H    TRP  89           H        TRP  89 -15.904   6.471 -10.222
  182    HA   TRP  89           HA       TRP  89 -18.127   5.606  -8.560
  183   1HB   TRP  89          HB2       TRP  89 -16.601   6.613  -6.580
  184   2HB   TRP  89          HB3       TRP  89 -16.664   4.897  -6.966
  185    HD1  TRP  89           HD1      TRP  89 -14.649   4.184  -8.908
  186    HE1  TRP  89           HE1      TRP  89 -12.168   4.844  -8.833
  187    HE3  TRP  89           HE3      TRP  89 -14.981   8.218  -5.786
  188    HZ2  TRP  89           HZ2      TRP  89 -10.556   6.812  -7.605
  189    HZ3  TRP  89           HZ3      TRP  89 -12.921   9.434  -5.209
  190    HH2  TRP  89           HH2      TRP  89 -10.755   8.744  -6.100
  191    H    GLY  90           H        GLY  90 -15.721   8.161  -8.116
  192   1HA   GLY  90          HA2       GLY  90 -17.897  10.129  -8.455
  193   2HA   GLY  90          HA3       GLY  90 -16.531  10.345  -7.371
  194    H    GLN  91           H        GLN  91 -14.769   9.150  -9.553
  195    HA   GLN  91           HA       GLN  91 -13.855  11.575 -10.634
  196   1HB   GLN  91          HB2       GLN  91 -12.462  10.123 -12.118
  197   2HB   GLN  91          HB3       GLN  91 -12.336   9.733 -10.407
  198   1HG   GLN  91          HG2       GLN  91 -12.652   7.630 -11.067
  199   2HG   GLN  91          HG3       GLN  91 -14.351   8.085 -11.195
  200   1HE2  GLN  91          HE21      GLN  91 -11.340   8.063 -13.057
  201   2HE2  GLN  91          HE22      GLN  91 -12.077   7.708 -14.577
  Start of MODEL    7
    1    H    TRP  57           H        TRP  57  16.457  -0.137 -16.862
    2    HA   TRP  57           HA       TRP  57  16.099   1.383 -15.182
    3   1HB   TRP  57          HB2       TRP  57  14.512  -0.656 -15.558
    4   2HB   TRP  57          HB3       TRP  57  15.070  -1.165 -13.967
    5    HD1  TRP  57           HD1      TRP  57  14.447   2.530 -14.775
    6    HE1  TRP  57           HE1      TRP  57  12.476   3.360 -13.343
    7    HE3  TRP  57           HE3      TRP  57  12.982  -1.930 -12.748
    8    HZ2  TRP  57           HZ2      TRP  57  10.556   2.268 -11.586
    9    HZ3  TRP  57           HZ3      TRP  57  11.069  -1.950 -11.201
   10    HH2  TRP  57           HH2      TRP  57   9.882   0.107 -10.632
   11    H    GLY  58           H        GLY  58  15.897   1.709 -12.758
   12   1HA   GLY  58          HA2       GLY  58  18.432   1.578 -11.572
   13   2HA   GLY  58          HA3       GLY  58  16.937   1.948 -10.726
   14    H    GLN  59           H        GLN  59  15.519  -0.332 -10.830
   15    HA   GLN  59           HA       GLN  59  15.227  -2.306  -9.756
   16   1HB   GLN  59          HB2       GLN  59  16.384  -3.995 -10.696
   17   2HB   GLN  59          HB3       GLN  59  17.123  -2.734 -11.668
   18   1HG   GLN  59          HG2       GLN  59  18.846  -2.636  -9.704
   19   2HG   GLN  59          HG3       GLN  59  18.242  -4.258  -9.366
   20   1HE2  GLN  59          HE21      GLN  59  20.442  -2.462 -11.105
   21   2HE2  GLN  59          HE22      GLN  59  20.915  -3.658 -12.257
   22    HA   PRO  60           HA       PRO  60  16.818  -2.113  -5.660
   23   1HB   PRO  60          HB2       PRO  60  16.964  -4.707  -4.876
   24   2HB   PRO  60          HB3       PRO  60  15.431  -3.854  -5.088
   25   1HG   PRO  60          HG2       PRO  60  16.817  -5.747  -6.946
   26   2HG   PRO  60          HG3       PRO  60  15.096  -5.645  -6.528
   27   1HD   PRO  60          HD2       PRO  60  16.107  -4.620  -8.824
   28   2HD   PRO  60          HD3       PRO  60  14.717  -3.902  -7.985
   29    H    HIS  61           H        HIS  61  18.801  -1.617  -4.988
   30    HA   HIS  61           HA       HIS  61  21.103  -2.945  -6.166
   31   1HB   HIS  61          HB2       HIS  61  20.639  -0.409  -4.681
   32   2HB   HIS  61          HB3       HIS  61  22.240  -1.132  -4.573
   33    HD1  HIS  61           HD1      HIS  61  21.122   1.538  -6.182
   34    HD2  HIS  61           HD2      HIS  61  22.533  -2.054  -7.722
   35    HE1  HIS  61           HE1      HIS  61  21.885   2.062  -8.521
   36    HE2  HIS  61           HE2      HIS  61  22.655  -0.144  -9.462
   37    H    GLY  62           H        GLY  62  19.181  -3.776  -3.726
   38   1HA   GLY  62          HA2       GLY  62  20.924  -5.581  -2.540
   39   2HA   GLY  62          HA3       GLY  62  20.952  -4.137  -1.539
   40    H    GLY  63           H        GLY  63  18.195  -5.464  -3.316
   41   1HA   GLY  63          HA2       GLY  63  16.867  -7.024  -1.620
   42   2HA   GLY  63          HA3       GLY  63  16.661  -5.464  -0.837
   43    H    GLY  64           H        GLY  64  15.117  -4.093  -1.558
   44   1HA   GLY  64          HA2       GLY  64  13.833  -4.688  -4.138
   45   2HA   GLY  64          HA3       GLY  64  12.845  -4.620  -2.686
   46    H    TRP  65           H        TRP  65  11.670  -2.930  -3.773
   47    HA   TRP  65           HA       TRP  65  12.833  -0.316  -3.233
   48   1HB   TRP  65          HB2       TRP  65  11.652   0.299  -5.581
   49   2HB   TRP  65          HB3       TRP  65  13.360  -0.101  -5.436
   50    HD1  TRP  65           HD1      TRP  65  13.792  -2.945  -5.743
   51    HE1  TRP  65           HE1      TRP  65  12.835  -4.430  -7.607
   52    HE3  TRP  65           HE3      TRP  65   9.882   0.008  -7.198
   53    HZ2  TRP  65           HZ2      TRP  65  10.705  -4.357  -9.462
   54    HZ3  TRP  65           HZ3      TRP  65   8.434  -0.772  -9.027
   55    HH2  TRP  65           HH2      TRP  65   8.838  -2.909 -10.135
   56    H    GLY  66           H        GLY  66   9.992  -1.252  -5.121
   57   1HA   GLY  66          HA2       GLY  66   8.314  -0.049  -3.007
   58   2HA   GLY  66          HA3       GLY  66   7.973   0.124  -4.722
   59    H    GLN  67           H        GLN  67   9.144  -2.956  -3.870
   60    HA   GLN  67           HA       GLN  67   6.613  -4.161  -4.506
   61   1HB   GLN  67          HB2       GLN  67   7.796  -6.275  -4.344
   62   2HB   GLN  67          HB3       GLN  67   8.758  -5.128  -5.266
   63   1HG   GLN  67          HG2       GLN  67  10.079  -4.672  -3.217
   64   2HG   GLN  67          HG3       GLN  67   9.174  -5.948  -2.403
   65   1HE2  GLN  67          HE21      GLN  67   9.257  -8.100  -3.437
   66   2HE2  GLN  67          HE22      GLN  67  10.741  -8.591  -4.171
   67    HA   PRO  68           HA       PRO  68   4.940  -4.773  -0.479
   68   1HB   PRO  68          HB2       PRO  68   3.945  -7.319  -0.684
   69   2HB   PRO  68          HB3       PRO  68   3.156  -5.894  -1.361
   70   1HG   PRO  68          HG2       PRO  68   4.882  -7.925  -2.712
   71   2HG   PRO  68          HG3       PRO  68   3.394  -7.155  -3.291
   72   1HD   PRO  68          HD2       PRO  68   5.825  -6.370  -4.139
   73   2HD   PRO  68          HD3       PRO  68   4.490  -5.219  -3.922
   74    H    HIS  69           H        HIS  69   5.161  -5.984   1.493
   75    HA   HIS  69           HA       HIS  69   7.579  -7.669   1.556
   76   1HB   HIS  69          HB2       HIS  69   7.758  -6.851   3.971
   77   2HB   HIS  69          HB3       HIS  69   8.156  -5.694   2.707
   78    HD1  HIS  69           HD1      HIS  69   6.053  -6.135   5.637
   79    HD2  HIS  69           HD2      HIS  69   5.970  -3.801   2.201
   80    HE1  HIS  69           HE1      HIS  69   4.425  -4.281   6.123
   81    HE2  HIS  69           HE2      HIS  69   4.457  -2.833   4.061
   82    H    GLY  70           H        GLY  70   6.896  -9.706   1.714
   83   1HA   GLY  70          HA2       GLY  70   6.177 -11.513   3.058
   84   2HA   GLY  70          HA3       GLY  70   5.175 -10.399   3.977
   85    H    GLY  71           H        GLY  71   4.118  -9.225   1.429
   86   1HA   GLY  71          HA2       GLY  71   2.913 -10.738  -0.379
   87   2HA   GLY  71          HA3       GLY  71   2.013 -11.212   1.053
   88    H    GLY  72           H        GLY  72   2.617  -8.689  -1.262
   89   1HA   GLY  72          HA2       GLY  72   1.436  -6.793  -1.804
   90   2HA   GLY  72          HA3       GLY  72   0.062  -7.574  -1.035
   91    H    TRP  73           H        TRP  73  -0.576  -5.453  -0.353
   92    HA   TRP  73           HA       TRP  73   0.694  -4.705   2.172
   93   1HB   TRP  73          HB2       TRP  73   0.054  -2.233   1.249
   94   2HB   TRP  73          HB3       TRP  73   1.661  -2.941   1.122
   95    HD1  TRP  73           HD1      TRP  73   1.862  -4.510  -1.330
   96    HE1  TRP  73           HE1      TRP  73   1.249  -3.685  -3.682
   97    HE3  TRP  73           HE3      TRP  73  -1.250  -0.668  -0.042
   98    HZ2  TRP  73           HZ2      TRP  73  -0.344  -1.659  -4.845
   99    HZ3  TRP  73           HZ3      TRP  73  -2.277   0.667  -1.836
  100    HH2  TRP  73           HH2      TRP  73  -1.833   0.181  -4.187
  101    H    GLY  74           H        GLY  74  -1.790  -3.094   0.239
  102   1HA   GLY  74          HA2       GLY  74  -3.713  -3.676   2.405
  103   2HA   GLY  74          HA3       GLY  74  -3.698  -2.172   1.496
  104    H    GLN  75           H        GLN  75  -3.047  -4.916  -0.406
  105    HA   GLN  75           HA       GLN  75  -5.643  -4.656  -1.690
  106   1HB   GLN  75          HB2       GLN  75  -4.690  -5.967  -3.488
  107   2HB   GLN  75          HB3       GLN  75  -3.566  -4.690  -3.043
  108   1HG   GLN  75          HG2       GLN  75  -2.334  -6.364  -1.662
  109   2HG   GLN  75          HG3       GLN  75  -3.384  -7.607  -2.340
  110   1HE2  GLN  75          HE21      GLN  75  -0.912  -8.126  -2.788
  111   2HE2  GLN  75          HE22      GLN  75  -0.398  -7.713  -4.385
  112    HA   PRO  76           HA       PRO  76  -7.460  -8.290   0.012
  113   1HB   PRO  76          HB2       PRO  76  -8.836  -9.279  -2.122
  114   2HB   PRO  76          HB3       PRO  76  -9.355  -7.861  -1.204
  115   1HG   PRO  76          HG2       PRO  76  -7.885  -7.998  -3.807
  116   2HG   PRO  76          HG3       PRO  76  -9.224  -6.936  -3.331
  117   1HD   PRO  76          HD2       PRO  76  -6.661  -6.094  -3.351
  118   2HD   PRO  76          HD3       PRO  76  -7.839  -5.503  -2.163
  119    H    HIS  77           H        HIS  77  -7.155 -10.490   0.207
  120    HA   HIS  77           HA       HIS  77  -5.009 -11.606  -1.440
  121   1HB   HIS  77          HB2       HIS  77  -4.944 -11.574   1.121
  122   2HB   HIS  77          HB3       HIS  77  -6.160 -12.845   1.052
  123    HD1  HIS  77           HD1      HIS  77  -3.693 -13.710   2.369
  124    HD2  HIS  77           HD2      HIS  77  -4.070 -13.818  -1.767
  125    HE1  HIS  77           HE1      HIS  77  -1.988 -15.383   1.581
  126    HE2  HIS  77           HE2      HIS  77  -2.176 -15.368  -0.931
  127    H    GLY  78           H        GLY  78  -8.208 -11.510  -1.731
  128   1HA   GLY  78          HA2       GLY  78  -8.665 -13.317  -3.620
  129   2HA   GLY  78          HA3       GLY  78  -8.676 -14.350  -2.199
  130    H    GLY  79           H        GLY  79  -9.932 -11.054  -2.636
  131   1HA   GLY  79          HA2       GLY  79 -12.602 -11.591  -3.021
  132   2HA   GLY  79          HA3       GLY  79 -12.364 -11.710  -1.284
  133    H    GLY  80           H        GLY  80 -11.588  -9.831  -0.142
  134   1HA   GLY  80          HA2       GLY  80 -11.360  -7.299  -1.444
  135   2HA   GLY  80          HA3       GLY  80 -12.945  -7.496  -0.707
  136    H    TRP  81           H        TRP  81 -12.319  -5.652   0.600
  137    HA   TRP  81           HA       TRP  81 -11.014  -6.518   3.052
  138   1HB   TRP  81          HB2       TRP  81  -9.902  -4.064   2.915
  139   2HB   TRP  81          HB3       TRP  81  -9.081  -5.525   2.376
  140    HD1  TRP  81           HD1      TRP  81  -9.616  -6.053  -0.414
  141    HE1  TRP  81           HE1      TRP  81  -9.465  -4.356  -2.336
  142    HE3  TRP  81           HE3      TRP  81 -10.013  -1.734   2.291
  143    HZ2  TRP  81           HZ2      TRP  81  -9.499  -1.551  -2.666
  144    HZ3  TRP  81           HZ3      TRP  81  -9.942   0.415   1.095
  145    HH2  TRP  81           HH2      TRP  81  -9.690   0.503  -1.332
  146    H    GLY  82           H        GLY  82 -11.832  -3.294   1.851
  147   1HA   GLY  82          HA2       GLY  82 -13.727  -3.040   4.092
  148   2HA   GLY  82          HA3       GLY  82 -12.908  -1.699   3.303
  149    H    GLN  83           H        GLN  83 -13.522  -3.099   0.650
  150    HA   GLN  83           HA       GLN  83 -15.828  -1.612   0.017
  151   1HB   GLN  83          HB2       GLN  83 -15.721  -2.680  -2.154
  152   2HB   GLN  83          HB3       GLN  83 -14.096  -2.263  -1.628
  153   1HG   GLN  83          HG2       GLN  83 -13.903  -4.655  -0.811
  154   2HG   GLN  83          HG3       GLN  83 -15.383  -4.971  -1.717
  155   1HE2  GLN  83          HE21      GLN  83 -12.208  -5.347  -1.879
  156   2HE2  GLN  83          HE22      GLN  83 -11.945  -5.213  -3.582
  157    HA   PRO  84           HA       PRO  84 -19.185  -4.227   1.155
  158   1HB   PRO  84          HB2       PRO  84 -20.920  -3.832  -0.915
  159   2HB   PRO  84          HB3       PRO  84 -20.647  -2.649   0.368
  160   1HG   PRO  84          HG2       PRO  84 -19.499  -2.750  -2.393
  161   2HG   PRO  84          HG3       PRO  84 -20.116  -1.355  -1.487
  162   1HD   PRO  84          HD2       PRO  84 -17.477  -1.862  -1.719
  163   2HD   PRO  84          HD3       PRO  84 -18.174  -1.137  -0.255
  164    H    HIS  85           H        HIS  85 -20.720  -5.939   0.167
  165    HA   HIS  85           HA       HIS  85 -19.060  -7.777  -1.400
  166   1HB   HIS  85          HB2       HIS  85 -20.704  -9.507  -0.608
  167   2HB   HIS  85          HB3       HIS  85 -19.788  -8.723   0.677
  168    HD1  HIS  85           HD1      HIS  85 -21.092  -7.156   2.275
  169    HD2  HIS  85           HD2      HIS  85 -23.453  -9.012  -0.596
  170    HE1  HIS  85           HE1      HIS  85 -23.467  -6.796   3.022
  171    HE2  HIS  85           HE2      HIS  85 -24.873  -8.002   1.315
  172    H    GLY  86           H        GLY  86 -22.112  -6.077  -1.427
  173   1HA   GLY  86          HA2       GLY  86 -22.384  -6.530  -4.258
  174   2HA   GLY  86          HA3       GLY  86 -23.606  -7.360  -3.306
  175    H    GLY  87           H        GLY  87 -22.263  -4.292  -2.314
  176   1HA   GLY  87          HA2       GLY  87 -23.957  -2.491  -3.541
  177   2HA   GLY  87          HA3       GLY  87 -24.853  -3.107  -2.161
  178    H    GLY  88           H        GLY  88 -24.201  -2.572  -0.073
  179   1HA   GLY  88          HA2       GLY  88 -21.943  -0.697   0.158
  180   2HA   GLY  88          HA3       GLY  88 -23.527  -0.213   0.746
  181    H    TRP  89           H        TRP  89 -22.580   0.046   2.831
  182    HA   TRP  89           HA       TRP  89 -22.586  -2.433   4.352
  183   1HB   TRP  89          HB2       TRP  89 -20.471  -1.279   5.572
  184   2HB   TRP  89          HB3       TRP  89 -20.313  -2.484   4.298
  185    HD1  TRP  89           HD1      TRP  89 -20.201  -1.248   1.693
  186    HE1  TRP  89           HE1      TRP  89 -18.738   0.752   1.019
  187    HE3  TRP  89           HE3      TRP  89 -19.312   0.699   6.335
  188    HZ2  TRP  89           HZ2      TRP  89 -17.375   2.876   2.289
  189    HZ3  TRP  89           HZ3      TRP  89 -17.915   2.715   6.518
  190    HH2  TRP  89           HH2      TRP  89 -16.967   3.781   4.537
  191    H    GLY  90           H        GLY  90 -21.424   0.805   5.168
  192   1HA   GLY  90          HA2       GLY  90 -23.808   1.178   6.858
  193   2HA   GLY  90          HA3       GLY  90 -22.203   1.396   7.538
  194    H    GLN  91           H        GLN  91 -22.546   2.353   4.270
  195    HA   GLN  91           HA       GLN  91 -21.816   5.010   4.761
  196   1HB   GLN  91          HB2       GLN  91 -22.637   5.367   2.363
  197   2HB   GLN  91          HB3       GLN  91 -21.353   4.192   2.609
  198   1HG   GLN  91          HG2       GLN  91 -22.800   2.378   2.286
  199   2HG   GLN  91          HG3       GLN  91 -24.236   3.380   2.483
  200   1HE2  GLN  91          HE21      GLN  91 -24.397   1.915   0.382
  201   2HE2  GLN  91          HE22      GLN  91 -24.030   2.762  -1.079
  Start of MODEL    8
    1    H    TRP  57           H        TRP  57  16.305  -0.210 -16.638
    2    HA   TRP  57           HA       TRP  57  14.314   0.908 -15.855
    3   1HB   TRP  57          HB2       TRP  57  13.096  -1.333 -15.640
    4   2HB   TRP  57          HB3       TRP  57  13.954  -1.531 -14.115
    5    HD1  TRP  57           HD1      TRP  57  11.944   1.441 -15.631
    6    HE1  TRP  57           HE1      TRP  57  10.315   2.284 -13.825
    7    HE3  TRP  57           HE3      TRP  57  13.089  -1.860 -11.897
    8    HZ2  TRP  57           HZ2      TRP  57   9.610   1.636 -11.170
    9    HZ3  TRP  57           HZ3      TRP  57  11.891  -1.679  -9.756
   10    HH2  TRP  57           HH2      TRP  57  10.188   0.033  -9.401
   11    H    GLY  58           H        GLY  58  14.194   1.743 -13.551
   12   1HA   GLY  58          HA2       GLY  58  16.752   2.407 -12.642
   13   2HA   GLY  58          HA3       GLY  58  15.269   2.629 -11.727
   14    H    GLN  59           H        GLN  59  14.694  -0.276 -11.821
   15    HA   GLN  59           HA       GLN  59  14.916  -2.056 -10.441
   16   1HB   GLN  59          HB2       GLN  59  17.014  -3.141 -10.413
   17   2HB   GLN  59          HB3       GLN  59  16.940  -2.286 -11.943
   18   1HG   GLN  59          HG2       GLN  59  18.562  -0.783 -11.341
   19   2HG   GLN  59          HG3       GLN  59  18.251  -0.969  -9.616
   20   1HE2  GLN  59          HE21      GLN  59  18.752  -3.194  -8.754
   21   2HE2  GLN  59          HE22      GLN  59  20.210  -3.931  -9.313
   22    HA   PRO  60           HA       PRO  60  15.169  -0.751  -6.256
   23   1HB   PRO  60          HB2       PRO  60  15.924  -3.061  -4.992
   24   2HB   PRO  60          HB3       PRO  60  14.283  -2.740  -5.561
   25   1HG   PRO  60          HG2       PRO  60  16.456  -4.341  -6.849
   26   2HG   PRO  60          HG3       PRO  60  14.722  -4.698  -6.727
   27   1HD   PRO  60          HD2       PRO  60  15.823  -3.727  -8.984
   28   2HD   PRO  60          HD3       PRO  60  14.181  -3.284  -8.474
   29    H    HIS  61           H        HIS  61  16.609  -0.228  -4.561
   30    HA   HIS  61           HA       HIS  61  19.434  -0.363  -5.349
   31   1HB   HIS  61          HB2       HIS  61  18.491   1.891  -5.035
   32   2HB   HIS  61          HB3       HIS  61  18.066   1.480  -3.376
   33    HD1  HIS  61           HD1      HIS  61  19.634   3.626  -2.866
   34    HD2  HIS  61           HD2      HIS  61  21.549   0.209  -4.253
   35    HE1  HIS  61           HE1      HIS  61  22.065   3.941  -2.300
   36    HE2  HIS  61           HE2      HIS  61  23.215   1.900  -3.228
   37    H    GLY  62           H        GLY  62  17.184  -1.201  -2.816
   38   1HA   GLY  62          HA2       GLY  62  18.775  -3.218  -1.735
   39   2HA   GLY  62          HA3       GLY  62  19.068  -1.771  -0.783
   40    H    GLY  63           H        GLY  63  16.019  -2.733  -2.291
   41   1HA   GLY  63          HA2       GLY  63  14.783  -4.005  -0.176
   42   2HA   GLY  63          HA3       GLY  63  14.579  -2.287   0.131
   43    H    GLY  64           H        GLY  64  14.600  -3.929  -3.007
   44   1HA   GLY  64          HA2       GLY  64  13.023  -4.005  -4.677
   45   2HA   GLY  64          HA3       GLY  64  11.853  -4.189  -3.380
   46    H    TRP  65           H        TRP  65  10.342  -2.977  -4.584
   47    HA   TRP  65           HA       TRP  65  10.648  -0.105  -4.220
   48   1HB   TRP  65          HB2       TRP  65   9.522  -0.037  -6.675
   49   2HB   TRP  65          HB3       TRP  65  11.255   0.113  -6.401
   50    HD1  TRP  65           HD1      TRP  65  12.550  -2.464  -6.441
   51    HE1  TRP  65           HE1      TRP  65  12.231  -4.300  -8.208
   52    HE3  TRP  65           HE3      TRP  65   8.039  -0.982  -8.334
   53    HZ2  TRP  65           HZ2      TRP  65  10.320  -5.024 -10.160
   54    HZ3  TRP  65           HZ3      TRP  65   7.034  -2.301 -10.153
   55    HH2  TRP  65           HH2      TRP  65   8.153  -4.279 -11.046
   56    H    GLY  66           H        GLY  66   8.370  -1.988  -6.161
   57   1HA   GLY  66          HA2       GLY  66   6.218  -1.044  -4.380
   58   2HA   GLY  66          HA3       GLY  66   6.013  -1.425  -6.083
   59    H    GLN  67           H        GLN  67   7.819  -3.859  -5.540
   60    HA   GLN  67           HA       GLN  67   5.765  -5.754  -5.301
   61   1HB   GLN  67          HB2       GLN  67   7.530  -7.416  -5.189
   62   2HB   GLN  67          HB3       GLN  67   7.938  -6.198  -6.389
   63   1HG   GLN  67          HG2       GLN  67   9.333  -5.090  -4.594
   64   2HG   GLN  67          HG3       GLN  67   9.095  -6.556  -3.643
   65   1HE2  GLN  67          HE21      GLN  67  11.006  -7.532  -3.661
   66   2HE2  GLN  67          HE22      GLN  67  11.917  -7.930  -5.074
   67    HA   PRO  68           HA       PRO  68   5.016  -6.197  -0.987
   68   1HB   PRO  68          HB2       PRO  68   4.828  -8.933  -0.764
   69   2HB   PRO  68          HB3       PRO  68   3.534  -7.890  -1.358
   70   1HG   PRO  68          HG2       PRO  68   5.503  -9.529  -2.893
   71   2HG   PRO  68          HG3       PRO  68   3.776  -9.268  -3.203
   72   1HD   PRO  68          HD2       PRO  68   5.682  -7.981  -4.600
   73   2HD   PRO  68          HD3       PRO  68   4.136  -7.209  -4.193
   74    H    HIS  69           H        HIS  69   6.215  -6.286   0.822
   75    HA   HIS  69           HA       HIS  69   8.793  -7.704   0.682
   76   1HB   HIS  69          HB2       HIS  69   8.570  -5.074   0.949
   77   2HB   HIS  69          HB3       HIS  69   8.345  -5.501   2.642
   78    HD1  HIS  69           HD1      HIS  69  10.413  -5.905   3.971
   79    HD2  HIS  69           HD2      HIS  69  11.120  -6.038  -0.122
   80    HE1  HIS  69           HE1      HIS  69  12.908  -6.101   3.726
   81    HE2  HIS  69           HE2      HIS  69  13.318  -6.092   1.240
   82    H    GLY  70           H        GLY  70   5.851  -8.179   1.887
   83   1HA   GLY  70          HA2       GLY  70   6.710 -10.018   3.863
   84   2HA   GLY  70          HA3       GLY  70   6.098  -8.561   4.631
   85    H    GLY  71           H        GLY  71   4.879  -9.890   1.610
   86   1HA   GLY  71          HA2       GLY  71   2.979 -11.360   1.440
   87   2HA   GLY  71          HA3       GLY  71   2.465 -10.808   3.027
   88    H    GLY  72           H        GLY  72   2.627 -10.021  -0.380
   89   1HA   GLY  72          HA2       GLY  72   1.413  -8.559  -1.668
   90   2HA   GLY  72          HA3       GLY  72   0.184  -8.668  -0.415
   91    H    TRP  73           H        TRP  73  -0.068  -6.382  -1.253
   92    HA   TRP  73           HA       TRP  73   1.365  -4.603   0.560
   93   1HB   TRP  73          HB2       TRP  73   1.314  -2.979  -1.594
   94   2HB   TRP  73          HB3       TRP  73   2.703  -3.973  -1.170
   95    HD1  TRP  73           HD1      TRP  73   2.512  -6.587  -2.412
   96    HE1  TRP  73           HE1      TRP  73   2.000  -7.047  -4.886
   97    HE3  TRP  73           HE3      TRP  73   0.281  -2.148  -3.609
   98    HZ2  TRP  73           HZ2      TRP  73   0.811  -5.700  -7.068
   99    HZ3  TRP  73           HZ3      TRP  73  -0.515  -1.813  -5.914
  100    HH2  TRP  73           HH2      TRP  73  -0.254  -3.554  -7.606
  101    H    GLY  74           H        GLY  74  -0.719  -3.947  -2.222
  102   1HA   GLY  74          HA2       GLY  74  -2.599  -2.618  -0.390
  103   2HA   GLY  74          HA3       GLY  74  -2.444  -2.283  -2.107
  104    H    GLN  75           H        GLN  75  -2.320  -5.282  -2.581
  105    HA   GLN  75           HA       GLN  75  -5.031  -5.650  -3.224
  106   1HB   GLN  75          HB2       GLN  75  -4.417  -7.905  -3.849
  107   2HB   GLN  75          HB3       GLN  75  -3.153  -6.796  -4.364
  108   1HG   GLN  75          HG2       GLN  75  -1.977  -7.419  -2.180
  109   2HG   GLN  75          HG3       GLN  75  -3.114  -8.764  -2.109
  110   1HE2  GLN  75          HE21      GLN  75  -1.136  -7.208  -4.617
  111   2HE2  GLN  75          HE22      GLN  75  -0.450  -8.673  -5.224
  112    HA   PRO  76           HA       PRO  76  -6.928  -7.082   0.481
  113   1HB   PRO  76          HB2       PRO  76  -8.566  -9.055  -0.513
  114   2HB   PRO  76          HB3       PRO  76  -8.929  -7.329  -0.585
  115   1HG   PRO  76          HG2       PRO  76  -7.795  -9.119  -2.691
  116   2HG   PRO  76          HG3       PRO  76  -8.994  -7.821  -2.847
  117   1HD   PRO  76          HD2       PRO  76  -6.420  -7.474  -3.554
  118   2HD   PRO  76          HD3       PRO  76  -7.383  -6.161  -2.844
  119    H    HIS  77           H        HIS  77  -6.968  -8.805   1.973
  120    HA   HIS  77           HA       HIS  77  -5.094 -10.982   1.329
  121   1HB   HIS  77          HB2       HIS  77  -4.849 -11.134   3.855
  122   2HB   HIS  77          HB3       HIS  77  -4.189  -9.687   3.101
  123    HD1  HIS  77           HD1      HIS  77  -6.630 -10.822   5.605
  124    HD2  HIS  77           HD2      HIS  77  -5.773  -7.321   3.535
  125    HE1  HIS  77           HE1      HIS  77  -7.850  -8.998   6.834
  126    HE2  HIS  77           HE2      HIS  77  -7.385  -6.902   5.515
  127    H    GLY  78           H        GLY  78  -8.265 -10.202   2.555
  128   1HA   GLY  78          HA2       GLY  78  -8.812 -13.083   2.902
  129   2HA   GLY  78          HA3       GLY  78  -9.672 -11.803   3.743
  130    H    GLY  79           H        GLY  79 -10.521 -10.095   1.947
  131   1HA   GLY  79          HA2       GLY  79 -11.460 -11.251  -0.487
  132   2HA   GLY  79          HA3       GLY  79 -12.716 -11.257   0.742
  133    H    GLY  80           H        GLY  80 -10.261  -8.761   0.485
  134   1HA   GLY  80          HA2       GLY  80 -10.970  -6.826  -1.080
  135   2HA   GLY  80          HA3       GLY  80 -12.413  -6.833  -0.074
  136    H    TRP  81           H        TRP  81 -11.632  -4.545   0.178
  137    HA   TRP  81           HA       TRP  81 -10.095  -4.370   2.648
  138   1HB   TRP  81          HB2       TRP  81  -9.049  -2.211   1.415
  139   2HB   TRP  81          HB3       TRP  81  -8.258  -3.783   1.440
  140    HD1  TRP  81           HD1      TRP  81  -9.080  -5.391  -0.822
  141    HE1  TRP  81           HE1      TRP  81  -9.142  -4.631  -3.274
  142    HE3  TRP  81           HE3      TRP  81  -9.233  -0.335  -0.092
  143    HZ2  TRP  81           HZ2      TRP  81  -9.235  -2.202  -4.716
  144    HZ3  TRP  81           HZ3      TRP  81  -9.305   1.138  -2.062
  145    HH2  TRP  81           HH2      TRP  81  -9.305   0.222  -4.325
  146    H    GLY  82           H        GLY  82 -11.087  -1.895   0.324
  147   1HA   GLY  82          HA2       GLY  82 -12.708  -0.669   2.449
  148   2HA   GLY  82          HA3       GLY  82 -12.060   0.171   1.049
  149    H    GLN  83           H        GLN  83 -12.977  -2.252  -0.599
  150    HA   GLN  83           HA       GLN  83 -15.346  -1.148  -1.580
  151   1HB   GLN  83          HB2       GLN  83 -15.579  -3.177  -2.886
  152   2HB   GLN  83          HB3       GLN  83 -13.891  -2.687  -2.855
  153   1HG   GLN  83          HG2       GLN  83 -13.651  -4.340  -0.912
  154   2HG   GLN  83          HG3       GLN  83 -15.207  -4.974  -1.444
  155   1HE2  GLN  83          HE21      GLN  83 -11.906  -5.175  -1.802
  156   2HE2  GLN  83          HE22      GLN  83 -11.847  -6.069  -3.280
  157    HA   PRO  84           HA       PRO  84 -18.560  -2.484   1.114
  158   1HB   PRO  84          HB2       PRO  84 -20.538  -3.116  -0.674
  159   2HB   PRO  84          HB3       PRO  84 -20.119  -1.464  -0.212
  160   1HG   PRO  84          HG2       PRO  84 -19.314  -3.018  -2.636
  161   2HG   PRO  84          HG3       PRO  84 -19.800  -1.318  -2.504
  162   1HD   PRO  84          HD2       PRO  84 -17.218  -2.051  -2.725
  163   2HD   PRO  84          HD3       PRO  84 -17.718  -0.649  -1.756
  164    H    HIS  85           H        HIS  85 -19.634  -4.316   1.914
  165    HA   HIS  85           HA       HIS  85 -18.714  -6.855   0.746
  166   1HB   HIS  85          HB2       HIS  85 -18.195  -6.010   3.224
  167   2HB   HIS  85          HB3       HIS  85 -19.766  -6.743   3.528
  168    HD1  HIS  85           HD1      HIS  85 -19.587  -9.089   4.253
  169    HD2  HIS  85           HD2      HIS  85 -16.477  -8.030   1.710
  170    HE1  HIS  85           HE1      HIS  85 -18.145 -11.141   4.065
  171    HE2  HIS  85           HE2      HIS  85 -16.223 -10.448   2.591
  172    H    GLY  86           H        GLY  86 -21.494  -5.050   1.831
  173   1HA   GLY  86          HA2       GLY  86 -23.231  -7.340   1.165
  174   2HA   GLY  86          HA3       GLY  86 -23.688  -6.004   2.212
  175    H    GLY  87           H        GLY  87 -23.396  -3.776   0.974
  176   1HA   GLY  87          HA2       GLY  87 -23.979  -3.835  -1.830
  177   2HA   GLY  87          HA3       GLY  87 -25.417  -3.543  -0.864
  178    H    GLY  88           H        GLY  88 -22.239  -2.418   0.085
  179   1HA   GLY  88          HA2       GLY  88 -21.616  -0.110  -0.852
  180   2HA   GLY  88          HA3       GLY  88 -23.212   0.341  -0.268
  181    H    TRP  89           H        TRP  89 -21.895   1.944   0.925
  182    HA   TRP  89           HA       TRP  89 -21.286   0.908   3.577
  183   1HB   TRP  89          HB2       TRP  89 -19.240   2.656   3.399
  184   2HB   TRP  89          HB3       TRP  89 -19.070   0.937   3.063
  185    HD1  TRP  89           HD1      TRP  89 -19.583   0.371   0.269
  186    HE1  TRP  89           HE1      TRP  89 -18.580   1.626  -1.735
  187    HE3  TRP  89           HE3      TRP  89 -18.284   4.727   2.609
  188    HZ2  TRP  89           HZ2      TRP  89 -17.385   4.131  -2.259
  189    HZ3  TRP  89           HZ3      TRP  89 -17.213   6.502   1.284
  190    HH2  TRP  89           HH2      TRP  89 -16.773   6.208  -1.100
  191    H    GLY  90           H        GLY  90 -20.550   4.030   2.096
  192   1HA   GLY  90          HA2       GLY  90 -22.755   5.246   3.612
  193   2HA   GLY  90          HA3       GLY  90 -21.124   5.863   3.829
  194    H    GLN  91           H        GLN  91 -22.049   4.706   0.710
  195    HA   GLN  91           HA       GLN  91 -21.496   7.196  -0.524
  196   1HB   GLN  91          HB2       GLN  91 -23.044   4.988  -1.852
  197   2HB   GLN  91          HB3       GLN  91 -21.899   6.114  -2.569
  198   1HG   GLN  91          HG2       GLN  91 -20.131   4.970  -1.136
  199   2HG   GLN  91          HG3       GLN  91 -21.337   3.713  -0.864
  200   1HE2  GLN  91          HE21      GLN  91 -20.912   2.028  -2.085
  201   2HE2  GLN  91          HE22      GLN  91 -20.413   2.064  -3.738
  Start of MODEL    9
    1    H    TRP  57           H        TRP  57  13.548   7.655 -12.459
    2    HA   TRP  57           HA       TRP  57  14.032   5.451 -12.058
    3   1HB   TRP  57          HB2       TRP  57  13.585   7.143 -10.116
    4   2HB   TRP  57          HB3       TRP  57  12.194   6.119  -9.778
    5    HD1  TRP  57           HD1      TRP  57  12.811   4.664  -7.768
    6    HE1  TRP  57           HE1      TRP  57  14.836   3.233  -7.077
    7    HE3  TRP  57           HE3      TRP  57  15.958   5.788 -11.637
    8    HZ2  TRP  57           HZ2      TRP  57  17.425   2.658  -8.044
    9    HZ3  TRP  57           HZ3      TRP  57  18.191   4.757 -11.679
   10    HH2  TRP  57           HH2      TRP  57  18.909   3.224  -9.919
   11    H    GLY  58           H        GLY  58  13.458   3.299 -11.861
   12   1HA   GLY  58          HA2       GLY  58  10.692   2.516 -11.593
   13   2HA   GLY  58          HA3       GLY  58  11.341   2.278 -13.208
   14    H    GLN  59           H        GLN  59  13.336   1.953 -10.365
   15    HA   GLN  59           HA       GLN  59  12.994  -0.848 -10.030
   16   1HB   GLN  59          HB2       GLN  59  15.084  -1.641 -10.947
   17   2HB   GLN  59          HB3       GLN  59  14.173  -0.830 -12.214
   18   1HG   GLN  59          HG2       GLN  59  15.576   1.234 -11.616
   19   2HG   GLN  59          HG3       GLN  59  16.628   0.096 -10.778
   20   1HE2  GLN  59          HE21      GLN  59  14.990   0.477 -13.902
   21   2HE2  GLN  59          HE22      GLN  59  16.306  -0.102 -14.858
   22    HA   PRO  60           HA       PRO  60  15.004   0.116  -6.230
   23   1HB   PRO  60          HB2       PRO  60  16.124  -2.272  -5.569
   24   2HB   PRO  60          HB3       PRO  60  14.389  -1.956  -5.461
   25   1HG   PRO  60          HG2       PRO  60  15.928  -3.364  -7.607
   26   2HG   PRO  60          HG3       PRO  60  14.374  -3.802  -6.873
   27   1HD   PRO  60          HD2       PRO  60  14.551  -2.581  -9.281
   28   2HD   PRO  60          HD3       PRO  60  13.196  -2.301  -8.168
   29    H    HIS  61           H        HIS  61  16.930   0.873  -5.491
   30    HA   HIS  61           HA       HIS  61  19.215   0.634  -7.294
   31   1HB   HIS  61          HB2       HIS  61  18.186   2.828  -6.168
   32   2HB   HIS  61          HB3       HIS  61  19.317   2.387  -4.893
   33    HD1  HIS  61           HD1      HIS  61  21.022   4.209  -5.250
   34    HD2  HIS  61           HD2      HIS  61  20.173   2.094  -8.724
   35    HE1  HIS  61           HE1      HIS  61  22.721   4.978  -6.936
   36    HE2  HIS  61           HE2      HIS  61  22.241   3.622  -9.004
   37    H    GLY  62           H        GLY  62  18.151  -1.179  -4.865
   38   1HA   GLY  62          HA2       GLY  62  20.320  -2.684  -4.372
   39   2HA   GLY  62          HA3       GLY  62  20.571  -1.334  -3.276
   40    H    GLY  63           H        GLY  63  17.555  -2.964  -4.201
   41   1HA   GLY  63          HA2       GLY  63  17.179  -4.681  -2.116
   42   2HA   GLY  63          HA3       GLY  63  16.742  -3.117  -1.447
   43    H    GLY  64           H        GLY  64  14.867  -2.086  -2.138
   44   1HA   GLY  64          HA2       GLY  64  13.254  -3.292  -4.228
   45   2HA   GLY  64          HA3       GLY  64  12.611  -3.469  -2.602
   46    H    TRP  65           H        TRP  65  10.790  -2.258  -3.486
   47    HA   TRP  65           HA       TRP  65  11.168   0.598  -3.058
   48   1HB   TRP  65          HB2       TRP  65   9.490   0.771  -5.165
   49   2HB   TRP  65          HB3       TRP  65  11.238   0.912  -5.311
   50    HD1  TRP  65           HD1      TRP  65  12.452  -1.679  -5.758
   51    HE1  TRP  65           HE1      TRP  65  11.699  -3.422  -7.487
   52    HE3  TRP  65           HE3      TRP  65   7.656  -0.068  -6.489
   53    HZ2  TRP  65           HZ2      TRP  65   9.377  -4.034  -8.976
   54    HZ3  TRP  65           HZ3      TRP  65   6.235  -1.288  -8.086
   55    HH2  TRP  65           HH2      TRP  65   7.079  -3.228  -9.303
   56    H    GLY  66           H        GLY  66   8.475  -1.190  -4.491
   57   1HA   GLY  66          HA2       GLY  66   6.885  -0.525  -2.091
   58   2HA   GLY  66          HA3       GLY  66   6.230  -0.483  -3.720
   59    H    GLN  67           H        GLN  67   8.402  -3.050  -3.149
   60    HA   GLN  67           HA       GLN  67   6.311  -4.985  -3.474
   61   1HB   GLN  67          HB2       GLN  67   8.088  -6.630  -3.489
   62   2HB   GLN  67          HB3       GLN  67   8.556  -5.258  -4.484
   63   1HG   GLN  67          HG2       GLN  67   9.977  -4.417  -2.716
   64   2HG   GLN  67          HG3       GLN  67   9.458  -5.725  -1.652
   65   1HE2  GLN  67          HE21      GLN  67  11.529  -4.785  -4.216
   66   2HE2  GLN  67          HE22      GLN  67  12.378  -6.282  -4.379
   67    HA   PRO  68           HA       PRO  68   5.371  -5.981   0.709
   68   1HB   PRO  68          HB2       PRO  68   5.198  -8.716   0.592
   69   2HB   PRO  68          HB3       PRO  68   3.933  -7.620   0.030
   70   1HG   PRO  68          HG2       PRO  68   6.039  -9.050  -1.540
   71   2HG   PRO  68          HG3       PRO  68   4.328  -8.792  -1.932
   72   1HD   PRO  68          HD2       PRO  68   6.281  -7.315  -3.048
   73   2HD   PRO  68          HD3       PRO  68   4.691  -6.627  -2.658
   74    H    HIS  69           H        HIS  69   6.200  -6.929   2.636
   75    HA   HIS  69           HA       HIS  69   9.036  -7.688   2.424
   76   1HB   HIS  69          HB2       HIS  69   8.588  -5.586   3.650
   77   2HB   HIS  69          HB3       HIS  69   7.574  -6.476   4.780
   78    HD1  HIS  69           HD1      HIS  69   9.335  -5.499   6.572
   79    HD2  HIS  69           HD2      HIS  69  10.774  -8.386   3.952
   80    HE1  HIS  69           HE1      HIS  69  11.465  -6.343   7.607
   81    HE2  HIS  69           HE2      HIS  69  12.362  -8.027   5.963
   82    H    GLY  70           H        GLY  70   5.924  -8.573   3.736
   83   1HA   GLY  70          HA2       GLY  70   7.058 -11.183   4.478
   84   2HA   GLY  70          HA3       GLY  70   6.073 -10.313   5.645
   85    H    GLY  71           H        GLY  71   5.343 -10.158   2.244
   86   1HA   GLY  71          HA2       GLY  71   3.867 -11.734   1.113
   87   2HA   GLY  71          HA3       GLY  71   3.107 -12.038   2.668
   88    H    GLY  72           H        GLY  72   3.276  -9.942  -0.087
   89   1HA   GLY  72          HA2       GLY  72   1.886  -8.276  -0.837
   90   2HA   GLY  72          HA3       GLY  72   0.651  -9.025   0.167
   91    H    TRP  73           H        TRP  73   0.129  -6.593   0.153
   92    HA   TRP  73           HA       TRP  73   1.102  -5.513   2.676
   93   1HB   TRP  73          HB2       TRP  73   1.075  -3.200   1.291
   94   2HB   TRP  73          HB3       TRP  73   2.530  -4.162   1.527
   95    HD1  TRP  73           HD1      TRP  73   2.844  -6.099  -0.606
   96    HE1  TRP  73           HE1      TRP  73   2.673  -5.614  -3.123
   97    HE3  TRP  73           HE3      TRP  73   0.161  -1.753  -0.409
   98    HZ2  TRP  73           HZ2      TRP  73   1.554  -3.642  -4.808
   99    HZ3  TRP  73           HZ3      TRP  73  -0.418  -0.629  -2.520
  100    HH2  TRP  73           HH2      TRP  73   0.267  -1.554  -4.673
  101    H    GLY  74           H        GLY  74  -0.713  -3.972   0.062
  102   1HA   GLY  74          HA2       GLY  74  -3.066  -3.933   1.849
  103   2HA   GLY  74          HA3       GLY  74  -2.624  -2.581   0.817
  104    H    GLN  75           H        GLN  75  -2.145  -5.682  -0.549
  105    HA   GLN  75           HA       GLN  75  -4.133  -5.176  -2.557
  106   1HB   GLN  75          HB2       GLN  75  -3.313  -7.201  -3.607
  107   2HB   GLN  75          HB3       GLN  75  -1.951  -6.226  -3.075
  108   1HG   GLN  75          HG2       GLN  75  -1.651  -7.650  -1.138
  109   2HG   GLN  75          HG3       GLN  75  -3.061  -8.603  -1.600
  110   1HE2  GLN  75          HE21      GLN  75   0.102  -7.549  -2.784
  111   2HE2  GLN  75          HE22      GLN  75   0.446  -8.988  -3.675
  112    HA   PRO  76           HA       PRO  76  -7.570  -7.394  -0.928
  113   1HB   PRO  76          HB2       PRO  76  -8.525  -8.656  -3.161
  114   2HB   PRO  76          HB3       PRO  76  -8.773  -6.942  -2.818
  115   1HG   PRO  76          HG2       PRO  76  -6.760  -8.246  -4.605
  116   2HG   PRO  76          HG3       PRO  76  -7.719  -6.779  -4.881
  117   1HD   PRO  76          HD2       PRO  76  -5.134  -6.674  -4.136
  118   2HD   PRO  76          HD3       PRO  76  -6.318  -5.470  -3.590
  119    H    HIS  77           H        HIS  77  -8.294  -9.457  -0.301
  120    HA   HIS  77           HA       HIS  77  -6.289 -11.572  -0.651
  121   1HB   HIS  77          HB2       HIS  77  -6.763 -10.885   1.666
  122   2HB   HIS  77          HB3       HIS  77  -8.461 -11.293   1.439
  123    HD1  HIS  77           HD1      HIS  77  -8.137 -12.979   3.455
  124    HD2  HIS  77           HD2      HIS  77  -5.999 -13.887   0.009
  125    HE1  HIS  77           HE1      HIS  77  -7.410 -15.371   3.726
  126    HE2  HIS  77           HE2      HIS  77  -6.048 -15.872   1.666
  127    H    GLY  78           H        GLY  78  -9.659 -10.795  -1.124
  128   1HA   GLY  78          HA2       GLY  78  -9.945 -13.208  -2.746
  129   2HA   GLY  78          HA3       GLY  78 -11.058 -13.023  -1.398
  130    H    GLY  79           H        GLY  79  -9.906 -10.257  -3.184
  131   1HA   GLY  79          HA2       GLY  79 -11.647  -9.992  -5.258
  132   2HA   GLY  79          HA3       GLY  79 -12.611  -9.534  -3.861
  133    H    GLY  80           H        GLY  80 -12.519  -7.482  -3.191
  134   1HA   GLY  80          HA2       GLY  80 -10.279  -5.825  -4.184
  135   2HA   GLY  80          HA3       GLY  80 -11.940  -5.252  -4.159
  136    H    TRP  81           H        TRP  81 -11.148  -3.462  -2.909
  137    HA   TRP  81           HA       TRP  81 -11.188  -4.053  -0.060
  138   1HB   TRP  81          HB2       TRP  81  -9.224  -2.200  -0.006
  139   2HB   TRP  81          HB3       TRP  81  -8.918  -3.933   0.005
  140    HD1  TRP  81           HD1      TRP  81  -8.638  -4.968  -2.673
  141    HE1  TRP  81           HE1      TRP  81  -7.200  -3.964  -4.550
  142    HE3  TRP  81           HE3      TRP  81  -8.208  -0.196  -0.893
  143    HZ2  TRP  81           HZ2      TRP  81  -6.027  -1.474  -5.190
  144    HZ3  TRP  81           HZ3      TRP  81  -6.909   1.436  -2.197
  145    HH2  TRP  81           HH2      TRP  81  -5.840   0.808  -4.301
  146    H    GLY  82           H        GLY  82 -10.213  -1.144  -1.819
  147   1HA   GLY  82          HA2       GLY  82 -12.550   0.226  -0.647
  148   2HA   GLY  82          HA3       GLY  82 -11.017   1.007  -1.009
  149    H    GLN  83           H        GLN  83 -11.054  -0.681  -3.600
  150    HA   GLN  83           HA       GLN  83 -11.922   1.333  -5.323
  151   1HB   GLN  83          HB2       GLN  83 -11.656  -0.288  -7.112
  152   2HB   GLN  83          HB3       GLN  83 -10.341  -0.455  -5.957
  153   1HG   GLN  83          HG2       GLN  83 -11.628  -2.342  -4.918
  154   2HG   GLN  83          HG3       GLN  83 -12.733  -2.241  -6.288
  155   1HE2  GLN  83          HE21      GLN  83  -9.223  -2.290  -5.740
  156   2HE2  GLN  83          HE22      GLN  83  -8.875  -3.448  -6.975
  157    HA   PRO  84           HA       PRO  84 -16.300   0.965  -5.625
  158   1HB   PRO  84          HB2       PRO  84 -16.684   1.288  -8.323
  159   2HB   PRO  84          HB3       PRO  84 -16.363   2.614  -7.203
  160   1HG   PRO  84          HG2       PRO  84 -14.482   1.180  -9.029
  161   2HG   PRO  84          HG3       PRO  84 -14.590   2.912  -8.665
  162   1HD   PRO  84          HD2       PRO  84 -12.711   1.340  -7.551
  163   2HD   PRO  84          HD3       PRO  84 -13.446   2.692  -6.667
  164    H    HIS  85           H        HIS  85 -18.034  -0.342  -6.474
  165    HA   HIS  85           HA       HIS  85 -17.106  -2.903  -7.596
  166   1HB   HIS  85          HB2       HIS  85 -19.526  -2.569  -5.827
  167   2HB   HIS  85          HB3       HIS  85 -18.730  -4.065  -6.302
  168    HD1  HIS  85           HD1      HIS  85 -17.492  -5.035  -4.408
  169    HD2  HIS  85           HD2      HIS  85 -17.413  -0.881  -4.323
  170    HE1  HIS  85           HE1      HIS  85 -16.135  -4.429  -2.378
  171    HE2  HIS  85           HE2      HIS  85 -16.028  -1.913  -2.397
  172    H    GLY  86           H        GLY  86 -17.639  -2.872  -9.683
  173   1HA   GLY  86          HA2       GLY  86 -19.243  -3.249 -11.379
  174   2HA   GLY  86          HA3       GLY  86 -20.458  -2.485 -10.367
  175    H    GLY  87           H        GLY  87 -18.589  -0.204  -9.819
  176   1HA   GLY  87          HA2       GLY  87 -17.572   1.231 -11.801
  177   2HA   GLY  87          HA3       GLY  87 -19.277   1.307 -12.218
  178    H    GLY  88           H        GLY  88 -16.807   2.356 -10.003
  179   1HA   GLY  88          HA2       GLY  88 -16.746   4.082  -8.488
  180   2HA   GLY  88          HA3       GLY  88 -18.082   4.773  -9.398
  181    H    TRP  89           H        TRP  89 -18.909   5.565  -7.399
  182    HA   TRP  89           HA       TRP  89 -20.551   3.579  -6.025
  183   1HB   TRP  89          HB2       TRP  89 -19.896   5.140  -3.903
  184   2HB   TRP  89          HB3       TRP  89 -19.099   3.617  -4.283
  185    HD1  TRP  89           HD1      TRP  89 -16.875   4.063  -6.098
  186    HE1  TRP  89           HE1      TRP  89 -15.014   5.803  -5.794
  187    HE3  TRP  89           HE3      TRP  89 -19.269   7.242  -2.893
  188    HZ2  TRP  89           HZ2      TRP  89 -14.606   8.212  -4.372
  189    HZ3  TRP  89           HZ3      TRP  89 -18.072   9.242  -2.106
  190    HH2  TRP  89           HH2      TRP  89 -15.789   9.716  -2.831
  191    H    GLY  90           H        GLY  90 -19.846   6.963  -5.278
  192   1HA   GLY  90          HA2       GLY  90 -22.564   7.673  -6.166
  193   2HA   GLY  90          HA3       GLY  90 -22.014   8.127  -4.561
  194    H    GLN  91           H        GLN  91 -19.601   8.173  -6.986
  195    HA   GLN  91           HA       GLN  91 -19.040  10.895  -6.657
  196   1HB   GLN  91          HB2       GLN  91 -17.679  10.571  -8.799
  197   2HB   GLN  91          HB3       GLN  91 -17.269   9.554  -7.424
  198   1HG   GLN  91          HG2       GLN  91 -18.267   7.663  -8.382
  199   2HG   GLN  91          HG3       GLN  91 -19.133   8.624  -9.579
  200   1HE2  GLN  91          HE21      GLN  91 -15.890   7.684  -8.548
  201   2HE2  GLN  91          HE22      GLN  91 -15.182   7.725 -10.124
  Start of MODEL   10
    1    H    TRP  57           H        TRP  57  18.137   5.853 -12.329
    2    HA   TRP  57           HA       TRP  57  18.693   4.287  -9.899
    3   1HB   TRP  57          HB2       TRP  57  16.551   5.881 -10.322
    4   2HB   TRP  57          HB3       TRP  57  16.002   4.420 -11.136
    5    HD1  TRP  57           HD1      TRP  57  17.719   5.110  -7.708
    6    HE1  TRP  57           HE1      TRP  57  16.475   3.737  -5.921
    7    HE3  TRP  57           HE3      TRP  57  14.214   2.881 -10.689
    8    HZ2  TRP  57           HZ2      TRP  57  14.297   1.946  -5.792
    9    HZ3  TRP  57           HZ3      TRP  57  12.587   1.352  -9.656
   10    HH2  TRP  57           HH2      TRP  57  12.630   0.894  -7.258
   11    H    GLY  58           H        GLY  58  16.980   2.252 -10.429
   12   1HA   GLY  58          HA2       GLY  58  16.602   1.046 -12.760
   13   2HA   GLY  58          HA3       GLY  58  18.349   0.912 -12.630
   14    H    GLN  59           H        GLN  59  18.291   0.603  -9.721
   15    HA   GLN  59           HA       GLN  59  16.995  -2.022  -9.470
   16   1HB   GLN  59          HB2       GLN  59  18.957  -2.974  -8.448
   17   2HB   GLN  59          HB3       GLN  59  19.413  -2.295 -10.005
   18   1HG   GLN  59          HG2       GLN  59  20.203  -0.258  -8.781
   19   2HG   GLN  59          HG3       GLN  59  19.933  -1.139  -7.278
   20   1HE2  GLN  59          HE21      GLN  59  21.985  -1.349  -6.588
   21   2HE2  GLN  59          HE22      GLN  59  23.223  -2.203  -7.441
   22    HA   PRO  60           HA       PRO  60  15.607  -0.555  -5.549
   23   1HB   PRO  60          HB2       PRO  60  15.471  -2.853  -4.121
   24   2HB   PRO  60          HB3       PRO  60  14.325  -2.454  -5.402
   25   1HG   PRO  60          HG2       PRO  60  16.714  -4.248  -5.490
   26   2HG   PRO  60          HG3       PRO  60  15.102  -4.494  -6.188
   27   1HD   PRO  60          HD2       PRO  60  17.232  -3.672  -7.658
   28   2HD   PRO  60          HD3       PRO  60  15.565  -3.190  -8.030
   29    H    HIS  61           H        HIS  61  16.499   0.301  -3.751
   30    HA   HIS  61           HA       HIS  61  19.172  -0.658  -2.986
   31   1HB   HIS  61          HB2       HIS  61  18.006   2.027  -2.273
   32   2HB   HIS  61          HB3       HIS  61  19.693   1.527  -2.239
   33    HD1  HIS  61           HD1      HIS  61  18.518   4.011  -3.839
   34    HD2  HIS  61           HD2      HIS  61  19.506   0.302  -5.429
   35    HE1  HIS  61           HE1      HIS  61  18.949   4.420  -6.282
   36    HE2  HIS  61           HE2      HIS  61  19.463   2.147  -7.240
   37    H    GLY  62           H        GLY  62  18.966  -2.059  -1.365
   38   1HA   GLY  62          HA2       GLY  62  18.824  -2.302   1.023
   39   2HA   GLY  62          HA3       GLY  62  17.482  -1.166   1.016
   40    H    GLY  63           H        GLY  63  16.197  -2.472  -1.289
   41   1HA   GLY  63          HA2       GLY  63  15.627  -5.067  -1.282
   42   2HA   GLY  63          HA3       GLY  63  14.868  -4.578   0.226
   43    H    GLY  64           H        GLY  64  14.717  -4.457  -3.241
   44   1HA   GLY  64          HA2       GLY  64  13.056  -3.815  -4.697
   45   2HA   GLY  64          HA3       GLY  64  11.961  -4.268  -3.399
   46    H    TRP  65           H        TRP  65  10.624  -2.552  -4.290
   47    HA   TRP  65           HA       TRP  65  11.297   0.027  -3.069
   48   1HB   TRP  65          HB2       TRP  65   9.938   0.865  -5.274
   49   2HB   TRP  65          HB3       TRP  65  11.694   0.833  -5.150
   50    HD1  TRP  65           HD1      TRP  65  12.661  -1.831  -5.917
   51    HE1  TRP  65           HE1      TRP  65  12.087  -3.031  -8.112
   52    HE3  TRP  65           HE3      TRP  65   8.382   0.693  -7.108
   53    HZ2  TRP  65           HZ2      TRP  65  10.081  -2.917 -10.101
   54    HZ3  TRP  65           HZ3      TRP  65   7.195   0.088  -9.177
   55    HH2  TRP  65           HH2      TRP  65   8.028  -1.679 -10.642
   56    H    GLY  66           H        GLY  66   8.615  -0.969  -5.147
   57   1HA   GLY  66          HA2       GLY  66   6.782  -0.331  -2.931
   58   2HA   GLY  66          HA3       GLY  66   6.369  -0.250  -4.637
   59    H    GLN  67           H        GLN  67   7.854  -2.890  -4.986
   60    HA   GLN  67           HA       GLN  67   5.615  -4.575  -4.901
   61   1HB   GLN  67          HB2       GLN  67   7.135  -6.365  -5.497
   62   2HB   GLN  67          HB3       GLN  67   7.562  -4.912  -6.391
   63   1HG   GLN  67          HG2       GLN  67   9.294  -4.492  -4.583
   64   2HG   GLN  67          HG3       GLN  67   8.982  -6.144  -4.054
   65   1HE2  GLN  67          HE21      GLN  67  10.354  -7.567  -4.819
   66   2HE2  GLN  67          HE22      GLN  67  11.174  -7.486  -6.337
   67    HA   PRO  68           HA       PRO  68   5.431  -6.079  -0.766
   68   1HB   PRO  68          HB2       PRO  68   4.786  -8.707  -1.167
   69   2HB   PRO  68          HB3       PRO  68   3.632  -7.379  -1.325
   70   1HG   PRO  68          HG2       PRO  68   5.144  -8.839  -3.452
   71   2HG   PRO  68          HG3       PRO  68   3.454  -8.305  -3.445
   72   1HD   PRO  68          HD2       PRO  68   5.380  -6.956  -4.764
   73   2HD   PRO  68          HD3       PRO  68   4.007  -6.132  -3.998
   74    H    HIS  69           H        HIS  69   6.564  -7.268   0.791
   75    HA   HIS  69           HA       HIS  69   9.121  -8.351  -0.155
   76   1HB   HIS  69          HB2       HIS  69   9.757  -8.103   2.305
   77   2HB   HIS  69          HB3       HIS  69   9.497  -6.613   1.404
   78    HD1  HIS  69           HD1      HIS  69   7.253  -5.317   1.913
   79    HD2  HIS  69           HD2      HIS  69   8.081  -8.496   4.457
   80    HE1  HIS  69           HE1      HIS  69   5.732  -5.009   3.892
   81    HE2  HIS  69           HE2      HIS  69   6.189  -6.991   5.378
   82    H    GLY  70           H        GLY  70   6.231  -9.160   1.626
   83   1HA   GLY  70          HA2       GLY  70   6.570 -11.933   1.263
   84   2HA   GLY  70          HA3       GLY  70   7.081 -11.510   2.890
   85    H    GLY  71           H        GLY  71   4.483  -9.959   1.079
   86   1HA   GLY  71          HA2       GLY  71   2.373 -11.446   2.276
   87   2HA   GLY  71          HA3       GLY  71   2.650  -9.950   3.155
   88    H    GLY  72           H        GLY  72   2.873  -7.977   1.596
   89   1HA   GLY  72          HA2       GLY  72   1.741  -7.833  -0.904
   90   2HA   GLY  72          HA3       GLY  72   0.377  -7.791   0.205
   91    H    TRP  73           H        TRP  73  -0.037  -5.674  -0.680
   92    HA   TRP  73           HA       TRP  73   1.377  -3.612   0.816
   93   1HB   TRP  73          HB2       TRP  73   1.128  -2.268  -1.513
   94   2HB   TRP  73          HB3       TRP  73   2.596  -3.117  -1.042
   95    HD1  TRP  73           HD1      TRP  73   2.547  -5.861  -1.953
   96    HE1  TRP  73           HE1      TRP  73   1.956  -6.659  -4.321
   97    HE3  TRP  73           HE3      TRP  73  -0.069  -1.772  -3.551
   98    HZ2  TRP  73           HZ2      TRP  73   0.569  -5.681  -6.580
   99    HZ3  TRP  73           HZ3      TRP  73  -0.995  -1.783  -5.831
  100    HH2  TRP  73           HH2      TRP  73  -0.681  -3.697  -7.313
  101    H    GLY  74           H        GLY  74  -0.861  -3.410  -1.916
  102   1HA   GLY  74          HA2       GLY  74  -2.749  -2.002  -0.149
  103   2HA   GLY  74          HA3       GLY  74  -2.672  -1.828  -1.896
  104    H    GLN  75           H        GLN  75  -2.362  -4.867  -2.033
  105    HA   GLN  75           HA       GLN  75  -5.082  -5.448  -2.526
  106   1HB   GLN  75          HB2       GLN  75  -4.339  -7.705  -2.997
  107   2HB   GLN  75          HB3       GLN  75  -3.198  -6.558  -3.685
  108   1HG   GLN  75          HG2       GLN  75  -1.813  -6.898  -1.592
  109   2HG   GLN  75          HG3       GLN  75  -2.871  -8.264  -1.239
  110   1HE2  GLN  75          HE21      GLN  75  -2.208 -10.154  -1.947
  111   2HE2  GLN  75          HE22      GLN  75  -1.120 -10.429  -3.261
  112    HA   PRO  76           HA       PRO  76  -6.640  -6.752   1.381
  113   1HB   PRO  76          HB2       PRO  76  -8.203  -8.880   0.665
  114   2HB   PRO  76          HB3       PRO  76  -8.670  -7.194   0.426
  115   1HG   PRO  76          HG2       PRO  76  -7.514  -9.137  -1.531
  116   2HG   PRO  76          HG3       PRO  76  -8.808  -7.947  -1.763
  117   1HD   PRO  76          HD2       PRO  76  -6.287  -7.518  -2.624
  118   2HD   PRO  76          HD3       PRO  76  -7.323  -6.200  -2.039
  119    H    HIS  77           H        HIS  77  -6.287  -8.224   3.023
  120    HA   HIS  77           HA       HIS  77  -4.353 -10.344   2.404
  121   1HB   HIS  77          HB2       HIS  77  -4.005  -8.415   4.167
  122   2HB   HIS  77          HB3       HIS  77  -4.959  -9.475   5.199
  123    HD1  HIS  77           HD1      HIS  77  -2.146  -8.975   6.072
  124    HD2  HIS  77           HD2      HIS  77  -3.150 -12.049   3.463
  125    HE1  HIS  77           HE1      HIS  77  -0.281 -10.651   6.258
  126    HE2  HIS  77           HE2      HIS  77  -0.953 -12.541   4.734
  127    H    GLY  78           H        GLY  78  -7.553 -10.173   2.604
  128   1HA   GLY  78          HA2       GLY  78  -8.165 -12.793   2.787
  129   2HA   GLY  78          HA3       GLY  78  -8.065 -12.319   4.477
  130    H    GLY  79           H        GLY  79  -9.056  -9.578   3.782
  131   1HA   GLY  79          HA2       GLY  79 -11.902 -10.319   3.497
  132   2HA   GLY  79          HA3       GLY  79 -11.325  -8.990   4.490
  133    H    GLY  80           H        GLY  80 -10.430  -7.114   3.412
  134   1HA   GLY  80          HA2       GLY  80 -10.612  -6.799   0.585
  135   2HA   GLY  80          HA3       GLY  80 -12.020  -6.113   1.382
  136    H    TRP  81           H        TRP  81 -11.341  -4.068   0.537
  137    HA   TRP  81           HA       TRP  81  -9.463  -2.730   2.321
  138   1HB   TRP  81          HB2       TRP  81  -8.750  -1.500   0.022
  139   2HB   TRP  81          HB3       TRP  81  -7.866  -2.859   0.708
  140    HD1  TRP  81           HD1      TRP  81  -8.919  -5.373  -0.271
  141    HE1  TRP  81           HE1      TRP  81  -9.389  -5.960  -2.725
  142    HE3  TRP  81           HE3      TRP  81  -9.260  -0.643  -2.177
  143    HZ2  TRP  81           HZ2      TRP  81  -9.839  -4.597  -5.160
  144    HZ3  TRP  81           HZ3      TRP  81  -9.711  -0.372  -4.580
  145    HH2  TRP  81           HH2      TRP  81  -9.994  -2.310  -6.040
  146    H    GLY  82           H        GLY  82 -10.919  -1.699  -0.732
  147   1HA   GLY  82          HA2       GLY  82 -12.419   0.341   0.789
  148   2HA   GLY  82          HA3       GLY  82 -11.809   0.575  -0.841
  149    H    GLN  83           H        GLN  83 -13.051  -2.539  -0.403
  150    HA   GLN  83           HA       GLN  83 -15.432  -1.813  -1.934
  151   1HB   GLN  83          HB2       GLN  83 -15.580  -4.156  -2.518
  152   2HB   GLN  83          HB3       GLN  83 -13.938  -3.592  -2.798
  153   1HG   GLN  83          HG2       GLN  83 -13.361  -4.546  -0.533
  154   2HG   GLN  83          HG3       GLN  83 -14.946  -5.316  -0.556
  155   1HE2  GLN  83          HE21      GLN  83 -15.305  -7.050  -1.884
  156   2HE2  GLN  83          HE22      GLN  83 -14.047  -7.851  -2.757
  157    HA   PRO  84           HA       PRO  84 -18.245  -2.454   1.397
  158   1HB   PRO  84          HB2       PRO  84 -20.360  -3.607   0.129
  159   2HB   PRO  84          HB3       PRO  84 -19.962  -1.892  -0.018
  160   1HG   PRO  84          HG2       PRO  84 -19.341  -4.148  -1.885
  161   2HG   PRO  84          HG3       PRO  84 -19.916  -2.512  -2.258
  162   1HD   PRO  84          HD2       PRO  84 -17.326  -3.219  -2.522
  163   2HD   PRO  84          HD3       PRO  84 -17.814  -1.584  -2.034
  164    H    HIS  85           H        HIS  85 -18.686  -3.956   2.928
  165    HA   HIS  85           HA       HIS  85 -17.849  -6.701   2.372
  166   1HB   HIS  85          HB2       HIS  85 -18.413  -5.289   4.988
  167   2HB   HIS  85          HB3       HIS  85 -17.874  -6.959   4.844
  168    HD1  HIS  85           HD1      HIS  85 -15.418  -7.308   4.880
  169    HD2  HIS  85           HD2      HIS  85 -16.423  -3.399   3.889
  170    HE1  HIS  85           HE1      HIS  85 -13.236  -6.064   4.752
  171    HE2  HIS  85           HE2      HIS  85 -13.863  -3.722   4.065
  172    H    GLY  86           H        GLY  86 -20.657  -4.821   3.251
  173   1HA   GLY  86          HA2       GLY  86 -22.249  -7.313   3.272
  174   2HA   GLY  86          HA3       GLY  86 -22.649  -5.905   4.244
  175    H    GLY  87           H        GLY  87 -22.507  -3.827   2.560
  176   1HA   GLY  87          HA2       GLY  87 -23.655  -4.284   0.000
  177   2HA   GLY  87          HA3       GLY  87 -24.904  -3.882   1.169
  178    H    GLY  88           H        GLY  88 -22.084  -2.722  -0.544
  179   1HA   GLY  88          HA2       GLY  88 -21.497  -0.583  -1.159
  180   2HA   GLY  88          HA3       GLY  88 -23.068  -0.053  -0.572
  181    H    TRP  89           H        TRP  89 -21.599   1.815   0.012
  182    HA   TRP  89           HA       TRP  89 -20.891   1.543   2.820
  183   1HB   TRP  89          HB2       TRP  89 -18.782   3.050   2.084
  184   2HB   TRP  89          HB3       TRP  89 -18.703   1.299   2.242
  185    HD1  TRP  89           HD1      TRP  89 -19.360  -0.003  -0.258
  186    HE1  TRP  89           HE1      TRP  89 -18.404   0.586  -2.569
  187    HE3  TRP  89           HE3      TRP  89 -17.795   4.768   0.706
  188    HZ2  TRP  89           HZ2      TRP  89 -17.141   2.782  -3.820
  189    HZ3  TRP  89           HZ3      TRP  89 -16.720   6.044  -1.102
  190    HH2  TRP  89           HH2      TRP  89 -16.400   5.070  -3.317
  191    H    GLY  90           H        GLY  90 -20.111   4.062   0.468
  192   1HA   GLY  90          HA2       GLY  90 -22.170   5.784   1.668
  193   2HA   GLY  90          HA3       GLY  90 -20.506   6.347   1.606
  194    H    GLN  91           H        GLN  91 -21.664   4.383  -0.984
  195    HA   GLN  91           HA       GLN  91 -21.125   6.393  -2.913
  196   1HB   GLN  91          HB2       GLN  91 -22.770   3.942  -3.475
  197   2HB   GLN  91          HB3       GLN  91 -21.644   4.779  -4.535
  198   1HG   GLN  91          HG2       GLN  91 -19.824   4.044  -2.920
  199   2HG   GLN  91          HG3       GLN  91 -21.033   2.963  -2.228
  200   1HE2  GLN  91          HE21      GLN  91 -20.074   3.923  -5.512
  201   2HE2  GLN  91          HE22      GLN  91 -19.913   2.314  -6.118
  Start of MODEL   11
    1    H    TRP  57           H        TRP  57   7.624   1.863 -11.458
    2    HA   TRP  57           HA       TRP  57   9.794   2.560 -11.385
    3   1HB   TRP  57          HB2       TRP  57   8.915   1.592  -9.296
    4   2HB   TRP  57          HB3       TRP  57   9.546   0.015  -9.761
    5    HD1  TRP  57           HD1      TRP  57  11.566  -0.480  -8.279
    6    HE1  TRP  57           HE1      TRP  57  13.631   0.827  -7.472
    7    HE3  TRP  57           HE3      TRP  57  10.471   4.090 -10.292
    8    HZ2  TRP  57           HZ2      TRP  57  14.659   3.450  -7.663
    9    HZ3  TRP  57           HZ3      TRP  57  12.047   5.945  -9.934
   10    HH2  TRP  57           HH2      TRP  57  14.097   5.630  -8.645
   11    H    GLY  58           H        GLY  58  12.029   2.256 -11.706
   12   1HA   GLY  58          HA2       GLY  58  12.691   0.542 -13.876
   13   2HA   GLY  58          HA3       GLY  58  13.818   1.526 -12.955
   14    H    GLN  59           H        GLN  59  14.047   0.607 -10.576
   15    HA   GLN  59           HA       GLN  59  13.820  -2.155 -10.135
   16   1HB   GLN  59          HB2       GLN  59  16.086  -2.922 -10.456
   17   2HB   GLN  59          HB3       GLN  59  15.491  -2.257 -11.969
   18   1HG   GLN  59          HG2       GLN  59  16.662  -0.103 -11.303
   19   2HG   GLN  59          HG3       GLN  59  17.463  -1.059 -10.057
   20   1HE2  GLN  59          HE21      GLN  59  17.285  -0.299 -13.399
   21   2HE2  GLN  59          HE22      GLN  59  18.627  -1.257 -13.917
   22    HA   PRO  60           HA       PRO  60  14.830  -0.789  -6.070
   23   1HB   PRO  60          HB2       PRO  60  15.808  -3.060  -4.946
   24   2HB   PRO  60          HB3       PRO  60  14.093  -2.819  -5.289
   25   1HG   PRO  60          HG2       PRO  60  16.147  -4.320  -6.866
   26   2HG   PRO  60          HG3       PRO  60  14.474  -4.774  -6.487
   27   1HD   PRO  60          HD2       PRO  60  15.191  -3.746  -8.884
   28   2HD   PRO  60          HD3       PRO  60  13.602  -3.439  -8.155
   29    H    HIS  61           H        HIS  61  16.469   0.480  -5.500
   30    HA   HIS  61           HA       HIS  61  19.169  -0.139  -6.388
   31   1HB   HIS  61          HB2       HIS  61  17.781   2.284  -5.334
   32   2HB   HIS  61          HB3       HIS  61  19.529   2.179  -5.155
   33    HD1  HIS  61           HD1      HIS  61  19.801   4.169  -6.817
   34    HD2  HIS  61           HD2      HIS  61  18.023   0.785  -8.446
   35    HE1  HIS  61           HE1      HIS  61  19.855   4.515  -9.307
   36    HE2  HIS  61           HE2      HIS  61  18.851   2.416 -10.275
   37    H    GLY  62           H        GLY  62  17.459  -1.188  -3.876
   38   1HA   GLY  62          HA2       GLY  62  19.673  -1.981  -2.350
   39   2HA   GLY  62          HA3       GLY  62  18.974  -0.558  -1.593
   40    H    GLY  63           H        GLY  63  17.210  -3.086  -3.315
   41   1HA   GLY  63          HA2       GLY  63  16.449  -4.919  -1.588
   42   2HA   GLY  63          HA3       GLY  63  15.628  -3.529  -0.893
   43    H    GLY  64           H        GLY  64  13.722  -2.864  -1.744
   44   1HA   GLY  64          HA2       GLY  64  12.871  -4.063  -4.298
   45   2HA   GLY  64          HA3       GLY  64  11.847  -4.210  -2.877
   46    H    TRP  65           H        TRP  65  10.201  -3.132  -4.092
   47    HA   TRP  65           HA       TRP  65  10.388  -0.239  -3.837
   48   1HB   TRP  65          HB2       TRP  65   9.144  -0.302  -6.233
   49   2HB   TRP  65          HB3       TRP  65  10.879  -0.071  -6.052
   50    HD1  TRP  65           HD1      TRP  65  12.282  -2.595  -6.079
   51    HE1  TRP  65           HE1      TRP  65  11.951  -4.498  -7.773
   52    HE3  TRP  65           HE3      TRP  65   7.622  -1.359  -7.783
   53    HZ2  TRP  65           HZ2      TRP  65   9.978  -5.361  -9.601
   54    HZ3  TRP  65           HZ3      TRP  65   6.585  -2.776  -9.506
   55    HH2  TRP  65           HH2      TRP  65   7.740  -4.735 -10.396
   56    H    GLY  66           H        GLY  66   8.106  -2.286  -5.601
   57   1HA   GLY  66          HA2       GLY  66   6.002  -1.371  -3.749
   58   2HA   GLY  66          HA3       GLY  66   5.734  -1.837  -5.422
   59    H    GLN  67           H        GLN  67   7.675  -4.158  -4.879
   60    HA   GLN  67           HA       GLN  67   5.742  -6.141  -4.466
   61   1HB   GLN  67          HB2       GLN  67   7.583  -7.704  -4.371
   62   2HB   GLN  67          HB3       GLN  67   7.920  -6.497  -5.603
   63   1HG   GLN  67          HG2       GLN  67   9.313  -5.295  -3.893
   64   2HG   GLN  67          HG3       GLN  67   9.120  -6.709  -2.858
   65   1HE2  GLN  67          HE21      GLN  67  11.435  -6.862  -2.950
   66   2HE2  GLN  67          HE22      GLN  67  12.195  -7.618  -4.304
   67    HA   PRO  68           HA       PRO  68   5.261  -6.405  -0.095
   68   1HB   PRO  68          HB2       PRO  68   4.962  -9.086   0.269
   69   2HB   PRO  68          HB3       PRO  68   3.705  -8.056  -0.425
   70   1HG   PRO  68          HG2       PRO  68   5.673  -9.836  -1.807
   71   2HG   PRO  68          HG3       PRO  68   3.947  -9.602  -2.143
   72   1HD   PRO  68          HD2       PRO  68   5.886  -8.415  -3.609
   73   2HD   PRO  68          HD3       PRO  68   4.313  -7.648  -3.313
   74    H    HIS  69           H        HIS  69   6.368  -6.839   1.807
   75    HA   HIS  69           HA       HIS  69   9.125  -7.740   1.446
   76   1HB   HIS  69          HB2       HIS  69   8.754  -5.553   2.522
   77   2HB   HIS  69          HB3       HIS  69   7.826  -6.341   3.794
   78    HD1  HIS  69           HD1      HIS  69   9.692  -5.203   5.370
   79    HD2  HIS  69           HD2      HIS  69  10.983  -8.305   2.925
   80    HE1  HIS  69           HE1      HIS  69  11.895  -5.943   6.329
   81    HE2  HIS  69           HE2      HIS  69  12.614  -7.880   4.886
   82    H    GLY  70           H        GLY  70   6.158  -8.576   3.077
   83   1HA   GLY  70          HA2       GLY  70   7.291 -11.168   3.765
   84   2HA   GLY  70          HA3       GLY  70   6.735 -10.191   5.115
   85    H    GLY  71           H        GLY  71   5.127 -10.046   2.030
   86   1HA   GLY  71          HA2       GLY  71   3.278 -12.064   2.166
   87   2HA   GLY  71          HA3       GLY  71   2.638 -10.818   3.225
   88    H    GLY  72           H        GLY  72   1.830  -8.919   2.358
   89   1HA   GLY  72          HA2       GLY  72   1.802  -8.743  -0.588
   90   2HA   GLY  72          HA3       GLY  72   0.303  -8.636   0.325
   91    H    TRP  73           H        TRP  73   0.018  -6.562  -0.685
   92    HA   TRP  73           HA       TRP  73   1.264  -4.438   0.870
   93   1HB   TRP  73          HB2       TRP  73   1.328  -3.208  -1.533
   94   2HB   TRP  73          HB3       TRP  73   2.713  -4.046  -0.840
   95    HD1  TRP  73           HD1      TRP  73   2.745  -6.828  -1.624
   96    HE1  TRP  73           HE1      TRP  73   2.443  -7.735  -4.008
   97    HE3  TRP  73           HE3      TRP  73   0.396  -2.804  -3.723
   98    HZ2  TRP  73           HZ2      TRP  73   1.356  -6.857  -6.465
   99    HZ3  TRP  73           HZ3      TRP  73  -0.240  -2.917  -6.098
  100    HH2  TRP  73           HH2      TRP  73   0.232  -4.902  -7.438
  101    H    GLY  74           H        GLY  74  -0.605  -4.334  -2.129
  102   1HA   GLY  74          HA2       GLY  74  -2.678  -2.830  -0.683
  103   2HA   GLY  74          HA3       GLY  74  -2.385  -2.749  -2.413
  104    H    GLN  75           H        GLN  75  -2.108  -5.800  -2.334
  105    HA   GLN  75           HA       GLN  75  -4.746  -6.382  -3.151
  106   1HB   GLN  75          HB2       GLN  75  -3.997  -8.662  -3.396
  107   2HB   GLN  75          HB3       GLN  75  -2.723  -7.585  -3.950
  108   1HG   GLN  75          HG2       GLN  75  -1.710  -7.846  -1.634
  109   2HG   GLN  75          HG3       GLN  75  -2.841  -9.180  -1.414
  110   1HE2  GLN  75          HE21      GLN  75  -0.349  -9.885  -1.169
  111   2HE2  GLN  75          HE22      GLN  75   0.254 -10.700  -2.568
  112    HA   PRO  76           HA       PRO  76  -6.790  -7.423   0.612
  113   1HB   PRO  76          HB2       PRO  76  -8.447  -9.417  -0.193
  114   2HB   PRO  76          HB3       PRO  76  -8.709  -7.722  -0.614
  115   1HG   PRO  76          HG2       PRO  76  -7.487  -9.913  -2.245
  116   2HG   PRO  76          HG3       PRO  76  -8.639  -8.658  -2.740
  117   1HD   PRO  76          HD2       PRO  76  -5.988  -8.489  -3.263
  118   2HD   PRO  76          HD3       PRO  76  -6.994  -7.059  -2.963
  119    H    HIS  77           H        HIS  77  -6.472  -8.704   2.351
  120    HA   HIS  77           HA       HIS  77  -4.738 -11.024   2.012
  121   1HB   HIS  77          HB2       HIS  77  -4.574 -10.921   4.512
  122   2HB   HIS  77          HB3       HIS  77  -4.024  -9.463   3.694
  123    HD1  HIS  77           HD1      HIS  77  -6.902 -10.768   5.749
  124    HD2  HIS  77           HD2      HIS  77  -5.392  -7.159   4.346
  125    HE1  HIS  77           HE1      HIS  77  -8.227  -8.983   6.924
  126    HE2  HIS  77           HE2      HIS  77  -7.239  -6.808   6.123
  127    H    GLY  78           H        GLY  78  -7.982 -10.186   2.996
  128   1HA   GLY  78          HA2       GLY  78  -8.539 -13.060   3.405
  129   2HA   GLY  78          HA3       GLY  78  -9.343 -11.789   4.316
  130    H    GLY  79           H        GLY  79  -9.717 -10.016   2.069
  131   1HA   GLY  79          HA2       GLY  79 -11.298 -11.506   0.142
  132   2HA   GLY  79          HA3       GLY  79 -12.219 -10.489   1.240
  133    H    GLY  80           H        GLY  80 -11.673  -8.172   1.279
  134   1HA   GLY  80          HA2       GLY  80 -10.525  -7.257  -1.284
  135   2HA   GLY  80          HA3       GLY  80 -12.053  -6.619  -0.693
  136    H    TRP  81           H        TRP  81 -11.077  -4.522  -0.804
  137    HA   TRP  81           HA       TRP  81  -9.672  -3.855   1.657
  138   1HB   TRP  81          HB2       TRP  81  -8.278  -2.245  -0.001
  139   2HB   TRP  81          HB3       TRP  81  -7.703  -3.825   0.518
  140    HD1  TRP  81           HD1      TRP  81  -8.576  -5.898  -1.297
  141    HE1  TRP  81           HE1      TRP  81  -8.395  -5.847  -3.857
  142    HE3  TRP  81           HE3      TRP  81  -8.139  -0.851  -1.970
  143    HZ2  TRP  81           HZ2      TRP  81  -8.095  -3.918  -5.901
  144    HZ3  TRP  81           HZ3      TRP  81  -7.906   0.017  -4.260
  145    HH2  TRP  81           HH2      TRP  81  -7.885  -1.486  -6.184
  146    H    GLY  82           H        GLY  82 -10.181  -2.013  -1.318
  147   1HA   GLY  82          HA2       GLY  82 -11.801  -0.113   0.244
  148   2HA   GLY  82          HA3       GLY  82 -10.894   0.287  -1.207
  149    H    GLN  83           H        GLN  83 -11.955  -2.354  -2.366
  150    HA   GLN  83           HA       GLN  83 -14.036  -1.258  -3.882
  151   1HB   GLN  83          HB2       GLN  83 -14.370  -3.479  -4.765
  152   2HB   GLN  83          HB3       GLN  83 -12.645  -3.203  -4.564
  153   1HG   GLN  83          HG2       GLN  83 -12.916  -4.395  -2.313
  154   2HG   GLN  83          HG3       GLN  83 -14.470  -4.938  -2.944
  155   1HE2  GLN  83          HE21      GLN  83 -13.737  -7.089  -2.850
  156   2HE2  GLN  83          HE22      GLN  83 -12.652  -7.721  -4.036
  157    HA   PRO  84           HA       PRO  84 -17.631  -1.686  -1.372
  158   1HB   PRO  84          HB2       PRO  84 -19.539  -2.235  -3.223
  159   2HB   PRO  84          HB3       PRO  84 -18.810  -0.636  -3.040
  160   1HG   PRO  84          HG2       PRO  84 -18.187  -2.787  -5.025
  161   2HG   PRO  84          HG3       PRO  84 -18.337  -1.038  -5.279
  162   1HD   PRO  84          HD2       PRO  84 -15.941  -2.285  -5.056
  163   2HD   PRO  84          HD3       PRO  84 -16.206  -0.619  -4.509
  164    H    HIS  85           H        HIS  85 -18.660  -3.229  -0.213
  165    HA   HIS  85           HA       HIS  85 -18.179  -6.007  -0.965
  166   1HB   HIS  85          HB2       HIS  85 -19.128  -4.737   1.608
  167   2HB   HIS  85          HB3       HIS  85 -18.992  -6.477   1.373
  168    HD1  HIS  85           HD1      HIS  85 -16.220  -6.018  -0.323
  169    HD2  HIS  85           HD2      HIS  85 -17.098  -4.848   3.567
  170    HE1  HIS  85           HE1      HIS  85 -13.995  -5.773   0.824
  171    HE2  HIS  85           HE2      HIS  85 -14.549  -4.979   3.150
  172    H    GLY  86           H        GLY  86 -20.788  -3.725  -0.539
  173   1HA   GLY  86          HA2       GLY  86 -22.617  -5.666  -1.740
  174   2HA   GLY  86          HA3       GLY  86 -23.065  -5.000  -0.177
  175    H    GLY  87           H        GLY  87 -21.348  -3.089  -2.535
  176   1HA   GLY  87          HA2       GLY  87 -23.304  -1.981  -4.073
  177   2HA   GLY  87          HA3       GLY  87 -23.462  -1.136  -2.540
  178    H    GLY  88           H        GLY  88 -22.086   0.496  -2.063
  179   1HA   GLY  88          HA2       GLY  88 -19.791   0.899  -3.878
  180   2HA   GLY  88          HA3       GLY  88 -20.901   2.213  -3.515
  181    H    TRP  89           H        TRP  89 -19.085   3.405  -2.739
  182    HA   TRP  89           HA       TRP  89 -18.543   2.863   0.070
  183   1HB   TRP  89          HB2       TRP  89 -16.044   3.602  -0.640
  184   2HB   TRP  89          HB3       TRP  89 -16.551   1.923  -0.497
  185    HD1  TRP  89           HD1      TRP  89 -17.578   0.922  -3.004
  186    HE1  TRP  89           HE1      TRP  89 -16.473   1.176  -5.308
  187    HE3  TRP  89           HE3      TRP  89 -14.548   4.916  -2.006
  188    HZ2  TRP  89           HZ2      TRP  89 -14.559   2.847  -6.544
  189    HZ3  TRP  89           HZ3      TRP  89 -13.108   5.781  -3.805
  190    HH2  TRP  89           HH2      TRP  89 -13.115   4.766  -6.026
  191    H    GLY  90           H        GLY  90 -16.960   5.017  -2.246
  192   1HA   GLY  90          HA2       GLY  90 -18.287   7.304  -0.945
  193   2HA   GLY  90          HA3       GLY  90 -16.539   7.283  -1.124
  194    H    GLN  91           H        GLN  91 -18.312   5.832  -3.674
  195    HA   GLN  91           HA       GLN  91 -17.287   7.553  -5.630
  196   1HB   GLN  91          HB2       GLN  91 -19.103   6.494  -7.089
  197   2HB   GLN  91          HB3       GLN  91 -17.924   5.412  -6.361
  198   1HG   GLN  91          HG2       GLN  91 -19.459   4.623  -4.778
  199   2HG   GLN  91          HG3       GLN  91 -20.578   5.951  -5.077
  200   1HE2  GLN  91          HE21      GLN  91 -19.426   2.874  -6.150
  201   2HE2  GLN  91          HE22      GLN  91 -20.641   2.599  -7.348
  Start of MODEL   12
    1    H    TRP  57           H        TRP  57  11.066   3.560 -14.955
    2    HA   TRP  57           HA       TRP  57   9.906   5.010 -12.738
    3   1HB   TRP  57          HB2       TRP  57   9.794   2.790 -11.800
    4   2HB   TRP  57          HB3       TRP  57   9.245   2.713 -13.470
    5    HD1  TRP  57           HD1      TRP  57  12.760   2.865 -13.985
    6    HE1  TRP  57           HE1      TRP  57  13.847   0.536 -14.121
    7    HE3  TRP  57           HE3      TRP  57   8.985   0.084 -11.944
    8    HZ2  TRP  57           HZ2      TRP  57  13.192  -2.126 -13.453
    9    HZ3  TRP  57           HZ3      TRP  57   9.296  -2.347 -11.728
   10    HH2  TRP  57           HH2      TRP  57  11.356  -3.427 -12.467
   11    H    GLY  58           H        GLY  58  11.004   4.103 -10.571
   12   1HA   GLY  58          HA2       GLY  58  13.717   5.203 -10.642
   13   2HA   GLY  58          HA3       GLY  58  12.729   4.974  -9.207
   14    H    GLN  59           H        GLN  59  12.032   2.220 -10.008
   15    HA   GLN  59           HA       GLN  59  12.710   0.118  -9.520
   16   1HB   GLN  59          HB2       GLN  59  14.505  -0.719 -10.739
   17   2HB   GLN  59          HB3       GLN  59  14.026   0.695 -11.662
   18   1HG   GLN  59          HG2       GLN  59  16.049   1.338  -9.691
   19   2HG   GLN  59          HG3       GLN  59  16.570   0.060 -10.783
   20   1HE2  GLN  59          HE21      GLN  59  17.452   2.854 -10.512
   21   2HE2  GLN  59          HE22      GLN  59  17.264   3.554 -12.079
   22    HA   PRO  60           HA       PRO  60  14.736   0.086  -5.619
   23   1HB   PRO  60          HB2       PRO  60  15.569  -2.482  -5.417
   24   2HB   PRO  60          HB3       PRO  60  13.866  -2.022  -5.321
   25   1HG   PRO  60          HG2       PRO  60  15.399  -3.138  -7.633
   26   2HG   PRO  60          HG3       PRO  60  13.767  -3.542  -7.072
   27   1HD   PRO  60          HD2       PRO  60  14.248  -1.887  -9.177
   28   2HD   PRO  60          HD3       PRO  60  12.820  -1.737  -8.135
   29    H    HIS  61           H        HIS  61  16.644   0.865  -4.993
   30    HA   HIS  61           HA       HIS  61  18.982   0.462  -6.676
   31   1HB   HIS  61          HB2       HIS  61  18.181   2.404  -4.575
   32   2HB   HIS  61          HB3       HIS  61  19.903   2.089  -4.759
   33    HD1  HIS  61           HD1      HIS  61  19.624   4.776  -5.447
   34    HD2  HIS  61           HD2      HIS  61  18.392   1.907  -8.187
   35    HE1  HIS  61           HE1      HIS  61  19.547   5.957  -7.667
   36    HE2  HIS  61           HE2      HIS  61  18.717   4.222  -9.295
   37    H    GLY  62           H        GLY  62  17.678  -1.356  -4.364
   38   1HA   GLY  62          HA2       GLY  62  19.810  -2.985  -3.866
   39   2HA   GLY  62          HA3       GLY  62  19.920  -1.756  -2.613
   40    H    GLY  63           H        GLY  63  17.024  -3.221  -4.046
   41   1HA   GLY  63          HA2       GLY  63  16.383  -5.182  -2.294
   42   2HA   GLY  63          HA3       GLY  63  15.962  -3.725  -1.407
   43    H    GLY  64           H        GLY  64  14.146  -2.570  -1.969
   44   1HA   GLY  64          HA2       GLY  64  12.670  -3.310  -4.369
   45   2HA   GLY  64          HA3       GLY  64  11.897  -3.698  -2.839
   46    H    TRP  65           H        TRP  65  10.191  -2.276  -3.558
   47    HA   TRP  65           HA       TRP  65  10.685   0.466  -2.713
   48   1HB   TRP  65          HB2       TRP  65   9.114   1.025  -4.837
   49   2HB   TRP  65          HB3       TRP  65  10.871   1.101  -4.889
   50    HD1  TRP  65           HD1      TRP  65  12.009  -1.429  -5.682
   51    HE1  TRP  65           HE1      TRP  65  11.262  -2.875  -7.669
   52    HE3  TRP  65           HE3      TRP  65   7.292   0.439  -6.313
   53    HZ2  TRP  65           HZ2      TRP  65   8.976  -3.182  -9.300
   54    HZ3  TRP  65           HZ3      TRP  65   5.891  -0.484  -8.112
   55    HH2  TRP  65           HH2      TRP  65   6.716  -2.256  -9.574
   56    H    GLY  66           H        GLY  66   7.996  -0.999  -4.486
   57   1HA   GLY  66          HA2       GLY  66   6.270  -0.401  -2.170
   58   2HA   GLY  66          HA3       GLY  66   5.725  -0.447  -3.840
   59    H    GLN  67           H        GLN  67   7.504  -2.954  -4.112
   60    HA   GLN  67           HA       GLN  67   5.472  -4.855  -3.889
   61   1HB   GLN  67          HB2       GLN  67   7.171  -6.514  -4.348
   62   2HB   GLN  67          HB3       GLN  67   7.478  -5.088  -5.327
   63   1HG   GLN  67          HG2       GLN  67   9.126  -4.384  -3.540
   64   2HG   GLN  67          HG3       GLN  67   8.948  -6.010  -2.880
   65   1HE2  GLN  67          HE21      GLN  67  10.721  -7.090  -3.370
   66   2HE2  GLN  67          HE22      GLN  67  11.466  -7.164  -4.926
   67    HA   PRO  68           HA       PRO  68   5.407  -6.064   0.347
   68   1HB   PRO  68          HB2       PRO  68   4.943  -8.741   0.154
   69   2HB   PRO  68          HB3       PRO  68   3.704  -7.518  -0.152
   70   1HG   PRO  68          HG2       PRO  68   5.389  -9.039  -2.104
   71   2HG   PRO  68          HG3       PRO  68   3.659  -8.656  -2.179
   72   1HD   PRO  68          HD2       PRO  68   5.506  -7.261  -3.571
   73   2HD   PRO  68          HD3       PRO  68   4.039  -6.502  -2.918
   74    H    HIS  69           H        HIS  69   6.609  -7.079   1.983
   75    HA   HIS  69           HA       HIS  69   9.256  -8.001   1.116
   76   1HB   HIS  69          HB2       HIS  69   9.197  -6.065   2.637
   77   2HB   HIS  69          HB3       HIS  69   8.336  -7.030   3.831
   78    HD1  HIS  69           HD1      HIS  69  10.367  -6.501   5.448
   79    HD2  HIS  69           HD2      HIS  69  11.278  -8.854   2.146
   80    HE1  HIS  69           HE1      HIS  69  12.602  -7.537   5.955
   81    HE2  HIS  69           HE2      HIS  69  13.174  -8.884   3.905
   82    H    GLY  70           H        GLY  70   6.428  -8.947   2.941
   83   1HA   GLY  70          HA2       GLY  70   7.659 -11.606   3.335
   84   2HA   GLY  70          HA3       GLY  70   6.607 -10.869   4.533
   85    H    GLY  71           H        GLY  71   4.646  -9.831   2.780
   86   1HA   GLY  71          HA2       GLY  71   3.648 -11.715   0.946
   87   2HA   GLY  71          HA3       GLY  71   2.947 -12.049   2.523
   88    H    GLY  72           H        GLY  72   3.063  -9.850  -0.168
   89   1HA   GLY  72          HA2       GLY  72   1.629  -8.188  -0.840
   90   2HA   GLY  72          HA3       GLY  72   0.441  -8.931   0.222
   91    H    TRP  73           H        TRP  73  -0.116  -6.551   0.347
   92    HA   TRP  73           HA       TRP  73   1.076  -5.485   2.779
   93   1HB   TRP  73          HB2       TRP  73   0.882  -3.154   1.439
   94   2HB   TRP  73          HB3       TRP  73   2.369  -4.091   1.527
   95    HD1  TRP  73           HD1      TRP  73   2.531  -5.985  -0.657
   96    HE1  TRP  73           HE1      TRP  73   2.121  -5.467  -3.140
   97    HE3  TRP  73           HE3      TRP  73  -0.222  -1.709  -0.146
   98    HZ2  TRP  73           HZ2      TRP  73   0.809  -3.498  -4.684
   99    HZ3  TRP  73           HZ3      TRP  73  -1.015  -0.567  -2.176
  100    HH2  TRP  73           HH2      TRP  73  -0.508  -1.445  -4.398
  101    H    GLY  74           H        GLY  74  -1.005  -3.963   0.358
  102   1HA   GLY  74          HA2       GLY  74  -3.161  -3.934   2.378
  103   2HA   GLY  74          HA3       GLY  74  -2.865  -2.612   1.260
  104    H    GLN  75           H        GLN  75  -2.442  -5.700  -0.113
  105    HA   GLN  75           HA       GLN  75  -4.786  -5.322  -1.764
  106   1HB   GLN  75          HB2       GLN  75  -3.928  -7.160  -3.085
  107   2HB   GLN  75          HB3       GLN  75  -2.622  -6.036  -2.735
  108   1HG   GLN  75          HG2       GLN  75  -1.931  -7.539  -0.869
  109   2HG   GLN  75          HG3       GLN  75  -3.135  -8.697  -1.432
  110   1HE2  GLN  75          HE21      GLN  75  -2.875  -8.528  -4.134
  111   2HE2  GLN  75          HE22      GLN  75  -1.306  -9.067  -4.614
  112    HA   PRO  76           HA       PRO  76  -7.521  -8.077   0.318
  113   1HB   PRO  76          HB2       PRO  76  -8.798  -9.278  -1.772
  114   2HB   PRO  76          HB3       PRO  76  -9.126  -7.621  -1.254
  115   1HG   PRO  76          HG2       PRO  76  -7.407  -8.598  -3.500
  116   2HG   PRO  76          HG3       PRO  76  -8.546  -7.239  -3.471
  117   1HD   PRO  76          HD2       PRO  76  -5.884  -6.883  -3.240
  118   2HD   PRO  76          HD3       PRO  76  -7.051  -5.843  -2.397
  119    H    HIS  77           H        HIS  77  -7.668 -10.171   1.037
  120    HA   HIS  77           HA       HIS  77  -5.657 -12.020  -0.019
  121   1HB   HIS  77          HB2       HIS  77  -5.664 -11.436   2.420
  122   2HB   HIS  77          HB3       HIS  77  -7.230 -12.228   2.556
  123    HD1  HIS  77           HD1      HIS  77  -3.750 -12.880   2.993
  124    HD2  HIS  77           HD2      HIS  77  -6.998 -15.091   1.641
  125    HE1  HIS  77           HE1      HIS  77  -3.051 -15.289   3.186
  126    HE2  HIS  77           HE2      HIS  77  -4.999 -16.603   2.278
  127    H    GLY  78           H        GLY  78  -9.097 -11.662   0.477
  128   1HA   GLY  78          HA2       GLY  78  -9.490 -14.230  -0.929
  129   2HA   GLY  78          HA3       GLY  78 -10.498 -13.763   0.431
  130    H    GLY  79           H        GLY  79 -10.880 -11.053  -0.182
  131   1HA   GLY  79          HA2       GLY  79 -11.750 -10.664  -2.857
  132   2HA   GLY  79          HA3       GLY  79 -13.103 -11.133  -1.839
  133    H    GLY  80           H        GLY  80 -10.830  -8.636  -2.627
  134   1HA   GLY  80          HA2       GLY  80 -10.822  -6.386  -2.173
  135   2HA   GLY  80          HA3       GLY  80 -12.517  -6.570  -1.741
  136    H    TRP  81           H        TRP  81 -11.754  -4.817  -0.215
  137    HA   TRP  81           HA       TRP  81 -11.181  -6.058   2.353
  138   1HB   TRP  81          HB2       TRP  81  -9.617  -3.883   2.664
  139   2HB   TRP  81          HB3       TRP  81  -8.996  -5.449   2.154
  140    HD1  TRP  81           HD1      TRP  81  -9.047  -5.699  -0.729
  141    HE1  TRP  81           HE1      TRP  81  -8.174  -3.966  -2.413
  142    HE3  TRP  81           HE3      TRP  81  -9.133  -1.554   2.262
  143    HZ2  TRP  81           HZ2      TRP  81  -7.590  -1.203  -2.467
  144    HZ3  TRP  81           HZ3      TRP  81  -8.398   0.596   1.317
  145    HH2  TRP  81           HH2      TRP  81  -7.642   0.767  -0.999
  146    H    GLY  82           H        GLY  82 -11.093  -2.672   1.335
  147   1HA   GLY  82          HA2       GLY  82 -13.479  -2.209   3.017
  148   2HA   GLY  82          HA3       GLY  82 -12.149  -1.069   2.889
  149    H    GLN  83           H        GLN  83 -12.922  -2.596  -0.052
  150    HA   GLN  83           HA       GLN  83 -13.888  -0.107  -1.142
  151   1HB   GLN  83          HB2       GLN  83 -13.774  -1.217  -3.290
  152   2HB   GLN  83          HB3       GLN  83 -12.309  -1.561  -2.382
  153   1HG   GLN  83          HG2       GLN  83 -13.318  -3.744  -1.725
  154   2HG   GLN  83          HG3       GLN  83 -14.652  -3.394  -2.823
  155   1HE2  GLN  83          HE21      GLN  83 -14.429  -3.854  -4.919
  156   2HE2  GLN  83          HE22      GLN  83 -12.973  -4.411  -5.665
  157    HA   PRO  84           HA       PRO  84 -18.223  -0.870  -0.962
  158   1HB   PRO  84          HB2       PRO  84 -19.074   0.180  -3.329
  159   2HB   PRO  84          HB3       PRO  84 -18.578   1.168  -1.950
  160   1HG   PRO  84          HG2       PRO  84 -17.024   0.409  -4.394
  161   2HG   PRO  84          HG3       PRO  84 -17.124   1.978  -3.572
  162   1HD   PRO  84          HD2       PRO  84 -15.029   0.312  -3.238
  163   2HD   PRO  84          HD3       PRO  84 -15.624   1.355  -1.930
  164    H    HIS  85           H        HIS  85 -19.689  -2.419  -1.499
  165    HA   HIS  85           HA       HIS  85 -18.856  -4.361  -3.523
  166   1HB   HIS  85          HB2       HIS  85 -20.817  -4.526  -1.231
  167   2HB   HIS  85          HB3       HIS  85 -20.624  -5.804  -2.426
  168    HD1  HIS  85           HD1      HIS  85 -18.907  -7.519  -1.903
  169    HD2  HIS  85           HD2      HIS  85 -18.295  -4.002   0.224
  170    HE1  HIS  85           HE1      HIS  85 -16.999  -8.002  -0.339
  171    HE2  HIS  85           HE2      HIS  85 -16.589  -5.832   0.874
  172    H    GLY  86           H        GLY  86 -21.430  -2.134  -2.740
  173   1HA   GLY  86          HA2       GLY  86 -22.719  -2.835  -5.305
  174   2HA   GLY  86          HA3       GLY  86 -23.654  -2.448  -3.868
  175    H    GLY  87           H        GLY  87 -22.141  -0.275  -2.921
  176   1HA   GLY  87          HA2       GLY  87 -21.652   1.676  -4.913
  177   2HA   GLY  87          HA3       GLY  87 -23.290   1.855  -4.304
  178    H    GLY  88           H        GLY  88 -19.924   2.279  -3.648
  179   1HA   GLY  88          HA2       GLY  88 -18.818   3.446  -2.009
  180   2HA   GLY  88          HA3       GLY  88 -20.339   4.283  -1.736
  181    H    TRP  89           H        TRP  89 -19.368   4.233   0.498
  182    HA   TRP  89           HA       TRP  89 -20.561   2.017   1.953
  183   1HB   TRP  89          HB2       TRP  89 -18.291   2.175   3.395
  184   2HB   TRP  89          HB3       TRP  89 -18.525   1.010   2.098
  185    HD1  TRP  89           HD1      TRP  89 -17.637   2.065  -0.437
  186    HE1  TRP  89           HE1      TRP  89 -15.406   3.256  -0.890
  187    HE3  TRP  89           HE3      TRP  89 -16.495   3.484   4.340
  188    HZ2  TRP  89           HZ2      TRP  89 -13.416   4.614   0.584
  189    HZ3  TRP  89           HZ3      TRP  89 -14.407   4.725   4.733
  190    HH2  TRP  89           HH2      TRP  89 -12.900   5.277   2.893
  191    H    GLY  90           H        GLY  90 -18.232   4.503   2.912
  192   1HA   GLY  90          HA2       GLY  90 -20.303   5.606   4.706
  193   2HA   GLY  90          HA3       GLY  90 -18.582   5.611   5.062
  194    H    GLN  91           H        GLN  91 -18.105   6.336   2.139
  195    HA   GLN  91           HA       GLN  91 -17.843   9.109   2.506
  196   1HB   GLN  91          HB2       GLN  91 -17.404   9.122   0.011
  197   2HB   GLN  91          HB3       GLN  91 -16.376   8.064   0.966
  198   1HG   GLN  91          HG2       GLN  91 -17.163   6.200  -0.005
  199   2HG   GLN  91          HG3       GLN  91 -18.812   6.815  -0.096
  200   1HE2  GLN  91          HE21      GLN  91 -19.421   6.693  -2.136
  201   2HE2  GLN  91          HE22      GLN  91 -18.513   7.243  -3.500
  Start of MODEL   13
    1    H    TRP  57           H        TRP  57  12.973   0.714 -16.500
    2    HA   TRP  57           HA       TRP  57  13.563  -1.115 -15.166
    3   1HB   TRP  57          HB2       TRP  57  15.509  -1.546 -16.988
    4   2HB   TRP  57          HB3       TRP  57  16.461  -0.790 -15.714
    5    HD1  TRP  57           HD1      TRP  57  13.755  -3.593 -15.787
    6    HE1  TRP  57           HE1      TRP  57  14.579  -5.512 -14.283
    7    HE3  TRP  57           HE3      TRP  57  18.194  -1.573 -14.249
    8    HZ2  TRP  57           HZ2      TRP  57  16.813  -6.093 -12.659
    9    HZ3  TRP  57           HZ3      TRP  57  19.615  -2.876 -12.721
   10    HH2  TRP  57           HH2      TRP  57  18.938  -5.089 -11.942
   11    H    GLY  58           H        GLY  58  15.572  -0.945 -13.369
   12   1HA   GLY  58          HA2       GLY  58  16.632   1.482 -12.643
   13   2HA   GLY  58          HA3       GLY  58  14.982   1.523 -12.041
   14    H    GLN  59           H        GLN  59  14.916  -1.351 -11.524
   15    HA   GLN  59           HA       GLN  59  15.180  -2.738  -9.755
   16   1HB   GLN  59          HB2       GLN  59  17.386  -3.395  -9.223
   17   2HB   GLN  59          HB3       GLN  59  17.428  -2.902 -10.907
   18   1HG   GLN  59          HG2       GLN  59  18.688  -1.037 -10.474
   19   2HG   GLN  59          HG3       GLN  59  18.141  -0.917  -8.802
   20   1HE2  GLN  59          HE21      GLN  59  20.621  -1.869 -10.826
   21   2HE2  GLN  59          HE22      GLN  59  21.550  -2.786  -9.694
   22    HA   PRO  60           HA       PRO  60  14.648  -0.512  -6.002
   23   1HB   PRO  60          HB2       PRO  60  15.222  -2.394  -4.137
   24   2HB   PRO  60          HB3       PRO  60  13.750  -2.432  -5.113
   25   1HG   PRO  60          HG2       PRO  60  16.303  -3.952  -5.475
   26   2HG   PRO  60          HG3       PRO  60  14.630  -4.521  -5.628
   27   1HD   PRO  60          HD2       PRO  60  16.163  -3.885  -7.771
   28   2HD   PRO  60          HD3       PRO  60  14.401  -3.668  -7.755
   29    H    HIS  61           H        HIS  61  15.749   0.640  -4.441
   30    HA   HIS  61           HA       HIS  61  18.655   0.598  -4.674
   31   1HB   HIS  61          HB2       HIS  61  17.478   2.752  -4.884
   32   2HB   HIS  61          HB3       HIS  61  16.837   2.558  -3.255
   33    HD1  HIS  61           HD1      HIS  61  18.116   4.930  -2.933
   34    HD2  HIS  61           HD2      HIS  61  20.505   1.560  -3.377
   35    HE1  HIS  61           HE1      HIS  61  20.388   5.600  -2.087
   36    HE2  HIS  61           HE2      HIS  61  21.838   3.572  -2.447
   37    H    GLY  62           H        GLY  62  16.120  -0.065  -2.366
   38   1HA   GLY  62          HA2       GLY  62  18.177  -0.701  -0.342
   39   2HA   GLY  62          HA3       GLY  62  16.527  -0.228   0.040
   40    H    GLY  63           H        GLY  63  15.463  -1.939  -2.154
   41   1HA   GLY  63          HA2       GLY  63  16.187  -4.614  -1.867
   42   2HA   GLY  63          HA3       GLY  63  15.000  -4.270  -0.618
   43    H    GLY  64           H        GLY  64  13.269  -2.573  -1.885
   44   1HA   GLY  64          HA2       GLY  64  12.463  -3.862  -4.385
   45   2HA   GLY  64          HA3       GLY  64  11.355  -3.990  -3.025
   46    H    TRP  65           H        TRP  65   9.858  -2.882  -4.460
   47    HA   TRP  65           HA       TRP  65  10.047   0.003  -4.111
   48   1HB   TRP  65          HB2       TRP  65   9.045   0.005  -6.617
   49   2HB   TRP  65          HB3       TRP  65  10.758   0.203  -6.263
   50    HD1  TRP  65           HD1      TRP  65  12.094  -2.367  -6.176
   51    HE1  TRP  65           HE1      TRP  65  11.913  -4.222  -7.942
   52    HE3  TRP  65           HE3      TRP  65   7.697  -0.962  -8.369
   53    HZ2  TRP  65           HZ2      TRP  65  10.140  -4.989 -10.006
   54    HZ3  TRP  65           HZ3      TRP  65   6.828  -2.310 -10.235
   55    HH2  TRP  65           HH2      TRP  65   8.026  -4.281 -11.035
   56    H    GLY  66           H        GLY  66   7.913  -1.944  -6.150
   57   1HA   GLY  66          HA2       GLY  66   5.668  -1.104  -4.427
   58   2HA   GLY  66          HA3       GLY  66   5.537  -1.394  -6.155
   59    H    GLN  67           H        GLN  67   7.518  -3.665  -4.600
   60    HA   GLN  67           HA       GLN  67   5.366  -5.651  -4.768
   61   1HB   GLN  67          HB2       GLN  67   7.106  -7.321  -4.932
   62   2HB   GLN  67          HB3       GLN  67   7.425  -6.042  -6.096
   63   1HG   GLN  67          HG2       GLN  67   9.042  -5.063  -4.484
   64   2HG   GLN  67          HG3       GLN  67   8.792  -6.471  -3.452
   65   1HE2  GLN  67          HE21      GLN  67  11.107  -6.750  -3.730
   66   2HE2  GLN  67          HE22      GLN  67  11.694  -7.578  -5.127
   67    HA   PRO  68           HA       PRO  68   5.179  -6.236  -0.406
   68   1HB   PRO  68          HB2       PRO  68   4.776  -8.925  -0.226
   69   2HB   PRO  68          HB3       PRO  68   3.523  -7.787  -0.730
   70   1HG   PRO  68          HG2       PRO  68   5.284  -9.532  -2.404
   71   2HG   PRO  68          HG3       PRO  68   3.552  -9.195  -2.578
   72   1HD   PRO  68          HD2       PRO  68   5.419  -7.979  -4.105
   73   2HD   PRO  68          HD3       PRO  68   3.923  -7.162  -3.609
   74    H    HIS  69           H        HIS  69   6.365  -6.925   1.385
   75    HA   HIS  69           HA       HIS  69   9.056  -7.883   0.751
   76   1HB   HIS  69          HB2       HIS  69   9.537  -7.156   3.134
   77   2HB   HIS  69          HB3       HIS  69   9.095  -5.869   2.016
   78    HD1  HIS  69           HD1      HIS  69   7.804  -7.779   4.974
   79    HD2  HIS  69           HD2      HIS  69   6.715  -4.548   2.598
   80    HE1  HIS  69           HE1      HIS  69   5.893  -6.674   6.177
   81    HE2  HIS  69           HE2      HIS  69   5.195  -4.773   4.679
   82    H    GLY  70           H        GLY  70   6.168  -8.748   2.505
   83   1HA   GLY  70          HA2       GLY  70   7.219 -11.437   2.872
   84   2HA   GLY  70          HA3       GLY  70   6.807 -10.568   4.344
   85    H    GLY  71           H        GLY  71   4.995 -10.065   1.412
   86   1HA   GLY  71          HA2       GLY  71   3.064 -12.007   1.496
   87   2HA   GLY  71          HA3       GLY  71   2.563 -10.846   2.716
   88    H    GLY  72           H        GLY  72   1.823  -8.816   2.094
   89   1HA   GLY  72          HA2       GLY  72   1.567  -8.370  -0.811
   90   2HA   GLY  72          HA3       GLY  72   0.157  -8.263   0.233
   91    H    TRP  73           H        TRP  73  -0.075  -6.093  -0.569
   92    HA   TRP  73           HA       TRP  73   1.423  -4.195   1.054
   93   1HB   TRP  73          HB2       TRP  73   1.364  -2.754  -1.229
   94   2HB   TRP  73          HB3       TRP  73   2.748  -3.722  -0.733
   95    HD1  TRP  73           HD1      TRP  73   2.546  -6.421  -1.753
   96    HE1  TRP  73           HE1      TRP  73   2.000  -7.090  -4.171
   97    HE3  TRP  73           HE3      TRP  73   0.289  -2.101  -3.291
   98    HZ2  TRP  73           HZ2      TRP  73   0.778  -5.934  -6.442
   99    HZ3  TRP  73           HZ3      TRP  73  -0.539  -1.964  -5.603
  100    HH2  TRP  73           HH2      TRP  73  -0.298  -3.841  -7.146
  101    H    GLY  74           H        GLY  74  -0.673  -3.701  -1.751
  102   1HA   GLY  74          HA2       GLY  74  -2.604  -2.385   0.054
  103   2HA   GLY  74          HA3       GLY  74  -2.310  -1.886  -1.605
  104    H    GLN  75           H        GLN  75  -2.305  -5.250  -1.298
  105    HA   GLN  75           HA       GLN  75  -4.924  -5.383  -2.576
  106   1HB   GLN  75          HB2       GLN  75  -4.312  -7.639  -3.214
  107   2HB   GLN  75          HB3       GLN  75  -3.001  -6.539  -3.618
  108   1HG   GLN  75          HG2       GLN  75  -1.928  -7.227  -1.434
  109   2HG   GLN  75          HG3       GLN  75  -3.136  -8.511  -1.360
  110   1HE2  GLN  75          HE21      GLN  75  -1.220  -9.889  -1.371
  111   2HE2  GLN  75          HE22      GLN  75  -0.520 -10.329  -2.888
  112    HA   PRO  76           HA       PRO  76  -7.109  -6.925   0.919
  113   1HB   PRO  76          HB2       PRO  76  -8.702  -8.831  -0.243
  114   2HB   PRO  76          HB3       PRO  76  -9.020  -7.097  -0.318
  115   1HG   PRO  76          HG2       PRO  76  -7.761  -8.883  -2.354
  116   2HG   PRO  76          HG3       PRO  76  -8.915  -7.557  -2.583
  117   1HD   PRO  76          HD2       PRO  76  -6.278  -7.268  -3.069
  118   2HD   PRO  76          HD3       PRO  76  -7.276  -5.938  -2.446
  119    H    HIS  77           H        HIS  77  -7.186  -8.626   2.391
  120    HA   HIS  77           HA       HIS  77  -5.349 -10.846   1.796
  121   1HB   HIS  77          HB2       HIS  77  -4.831  -9.235   3.704
  122   2HB   HIS  77          HB3       HIS  77  -6.211  -9.937   4.542
  123    HD1  HIS  77           HD1      HIS  77  -4.459 -10.724   6.367
  124    HD2  HIS  77           HD2      HIS  77  -4.059 -12.491   2.628
  125    HE1  HIS  77           HE1      HIS  77  -2.990 -12.733   6.727
  126    HE2  HIS  77           HE2      HIS  77  -2.833 -13.835   4.468
  127    H    GLY  78           H        GLY  78  -8.571 -10.023   2.832
  128   1HA   GLY  78          HA2       GLY  78  -9.408 -12.766   2.408
  129   2HA   GLY  78          HA3       GLY  78  -9.585 -12.191   4.059
  130    H    GLY  79           H        GLY  79  -9.968  -9.987   1.396
  131   1HA   GLY  79          HA2       GLY  79 -12.312  -9.921   0.364
  132   2HA   GLY  79          HA3       GLY  79 -12.841  -9.838   2.038
  133    H    GLY  80           H        GLY  80 -11.263  -8.131  -0.573
  134   1HA   GLY  80          HA2       GLY  80 -10.885  -5.896  -0.932
  135   2HA   GLY  80          HA3       GLY  80 -12.241  -5.625   0.155
  136    H    TRP  81           H        TRP  81 -10.666  -3.689   0.418
  137    HA   TRP  81           HA       TRP  81  -9.165  -4.182   2.875
  138   1HB   TRP  81          HB2       TRP  81  -7.502  -2.380   1.746
  139   2HB   TRP  81          HB3       TRP  81  -7.251  -4.119   1.645
  140    HD1  TRP  81           HD1      TRP  81  -8.654  -5.196  -0.680
  141    HE1  TRP  81           HE1      TRP  81  -8.474  -4.293  -3.077
  142    HE3  TRP  81           HE3      TRP  81  -6.985  -0.478   0.360
  143    HZ2  TRP  81           HZ2      TRP  81  -7.713  -1.895  -4.365
  144    HZ3  TRP  81           HZ3      TRP  81  -6.553   1.058  -1.513
  145    HH2  TRP  81           HH2      TRP  81  -6.909   0.362  -3.826
  146    H    GLY  82           H        GLY  82  -9.312  -1.345   0.769
  147   1HA   GLY  82          HA2       GLY  82 -10.725   0.071   2.945
  148   2HA   GLY  82          HA3       GLY  82  -9.497   0.825   1.941
  149    H    GLN  83           H        GLN  83 -11.660  -1.330   0.362
  150    HA   GLN  83           HA       GLN  83 -12.771   0.874  -1.152
  151   1HB   GLN  83          HB2       GLN  83 -13.687  -0.826  -2.610
  152   2HB   GLN  83          HB3       GLN  83 -12.005  -1.203  -2.266
  153   1HG   GLN  83          HG2       GLN  83 -12.762  -2.820  -0.556
  154   2HG   GLN  83          HG3       GLN  83 -14.428  -2.491  -1.032
  155   1HE2  GLN  83          HE21      GLN  83 -13.657  -5.021  -1.162
  156   2HE2  GLN  83          HE22      GLN  83 -13.404  -5.527  -2.794
  157    HA   PRO  84           HA       PRO  84 -16.638   1.209   0.928
  158   1HB   PRO  84          HB2       PRO  84 -18.352   1.641  -1.151
  159   2HB   PRO  84          HB3       PRO  84 -17.244   2.869  -0.531
  160   1HG   PRO  84          HG2       PRO  84 -16.952   1.081  -2.913
  161   2HG   PRO  84          HG3       PRO  84 -16.569   2.806  -2.753
  162   1HD   PRO  84          HD2       PRO  84 -14.664   0.898  -2.647
  163   2HD   PRO  84          HD3       PRO  84 -14.559   2.392  -1.692
  164    H    HIS  85           H        HIS  85 -18.668   0.174   1.296
  165    HA   HIS  85           HA       HIS  85 -18.793  -2.537   0.158
  166   1HB   HIS  85          HB2       HIS  85 -19.995  -1.535   2.747
  167   2HB   HIS  85          HB3       HIS  85 -19.962  -3.203   2.184
  168    HD1  HIS  85           HD1      HIS  85 -18.390  -1.282   4.597
  169    HD2  HIS  85           HD2      HIS  85 -16.934  -3.809   1.638
  170    HE1  HIS  85           HE1      HIS  85 -16.083  -1.938   5.349
  171    HE2  HIS  85           HE2      HIS  85 -15.255  -3.536   3.586
  172    H    GLY  86           H        GLY  86 -20.595   0.400   0.732
  173   1HA   GLY  86          HA2       GLY  86 -22.771  -0.704  -0.925
  174   2HA   GLY  86          HA3       GLY  86 -23.136   0.176   0.552
  175    H    GLY  87           H        GLY  87 -20.480   1.116  -1.502
  176   1HA   GLY  87          HA2       GLY  87 -20.590   2.729  -3.281
  177   2HA   GLY  87          HA3       GLY  87 -22.101   3.314  -2.603
  178    H    GLY  88           H        GLY  88 -18.637   3.459  -2.455
  179   1HA   GLY  88          HA2       GLY  88 -17.210   4.964  -1.470
  180   2HA   GLY  88          HA3       GLY  88 -18.581   6.063  -1.433
  181    H    TRP  89           H        TRP  89 -17.343   6.695   0.573
  182    HA   TRP  89           HA       TRP  89 -18.592   5.383   2.850
  183   1HB   TRP  89          HB2       TRP  89 -16.156   5.739   3.952
  184   2HB   TRP  89          HB3       TRP  89 -16.675   4.219   3.231
  185    HD1  TRP  89           HD1      TRP  89 -16.003   4.105   0.426
  186    HE1  TRP  89           HE1      TRP  89 -13.730   4.691  -0.616
  187    HE3  TRP  89           HE3      TRP  89 -14.121   7.018   4.181
  188    HZ2  TRP  89           HZ2      TRP  89 -11.432   6.186   0.066
  189    HZ3  TRP  89           HZ3      TRP  89 -11.877   7.986   3.909
  190    HH2  TRP  89           HH2      TRP  89 -10.560   7.578   1.893
  191    H    GLY  90           H        GLY  90 -15.901   7.670   2.647
  192   1HA   GLY  90          HA2       GLY  90 -17.697   9.787   3.630
  193   2HA   GLY  90          HA3       GLY  90 -16.185   9.456   4.463
  194    H    GLN  91           H        GLN  91 -16.134   9.071   1.054
  195    HA   GLN  91           HA       GLN  91 -14.112  10.972   0.674
  196   1HB   GLN  91          HB2       GLN  91 -14.732  10.700  -1.794
  197   2HB   GLN  91          HB3       GLN  91 -14.237   9.253  -0.925
  198   1HG   GLN  91          HG2       GLN  91 -16.427   8.431  -0.820
  199   2HG   GLN  91          HG3       GLN  91 -17.124   9.995  -1.242
  200   1HE2  GLN  91          HE21      GLN  91 -14.434   8.278  -2.747
  201   2HE2  GLN  91          HE22      GLN  91 -15.173   8.114  -4.300
  Start of MODEL   14
    1    H    TRP  57           H        TRP  57   9.452   9.187 -10.772
    2    HA   TRP  57           HA       TRP  57  10.109   7.068 -11.321
    3   1HB   TRP  57          HB2       TRP  57  11.479   7.745 -13.257
    4   2HB   TRP  57          HB3       TRP  57  12.741   8.307 -12.165
    5    HD1  TRP  57           HD1      TRP  57  14.676   6.646 -12.300
    6    HE1  TRP  57           HE1      TRP  57  14.916   4.084 -12.297
    7    HE3  TRP  57           HE3      TRP  57   9.726   5.366 -12.289
    8    HZ2  TRP  57           HZ2      TRP  57  13.230   1.819 -12.291
    9    HZ3  TRP  57           HZ3      TRP  57   9.125   2.981 -12.285
   10    HH2  TRP  57           HH2      TRP  57  10.842   1.245 -12.286
   11    H    GLY  58           H        GLY  58  11.134   5.638  -9.876
   12   1HA   GLY  58          HA2       GLY  58  12.999   6.667  -7.915
   13   2HA   GLY  58          HA3       GLY  58  11.400   6.311  -7.280
   14    H    GLN  59           H        GLN  59  13.781   4.747  -9.428
   15    HA   GLN  59           HA       GLN  59  12.997   2.122  -8.891
   16   1HB   GLN  59          HB2       GLN  59  15.102   1.444  -9.868
   17   2HB   GLN  59          HB3       GLN  59  14.458   2.804 -10.775
   18   1HG   GLN  59          HG2       GLN  59  16.405   3.309  -8.578
   19   2HG   GLN  59          HG3       GLN  59  16.982   2.702 -10.130
   20   1HE2  GLN  59          HE21      GLN  59  17.475   4.163 -11.597
   21   2HE2  GLN  59          HE22      GLN  59  16.918   5.797 -11.634
   22    HA   PRO  60           HA       PRO  60  14.530   1.192  -4.868
   23   1HB   PRO  60          HB2       PRO  60  15.393  -1.376  -5.180
   24   2HB   PRO  60          HB3       PRO  60  13.688  -0.930  -5.076
   25   1HG   PRO  60          HG2       PRO  60  15.353  -1.503  -7.496
   26   2HG   PRO  60          HG3       PRO  60  13.696  -2.019  -7.131
   27   1HD   PRO  60          HD2       PRO  60  14.221   0.041  -8.787
   28   2HD   PRO  60          HD3       PRO  60  12.793   0.021  -7.733
   29    H    HIS  61           H        HIS  61  16.348   1.814  -3.897
   30    HA   HIS  61           HA       HIS  61  18.871   1.650  -5.359
   31   1HB   HIS  61          HB2       HIS  61  17.876   3.741  -4.085
   32   2HB   HIS  61          HB3       HIS  61  18.636   2.977  -2.693
   33    HD1  HIS  61           HD1      HIS  61  20.231   5.089  -2.631
   34    HD2  HIS  61           HD2      HIS  61  20.632   2.651  -5.970
   35    HE1  HIS  61           HE1      HIS  61  22.415   5.751  -3.687
   36    HE2  HIS  61           HE2      HIS  61  22.677   4.202  -5.658
   37    H    GLY  62           H        GLY  62  17.299  -0.424  -3.479
   38   1HA   GLY  62          HA2       GLY  62  19.758  -1.659  -2.553
   39   2HA   GLY  62          HA3       GLY  62  18.631  -1.192  -1.289
   40    H    GLY  63           H        GLY  63  16.209  -1.792  -2.523
   41   1HA   GLY  63          HA2       GLY  63  16.364  -4.583  -3.360
   42   2HA   GLY  63          HA3       GLY  63  15.549  -4.265  -1.836
   43    H    GLY  64           H        GLY  64  13.793  -2.545  -1.975
   44   1HA   GLY  64          HA2       GLY  64  12.484  -2.453  -4.593
   45   2HA   GLY  64          HA3       GLY  64  11.617  -3.246  -3.286
   46    H    TRP  65           H        TRP  65   9.960  -1.660  -3.579
   47    HA   TRP  65           HA       TRP  65  10.460   0.732  -1.999
   48   1HB   TRP  65          HB2       TRP  65   8.941   1.880  -3.915
   49   2HB   TRP  65          HB3       TRP  65  10.700   1.944  -3.910
   50    HD1  TRP  65           HD1      TRP  65  11.829  -0.296  -5.345
   51    HE1  TRP  65           HE1      TRP  65  11.118  -1.120  -7.671
   52    HE3  TRP  65           HE3      TRP  65   7.157   1.770  -5.539
   53    HZ2  TRP  65           HZ2      TRP  65   8.874  -0.916  -9.374
   54    HZ3  TRP  65           HZ3      TRP  65   5.793   1.409  -7.555
   55    HH2  TRP  65           HH2      TRP  65   6.635   0.095  -9.432
   56    H    GLY  66           H        GLY  66   7.789  -0.113  -4.157
   57   1HA   GLY  66          HA2       GLY  66   6.054  -0.289  -1.774
   58   2HA   GLY  66          HA3       GLY  66   5.524   0.342  -3.325
   59    H    GLN  67           H        GLN  67   7.560  -2.332  -3.688
   60    HA   GLN  67           HA       GLN  67   5.353  -3.955  -4.596
   61   1HB   GLN  67          HB2       GLN  67   7.034  -5.463  -5.437
   62   2HB   GLN  67          HB3       GLN  67   7.511  -3.816  -5.830
   63   1HG   GLN  67          HG2       GLN  67   8.997  -3.860  -3.819
   64   2HG   GLN  67          HG3       GLN  67   8.622  -5.574  -3.659
   65   1HE2  GLN  67          HE21      GLN  67   9.653  -7.020  -4.921
   66   2HE2  GLN  67          HE22      GLN  67  10.841  -6.609  -6.106
   67    HA   PRO  68           HA       PRO  68   4.977  -6.482  -0.998
   68   1HB   PRO  68          HB2       PRO  68   4.111  -8.809  -2.036
   69   2HB   PRO  68          HB3       PRO  68   3.116  -7.352  -2.041
   70   1HG   PRO  68          HG2       PRO  68   4.701  -8.568  -4.254
   71   2HG   PRO  68          HG3       PRO  68   3.100  -7.806  -4.302
   72   1HD   PRO  68          HD2       PRO  68   5.440  -6.564  -5.057
   73   2HD   PRO  68          HD3       PRO  68   3.979  -5.711  -4.526
   74    H    HIS  69           H        HIS  69   6.057  -7.984   0.246
   75    HA   HIS  69           HA       HIS  69   8.381  -9.273  -1.027
   76   1HB   HIS  69          HB2       HIS  69   9.349  -9.217   1.334
   77   2HB   HIS  69          HB3       HIS  69   9.220  -7.674   0.497
   78    HD1  HIS  69           HD1      HIS  69   7.470  -5.981   1.392
   79    HD2  HIS  69           HD2      HIS  69   7.733  -9.496   3.594
   80    HE1  HIS  69           HE1      HIS  69   6.231  -5.528   3.533
   81    HE2  HIS  69           HE2      HIS  69   6.478  -7.638   4.885
   82    H    GLY  70           H        GLY  70   7.937 -11.356  -1.350
   83   1HA   GLY  70          HA2       GLY  70   7.316 -13.528  -0.950
   84   2HA   GLY  70          HA3       GLY  70   7.648 -13.182   0.740
   85    H    GLY  71           H        GLY  71   5.217 -11.431  -1.059
   86   1HA   GLY  71          HA2       GLY  71   2.948 -12.892  -0.780
   87   2HA   GLY  71          HA3       GLY  71   3.203 -12.255   0.837
   88    H    GLY  72           H        GLY  72   2.392 -10.308   1.291
   89   1HA   GLY  72          HA2       GLY  72   2.055  -8.332  -0.828
   90   2HA   GLY  72          HA3       GLY  72   0.581  -8.919  -0.075
   91    H    TRP  73           H        TRP  73   0.718  -6.403   0.195
   92    HA   TRP  73           HA       TRP  73   1.842  -5.887   2.869
   93   1HB   TRP  73          HB2       TRP  73   1.601  -3.384   1.765
   94   2HB   TRP  73          HB3       TRP  73   3.094  -4.313   1.844
   95    HD1  TRP  73           HD1      TRP  73   3.091  -6.197  -0.462
   96    HE1  TRP  73           HE1      TRP  73   2.869  -5.468  -2.910
   97    HE3  TRP  73           HE3      TRP  73   0.916  -1.628   0.255
   98    HZ2  TRP  73           HZ2      TRP  73   1.911  -3.235  -4.360
   99    HZ3  TRP  73           HZ3      TRP  73   0.381  -0.256  -1.715
  100    HH2  TRP  73           HH2      TRP  73   0.870  -1.044  -3.975
  101    H    GLY  74           H        GLY  74  -0.297  -3.986   0.794
  102   1HA   GLY  74          HA2       GLY  74  -2.283  -4.014   2.976
  103   2HA   GLY  74          HA3       GLY  74  -2.080  -2.700   1.827
  104    H    GLN  75           H        GLN  75  -1.745  -4.905  -0.299
  105    HA   GLN  75           HA       GLN  75  -4.340  -4.795  -1.332
  106   1HB   GLN  75          HB2       GLN  75  -3.588  -6.402  -2.985
  107   2HB   GLN  75          HB3       GLN  75  -2.316  -5.226  -2.684
  108   1HG   GLN  75          HG2       GLN  75  -1.307  -6.906  -1.098
  109   2HG   GLN  75          HG3       GLN  75  -2.464  -8.072  -1.740
  110   1HE2  GLN  75          HE21      GLN  75  -1.084  -9.417  -2.761
  111   2HE2  GLN  75          HE22      GLN  75  -0.080  -8.956  -4.089
  112    HA   PRO  76           HA       PRO  76  -6.626  -7.945   0.725
  113   1HB   PRO  76          HB2       PRO  76  -8.053  -9.025  -1.351
  114   2HB   PRO  76          HB3       PRO  76  -8.453  -7.491  -0.573
  115   1HG   PRO  76          HG2       PRO  76  -6.972  -7.995  -3.122
  116   2HG   PRO  76          HG3       PRO  76  -8.193  -6.761  -2.759
  117   1HD   PRO  76          HD2       PRO  76  -5.562  -6.190  -2.813
  118   2HD   PRO  76          HD3       PRO  76  -6.673  -5.393  -1.681
  119    H    HIS  77           H        HIS  77  -6.731 -10.178   1.092
  120    HA   HIS  77           HA       HIS  77  -4.710 -11.735  -0.372
  121   1HB   HIS  77          HB2       HIS  77  -4.790 -13.223   1.687
  122   2HB   HIS  77          HB3       HIS  77  -4.113 -11.615   1.924
  123    HD1  HIS  77           HD1      HIS  77  -7.433 -13.404   2.410
  124    HD2  HIS  77           HD2      HIS  77  -5.225 -10.259   3.990
  125    HE1  HIS  77           HE1      HIS  77  -8.734 -12.605   4.407
  126    HE2  HIS  77           HE2      HIS  77  -7.423 -10.647   5.296
  127    H    GLY  78           H        GLY  78  -8.047 -11.656   0.652
  128   1HA   GLY  78          HA2       GLY  78  -8.491 -14.278  -0.621
  129   2HA   GLY  78          HA3       GLY  78  -9.553 -13.549   0.574
  130    H    GLY  79           H        GLY  79 -10.334 -11.249  -0.197
  131   1HA   GLY  79          HA2       GLY  79 -10.723 -10.970  -3.031
  132   2HA   GLY  79          HA3       GLY  79 -12.161 -11.549  -2.204
  133    H    GLY  80           H        GLY  80  -9.894  -9.365  -0.682
  134   1HA   GLY  80          HA2       GLY  80 -10.363  -6.879  -1.142
  135   2HA   GLY  80          HA3       GLY  80 -12.006  -7.311  -0.690
  136    H    TRP  81           H        TRP  81 -11.643  -5.595   0.921
  137    HA   TRP  81           HA       TRP  81 -10.681  -6.770   3.406
  138   1HB   TRP  81          HB2       TRP  81  -9.708  -4.283   3.784
  139   2HB   TRP  81          HB3       TRP  81  -8.732  -5.617   3.180
  140    HD1  TRP  81           HD1      TRP  81  -8.846  -5.754   0.289
  141    HE1  TRP  81           HE1      TRP  81  -8.503  -3.791  -1.331
  142    HE3  TRP  81           HE3      TRP  81  -9.827  -1.890   3.488
  143    HZ2  TRP  81           HZ2      TRP  81  -8.624  -0.969  -1.263
  144    HZ3  TRP  81           HZ3      TRP  81  -9.690   0.412   2.631
  145    HH2  TRP  81           HH2      TRP  81  -9.101   0.862   0.304
  146    H    GLY  82           H        GLY  82 -11.490  -3.430   2.574
  147   1HA   GLY  82          HA2       GLY  82 -13.833  -3.661   4.358
  148   2HA   GLY  82          HA3       GLY  82 -12.852  -2.210   4.225
  149    H    GLN  83           H        GLN  83 -13.352  -3.788   1.252
  150    HA   GLN  83           HA       GLN  83 -15.057  -1.619   0.363
  151   1HB   GLN  83          HB2       GLN  83 -14.658  -2.460  -1.871
  152   2HB   GLN  83          HB3       GLN  83 -13.133  -2.379  -1.000
  153   1HG   GLN  83          HG2       GLN  83 -13.410  -4.828  -0.508
  154   2HG   GLN  83          HG3       GLN  83 -14.762  -4.821  -1.639
  155   1HE2  GLN  83          HE21      GLN  83 -13.040  -6.506  -2.412
  156   2HE2  GLN  83          HE22      GLN  83 -11.978  -5.927  -3.646
  157    HA   PRO  84           HA       PRO  84 -18.905  -3.760   0.500
  158   1HB   PRO  84          HB2       PRO  84 -20.123  -2.859  -1.766
  159   2HB   PRO  84          HB3       PRO  84 -19.935  -1.879  -0.308
  160   1HG   PRO  84          HG2       PRO  84 -18.296  -1.884  -2.812
  161   2HG   PRO  84          HG3       PRO  84 -18.872  -0.507  -1.853
  162   1HD   PRO  84          HD2       PRO  84 -16.340  -1.424  -1.677
  163   2HD   PRO  84          HD3       PRO  84 -17.197  -0.742  -0.280
  164    H    HIS  85           H        HIS  85 -20.055  -5.508  -0.367
  165    HA   HIS  85           HA       HIS  85 -18.629  -6.956  -2.494
  166   1HB   HIS  85          HB2       HIS  85 -19.127  -7.837   0.000
  167   2HB   HIS  85          HB3       HIS  85 -20.601  -8.380  -0.795
  168    HD1  HIS  85           HD1      HIS  85 -20.351 -10.203  -2.633
  169    HD2  HIS  85           HD2      HIS  85 -16.811  -9.218  -0.694
  170    HE1  HIS  85           HE1      HIS  85 -18.720 -12.016  -3.248
  171    HE2  HIS  85           HE2      HIS  85 -16.612 -11.445  -1.993
  172    H    GLY  86           H        GLY  86 -21.741  -5.749  -1.463
  173   1HA   GLY  86          HA2       GLY  86 -22.829  -6.527  -4.095
  174   2HA   GLY  86          HA3       GLY  86 -23.780  -6.701  -2.627
  175    H    GLY  87           H        GLY  87 -21.650  -3.980  -3.094
  176   1HA   GLY  87          HA2       GLY  87 -22.242  -1.848  -3.998
  177   2HA   GLY  87          HA3       GLY  87 -23.936  -2.281  -3.820
  178    H    GLY  88           H        GLY  88 -21.145  -0.931  -2.293
  179   1HA   GLY  88          HA2       GLY  88 -20.889   0.269  -0.353
  180   2HA   GLY  88          HA3       GLY  88 -22.623   0.547  -0.431
  181    H    TRP  89           H        TRP  89 -22.220   0.478   1.970
  182    HA   TRP  89           HA       TRP  89 -22.881  -2.191   2.922
  183   1HB   TRP  89          HB2       TRP  89 -21.203  -1.516   4.923
  184   2HB   TRP  89          HB3       TRP  89 -20.715  -2.502   3.549
  185    HD1  TRP  89           HD1      TRP  89 -19.699  -0.867   1.396
  186    HE1  TRP  89           HE1      TRP  89 -17.974   1.025   1.611
  187    HE3  TRP  89           HE3      TRP  89 -20.227   0.143   6.379
  188    HZ2  TRP  89           HZ2      TRP  89 -16.960   2.721   3.631
  189    HZ3  TRP  89           HZ3      TRP  89 -18.840   1.914   7.375
  190    HH2  TRP  89           HH2      TRP  89 -17.241   3.176   6.028
  191    H    GLY  90           H        GLY  90 -21.842   0.724   4.637
  192   1HA   GLY  90          HA2       GLY  90 -24.611   1.095   5.568
  193   2HA   GLY  90          HA3       GLY  90 -23.293   1.027   6.727
  194    H    GLN  91           H        GLN  91 -22.578   2.512   3.716
  195    HA   GLN  91           HA       GLN  91 -21.866   4.962   4.876
  196   1HB   GLN  91          HB2       GLN  91 -21.884   5.776   2.453
  197   2HB   GLN  91          HB3       GLN  91 -20.820   4.429   2.837
  198   1HG   GLN  91          HG2       GLN  91 -22.220   2.877   1.782
  199   2HG   GLN  91          HG3       GLN  91 -23.575   4.004   1.736
  200   1HE2  GLN  91          HE21      GLN  91 -20.223   3.744   0.600
  201   2HE2  GLN  91          HE22      GLN  91 -20.516   4.435  -0.957
  Start of MODEL   15
    1    H    TRP  57           H        TRP  57  14.159   9.369 -11.321
    2    HA   TRP  57           HA       TRP  57  14.262   7.091 -11.229
    3   1HB   TRP  57          HB2       TRP  57  14.638   8.577  -9.089
    4   2HB   TRP  57          HB3       TRP  57  13.232   7.707  -8.482
    5    HD1  TRP  57           HD1      TRP  57  16.043   6.127 -10.603
    6    HE1  TRP  57           HE1      TRP  57  17.159   4.275  -9.207
    7    HE3  TRP  57           HE3      TRP  57  13.582   6.853  -6.181
    8    HZ2  TRP  57           HZ2      TRP  57  17.014   3.257  -6.578
    9    HZ3  TRP  57           HZ3      TRP  57  14.129   5.396  -4.275
   10    HH2  TRP  57           HH2      TRP  57  15.810   3.635  -4.470
   11    H    GLY  58           H        GLY  58  13.349   5.023 -10.671
   12   1HA   GLY  58          HA2       GLY  58  10.692   4.668  -9.800
   13   2HA   GLY  58          HA3       GLY  58  10.719   4.662 -11.557
   14    H    GLN  59           H        GLN  59  12.982   3.358  -9.139
   15    HA   GLN  59           HA       GLN  59  12.262   0.656  -9.545
   16   1HB   GLN  59          HB2       GLN  59  14.138  -0.136 -10.844
   17   2HB   GLN  59          HB3       GLN  59  13.292   1.105 -11.758
   18   1HG   GLN  59          HG2       GLN  59  15.023   2.730 -10.868
   19   2HG   GLN  59          HG3       GLN  59  15.924   1.312 -10.332
   20   1HE2  GLN  59          HE21      GLN  59  14.107   2.176 -13.260
   21   2HE2  GLN  59          HE22      GLN  59  15.372   1.777 -14.367
   22    HA   PRO  60           HA       PRO  60  14.633   0.273  -5.851
   23   1HB   PRO  60          HB2       PRO  60  15.397  -2.334  -5.946
   24   2HB   PRO  60          HB3       PRO  60  13.744  -1.825  -5.580
   25   1HG   PRO  60          HG2       PRO  60  14.900  -2.802  -8.162
   26   2HG   PRO  60          HG3       PRO  60  13.344  -3.200  -7.410
   27   1HD   PRO  60          HD2       PRO  60  13.569  -1.412  -9.430
   28   2HD   PRO  60          HD3       PRO  60  12.346  -1.259  -8.154
   29    H    HIS  61           H        HIS  61  16.730   0.294  -5.063
   30    HA   HIS  61           HA       HIS  61  18.813   0.432  -7.108
   31   1HB   HIS  61          HB2       HIS  61  18.560   2.343  -5.572
   32   2HB   HIS  61          HB3       HIS  61  18.875   1.280  -4.204
   33    HD1  HIS  61           HD1      HIS  61  20.906   2.935  -3.708
   34    HD2  HIS  61           HD2      HIS  61  21.227   0.666  -7.174
   35    HE1  HIS  61           HE1      HIS  61  23.328   3.065  -4.374
   36    HE2  HIS  61           HE2      HIS  61  23.480   1.755  -6.522
   37    H    GLY  62           H        GLY  62  17.863  -1.403  -4.294
   38   1HA   GLY  62          HA2       GLY  62  19.577  -3.567  -4.998
   39   2HA   GLY  62          HA3       GLY  62  20.214  -2.689  -3.614
   40    H    GLY  63           H        GLY  63  16.801  -3.185  -4.351
   41   1HA   GLY  63          HA2       GLY  63  16.388  -5.432  -2.706
   42   2HA   GLY  63          HA3       GLY  63  16.141  -3.981  -1.746
   43    H    GLY  64           H        GLY  64  14.501  -2.459  -2.458
   44   1HA   GLY  64          HA2       GLY  64  12.666  -3.134  -4.534
   45   2HA   GLY  64          HA3       GLY  64  12.042  -3.611  -2.961
   46    H    TRP  65           H        TRP  65  10.321  -2.102  -3.362
   47    HA   TRP  65           HA       TRP  65  11.002   0.568  -2.421
   48   1HB   TRP  65          HB2       TRP  65   9.187   1.292  -4.285
   49   2HB   TRP  65          HB3       TRP  65  10.924   1.335  -4.562
   50    HD1  TRP  65           HD1      TRP  65  11.870  -1.183  -5.628
   51    HE1  TRP  65           HE1      TRP  65  10.835  -2.480  -7.588
   52    HE3  TRP  65           HE3      TRP  65   7.185   0.863  -5.565
   53    HZ2  TRP  65           HZ2      TRP  65   8.357  -2.616  -8.940
   54    HZ3  TRP  65           HZ3      TRP  65   5.542   0.095  -7.228
   55    HH2  TRP  65           HH2      TRP  65   6.117  -1.608  -8.880
   56    H    GLY  66           H        GLY  66   8.057  -0.697  -3.915
   57   1HA   GLY  66          HA2       GLY  66   6.715  -0.381  -1.301
   58   2HA   GLY  66          HA3       GLY  66   5.944  -0.007  -2.834
   59    H    GLN  67           H        GLN  67   7.922  -2.765  -2.977
   60    HA   GLN  67           HA       GLN  67   5.633  -4.463  -3.354
   61   1HB   GLN  67          HB2       GLN  67   7.235  -6.173  -3.965
   62   2HB   GLN  67          HB3       GLN  67   7.677  -4.659  -4.741
   63   1HG   GLN  67          HG2       GLN  67   9.350  -4.284  -2.959
   64   2HG   GLN  67          HG3       GLN  67   8.950  -5.870  -2.298
   65   1HE2  GLN  67          HE21      GLN  67   9.723  -4.455  -5.465
   66   2HE2  GLN  67          HE22      GLN  67  10.843  -5.686  -5.929
   67    HA   PRO  68           HA       PRO  68   5.276  -6.215   0.673
   68   1HB   PRO  68          HB2       PRO  68   4.710  -8.822   0.099
   69   2HB   PRO  68          HB3       PRO  68   3.540  -7.509  -0.077
   70   1HG   PRO  68          HG2       PRO  68   5.238  -8.827  -2.160
   71   2HG   PRO  68          HG3       PRO  68   3.531  -8.351  -2.245
   72   1HD   PRO  68          HD2       PRO  68   5.485  -6.871  -3.365
   73   2HD   PRO  68          HD3       PRO  68   4.039  -6.133  -2.647
   74    H    HIS  69           H        HIS  69   6.422  -7.343   2.223
   75    HA   HIS  69           HA       HIS  69   9.027  -8.355   1.350
   76   1HB   HIS  69          HB2       HIS  69   8.779  -6.542   3.130
   77   2HB   HIS  69          HB3       HIS  69   8.177  -7.811   4.190
   78    HD1  HIS  69           HD1      HIS  69  10.542  -6.680   5.343
   79    HD2  HIS  69           HD2      HIS  69  10.869  -9.500   2.309
   80    HE1  HIS  69           HE1      HIS  69  12.865  -7.622   5.548
   81    HE2  HIS  69           HE2      HIS  69  13.009  -9.389   3.757
   82    H    GLY  70           H        GLY  70   6.133  -9.698   1.749
   83   1HA   GLY  70          HA2       GLY  70   7.004 -12.321   1.932
   84   2HA   GLY  70          HA3       GLY  70   6.612 -11.823   3.571
   85    H    GLY  71           H        GLY  71   4.995 -10.844   0.579
   86   1HA   GLY  71          HA2       GLY  71   2.954 -12.472   0.187
   87   2HA   GLY  71          HA3       GLY  71   2.469 -11.770   1.723
   88    H    GLY  72           H        GLY  72   1.630  -9.722   1.786
   89   1HA   GLY  72          HA2       GLY  72   1.579  -8.200  -0.732
   90   2HA   GLY  72          HA3       GLY  72   0.061  -8.597   0.061
   91    H    TRP  73           H        TRP  73  -0.342  -6.326   0.190
   92    HA   TRP  73           HA       TRP  73   0.785  -5.158   2.604
   93   1HB   TRP  73          HB2       TRP  73   0.807  -2.921   1.093
   94   2HB   TRP  73          HB3       TRP  73   2.228  -3.930   1.343
   95    HD1  TRP  73           HD1      TRP  73   2.426  -5.979  -0.684
   96    HE1  TRP  73           HE1      TRP  73   2.188  -5.637  -3.217
   97    HE3  TRP  73           HE3      TRP  73  -0.142  -1.559  -0.662
   98    HZ2  TRP  73           HZ2      TRP  73   1.066  -3.737  -4.982
   99    HZ3  TRP  73           HZ3      TRP  73  -0.758  -0.544  -2.818
  100    HH2  TRP  73           HH2      TRP  73  -0.165  -1.611  -4.931
  101    H    GLY  74           H        GLY  74  -1.065  -3.721  -0.045
  102   1HA   GLY  74          HA2       GLY  74  -3.235  -3.197   1.875
  103   2HA   GLY  74          HA3       GLY  74  -2.919  -2.258   0.424
  104    H    GLN  75           H        GLN  75  -2.467  -4.939  -0.996
  105    HA   GLN  75           HA       GLN  75  -5.054  -5.153  -2.106
  106   1HB   GLN  75          HB2       GLN  75  -4.163  -6.992  -3.401
  107   2HB   GLN  75          HB3       GLN  75  -2.967  -5.707  -3.322
  108   1HG   GLN  75          HG2       GLN  75  -1.927  -6.992  -1.400
  109   2HG   GLN  75          HG3       GLN  75  -2.975  -8.331  -1.868
  110   1HE2  GLN  75          HE21      GLN  75  -0.041  -6.779  -2.394
  111   2HE2  GLN  75          HE22      GLN  75   0.445  -7.627  -3.819
  112    HA   PRO  76           HA       PRO  76  -7.120  -8.002   0.544
  113   1HB   PRO  76          HB2       PRO  76  -8.538  -9.495  -1.243
  114   2HB   PRO  76          HB3       PRO  76  -8.971  -7.840  -0.801
  115   1HG   PRO  76          HG2       PRO  76  -7.487  -8.834  -3.202
  116   2HG   PRO  76          HG3       PRO  76  -8.758  -7.600  -3.103
  117   1HD   PRO  76          HD2       PRO  76  -6.143  -6.960  -3.296
  118   2HD   PRO  76          HD3       PRO  76  -7.292  -5.970  -2.375
  119    H    HIS  77           H        HIS  77  -7.132 -10.157   1.280
  120    HA   HIS  77           HA       HIS  77  -4.957 -11.787   0.180
  121   1HB   HIS  77          HB2       HIS  77  -5.079 -12.992   2.362
  122   2HB   HIS  77          HB3       HIS  77  -4.706 -11.279   2.524
  123    HD1  HIS  77           HD1      HIS  77  -6.023 -10.111   4.256
  124    HD2  HIS  77           HD2      HIS  77  -8.014 -13.454   2.797
  125    HE1  HIS  77           HE1      HIS  77  -8.136 -10.279   5.610
  126    HE2  HIS  77           HE2      HIS  77  -9.365 -12.258   4.651
  127    H    GLY  78           H        GLY  78  -8.387 -11.816   0.867
  128   1HA   GLY  78          HA2       GLY  78  -8.546 -14.471  -0.425
  129   2HA   GLY  78          HA3       GLY  78  -9.569 -14.027   0.933
  130    H    GLY  79           H        GLY  79 -10.371 -11.495   0.273
  131   1HA   GLY  79          HA2       GLY  79 -11.257 -11.255  -2.420
  132   2HA   GLY  79          HA3       GLY  79 -12.533 -11.912  -1.406
  133    H    GLY  80           H        GLY  80 -10.494  -9.131  -2.027
  134   1HA   GLY  80          HA2       GLY  80 -10.931  -6.890  -1.700
  135   2HA   GLY  80          HA3       GLY  80 -12.545  -7.338  -1.166
  136    H    TRP  81           H        TRP  81 -12.011  -5.473   0.308
  137    HA   TRP  81           HA       TRP  81 -11.091  -6.561   2.843
  138   1HB   TRP  81          HB2       TRP  81  -9.877  -4.166   3.051
  139   2HB   TRP  81          HB3       TRP  81  -9.046  -5.619   2.507
  140    HD1  TRP  81           HD1      TRP  81  -9.204  -5.906  -0.362
  141    HE1  TRP  81           HE1      TRP  81  -8.730  -4.075  -2.100
  142    HE3  TRP  81           HE3      TRP  81  -9.826  -1.792   2.609
  143    HZ2  TRP  81           HZ2      TRP  81  -8.624  -1.254  -2.201
  144    HZ3  TRP  81           HZ3      TRP  81  -9.516   0.437   1.613
  145    HH2  TRP  81           HH2      TRP  81  -8.928   0.699  -0.741
  146    H    GLY  82           H        GLY  82 -11.644  -3.245   1.737
  147   1HA   GLY  82          HA2       GLY  82 -13.805  -3.041   3.730
  148   2HA   GLY  82          HA3       GLY  82 -12.843  -1.692   3.147
  149    H    GLN  83           H        GLN  83 -13.129  -2.874   0.348
  150    HA   GLN  83           HA       GLN  83 -15.237  -1.248  -0.519
  151   1HB   GLN  83          HB2       GLN  83 -14.927  -2.259  -2.691
  152   2HB   GLN  83          HB3       GLN  83 -13.356  -2.006  -1.947
  153   1HG   GLN  83          HG2       GLN  83 -13.494  -4.431  -1.200
  154   2HG   GLN  83          HG3       GLN  83 -14.847  -4.579  -2.321
  155   1HE2  GLN  83          HE21      GLN  83 -14.395  -3.873  -4.573
  156   2HE2  GLN  83          HE22      GLN  83 -12.841  -4.243  -5.233
  157    HA   PRO  84           HA       PRO  84 -18.884  -3.643   0.098
  158   1HB   PRO  84          HB2       PRO  84 -20.351  -3.001  -2.102
  159   2HB   PRO  84          HB3       PRO  84 -20.098  -1.891  -0.751
  160   1HG   PRO  84          HG2       PRO  84 -18.689  -2.017  -3.389
  161   2HG   PRO  84          HG3       PRO  84 -19.274  -0.598  -2.500
  162   1HD   PRO  84          HD2       PRO  84 -16.678  -1.347  -2.481
  163   2HD   PRO  84          HD3       PRO  84 -17.454  -0.583  -1.080
  164    H    HIS  85           H        HIS  85 -19.629  -5.661  -0.314
  165    HA   HIS  85           HA       HIS  85 -18.374  -7.116  -2.516
  166   1HB   HIS  85          HB2       HIS  85 -19.846  -8.038  -0.043
  167   2HB   HIS  85          HB3       HIS  85 -19.293  -9.134  -1.304
  168    HD1  HIS  85           HD1      HIS  85 -17.331 -10.317  -0.371
  169    HD2  HIS  85           HD2      HIS  85 -17.259  -6.260   0.519
  170    HE1  HIS  85           HE1      HIS  85 -15.145  -9.928   0.808
  171    HE2  HIS  85           HE2      HIS  85 -15.162  -7.482   1.414
  172    H    GLY  86           H        GLY  86 -21.504  -6.077  -1.360
  173   1HA   GLY  86          HA2       GLY  86 -22.709  -7.240  -3.797
  174   2HA   GLY  86          HA3       GLY  86 -23.549  -7.224  -2.253
  175    H    GLY  87           H        GLY  87 -22.871  -4.619  -1.417
  176   1HA   GLY  87          HA2       GLY  87 -23.385  -2.650  -3.373
  177   2HA   GLY  87          HA3       GLY  87 -24.899  -3.115  -2.614
  178    H    GLY  88           H        GLY  88 -21.920  -1.408  -2.255
  179   1HA   GLY  88          HA2       GLY  88 -21.200   0.108  -0.689
  180   2HA   GLY  88          HA3       GLY  88 -22.893   0.282  -0.246
  181    H    TRP  89           H        TRP  89 -21.733   0.631   1.880
  182    HA   TRP  89           HA       TRP  89 -21.829  -1.869   3.366
  183   1HB   TRP  89          HB2       TRP  89 -19.663  -0.826   4.588
  184   2HB   TRP  89          HB3       TRP  89 -19.558  -2.004   3.285
  185    HD1  TRP  89           HD1      TRP  89 -19.422  -0.704   0.708
  186    HE1  TRP  89           HE1      TRP  89 -17.881   1.253   0.077
  187    HE3  TRP  89           HE3      TRP  89 -18.414   1.076   5.393
  188    HZ2  TRP  89           HZ2      TRP  89 -16.421   3.282   1.391
  189    HZ3  TRP  89           HZ3      TRP  89 -16.933   3.028   5.619
  190    HH2  TRP  89           HH2      TRP  89 -15.957   4.107   3.658
  191    H    GLY  90           H        GLY  90 -20.540   1.314   4.216
  192   1HA   GLY  90          HA2       GLY  90 -22.886   1.734   5.950
  193   2HA   GLY  90          HA3       GLY  90 -21.261   1.917   6.594
  194    H    GLN  91           H        GLN  91 -21.715   2.893   3.334
  195    HA   GLN  91           HA       GLN  91 -21.155   5.633   4.040
  196   1HB   GLN  91          HB2       GLN  91 -21.220   5.960   1.532
  197   2HB   GLN  91          HB3       GLN  91 -20.016   4.822   2.121
  198   1HG   GLN  91          HG2       GLN  91 -21.264   2.964   1.390
  199   2HG   GLN  91          HG3       GLN  91 -22.706   3.943   1.125
  200   1HE2  GLN  91          HE21      GLN  91 -22.995   3.516  -1.003
  201   2HE2  GLN  91          HE22      GLN  91 -21.883   3.979  -2.242
  Start of MODEL   16
    1    H    TRP  57           H        TRP  57  13.284  10.922  -8.628
    2    HA   TRP  57           HA       TRP  57  13.050   9.013 -10.112
    3   1HB   TRP  57          HB2       TRP  57  14.380   9.308  -7.789
    4   2HB   TRP  57          HB3       TRP  57  13.382   7.917  -7.371
    5    HD1  TRP  57           HD1      TRP  57  14.783   8.376 -10.909
    6    HE1  TRP  57           HE1      TRP  57  16.467   6.486 -11.374
    7    HE3  TRP  57           HE3      TRP  57  14.966   6.286  -6.247
    8    HZ2  TRP  57           HZ2      TRP  57  17.709   4.387  -9.952
    9    HZ3  TRP  57           HZ3      TRP  57  16.426   4.340  -5.883
   10    HH2  TRP  57           HH2      TRP  57  17.769   3.410  -7.699
   11    H    GLY  58           H        GLY  58  12.508   6.553  -9.716
   12   1HA   GLY  58          HA2       GLY  58  10.106   5.925  -8.335
   13   2HA   GLY  58          HA3       GLY  58   9.774   6.217 -10.035
   14    H    GLN  59           H        GLN  59  12.554   4.659  -8.467
   15    HA   GLN  59           HA       GLN  59  11.745   2.034  -9.300
   16   1HB   GLN  59          HB2       GLN  59  13.525   1.612 -10.875
   17   2HB   GLN  59          HB3       GLN  59  12.599   3.002 -11.423
   18   1HG   GLN  59          HG2       GLN  59  14.384   4.419 -10.270
   19   2HG   GLN  59          HG3       GLN  59  15.338   2.937 -10.212
   20   1HE2  GLN  59          HE21      GLN  59  15.244   1.745 -12.447
   21   2HE2  GLN  59          HE22      GLN  59  15.621   2.747 -13.802
   22    HA   PRO  60           HA       PRO  60  14.400   0.919  -5.966
   23   1HB   PRO  60          HB2       PRO  60  15.169  -1.587  -6.680
   24   2HB   PRO  60          HB3       PRO  60  13.542  -1.208  -6.105
   25   1HG   PRO  60          HG2       PRO  60  14.524  -1.569  -8.908
   26   2HG   PRO  60          HG3       PRO  60  13.029  -2.161  -8.161
   27   1HD   PRO  60          HD2       PRO  60  13.096   0.031  -9.749
   28   2HD   PRO  60          HD3       PRO  60  11.960  -0.133  -8.395
   29    H    HIS  61           H        HIS  61  16.556   0.794  -5.351
   30    HA   HIS  61           HA       HIS  61  18.469   1.461  -7.452
   31   1HB   HIS  61          HB2       HIS  61  19.967   2.031  -5.515
   32   2HB   HIS  61          HB3       HIS  61  18.483   2.976  -5.594
   33    HD1  HIS  61           HD1      HIS  61  20.311   0.537  -3.484
   34    HD2  HIS  61           HD2      HIS  61  16.587   2.379  -3.563
   35    HE1  HIS  61           HE1      HIS  61  19.312   0.130  -1.213
   36    HE2  HIS  61           HE2      HIS  61  17.024   1.181  -1.312
   37    H    GLY  62           H        GLY  62  17.757  -1.033  -5.112
   38   1HA   GLY  62          HA2       GLY  62  19.421  -2.912  -6.473
   39   2HA   GLY  62          HA3       GLY  62  20.142  -2.406  -4.952
   40    H    GLY  63           H        GLY  63  16.684  -2.715  -5.514
   41   1HA   GLY  63          HA2       GLY  63  16.380  -5.338  -4.517
   42   2HA   GLY  63          HA3       GLY  63  16.213  -4.197  -3.192
   43    H    GLY  64           H        GLY  64  14.506  -2.624  -3.287
   44   1HA   GLY  64          HA2       GLY  64  12.521  -2.755  -5.355
   45   2HA   GLY  64          HA3       GLY  64  12.020  -3.603  -3.899
   46    H    TRP  65           H        TRP  65  10.289  -2.059  -3.780
   47    HA   TRP  65           HA       TRP  65  11.075   0.310  -2.280
   48   1HB   TRP  65          HB2       TRP  65   9.129   1.453  -3.763
   49   2HB   TRP  65          HB3       TRP  65  10.840   1.572  -4.159
   50    HD1  TRP  65           HD1      TRP  65  11.664  -0.605  -5.876
   51    HE1  TRP  65           HE1      TRP  65  10.461  -1.395  -8.003
   52    HE3  TRP  65           HE3      TRP  65   7.027   1.334  -4.945
   53    HZ2  TRP  65           HZ2      TRP  65   7.883  -1.213  -9.145
   54    HZ3  TRP  65           HZ3      TRP  65   5.248   0.982  -6.609
   55    HH2  TRP  65           HH2      TRP  65   5.668  -0.265  -8.665
   56    H    GLY  66           H        GLY  66   8.001  -0.557  -3.796
   57   1HA   GLY  66          HA2       GLY  66   6.875  -0.897  -1.084
   58   2HA   GLY  66          HA3       GLY  66   5.989  -0.173  -2.418
   59    H    GLN  67           H        GLN  67   7.920  -2.799  -3.370
   60    HA   GLN  67           HA       GLN  67   5.584  -4.380  -3.949
   61   1HB   GLN  67          HB2       GLN  67   7.099  -5.863  -5.108
   62   2HB   GLN  67          HB3       GLN  67   7.501  -4.202  -5.517
   63   1HG   GLN  67          HG2       GLN  67   9.325  -4.279  -3.848
   64   2HG   GLN  67          HG3       GLN  67   8.955  -5.983  -3.576
   65   1HE2  GLN  67          HE21      GLN  67   9.275  -3.931  -6.458
   66   2HE2  GLN  67          HE22      GLN  67  10.411  -4.951  -7.267
   67    HA   PRO  68           HA       PRO  68   5.619  -7.055  -0.449
   68   1HB   PRO  68          HB2       PRO  68   4.869  -9.427  -1.551
   69   2HB   PRO  68          HB3       PRO  68   3.751  -8.083  -1.296
   70   1HG   PRO  68          HG2       PRO  68   5.170  -8.920  -3.794
   71   2HG   PRO  68          HG3       PRO  68   3.490  -8.391  -3.584
   72   1HD   PRO  68          HD2       PRO  68   5.422  -6.752  -4.529
   73   2HD   PRO  68          HD3       PRO  68   4.065  -6.159  -3.552
   74    H    HIS  69           H        HIS  69   6.848  -8.600   0.623
   75    HA   HIS  69           HA       HIS  69   9.332  -9.337  -0.732
   76   1HB   HIS  69          HB2       HIS  69   9.498  -8.162   1.426
   77   2HB   HIS  69          HB3       HIS  69   8.599  -9.460   2.202
   78    HD1  HIS  69           HD1      HIS  69  10.773  -9.667   3.743
   79    HD2  HIS  69           HD2      HIS  69  11.258 -10.746  -0.240
   80    HE1  HIS  69           HE1      HIS  69  12.912 -10.988   3.660
   81    HE2  HIS  69           HE2      HIS  69  13.228 -11.558   1.226
   82    H    GLY  70           H        GLY  70   6.489 -10.742   0.724
   83   1HA   GLY  70          HA2       GLY  70   6.953 -13.250  -0.553
   84   2HA   GLY  70          HA3       GLY  70   7.278 -13.351   1.171
   85    H    GLY  71           H        GLY  71   4.804 -11.372  -0.395
   86   1HA   GLY  71          HA2       GLY  71   2.635 -13.116  -0.078
   87   2HA   GLY  71          HA3       GLY  71   2.781 -12.170   1.396
   88    H    GLY  72           H        GLY  72   2.633  -9.841   1.232
   89   1HA   GLY  72          HA2       GLY  72   1.823  -8.595  -1.212
   90   2HA   GLY  72          HA3       GLY  72   0.446  -8.929  -0.171
   91    H    TRP  73           H        TRP  73   0.113  -6.640  -0.085
   92    HA   TRP  73           HA       TRP  73   1.625  -5.409   2.075
   93   1HB   TRP  73          HB2       TRP  73   1.442  -3.234   0.488
   94   2HB   TRP  73          HB3       TRP  73   2.869  -4.263   0.553
   95    HD1  TRP  73           HD1      TRP  73   2.713  -6.393  -1.390
   96    HE1  TRP  73           HE1      TRP  73   2.082  -6.147  -3.867
   97    HE3  TRP  73           HE3      TRP  73   0.248  -1.922  -1.151
   98    HZ2  TRP  73           HZ2      TRP  73   0.723  -4.293  -5.511
   99    HZ3  TRP  73           HZ3      TRP  73  -0.686  -0.979  -3.224
  100    HH2  TRP  73           HH2      TRP  73  -0.452  -2.143  -5.358
  101    H    GLY  74           H        GLY  74  -0.601  -4.041  -0.307
  102   1HA   GLY  74          HA2       GLY  74  -2.444  -3.423   1.910
  103   2HA   GLY  74          HA3       GLY  74  -2.318  -2.499   0.421
  104    H    GLN  75           H        GLN  75  -2.141  -5.205  -1.022
  105    HA   GLN  75           HA       GLN  75  -4.812  -5.346  -1.840
  106   1HB   GLN  75          HB2       GLN  75  -4.179  -7.337  -3.058
  107   2HB   GLN  75          HB3       GLN  75  -2.883  -6.154  -3.171
  108   1HG   GLN  75          HG2       GLN  75  -1.816  -7.397  -1.216
  109   2HG   GLN  75          HG3       GLN  75  -2.973  -8.681  -1.565
  110   1HE2  GLN  75          HE21      GLN  75   0.009  -7.314  -2.350
  111   2HE2  GLN  75          HE22      GLN  75   0.363  -8.269  -3.744
  112    HA   PRO  76           HA       PRO  76  -6.851  -7.821   1.181
  113   1HB   PRO  76          HB2       PRO  76  -8.535  -9.306  -0.362
  114   2HB   PRO  76          HB3       PRO  76  -8.794  -7.592  -0.016
  115   1HG   PRO  76          HG2       PRO  76  -7.610  -8.877  -2.446
  116   2HG   PRO  76          HG3       PRO  76  -8.766  -7.536  -2.341
  117   1HD   PRO  76          HD2       PRO  76  -6.135  -7.137  -2.795
  118   2HD   PRO  76          HD3       PRO  76  -7.118  -5.990  -1.863
  119    H    HIS  77           H        HIS  77  -6.908  -9.881   2.107
  120    HA   HIS  77           HA       HIS  77  -5.081 -11.819   0.864
  121   1HB   HIS  77          HB2       HIS  77  -4.727 -10.778   3.246
  122   2HB   HIS  77          HB3       HIS  77  -5.929 -11.969   3.734
  123    HD1  HIS  77           HD1      HIS  77  -3.343 -12.413   5.016
  124    HD2  HIS  77           HD2      HIS  77  -4.115 -13.867   1.201
  125    HE1  HIS  77           HE1      HIS  77  -1.706 -14.289   4.668
  126    HE2  HIS  77           HE2      HIS  77  -2.250 -15.210   2.388
  127    H    GLY  78           H        GLY  78  -8.291 -11.397   2.180
  128   1HA   GLY  78          HA2       GLY  78  -8.939 -14.131   1.268
  129   2HA   GLY  78          HA3       GLY  78  -9.578 -13.489   2.773
  130    H    GLY  79           H        GLY  79  -9.227 -11.514  -0.088
  131   1HA   GLY  79          HA2       GLY  79 -10.884 -11.024  -1.716
  132   2HA   GLY  79          HA3       GLY  79 -12.086 -11.779  -0.681
  133    H    GLY  80           H        GLY  80 -10.369  -8.867  -1.441
  134   1HA   GLY  80          HA2       GLY  80 -10.769  -6.674  -0.891
  135   2HA   GLY  80          HA3       GLY  80 -12.379  -7.195  -0.414
  136    H    TRP  81           H        TRP  81 -11.916  -5.387   1.158
  137    HA   TRP  81           HA       TRP  81 -11.010  -6.578   3.654
  138   1HB   TRP  81          HB2       TRP  81  -9.895  -4.148   4.006
  139   2HB   TRP  81          HB3       TRP  81  -8.999  -5.541   3.411
  140    HD1  TRP  81           HD1      TRP  81  -9.116  -5.695   0.522
  141    HE1  TRP  81           HE1      TRP  81  -8.667  -3.766  -1.114
  142    HE3  TRP  81           HE3      TRP  81  -9.888  -1.757   3.688
  143    HZ2  TRP  81           HZ2      TRP  81  -8.635  -0.941  -1.069
  144    HZ3  TRP  81           HZ3      TRP  81  -9.626   0.528   2.813
  145    HH2  TRP  81           HH2      TRP  81  -9.012   0.925   0.484
  146    H    GLY  82           H        GLY  82 -11.636  -3.211   2.768
  147   1HA   GLY  82          HA2       GLY  82 -13.964  -3.275   4.586
  148   2HA   GLY  82          HA3       GLY  82 -12.922  -1.876   4.379
  149    H    GLN  83           H        GLN  83 -13.529  -3.517   1.469
  150    HA   GLN  83           HA       GLN  83 -15.283  -1.350   0.608
  151   1HB   GLN  83          HB2       GLN  83 -14.786  -2.067  -1.650
  152   2HB   GLN  83          HB3       GLN  83 -13.287  -1.917  -0.742
  153   1HG   GLN  83          HG2       GLN  83 -13.431  -4.408  -0.347
  154   2HG   GLN  83          HG3       GLN  83 -14.723  -4.427  -1.548
  155   1HE2  GLN  83          HE21      GLN  83 -14.047  -3.066  -3.578
  156   2HE2  GLN  83          HE22      GLN  83 -12.503  -3.485  -4.231
  157    HA   PRO  84           HA       PRO  84 -18.990  -3.727   0.569
  158   1HB   PRO  84          HB2       PRO  84 -20.196  -2.831  -1.711
  159   2HB   PRO  84          HB3       PRO  84 -20.129  -1.901  -0.212
  160   1HG   PRO  84          HG2       PRO  84 -18.412  -1.687  -2.653
  161   2HG   PRO  84          HG3       PRO  84 -19.112  -0.395  -1.658
  162   1HD   PRO  84          HD2       PRO  84 -16.530  -1.139  -1.432
  163   2HD   PRO  84          HD3       PRO  84 -17.478  -0.586  -0.036
  164    H    HIS  85           H        HIS  85 -19.895  -5.579  -0.285
  165    HA   HIS  85           HA       HIS  85 -18.335  -6.867  -2.406
  166   1HB   HIS  85          HB2       HIS  85 -19.961  -7.869  -0.108
  167   2HB   HIS  85          HB3       HIS  85 -19.776  -8.901  -1.522
  168    HD1  HIS  85           HD1      HIS  85 -18.418  -8.784   1.597
  169    HD2  HIS  85           HD2      HIS  85 -16.653  -8.613  -2.161
  170    HE1  HIS  85           HE1      HIS  85 -16.032  -9.497   1.942
  171    HE2  HIS  85           HE2      HIS  85 -14.961  -9.304  -0.331
  172    H    GLY  86           H        GLY  86 -21.553  -5.793  -1.582
  173   1HA   GLY  86          HA2       GLY  86 -22.538  -6.833  -4.162
  174   2HA   GLY  86          HA3       GLY  86 -23.556  -6.490  -2.772
  175    H    GLY  87           H        GLY  87 -22.088  -3.952  -2.248
  176   1HA   GLY  87          HA2       GLY  87 -22.143  -2.204  -4.409
  177   2HA   GLY  87          HA3       GLY  87 -23.774  -2.239  -3.754
  178    H    GLY  88           H        GLY  88 -23.206  -2.487  -1.032
  179   1HA   GLY  88          HA2       GLY  88 -21.394  -0.327  -0.313
  180   2HA   GLY  88          HA3       GLY  88 -23.102   0.002  -0.056
  181    H    TRP  89           H        TRP  89 -22.510   0.239   2.193
  182    HA   TRP  89           HA       TRP  89 -22.706  -2.304   3.597
  183   1HB   TRP  89          HB2       TRP  89 -20.908  -1.135   5.233
  184   2HB   TRP  89          HB3       TRP  89 -20.460  -2.266   3.962
  185    HD1  TRP  89           HD1      TRP  89 -19.945  -0.883   1.473
  186    HE1  TRP  89           HE1      TRP  89 -18.470   1.198   1.174
  187    HE3  TRP  89           HE3      TRP  89 -19.973   0.823   6.292
  188    HZ2  TRP  89           HZ2      TRP  89 -17.441   3.288   2.772
  189    HZ3  TRP  89           HZ3      TRP  89 -18.714   2.870   6.824
  190    HH2  TRP  89           HH2      TRP  89 -17.475   4.075   5.099
  191    H    GLY  90           H        GLY  90 -21.849   0.925   4.753
  192   1HA   GLY  90          HA2       GLY  90 -24.539   1.199   5.906
  193   2HA   GLY  90          HA3       GLY  90 -23.136   1.338   6.954
  194    H    GLN  91           H        GLN  91 -22.873   2.502   3.718
  195    HA   GLN  91           HA       GLN  91 -22.250   5.131   4.582
  196   1HB   GLN  91          HB2       GLN  91 -22.975   4.437   1.750
  197   2HB   GLN  91          HB3       GLN  91 -21.807   5.617   2.329
  198   1HG   GLN  91          HG2       GLN  91 -20.488   3.632   3.220
  199   2HG   GLN  91          HG3       GLN  91 -21.552   2.630   2.232
  200   1HE2  GLN  91          HE21      GLN  91 -19.887   5.733   1.765
  201   2HE2  GLN  91          HE22      GLN  91 -19.130   5.297   0.274
  Start of MODEL   17
    1    H    TRP  57           H        TRP  57  10.563   8.586  -3.727
    2    HA   TRP  57           HA       TRP  57  13.332   7.850  -4.350
    3   1HB   TRP  57          HB2       TRP  57  11.748   6.926  -2.428
    4   2HB   TRP  57          HB3       TRP  57  11.085   5.975  -3.752
    5    HD1  TRP  57           HD1      TRP  57  12.063   3.623  -3.483
    6    HE1  TRP  57           HE1      TRP  57  14.414   2.636  -3.132
    7    HE3  TRP  57           HE3      TRP  57  14.690   7.971  -2.902
    8    HZ2  TRP  57           HZ2      TRP  57  17.035   3.576  -2.669
    9    HZ3  TRP  57           HZ3      TRP  57  17.116   7.839  -2.509
   10    HH2  TRP  57           HH2      TRP  57  18.262   5.687  -2.394
   11    H    GLY  58           H        GLY  58  13.765   6.726  -6.208
   12   1HA   GLY  58          HA2       GLY  58  11.548   6.548  -8.156
   13   2HA   GLY  58          HA3       GLY  58  13.190   6.983  -8.602
   14    H    GLN  59           H        GLN  59  14.471   5.013  -6.930
   15    HA   GLN  59           HA       GLN  59  13.498   2.460  -7.943
   16   1HB   GLN  59          HB2       GLN  59  15.603   1.859  -8.971
   17   2HB   GLN  59          HB3       GLN  59  15.014   3.350  -9.693
   18   1HG   GLN  59          HG2       GLN  59  16.534   4.551  -8.037
   19   2HG   GLN  59          HG3       GLN  59  17.274   2.976  -7.761
   20   1HE2  GLN  59          HE21      GLN  59  18.396   5.421  -8.912
   21   2HE2  GLN  59          HE22      GLN  59  18.979   4.983 -10.479
   22    HA   PRO  60           HA       PRO  60  14.938   0.951  -4.064
   23   1HB   PRO  60          HB2       PRO  60  15.687  -1.591  -4.701
   24   2HB   PRO  60          HB3       PRO  60  14.002  -1.082  -4.556
   25   1HG   PRO  60          HG2       PRO  60  15.674  -1.426  -7.013
   26   2HG   PRO  60          HG3       PRO  60  13.985  -1.891  -6.733
   27   1HD   PRO  60          HD2       PRO  60  14.666   0.337  -8.104
   28   2HD   PRO  60          HD3       PRO  60  13.204   0.248  -7.101
   29    H    HIS  61           H        HIS  61  16.800   0.519  -2.858
   30    HA   HIS  61           HA       HIS  61  19.301   1.072  -4.274
   31   1HB   HIS  61          HB2       HIS  61  20.194   1.462  -1.946
   32   2HB   HIS  61          HB3       HIS  61  18.921   2.568  -2.453
   33    HD1  HIS  61           HD1      HIS  61  19.199  -0.673  -0.473
   34    HD2  HIS  61           HD2      HIS  61  16.959   2.823  -0.612
   35    HE1  HIS  61           HE1      HIS  61  17.635  -0.799   1.492
   36    HE2  HIS  61           HE2      HIS  61  16.231   1.288   1.338
   37    H    GLY  62           H        GLY  62  17.701  -1.362  -2.348
   38   1HA   GLY  62          HA2       GLY  62  19.447  -3.409  -3.239
   39   2HA   GLY  62          HA3       GLY  62  19.853  -2.951  -1.593
   40    H    GLY  63           H        GLY  63  16.605  -2.931  -2.952
   41   1HA   GLY  63          HA2       GLY  63  15.836  -5.485  -1.986
   42   2HA   GLY  63          HA3       GLY  63  15.418  -4.248  -0.811
   43    H    GLY  64           H        GLY  64  14.112  -2.396  -1.653
   44   1HA   GLY  64          HA2       GLY  64  12.714  -2.530  -4.092
   45   2HA   GLY  64          HA3       GLY  64  11.756  -3.332  -2.854
   46    H    TRP  65           H        TRP  65  10.170  -1.676  -3.251
   47    HA   TRP  65           HA       TRP  65  10.620   0.650  -1.558
   48   1HB   TRP  65          HB2       TRP  65   9.281   1.901  -3.540
   49   2HB   TRP  65          HB3       TRP  65  11.036   1.906  -3.409
   50    HD1  TRP  65           HD1      TRP  65  12.190  -0.338  -4.825
   51    HE1  TRP  65           HE1      TRP  65  11.623  -1.069  -7.220
   52    HE3  TRP  65           HE3      TRP  65   7.622   1.909  -5.294
   53    HZ2  TRP  65           HZ2      TRP  65   9.519  -0.731  -9.076
   54    HZ3  TRP  65           HZ3      TRP  65   6.399   1.657  -7.415
   55    HH2  TRP  65           HH2      TRP  65   7.329   0.364  -9.265
   56    H    GLY  66           H        GLY  66   8.100  -0.073  -3.931
   57   1HA   GLY  66          HA2       GLY  66   6.143  -0.049  -1.733
   58   2HA   GLY  66          HA3       GLY  66   5.783   0.297  -3.418
   59    H    GLN  67           H        GLN  67   7.551  -2.099  -4.124
   60    HA   GLN  67           HA       GLN  67   5.462  -3.975  -4.402
   61   1HB   GLN  67          HB2       GLN  67   7.129  -5.451  -5.338
   62   2HB   GLN  67          HB3       GLN  67   7.422  -3.818  -5.918
   63   1HG   GLN  67          HG2       GLN  67   9.114  -3.634  -4.018
   64   2HG   GLN  67          HG3       GLN  67   8.967  -5.386  -3.887
   65   1HE2  GLN  67          HE21      GLN  67   9.105  -6.484  -6.137
   66   2HE2  GLN  67          HE22      GLN  67  10.428  -5.968  -7.120
   67    HA   PRO  68           HA       PRO  68   5.559  -6.228  -0.616
   68   1HB   PRO  68          HB2       PRO  68   5.006  -8.752  -1.455
   69   2HB   PRO  68          HB3       PRO  68   3.793  -7.468  -1.400
   70   1HG   PRO  68          HG2       PRO  68   5.370  -8.485  -3.731
   71   2HG   PRO  68          HG3       PRO  68   3.649  -8.064  -3.642
   72   1HD   PRO  68          HD2       PRO  68   5.497  -6.402  -4.709
   73   2HD   PRO  68          HD3       PRO  68   4.062  -5.805  -3.851
   74    H    HIS  69           H        HIS  69   7.077  -7.124   0.653
   75    HA   HIS  69           HA       HIS  69   9.500  -8.135  -0.617
   76   1HB   HIS  69          HB2       HIS  69  10.399  -8.033   1.753
   77   2HB   HIS  69          HB3       HIS  69   9.933  -6.490   1.044
   78    HD1  HIS  69           HD1      HIS  69   8.478  -9.112   3.380
   79    HD2  HIS  69           HD2      HIS  69   8.241  -5.040   2.590
   80    HE1  HIS  69           HE1      HIS  69   6.998  -8.164   5.177
   81    HE2  HIS  69           HE2      HIS  69   6.940  -5.685   4.731
   82    H    GLY  70           H        GLY  70   6.829  -9.204   1.355
   83   1HA   GLY  70          HA2       GLY  70   7.977 -11.928   1.325
   84   2HA   GLY  70          HA3       GLY  70   7.045 -11.309   2.680
   85    H    GLY  71           H        GLY  71   5.019  -9.998   1.166
   86   1HA   GLY  71          HA2       GLY  71   3.807 -12.120  -0.441
   87   2HA   GLY  71          HA3       GLY  71   2.962 -11.636   1.020
   88    H    GLY  72           H        GLY  72   2.101  -9.503   1.159
   89   1HA   GLY  72          HA2       GLY  72   1.903  -8.113  -1.441
   90   2HA   GLY  72          HA3       GLY  72   0.472  -8.435  -0.471
   91    H    TRP  73           H        TRP  73   0.052  -6.180  -0.444
   92    HA   TRP  73           HA       TRP  73   1.450  -4.815   1.713
   93   1HB   TRP  73          HB2       TRP  73   1.234  -2.705   0.045
   94   2HB   TRP  73          HB3       TRP  73   2.694  -3.678   0.184
   95    HD1  TRP  73           HD1      TRP  73   2.659  -5.882  -1.684
   96    HE1  TRP  73           HE1      TRP  73   2.091  -5.742  -4.184
   97    HE3  TRP  73           HE3      TRP  73   0.051  -1.486  -1.673
   98    HZ2  TRP  73           HZ2      TRP  73   0.723  -3.993  -5.931
   99    HZ3  TRP  73           HZ3      TRP  73  -0.852  -0.647  -3.802
  100    HH2  TRP  73           HH2      TRP  73  -0.522  -1.875  -5.886
  101    H    GLY  74           H        GLY  74  -0.757  -3.624  -0.781
  102   1HA   GLY  74          HA2       GLY  74  -2.646  -2.900   1.351
  103   2HA   GLY  74          HA3       GLY  74  -2.586  -2.177  -0.250
  104    H    GLN  75           H        GLN  75  -2.268  -5.051  -1.308
  105    HA   GLN  75           HA       GLN  75  -4.928  -5.439  -2.075
  106   1HB   GLN  75          HB2       GLN  75  -4.201  -7.556  -2.992
  107   2HB   GLN  75          HB3       GLN  75  -2.963  -6.342  -3.286
  108   1HG   GLN  75          HG2       GLN  75  -1.856  -7.241  -1.157
  109   2HG   GLN  75          HG3       GLN  75  -2.932  -8.625  -1.352
  110   1HE2  GLN  75          HE21      GLN  75  -0.640  -6.650  -3.201
  111   2HE2  GLN  75          HE22      GLN  75   0.034  -7.963  -4.099
  112    HA   PRO  76           HA       PRO  76  -6.861  -7.528   1.286
  113   1HB   PRO  76          HB2       PRO  76  -8.452  -9.319  -0.021
  114   2HB   PRO  76          HB3       PRO  76  -8.810  -7.593   0.083
  115   1HG   PRO  76          HG2       PRO  76  -7.554  -9.137  -2.151
  116   2HG   PRO  76          HG3       PRO  76  -8.776  -7.854  -2.224
  117   1HD   PRO  76          HD2       PRO  76  -6.170  -7.389  -2.748
  118   2HD   PRO  76          HD3       PRO  76  -7.210  -6.175  -1.977
  119    H    HIS  77           H        HIS  77  -6.858  -9.446   2.498
  120    HA   HIS  77           HA       HIS  77  -4.946 -11.472   1.544
  121   1HB   HIS  77          HB2       HIS  77  -4.735 -12.003   4.033
  122   2HB   HIS  77          HB3       HIS  77  -4.056 -10.470   3.493
  123    HD1  HIS  77           HD1      HIS  77  -5.579  -8.311   4.008
  124    HD2  HIS  77           HD2      HIS  77  -6.589 -11.800   6.026
  125    HE1  HIS  77           HE1      HIS  77  -7.042  -7.581   5.918
  126    HE2  HIS  77           HE2      HIS  77  -7.570  -9.700   7.176
  127    H    GLY  78           H        GLY  78  -8.134 -10.942   2.863
  128   1HA   GLY  78          HA2       GLY  78  -8.709 -13.802   2.421
  129   2HA   GLY  78          HA3       GLY  78  -9.282 -12.982   3.866
  130    H    GLY  79           H        GLY  79  -9.198 -11.338   0.795
  131   1HA   GLY  79          HA2       GLY  79 -11.000 -11.235  -0.790
  132   2HA   GLY  79          HA3       GLY  79 -12.095 -11.755   0.482
  133    H    GLY  80           H        GLY  80 -10.520  -9.079  -1.028
  134   1HA   GLY  80          HA2       GLY  80 -10.842  -6.811  -0.859
  135   2HA   GLY  80          HA3       GLY  80 -12.411  -7.206  -0.170
  136    H    TRP  81           H        TRP  81 -11.803  -5.123   0.968
  137    HA   TRP  81           HA       TRP  81 -10.725  -5.821   3.580
  138   1HB   TRP  81          HB2       TRP  81  -9.557  -3.402   3.359
  139   2HB   TRP  81          HB3       TRP  81  -8.725  -4.908   2.988
  140    HD1  TRP  81           HD1      TRP  81  -9.056  -5.625   0.207
  141    HE1  TRP  81           HE1      TRP  81  -8.719  -4.068  -1.809
  142    HE3  TRP  81           HE3      TRP  81  -9.567  -1.121   2.571
  143    HZ2  TRP  81           HZ2      TRP  81  -8.668  -1.292  -2.331
  144    HZ3  TRP  81           HZ3      TRP  81  -9.357   0.938   1.241
  145    HH2  TRP  81           HH2      TRP  81  -8.916   0.853  -1.159
  146    H    GLY  82           H        GLY  82 -11.403  -2.700   2.056
  147   1HA   GLY  82          HA2       GLY  82 -13.425  -2.221   4.140
  148   2HA   GLY  82          HA3       GLY  82 -12.563  -0.971   3.257
  149    H    GLN  83           H        GLN  83 -13.047  -2.646   0.739
  150    HA   GLN  83           HA       GLN  83 -15.245  -1.221  -0.231
  151   1HB   GLN  83          HB2       GLN  83 -15.145  -2.694  -2.171
  152   2HB   GLN  83          HB3       GLN  83 -13.525  -2.221  -1.676
  153   1HG   GLN  83          HG2       GLN  83 -13.399  -4.413  -0.434
  154   2HG   GLN  83          HG3       GLN  83 -14.883  -4.867  -1.273
  155   1HE2  GLN  83          HE21      GLN  83 -11.510  -4.026  -1.675
  156   2HE2  GLN  83          HE22      GLN  83 -11.318  -4.740  -3.236
  157    HA   PRO  84           HA       PRO  84 -18.872  -3.290   1.150
  158   1HB   PRO  84          HB2       PRO  84 -20.334  -3.406  -1.191
  159   2HB   PRO  84          HB3       PRO  84 -20.229  -1.993  -0.139
  160   1HG   PRO  84          HG2       PRO  84 -18.743  -2.597  -2.657
  161   2HG   PRO  84          HG3       PRO  84 -19.415  -1.057  -2.090
  162   1HD   PRO  84          HD2       PRO  84 -16.790  -1.598  -1.920
  163   2HD   PRO  84          HD3       PRO  84 -17.629  -0.658  -0.669
  164    H    HIS  85           H        HIS  85 -20.106  -5.251   0.970
  165    HA   HIS  85           HA       HIS  85 -18.693  -7.348  -0.540
  166   1HB   HIS  85          HB2       HIS  85 -19.706  -8.895   1.222
  167   2HB   HIS  85          HB3       HIS  85 -18.417  -7.824   1.760
  168    HD1  HIS  85           HD1      HIS  85 -18.946  -6.258   3.649
  169    HD2  HIS  85           HD2      HIS  85 -22.342  -8.047   2.057
  170    HE1  HIS  85           HE1      HIS  85 -20.826  -5.625   5.194
  171    HE2  HIS  85           HE2      HIS  85 -22.855  -6.792   4.260
  172    H    GLY  86           H        GLY  86 -21.795  -5.949   0.257
  173   1HA   GLY  86          HA2       GLY  86 -23.073  -7.845  -1.617
  174   2HA   GLY  86          HA3       GLY  86 -23.903  -7.118  -0.250
  175    H    GLY  87           H        GLY  87 -21.741  -5.113  -2.042
  176   1HA   GLY  87          HA2       GLY  87 -22.264  -3.764  -3.948
  177   2HA   GLY  87          HA3       GLY  87 -23.969  -4.019  -3.617
  178    H    GLY  88           H        GLY  88 -22.261  -3.364  -0.777
  179   1HA   GLY  88          HA2       GLY  88 -21.779  -0.691  -0.670
  180   2HA   GLY  88          HA3       GLY  88 -23.532  -0.786  -0.547
  181    H    TRP  89           H        TRP  89 -22.884   0.319   1.528
  182    HA   TRP  89           HA       TRP  89 -22.886  -1.659   3.653
  183   1HB   TRP  89          HB2       TRP  89 -21.115  -0.072   4.824
  184   2HB   TRP  89          HB3       TRP  89 -20.596  -1.388   3.775
  185    HD1  TRP  89           HD1      TRP  89 -20.349  -0.478   1.036
  186    HE1  TRP  89           HE1      TRP  89 -19.120   1.624   0.241
  187    HE3  TRP  89           HE3      TRP  89 -20.312   2.127   5.428
  188    HZ2  TRP  89           HZ2      TRP  89 -18.227   4.075   1.338
  189    HZ3  TRP  89           HZ3      TRP  89 -19.246   4.345   5.473
  190    HH2  TRP  89           HH2      TRP  89 -18.225   5.297   3.469
  191    H    GLY  90           H        GLY  90 -22.486   1.823   3.163
  192   1HA   GLY  90          HA2       GLY  90 -25.026   2.353   4.474
  193   2HA   GLY  90          HA3       GLY  90 -23.597   2.955   5.306
  194    H    GLN  91           H        GLN  91 -22.029   3.728   3.181
  195    HA   GLN  91           HA       GLN  91 -21.608   5.664   2.040
  196   1HB   GLN  91          HB2       GLN  91 -24.159   5.317   0.545
  197   2HB   GLN  91          HB3       GLN  91 -22.539   5.634  -0.058
  198   1HG   GLN  91          HG2       GLN  91 -21.903   3.351   0.250
  199   2HG   GLN  91          HG3       GLN  91 -23.416   2.990   1.082
  200   1HE2  GLN  91          HE21      GLN  91 -25.317   2.821  -0.111
  201   2HE2  GLN  91          HE22      GLN  91 -25.309   2.606  -1.825
  Start of MODEL   18
    1    H    TRP  57           H        TRP  57   8.901   3.593 -13.055
    2    HA   TRP  57           HA       TRP  57  10.612   3.539 -11.397
    3   1HB   TRP  57          HB2       TRP  57   8.929   2.596  -9.684
    4   2HB   TRP  57          HB3       TRP  57   9.306   1.022 -10.376
    5    HD1  TRP  57           HD1      TRP  57  10.882  -0.170  -8.755
    6    HE1  TRP  57           HE1      TRP  57  12.988   0.469  -7.420
    7    HE3  TRP  57           HE3      TRP  57  11.113   4.801  -9.930
    8    HZ2  TRP  57           HZ2      TRP  57  14.542   2.774  -6.931
    9    HZ3  TRP  57           HZ3      TRP  57  12.940   6.151  -8.987
   10    HH2  TRP  57           HH2      TRP  57  14.619   5.158  -7.518
   11    H    GLY  58           H        GLY  58  12.464   2.291 -11.809
   12   1HA   GLY  58          HA2       GLY  58  12.134   0.423 -14.061
   13   2HA   GLY  58          HA3       GLY  58  13.593   1.336 -13.704
   14    H    GLN  59           H        GLN  59  13.912   0.801 -11.009
   15    HA   GLN  59           HA       GLN  59  13.713  -1.960 -10.392
   16   1HB   GLN  59          HB2       GLN  59  16.032  -2.617 -10.580
   17   2HB   GLN  59          HB3       GLN  59  15.458  -2.075 -12.150
   18   1HG   GLN  59          HG2       GLN  59  16.475   0.193 -11.514
   19   2HG   GLN  59          HG3       GLN  59  17.327  -0.704 -10.257
   20   1HE2  GLN  59          HE21      GLN  59  18.506   0.694 -12.440
   21   2HE2  GLN  59          HE22      GLN  59  19.353  -0.464 -13.401
   22    HA   PRO  60           HA       PRO  60  14.475  -0.352  -6.361
   23   1HB   PRO  60          HB2       PRO  60  15.574  -2.501  -5.103
   24   2HB   PRO  60          HB3       PRO  60  13.856  -2.385  -5.496
   25   1HG   PRO  60          HG2       PRO  60  16.040  -3.824  -6.953
   26   2HG   PRO  60          HG3       PRO  60  14.389  -4.364  -6.594
   27   1HD   PRO  60          HD2       PRO  60  15.097  -3.409  -9.019
   28   2HD   PRO  60          HD3       PRO  60  13.479  -3.153  -8.336
   29    H    HIS  61           H        HIS  61  16.098   0.405  -4.954
   30    HA   HIS  61           HA       HIS  61  18.783   0.414  -6.145
   31   1HB   HIS  61          HB2       HIS  61  17.699   2.612  -5.843
   32   2HB   HIS  61          HB3       HIS  61  17.575   2.304  -4.114
   33    HD1  HIS  61           HD1      HIS  61  19.018   4.558  -3.929
   34    HD2  HIS  61           HD2      HIS  61  20.971   1.261  -5.535
   35    HE1  HIS  61           HE1      HIS  61  21.470   5.103  -3.806
   36    HE2  HIS  61           HE2      HIS  61  22.635   3.058  -4.705
   37    H    GLY  62           H        GLY  62  17.000  -0.342  -3.236
   38   1HA   GLY  62          HA2       GLY  62  19.504  -1.379  -2.056
   39   2HA   GLY  62          HA3       GLY  62  18.252  -0.618  -1.087
   40    H    GLY  63           H        GLY  63  15.981  -1.783  -2.212
   41   1HA   GLY  63          HA2       GLY  63  16.135  -4.588  -2.467
   42   2HA   GLY  63          HA3       GLY  63  15.808  -4.183  -0.788
   43    H    GLY  64           H        GLY  64  14.546  -4.308  -4.009
   44   1HA   GLY  64          HA2       GLY  64  12.393  -4.225  -4.805
   45   2HA   GLY  64          HA3       GLY  64  11.876  -4.500  -3.147
   46    H    TRP  65           H        TRP  65  10.104  -3.071  -4.034
   47    HA   TRP  65           HA       TRP  65  10.640  -0.345  -3.178
   48   1HB   TRP  65          HB2       TRP  65   9.148   0.275  -5.332
   49   2HB   TRP  65          HB3       TRP  65  10.908   0.287  -5.350
   50    HD1  TRP  65           HD1      TRP  65  11.967  -2.279  -6.141
   51    HE1  TRP  65           HE1      TRP  65  11.204  -3.682  -8.153
   52    HE3  TRP  65           HE3      TRP  65   7.335  -0.231  -6.845
   53    HZ2  TRP  65           HZ2      TRP  65   8.938  -3.890  -9.829
   54    HZ3  TRP  65           HZ3      TRP  65   5.934  -1.088  -8.677
   55    HH2  TRP  65           HH2      TRP  65   6.721  -2.880 -10.137
   56    H    GLY  66           H        GLY  66   7.978  -1.788  -5.011
   57   1HA   GLY  66          HA2       GLY  66   6.189  -1.096  -2.775
   58   2HA   GLY  66          HA3       GLY  66   5.695  -1.225  -4.456
   59    H    GLN  67           H        GLN  67   7.420  -3.739  -4.625
   60    HA   GLN  67           HA       GLN  67   5.367  -5.609  -4.280
   61   1HB   GLN  67          HB2       GLN  67   7.028  -7.299  -4.752
   62   2HB   GLN  67          HB3       GLN  67   7.315  -5.907  -5.787
   63   1HG   GLN  67          HG2       GLN  67   9.033  -5.171  -4.073
   64   2HG   GLN  67          HG3       GLN  67   8.869  -6.782  -3.376
   65   1HE2  GLN  67          HE21      GLN  67  10.033  -8.382  -4.211
   66   2HE2  GLN  67          HE22      GLN  67  10.942  -8.300  -5.678
   67    HA   PRO  68           HA       PRO  68   5.465  -6.673  -0.006
   68   1HB   PRO  68          HB2       PRO  68   4.948  -9.345  -0.087
   69   2HB   PRO  68          HB3       PRO  68   3.718  -8.111  -0.381
   70   1HG   PRO  68          HG2       PRO  68   5.286  -9.733  -2.348
   71   2HG   PRO  68          HG3       PRO  68   3.563  -9.310  -2.365
   72   1HD   PRO  68          HD2       PRO  68   5.389  -8.011  -3.878
   73   2HD   PRO  68          HD3       PRO  68   3.961  -7.199  -3.207
   74    H    HIS  69           H        HIS  69   6.751  -7.588   1.602
   75    HA   HIS  69           HA       HIS  69   9.342  -8.569   0.666
   76   1HB   HIS  69          HB2       HIS  69  10.049  -8.118   3.043
   77   2HB   HIS  69          HB3       HIS  69   9.518  -6.698   2.147
   78    HD1  HIS  69           HD1      HIS  69   7.970  -5.246   3.403
   79    HD2  HIS  69           HD2      HIS  69   7.758  -9.192   4.686
   80    HE1  HIS  69           HE1      HIS  69   6.339  -5.243   5.317
   81    HE2  HIS  69           HE2      HIS  69   6.293  -7.627   6.132
   82    H    GLY  70           H        GLY  70   6.560  -9.523   2.550
   83   1HA   GLY  70          HA2       GLY  70   7.502 -12.276   2.511
   84   2HA   GLY  70          HA3       GLY  70   7.278 -11.572   4.105
   85    H    GLY  71           H        GLY  71   5.230 -10.672   1.430
   86   1HA   GLY  71          HA2       GLY  71   3.215 -12.545   1.551
   87   2HA   GLY  71          HA3       GLY  71   2.883 -11.432   2.870
   88    H    GLY  72           H        GLY  72   1.939  -9.503   2.441
   89   1HA   GLY  72          HA2       GLY  72   1.652  -8.742  -0.397
   90   2HA   GLY  72          HA3       GLY  72   0.257  -8.789   0.670
   91    H    TRP  73           H        TRP  73  -0.048  -6.555   0.103
   92    HA   TRP  73           HA       TRP  73   1.409  -4.792   1.902
   93   1HB   TRP  73          HB2       TRP  73   1.311  -3.125  -0.215
   94   2HB   TRP  73          HB3       TRP  73   2.717  -4.112   0.169
   95    HD1  TRP  73           HD1      TRP  73   2.571  -6.687  -1.135
   96    HE1  TRP  73           HE1      TRP  73   2.018  -7.107  -3.607
   97    HE3  TRP  73           HE3      TRP  73   0.199  -2.284  -2.187
   98    HZ2  TRP  73           HZ2      TRP  73   0.748  -5.746  -5.733
   99    HZ3  TRP  73           HZ3      TRP  73  -0.654  -1.920  -4.466
  100    HH2  TRP  73           HH2      TRP  73  -0.383  -3.617  -6.201
  101    H    GLY  74           H        GLY  74  -0.730  -4.129  -0.836
  102   1HA   GLY  74          HA2       GLY  74  -2.617  -2.890   1.056
  103   2HA   GLY  74          HA3       GLY  74  -2.454  -2.451  -0.638
  104    H    GLN  75           H        GLN  75  -2.282  -5.444  -1.240
  105    HA   GLN  75           HA       GLN  75  -4.951  -5.811  -1.999
  106   1HB   GLN  75          HB2       GLN  75  -4.312  -8.064  -2.608
  107   2HB   GLN  75          HB3       GLN  75  -3.020  -6.956  -3.048
  108   1HG   GLN  75          HG2       GLN  75  -1.948  -7.598  -0.825
  109   2HG   GLN  75          HG3       GLN  75  -3.105  -8.929  -0.795
  110   1HE2  GLN  75          HE21      GLN  75  -1.045  -7.416  -3.262
  111   2HE2  GLN  75          HE22      GLN  75  -0.337  -8.891  -3.818
  112    HA   PRO  76           HA       PRO  76  -7.013  -7.329   1.583
  113   1HB   PRO  76          HB2       PRO  76  -8.659  -9.225   0.506
  114   2HB   PRO  76          HB3       PRO  76  -8.951  -7.488   0.375
  115   1HG   PRO  76          HG2       PRO  76  -7.741  -9.362  -1.617
  116   2HG   PRO  76          HG3       PRO  76  -8.905  -8.048  -1.876
  117   1HD   PRO  76          HD2       PRO  76  -6.277  -7.768  -2.421
  118   2HD   PRO  76          HD3       PRO  76  -7.269  -6.420  -1.831
  119    H    HIS  77           H        HIS  77  -7.100  -9.055   3.050
  120    HA   HIS  77           HA       HIS  77  -5.268 -11.272   2.418
  121   1HB   HIS  77          HB2       HIS  77  -4.558  -9.763   4.260
  122   2HB   HIS  77          HB3       HIS  77  -6.027 -10.179   5.137
  123    HD1  HIS  77           HD1      HIS  77  -4.374 -11.056   7.028
  124    HD2  HIS  77           HD2      HIS  77  -4.326 -13.192   3.465
  125    HE1  HIS  77           HE1      HIS  77  -3.236 -13.233   7.565
  126    HE2  HIS  77           HE2      HIS  77  -3.295 -14.544   5.415
  127    H    GLY  78           H        GLY  78  -8.446 -10.431   3.590
  128   1HA   GLY  78          HA2       GLY  78  -9.148 -13.293   3.516
  129   2HA   GLY  78          HA3       GLY  78  -9.666 -12.288   4.861
  130    H    GLY  79           H        GLY  79  -9.544 -11.002   1.627
  131   1HA   GLY  79          HA2       GLY  79 -11.376 -11.033   0.055
  132   2HA   GLY  79          HA3       GLY  79 -12.469 -11.294   1.406
  133    H    GLY  80           H        GLY  80 -10.798  -8.972  -0.514
  134   1HA   GLY  80          HA2       GLY  80 -10.970  -6.687  -0.664
  135   2HA   GLY  80          HA3       GLY  80 -12.533  -6.875   0.117
  136    H    TRP  81           H        TRP  81 -11.703  -4.679   0.890
  137    HA   TRP  81           HA       TRP  81 -10.609  -5.066   3.562
  138   1HB   TRP  81          HB2       TRP  81  -9.267  -2.807   2.948
  139   2HB   TRP  81          HB3       TRP  81  -8.565  -4.415   2.802
  140    HD1  TRP  81           HD1      TRP  81  -9.044  -5.521   0.172
  141    HE1  TRP  81           HE1      TRP  81  -8.648  -4.328  -2.068
  142    HE3  TRP  81           HE3      TRP  81  -9.115  -0.682   1.815
  143    HZ2  TRP  81           HZ2      TRP  81  -8.390  -1.680  -3.016
  144    HZ3  TRP  81           HZ3      TRP  81  -8.783   1.123   0.177
  145    HH2  TRP  81           HH2      TRP  81  -8.427   0.633  -2.189
  146    H    GLY  82           H        GLY  82 -11.073  -2.148   1.617
  147   1HA   GLY  82          HA2       GLY  82 -13.029  -1.237   3.622
  148   2HA   GLY  82          HA3       GLY  82 -12.050  -0.181   2.615
  149    H    GLN  83           H        GLN  83 -12.682  -2.082   0.295
  150    HA   GLN  83           HA       GLN  83 -14.735  -0.580  -0.857
  151   1HB   GLN  83          HB2       GLN  83 -14.750  -2.233  -2.629
  152   2HB   GLN  83          HB3       GLN  83 -13.093  -1.912  -2.138
  153   1HG   GLN  83          HG2       GLN  83 -13.354  -3.975  -0.635
  154   2HG   GLN  83          HG3       GLN  83 -14.768  -4.336  -1.624
  155   1HE2  GLN  83          HE21      GLN  83 -13.361  -6.282  -1.990
  156   2HE2  GLN  83          HE22      GLN  83 -12.269  -6.217  -3.327
  157    HA   PRO  84           HA       PRO  84 -18.510  -2.204   0.722
  158   1HB   PRO  84          HB2       PRO  84 -20.067  -2.242  -1.530
  159   2HB   PRO  84          HB3       PRO  84 -19.699  -0.781  -0.611
  160   1HG   PRO  84          HG2       PRO  84 -18.441  -1.808  -3.120
  161   2HG   PRO  84          HG3       PRO  84 -18.882  -0.145  -2.685
  162   1HD   PRO  84          HD2       PRO  84 -16.342  -1.035  -2.544
  163   2HD   PRO  84          HD3       PRO  84 -16.990   0.151  -1.391
  164    H    HIS  85           H        HIS  85 -19.938  -4.029   0.678
  165    HA   HIS  85           HA       HIS  85 -18.879  -6.307  -0.864
  166   1HB   HIS  85          HB2       HIS  85 -20.275  -6.517   1.801
  167   2HB   HIS  85          HB3       HIS  85 -19.364  -7.763   0.956
  168    HD1  HIS  85           HD1      HIS  85 -17.175  -8.157   2.014
  169    HD2  HIS  85           HD2      HIS  85 -18.347  -4.185   2.352
  170    HE1  HIS  85           HE1      HIS  85 -15.325  -7.015   3.278
  171    HE2  HIS  85           HE2      HIS  85 -16.015  -4.595   3.393
  172    H    GLY  86           H        GLY  86 -20.244  -6.622  -2.501
  173   1HA   GLY  86          HA2       GLY  86 -22.232  -7.598  -3.331
  174   2HA   GLY  86          HA3       GLY  86 -23.058  -7.106  -1.860
  175    H    GLY  87           H        GLY  87 -21.898  -4.355  -2.097
  176   1HA   GLY  87          HA2       GLY  87 -22.293  -2.888  -4.268
  177   2HA   GLY  87          HA3       GLY  87 -23.952  -3.333  -3.900
  178    H    GLY  88           H        GLY  88 -21.207  -1.422  -2.950
  179   1HA   GLY  88          HA2       GLY  88 -21.011   0.384  -1.543
  180   2HA   GLY  88          HA3       GLY  88 -22.744   0.588  -1.762
  181    H    TRP  89           H        TRP  89 -22.817   1.314   0.429
  182    HA   TRP  89           HA       TRP  89 -23.079  -0.909   2.307
  183   1HB   TRP  89          HB2       TRP  89 -22.064   0.965   3.988
  184   2HB   TRP  89          HB3       TRP  89 -21.103  -0.309   3.247
  185    HD1  TRP  89           HD1      TRP  89 -20.102   0.558   0.659
  186    HE1  TRP  89           HE1      TRP  89 -18.873   2.761   0.188
  187    HE3  TRP  89           HE3      TRP  89 -21.690   3.239   4.707
  188    HZ2  TRP  89           HZ2      TRP  89 -18.602   5.309   1.384
  189    HZ3  TRP  89           HZ3      TRP  89 -20.898   5.553   4.973
  190    HH2  TRP  89           HH2      TRP  89 -19.384   6.565   3.344
  191    H    GLY  90           H        GLY  90 -23.130   2.593   2.792
  192   1HA   GLY  90          HA2       GLY  90 -26.044   2.442   3.198
  193   2HA   GLY  90          HA3       GLY  90 -25.020   3.184   4.417
  194    H    GLN  91           H        GLN  91 -24.016   3.643   1.175
  195    HA   GLN  91           HA       GLN  91 -24.162   6.435   1.315
  196   1HB   GLN  91          HB2       GLN  91 -23.842   6.284  -1.218
  197   2HB   GLN  91          HB3       GLN  91 -22.605   5.550  -0.207
  198   1HG   GLN  91          HG2       GLN  91 -23.343   3.379  -0.688
  199   2HG   GLN  91          HG3       GLN  91 -24.877   3.955  -1.339
  200   1HE2  GLN  91          HE21      GLN  91 -24.929   4.867  -3.403
  201   2HE2  GLN  91          HE22      GLN  91 -23.653   4.618  -4.541
  Start of MODEL   19
    1    H    TRP  57           H        TRP  57  19.132   2.074 -11.448
    2    HA   TRP  57           HA       TRP  57  16.311   2.880 -11.606
    3   1HB   TRP  57          HB2       TRP  57  16.712   0.389 -11.797
    4   2HB   TRP  57          HB3       TRP  57  17.470   0.462 -10.210
    5    HD1  TRP  57           HD1      TRP  57  15.826  -0.506  -8.511
    6    HE1  TRP  57           HE1      TRP  57  13.306  -0.276  -8.039
    7    HE3  TRP  57           HE3      TRP  57  14.534   2.501 -12.439
    8    HZ2  TRP  57           HZ2      TRP  57  11.067   1.010  -9.181
    9    HZ3  TRP  57           HZ3      TRP  57  12.183   3.186 -12.677
   10    HH2  TRP  57           HH2      TRP  57  10.487   2.454 -11.080
   11    H    GLY  58           H        GLY  58  15.502   3.646  -9.631
   12   1HA   GLY  58          HA2       GLY  58  17.353   5.091  -8.042
   13   2HA   GLY  58          HA3       GLY  58  15.636   4.910  -7.716
   14    H    GLN  59           H        GLN  59  15.811   1.982  -7.665
   15    HA   GLN  59           HA       GLN  59  15.953   0.347  -6.105
   16   1HB   GLN  59          HB2       GLN  59  18.108  -0.194  -5.305
   17   2HB   GLN  59          HB3       GLN  59  18.357   0.577  -6.863
   18   1HG   GLN  59          HG2       GLN  59  19.309   2.448  -5.940
   19   2HG   GLN  59          HG3       GLN  59  18.500   2.232  -4.389
   20   1HE2  GLN  59          HE21      GLN  59  19.182   0.247  -3.171
   21   2HE2  GLN  59          HE22      GLN  59  20.866  -0.137  -3.177
   22    HA   PRO  60           HA       PRO  60  14.590   1.861  -2.211
   23   1HB   PRO  60          HB2       PRO  60  15.074  -0.247  -0.577
   24   2HB   PRO  60          HB3       PRO  60  13.788  -0.251  -1.788
   25   1HG   PRO  60          HG2       PRO  60  16.522  -1.460  -1.925
   26   2HG   PRO  60          HG3       PRO  60  14.970  -2.140  -2.449
   27   1HD   PRO  60          HD2       PRO  60  16.739  -1.023  -4.174
   28   2HD   PRO  60          HD3       PRO  60  14.985  -0.970  -4.432
   29    H    HIS  61           H        HIS  61  15.336   2.987  -0.482
   30    HA   HIS  61           HA       HIS  61  18.234   2.963  -0.046
   31   1HB   HIS  61          HB2       HIS  61  16.332   5.041  -0.290
   32   2HB   HIS  61          HB3       HIS  61  16.896   5.073   1.378
   33    HD1  HIS  61           HD1      HIS  61  19.421   5.592   1.762
   34    HD2  HIS  61           HD2      HIS  61  18.190   5.837  -2.199
   35    HE1  HIS  61           HE1      HIS  61  21.277   6.783   0.553
   36    HE2  HIS  61           HE2      HIS  61  20.549   6.839  -1.859
   37    H    GLY  62           H        GLY  62  15.187   2.378   1.540
   38   1HA   GLY  62          HA2       GLY  62  16.681   1.596   3.965
   39   2HA   GLY  62          HA3       GLY  62  15.155   2.461   4.068
   40    H    GLY  63           H        GLY  63  15.683   0.019   1.636
   41   1HA   GLY  63          HA2       GLY  63  15.112  -2.290   1.771
   42   2HA   GLY  63          HA3       GLY  63  14.192  -1.947   3.228
   43    H    GLY  64           H        GLY  64  14.143  -2.120  -0.219
   44   1HA   GLY  64          HA2       GLY  64  12.423  -2.068  -1.739
   45   2HA   GLY  64          HA3       GLY  64  11.379  -2.483  -0.386
   46    H    TRP  65           H        TRP  65   9.931  -1.120  -1.815
   47    HA   TRP  65           HA       TRP  65   9.903   1.581  -0.729
   48   1HB   TRP  65          HB2       TRP  65   9.178   2.209  -3.250
   49   2HB   TRP  65          HB3       TRP  65  10.828   2.356  -2.659
   50    HD1  TRP  65           HD1      TRP  65  12.303  -0.102  -3.087
   51    HE1  TRP  65           HE1      TRP  65  12.413  -1.434  -5.279
   52    HE3  TRP  65           HE3      TRP  65   8.073   1.688  -5.331
   53    HZ2  TRP  65           HZ2      TRP  65  10.909  -1.690  -7.657
   54    HZ3  TRP  65           HZ3      TRP  65   7.480   0.849  -7.567
   55    HH2  TRP  65           HH2      TRP  65   8.870  -0.804  -8.704
   56    H    GLY  66           H        GLY  66   8.127   0.153  -3.434
   57   1HA   GLY  66          HA2       GLY  66   5.665   0.427  -1.826
   58   2HA   GLY  66          HA3       GLY  66   5.732   0.627  -3.571
   59    H    GLN  67           H        GLN  67   7.677  -1.924  -2.467
   60    HA   GLN  67           HA       GLN  67   5.712  -3.851  -3.466
   61   1HB   GLN  67          HB2       GLN  67   7.576  -5.371  -3.757
   62   2HB   GLN  67          HB3       GLN  67   7.961  -3.824  -4.498
   63   1HG   GLN  67          HG2       GLN  67   9.180  -3.267  -2.341
   64   2HG   GLN  67          HG3       GLN  67   9.015  -4.975  -1.937
   65   1HE2  GLN  67          HE21      GLN  67  11.481  -3.792  -2.170
   66   2HE2  GLN  67          HE22      GLN  67  12.292  -4.416  -3.563
   67    HA   PRO  68           HA       PRO  68   4.877  -5.603   0.487
   68   1HB   PRO  68          HB2       PRO  68   4.724  -8.265  -0.115
   69   2HB   PRO  68          HB3       PRO  68   3.450  -7.101  -0.490
   70   1HG   PRO  68          HG2       PRO  68   5.581  -8.216  -2.267
   71   2HG   PRO  68          HG3       PRO  68   3.867  -7.922  -2.619
   72   1HD   PRO  68          HD2       PRO  68   5.812  -6.244  -3.446
   73   2HD   PRO  68          HD3       PRO  68   4.199  -5.665  -2.982
   74    H    HIS  69           H        HIS  69   5.791  -6.777   2.212
   75    HA   HIS  69           HA       HIS  69   8.610  -7.515   1.792
   76   1HB   HIS  69          HB2       HIS  69   7.888  -5.588   3.395
   77   2HB   HIS  69          HB3       HIS  69   7.438  -6.896   4.484
   78    HD1  HIS  69           HD1      HIS  69   9.223  -7.085   6.180
   79    HD2  HIS  69           HD2      HIS  69  10.769  -6.423   2.381
   80    HE1  HIS  69           HE1      HIS  69  11.722  -7.166   6.448
   81    HE2  HIS  69           HE2      HIS  69  12.637  -6.680   4.151
   82    H    GLY  70           H        GLY  70   5.538  -8.559   3.084
   83   1HA   GLY  70          HA2       GLY  70   6.700 -11.238   3.478
   84   2HA   GLY  70          HA3       GLY  70   5.658 -10.536   4.705
   85    H    GLY  71           H        GLY  71   5.038  -9.983   1.325
   86   1HA   GLY  71          HA2       GLY  71   3.623 -11.365  -0.064
   87   2HA   GLY  71          HA3       GLY  71   2.878 -11.989   1.400
   88    H    GLY  72           H        GLY  72   2.851  -9.511  -0.989
   89   1HA   GLY  72          HA2       GLY  72   1.343  -7.846  -1.462
   90   2HA   GLY  72          HA3       GLY  72   0.197  -8.775  -0.504
   91    H    TRP  73           H        TRP  73  -0.438  -6.397  -0.178
   92    HA   TRP  73           HA       TRP  73   0.638  -5.582   2.405
   93   1HB   TRP  73          HB2       TRP  73   0.384  -3.123   1.321
   94   2HB   TRP  73          HB3       TRP  73   1.905  -4.008   1.360
   95    HD1  TRP  73           HD1      TRP  73   2.209  -5.649  -1.006
   96    HE1  TRP  73           HE1      TRP  73   1.854  -4.883  -3.432
   97    HE3  TRP  73           HE3      TRP  73  -0.730  -1.557  -0.139
   98    HZ2  TRP  73           HZ2      TRP  73   0.511  -2.811  -4.804
   99    HZ3  TRP  73           HZ3      TRP  73  -1.506  -0.235  -2.063
  100    HH2  TRP  73           HH2      TRP  73  -0.897  -0.850  -4.347
  101    H    GLY  74           H        GLY  74  -1.437  -3.871   0.109
  102   1HA   GLY  74          HA2       GLY  74  -3.579  -3.950   2.128
  103   2HA   GLY  74          HA3       GLY  74  -3.402  -2.715   0.891
  104    H    GLN  75           H        GLN  75  -2.756  -4.991  -1.054
  105    HA   GLN  75           HA       GLN  75  -5.295  -5.206  -2.209
  106   1HB   GLN  75          HB2       GLN  75  -4.303  -6.779  -3.748
  107   2HB   GLN  75          HB3       GLN  75  -3.149  -5.492  -3.426
  108   1HG   GLN  75          HG2       GLN  75  -2.148  -7.058  -1.682
  109   2HG   GLN  75          HG3       GLN  75  -3.114  -8.322  -2.442
  110   1HE2  GLN  75          HE21      GLN  75  -2.721  -8.804  -4.668
  111   2HE2  GLN  75          HE22      GLN  75  -1.165  -8.510  -5.360
  112    HA   PRO  76           HA       PRO  76  -7.268  -8.509  -0.062
  113   1HB   PRO  76          HB2       PRO  76  -8.675  -9.703  -2.055
  114   2HB   PRO  76          HB3       PRO  76  -9.120  -8.138  -1.366
  115   1HG   PRO  76          HG2       PRO  76  -7.632  -8.740  -3.892
  116   2HG   PRO  76          HG3       PRO  76  -8.914  -7.549  -3.604
  117   1HD   PRO  76          HD2       PRO  76  -6.295  -6.875  -3.692
  118   2HD   PRO  76          HD3       PRO  76  -7.462  -6.028  -2.656
  119    H    HIS  77           H        HIS  77  -6.819 -10.555   0.552
  120    HA   HIS  77           HA       HIS  77  -4.843 -12.026  -1.012
  121   1HB   HIS  77          HB2       HIS  77  -4.504 -11.604   1.437
  122   2HB   HIS  77          HB3       HIS  77  -5.887 -12.645   1.757
  123    HD1  HIS  77           HD1      HIS  77  -3.784 -13.867   3.120
  124    HD2  HIS  77           HD2      HIS  77  -3.936 -14.252  -1.014
  125    HE1  HIS  77           HE1      HIS  77  -2.344 -15.856   2.578
  126    HE2  HIS  77           HE2      HIS  77  -2.522 -16.122   0.078
  127    H    GLY  78           H        GLY  78  -8.153 -12.249   0.085
  128   1HA   GLY  78          HA2       GLY  78  -8.408 -14.775  -1.427
  129   2HA   GLY  78          HA3       GLY  78  -9.255 -14.506   0.089
  130    H    GLY  79           H        GLY  79 -10.059 -11.836  -0.334
  131   1HA   GLY  79          HA2       GLY  79 -11.357 -11.448  -2.813
  132   2HA   GLY  79          HA3       GLY  79 -12.475 -12.198  -1.684
  133    H    GLY  80           H        GLY  80 -10.824  -9.307  -2.583
  134   1HA   GLY  80          HA2       GLY  80 -11.090  -7.121  -1.931
  135   2HA   GLY  80          HA3       GLY  80 -12.652  -7.620  -1.297
  136    H    TRP  81           H        TRP  81 -11.932  -5.833   0.234
  137    HA   TRP  81           HA       TRP  81 -10.839  -7.110   2.611
  138   1HB   TRP  81          HB2       TRP  81  -9.570  -4.746   2.873
  139   2HB   TRP  81          HB3       TRP  81  -8.812  -6.173   2.174
  140    HD1  TRP  81           HD1      TRP  81  -9.219  -6.274  -0.686
  141    HE1  TRP  81           HE1      TRP  81  -8.844  -4.345  -2.339
  142    HE3  TRP  81           HE3      TRP  81  -9.490  -2.351   2.579
  143    HZ2  TRP  81           HZ2      TRP  81  -8.678  -1.526  -2.270
  144    HZ3  TRP  81           HZ3      TRP  81  -9.210  -0.069   1.704
  145    HH2  TRP  81           HH2      TRP  81  -8.812   0.333  -0.671
  146    H    GLY  82           H        GLY  82 -11.394  -3.709   1.808
  147   1HA   GLY  82          HA2       GLY  82 -13.396  -3.624   3.968
  148   2HA   GLY  82          HA3       GLY  82 -12.448  -2.251   3.418
  149    H    GLN  83           H        GLN  83 -12.980  -3.211   0.566
  150    HA   GLN  83           HA       GLN  83 -15.102  -1.477  -0.006
  151   1HB   GLN  83          HB2       GLN  83 -14.995  -2.330  -2.266
  152   2HB   GLN  83          HB3       GLN  83 -13.362  -2.164  -1.634
  153   1HG   GLN  83          HG2       GLN  83 -13.481  -4.629  -1.069
  154   2HG   GLN  83          HG3       GLN  83 -14.947  -4.678  -2.048
  155   1HE2  GLN  83          HE21      GLN  83 -12.930  -6.263  -2.786
  156   2HE2  GLN  83          HE22      GLN  83 -12.155  -5.664  -4.209
  157    HA   PRO  84           HA       PRO  84 -18.765  -3.808   0.730
  158   1HB   PRO  84          HB2       PRO  84 -20.360  -2.997  -1.326
  159   2HB   PRO  84          HB3       PRO  84 -20.001  -1.990   0.081
  160   1HG   PRO  84          HG2       PRO  84 -18.768  -1.944  -2.644
  161   2HG   PRO  84          HG3       PRO  84 -19.257  -0.587  -1.614
  162   1HD   PRO  84          HD2       PRO  84 -16.686  -1.378  -1.828
  163   2HD   PRO  84          HD3       PRO  84 -17.350  -0.717  -0.319
  164    H    HIS  85           H        HIS  85 -20.059  -5.553  -0.034
  165    HA   HIS  85           HA       HIS  85 -18.738  -7.104  -2.136
  166   1HB   HIS  85          HB2       HIS  85 -20.524  -7.814   0.171
  167   2HB   HIS  85          HB3       HIS  85 -20.332  -8.932  -1.175
  168    HD1  HIS  85           HD1      HIS  85 -18.942 -10.719  -0.105
  169    HD2  HIS  85           HD2      HIS  85 -17.382  -6.916   0.502
  170    HE1  HIS  85           HE1      HIS  85 -16.696 -11.077   0.967
  171    HE2  HIS  85           HE2      HIS  85 -15.809  -8.760   1.404
  172    H    GLY  86           H        GLY  86 -21.782  -5.595  -1.320
  173   1HA   GLY  86          HA2       GLY  86 -22.903  -6.561  -3.876
  174   2HA   GLY  86          HA3       GLY  86 -23.872  -6.129  -2.476
  175    H    GLY  87           H        GLY  87 -22.199  -3.741  -1.936
  176   1HA   GLY  87          HA2       GLY  87 -22.058  -1.975  -4.068
  177   2HA   GLY  87          HA3       GLY  87 -23.707  -1.884  -3.470
  178    H    GLY  88           H        GLY  88 -22.971  -2.375  -0.697
  179   1HA   GLY  88          HA2       GLY  88 -21.164  -0.233   0.039
  180   2HA   GLY  88          HA3       GLY  88 -22.857   0.095   0.375
  181    H    TRP  89           H        TRP  89 -22.140   0.236   2.607
  182    HA   TRP  89           HA       TRP  89 -22.337  -2.357   3.915
  183   1HB   TRP  89          HB2       TRP  89 -20.430  -1.303   5.507
  184   2HB   TRP  89          HB3       TRP  89 -20.079  -2.398   4.175
  185    HD1  TRP  89           HD1      TRP  89 -19.627  -0.948   1.719
  186    HE1  TRP  89           HE1      TRP  89 -18.105   1.100   1.423
  187    HE3  TRP  89           HE3      TRP  89 -19.402   0.599   6.585
  188    HZ2  TRP  89           HZ2      TRP  89 -16.951   3.108   3.042
  189    HZ3  TRP  89           HZ3      TRP  89 -18.066   2.591   7.128
  190    HH2  TRP  89           HH2      TRP  89 -16.865   3.819   5.392
  191    H    GLY  90           H        GLY  90 -21.341   0.809   5.136
  192   1HA   GLY  90          HA2       GLY  90 -23.938   1.031   6.512
  193   2HA   GLY  90          HA3       GLY  90 -22.438   1.228   7.407
  194    H    GLN  91           H        GLN  91 -22.419   2.401   4.186
  195    HA   GLN  91           HA       GLN  91 -22.056   5.097   5.110
  196   1HB   GLN  91          HB2       GLN  91 -21.865   5.586   2.635
  197   2HB   GLN  91          HB3       GLN  91 -20.699   4.438   3.279
  198   1HG   GLN  91          HG2       GLN  91 -21.798   2.607   2.298
  199   2HG   GLN  91          HG3       GLN  91 -23.243   3.559   1.955
  200   1HE2  GLN  91          HE21      GLN  91 -21.128   2.000   0.344
  201   2HE2  GLN  91          HE22      GLN  91 -20.762   3.071  -0.961
  Start of MODEL   20
    1    H    TRP  57           H        TRP  57  18.411   2.051  -3.753
    2    HA   TRP  57           HA       TRP  57  20.413   1.294  -4.593
    3   1HB   TRP  57          HB2       TRP  57  21.202   0.355  -2.435
    4   2HB   TRP  57          HB3       TRP  57  20.130  -1.022  -2.662
    5    HD1  TRP  57           HD1      TRP  57  21.597  -3.032  -3.247
    6    HE1  TRP  57           HE1      TRP  57  23.558  -3.481  -4.851
    7    HE3  TRP  57           HE3      TRP  57  22.293   1.710  -5.029
    8    HZ2  TRP  57           HZ2      TRP  57  25.186  -2.020  -6.635
    9    HZ3  TRP  57           HZ3      TRP  57  24.074   2.099  -6.681
   10    HH2  TRP  57           HH2      TRP  57  25.491   0.272  -7.466
   11    H    GLY  58           H        GLY  58  20.652  -0.312  -6.273
   12   1HA   GLY  58          HA2       GLY  58  18.281  -0.940  -7.592
   13   2HA   GLY  58          HA3       GLY  58  19.845  -1.658  -7.948
   14    H    GLN  59           H        GLN  59  20.015  -2.744  -5.170
   15    HA   GLN  59           HA       GLN  59  17.935  -4.814  -5.314
   16   1HB   GLN  59          HB2       GLN  59  19.546  -6.571  -4.946
   17   2HB   GLN  59          HB3       GLN  59  20.027  -5.650  -6.365
   18   1HG   GLN  59          HG2       GLN  59  21.698  -4.470  -5.061
   19   2HG   GLN  59          HG3       GLN  59  21.189  -5.328  -3.607
   20   1HE2  GLN  59          HE21      GLN  59  20.981  -7.862  -4.297
   21   2HE2  GLN  59          HE22      GLN  59  22.472  -8.491  -4.903
   22    HA   PRO  60           HA       PRO  60  17.501  -4.226  -0.970
   23   1HB   PRO  60          HB2       PRO  60  16.916  -6.750  -0.125
   24   2HB   PRO  60          HB3       PRO  60  15.764  -5.722  -0.983
   25   1HG   PRO  60          HG2       PRO  60  17.487  -7.930  -2.038
   26   2HG   PRO  60          HG3       PRO  60  15.789  -7.566  -2.398
   27   1HD   PRO  60          HD2       PRO  60  17.793  -6.885  -4.073
   28   2HD   PRO  60          HD3       PRO  60  16.335  -5.889  -3.890
   29    H    HIS  61           H        HIS  61  18.604  -4.399   0.966
   30    HA   HIS  61           HA       HIS  61  21.217  -5.706   0.795
   31   1HB   HIS  61          HB2       HIS  61  21.069  -3.274   1.376
   32   2HB   HIS  61          HB3       HIS  61  20.236  -3.726   2.859
   33    HD1  HIS  61           HD1      HIS  61  23.501  -2.961   1.645
   34    HD2  HIS  61           HD2      HIS  61  21.969  -5.605   4.460
   35    HE1  HIS  61           HE1      HIS  61  25.445  -3.576   3.115
   36    HE2  HIS  61           HE2      HIS  61  24.512  -5.244   4.758
   37    H    GLY  62           H        GLY  62  18.227  -5.744   2.597
   38   1HA   GLY  62          HA2       GLY  62  19.325  -7.886   4.308
   39   2HA   GLY  62          HA3       GLY  62  18.010  -6.821   4.782
   40    H    GLY  63           H        GLY  63  16.785  -7.023   2.076
   41   1HA   GLY  63          HA2       GLY  63  16.185  -9.683   1.425
   42   2HA   GLY  63          HA3       GLY  63  15.005  -9.139   2.606
   43    H    GLY  64           H        GLY  64  14.451  -6.606   1.930
   44   1HA   GLY  64          HA2       GLY  64  13.898  -6.521  -0.943
   45   2HA   GLY  64          HA3       GLY  64  12.514  -6.542   0.143
   46    H    TRP  65           H        TRP  65  11.950  -4.490  -0.795
   47    HA   TRP  65           HA       TRP  65  13.185  -2.286   0.648
   48   1HB   TRP  65          HB2       TRP  65  12.899  -1.035  -1.727
   49   2HB   TRP  65          HB3       TRP  65  14.410  -1.764  -1.197
   50    HD1  TRP  65           HD1      TRP  65  14.590  -4.523  -2.033
   51    HE1  TRP  65           HE1      TRP  65  14.106  -5.431  -4.387
   52    HE3  TRP  65           HE3      TRP  65  11.698  -0.694  -3.795
   53    HZ2  TRP  65           HZ2      TRP  65  12.691  -4.627  -6.695
   54    HZ3  TRP  65           HZ3      TRP  65  10.819  -0.840  -6.088
   55    HH2  TRP  65           HH2      TRP  65  11.307  -2.766  -7.507
   56    H    GLY  66           H        GLY  66  11.003  -2.327  -2.135
   57   1HA   GLY  66          HA2       GLY  66   8.948  -1.092  -0.416
   58   2HA   GLY  66          HA3       GLY  66   9.110  -0.803  -2.142
   59    H    GLN  67           H        GLN  67   9.649  -3.799  -2.434
   60    HA   GLN  67           HA       GLN  67   7.057  -4.551  -3.194
   61   1HB   GLN  67          HB2       GLN  67   7.990  -6.788  -3.525
   62   2HB   GLN  67          HB3       GLN  67   9.073  -5.556  -4.158
   63   1HG   GLN  67          HG2       GLN  67  10.361  -5.726  -2.013
   64   2HG   GLN  67          HG3       GLN  67   9.365  -7.125  -1.613
   65   1HE2  GLN  67          HE21      GLN  67  11.779  -5.856  -3.791
   66   2HE2  GLN  67          HE22      GLN  67  12.319  -7.381  -4.396
   67    HA   PRO  68           HA       PRO  68   4.991  -5.974   0.417
   68   1HB   PRO  68          HB2       PRO  68   4.010  -8.411  -0.486
   69   2HB   PRO  68          HB3       PRO  68   3.237  -6.845  -0.736
   70   1HG   PRO  68          HG2       PRO  68   4.958  -8.429  -2.587
   71   2HG   PRO  68          HG3       PRO  68   3.525  -7.447  -2.946
   72   1HD   PRO  68          HD2       PRO  68   6.003  -6.565  -3.478
   73   2HD   PRO  68          HD3       PRO  68   4.724  -5.465  -2.923
   74    H    HIS  69           H        HIS  69   5.232  -7.344   2.178
   75    HA   HIS  69           HA       HIS  69   7.303  -9.423   1.946
   76   1HB   HIS  69          HB2       HIS  69   8.133  -7.283   3.010
   77   2HB   HIS  69          HB3       HIS  69   7.008  -7.592   4.328
   78    HD1  HIS  69           HD1      HIS  69   9.260  -7.656   5.794
   79    HD2  HIS  69           HD2      HIS  69   8.717 -10.792   3.123
   80    HE1  HIS  69           HE1      HIS  69  10.849  -9.457   6.538
   81    HE2  HIS  69           HE2      HIS  69  10.563 -11.311   4.857
   82    H    GLY  70           H        GLY  70   4.153  -8.996   2.449
   83   1HA   GLY  70          HA2       GLY  70   3.984 -11.372   4.141
   84   2HA   GLY  70          HA3       GLY  70   3.154  -9.929   4.703
   85    H    GLY  71           H        GLY  71   3.379 -10.588   1.297
   86   1HA   GLY  71          HA2       GLY  71   1.810 -11.708  -0.083
   87   2HA   GLY  71          HA3       GLY  71   0.686 -11.743   1.268
   88    H    GLY  72           H        GLY  72   2.352  -8.793   0.505
   89   1HA   GLY  72          HA2       GLY  72   1.357  -7.281  -1.249
   90   2HA   GLY  72          HA3       GLY  72  -0.192  -7.710  -0.534
   91    H    TRP  73           H        TRP  73  -0.433  -5.381  -0.307
   92    HA   TRP  73           HA       TRP  73   0.590  -4.494   2.277
   93   1HB   TRP  73          HB2       TRP  73   0.784  -2.142   0.968
   94   2HB   TRP  73          HB3       TRP  73   2.146  -3.236   1.191
   95    HD1  TRP  73           HD1      TRP  73   2.293  -5.142  -0.995
   96    HE1  TRP  73           HE1      TRP  73   2.210  -4.570  -3.497
   97    HE3  TRP  73           HE3      TRP  73   0.060  -0.554  -0.697
   98    HZ2  TRP  73           HZ2      TRP  73   1.324  -2.445  -5.135
   99    HZ3  TRP  73           HZ3      TRP  73  -0.368   0.685  -2.780
  100    HH2  TRP  73           HH2      TRP  73   0.252  -0.242  -4.951
  101    H    GLY  74           H        GLY  74  -1.044  -2.701  -0.294
  102   1HA   GLY  74          HA2       GLY  74  -3.351  -2.398   1.523
  103   2HA   GLY  74          HA3       GLY  74  -2.843  -1.186   0.357
  104    H    GLN  75           H        GLN  75  -2.656  -4.392  -0.786
  105    HA   GLN  75           HA       GLN  75  -5.102  -3.963  -2.361
  106   1HB   GLN  75          HB2       GLN  75  -4.130  -5.409  -4.044
  107   2HB   GLN  75          HB3       GLN  75  -2.989  -4.134  -3.638
  108   1HG   GLN  75          HG2       GLN  75  -1.883  -5.778  -2.084
  109   2HG   GLN  75          HG3       GLN  75  -2.902  -7.019  -2.811
  110   1HE2  GLN  75          HE21      GLN  75  -1.015  -4.276  -4.048
  111   2HE2  GLN  75          HE22      GLN  75  -0.149  -5.187  -5.233
  112    HA   PRO  76           HA       PRO  76  -7.104  -7.426  -0.520
  113   1HB   PRO  76          HB2       PRO  76  -8.404  -8.513  -2.662
  114   2HB   PRO  76          HB3       PRO  76  -8.940  -7.048  -1.835
  115   1HG   PRO  76          HG2       PRO  76  -7.375  -7.331  -4.368
  116   2HG   PRO  76          HG3       PRO  76  -8.704  -6.218  -3.989
  117   1HD   PRO  76          HD2       PRO  76  -6.121  -5.437  -3.959
  118   2HD   PRO  76          HD3       PRO  76  -7.325  -4.764  -2.839
  119    H    HIS  77           H        HIS  77  -6.831  -9.594  -0.144
  120    HA   HIS  77           HA       HIS  77  -4.712 -10.896  -1.695
  121   1HB   HIS  77          HB2       HIS  77  -4.735 -10.599   0.915
  122   2HB   HIS  77          HB3       HIS  77  -5.796 -12.004   0.870
  123    HD1  HIS  77           HD1      HIS  77  -3.762 -13.142   2.220
  124    HD2  HIS  77           HD2      HIS  77  -3.042 -12.223  -1.769
  125    HE1  HIS  77           HE1      HIS  77  -1.734 -14.482   1.576
  126    HE2  HIS  77           HE2      HIS  77  -1.369 -13.977  -0.865
  127    H    GLY  78           H        GLY  78  -8.056 -11.209  -0.738
  128   1HA   GLY  78          HA2       GLY  78  -8.228 -13.685  -2.344
  129   2HA   GLY  78          HA3       GLY  78  -9.238 -13.373  -0.939
  130    H    GLY  79           H        GLY  79  -9.734 -10.592  -1.590
  131   1HA   GLY  79          HA2       GLY  79 -10.960 -10.533  -4.199
  132   2HA   GLY  79          HA3       GLY  79 -12.117 -10.688  -2.887
  133    H    GLY  80           H        GLY  80 -11.647  -9.045  -1.028
  134   1HA   GLY  80          HA2       GLY  80 -10.819  -6.457  -2.161
  135   2HA   GLY  80          HA3       GLY  80 -12.409  -6.609  -1.428
  136    H    TRP  81           H        TRP  81 -11.723  -4.919   0.015
  137    HA   TRP  81           HA       TRP  81 -10.389  -6.005   2.368
  138   1HB   TRP  81          HB2       TRP  81  -9.269  -3.549   2.413
  139   2HB   TRP  81          HB3       TRP  81  -8.468  -4.963   1.737
  140    HD1  TRP  81           HD1      TRP  81  -9.096  -5.259  -1.074
  141    HE1  TRP  81           HE1      TRP  81  -8.969  -3.414  -2.855
  142    HE3  TRP  81           HE3      TRP  81  -9.342  -1.174   1.986
  143    HZ2  TRP  81           HZ2      TRP  81  -8.964  -0.590  -2.952
  144    HZ3  TRP  81           HZ3      TRP  81  -9.267   1.066   0.969
  145    HH2  TRP  81           HH2      TRP  81  -9.082   1.350  -1.449
  146    H    GLY  82           H        GLY  82 -11.213  -2.686   1.465
  147   1HA   GLY  82          HA2       GLY  82 -13.033  -2.603   3.776
  148   2HA   GLY  82          HA3       GLY  82 -12.253  -1.207   3.046
  149    H    GLN  83           H        GLN  83 -12.964  -2.399   0.328
  150    HA   GLN  83           HA       GLN  83 -15.280  -0.885  -0.127
  151   1HB   GLN  83          HB2       GLN  83 -15.289  -1.839  -2.345
  152   2HB   GLN  83          HB3       GLN  83 -13.629  -1.505  -1.874
  153   1HG   GLN  83          HG2       GLN  83 -13.524  -3.956  -1.167
  154   2HG   GLN  83          HG3       GLN  83 -15.018  -4.151  -2.082
  155   1HE2  GLN  83          HE21      GLN  83 -14.961  -4.142  -4.284
  156   2HE2  GLN  83          HE22      GLN  83 -13.498  -4.109  -5.203
  157    HA   PRO  84           HA       PRO  84 -18.628  -3.469   1.106
  158   1HB   PRO  84          HB2       PRO  84 -20.454  -2.931  -0.862
  159   2HB   PRO  84          HB3       PRO  84 -20.114  -1.848   0.489
  160   1HG   PRO  84          HG2       PRO  84 -19.105  -1.747  -2.321
  161   2HG   PRO  84          HG3       PRO  84 -19.640  -0.420  -1.273
  162   1HD   PRO  84          HD2       PRO  84 -17.030  -0.950  -1.695
  163   2HD   PRO  84          HD3       PRO  84 -17.628  -0.335  -0.140
  164    H    HIS  85           H        HIS  85 -19.885  -5.331   0.508
  165    HA   HIS  85           HA       HIS  85 -18.809  -6.759  -1.835
  166   1HB   HIS  85          HB2       HIS  85 -19.364  -8.854  -0.482
  167   2HB   HIS  85          HB3       HIS  85 -17.972  -7.912   0.046
  168    HD1  HIS  85           HD1      HIS  85 -18.232  -6.568   2.272
  169    HD2  HIS  85           HD2      HIS  85 -21.463  -9.003   1.329
  170    HE1  HIS  85           HE1      HIS  85 -19.597  -6.718   4.378
  171    HE2  HIS  85           HE2      HIS  85 -21.501  -8.266   3.808
  172    H    GLY  86           H        GLY  86 -20.334  -6.668  -3.354
  173   1HA   GLY  86          HA2       GLY  86 -22.308  -7.546  -4.312
  174   2HA   GLY  86          HA3       GLY  86 -22.982  -7.726  -2.699
  175    H    GLY  87           H        GLY  87 -22.121  -4.929  -2.024
  176   1HA   GLY  87          HA2       GLY  87 -22.940  -2.862  -3.457
  177   2HA   GLY  87          HA3       GLY  87 -24.488  -3.633  -3.140
  178    H    GLY  88           H        GLY  88 -21.839  -1.830  -1.786
  179   1HA   GLY  88          HA2       GLY  88 -21.646  -0.625   0.162
  180   2HA   GLY  88          HA3       GLY  88 -23.404  -0.603   0.182
  181    H    TRP  89           H        TRP  89 -23.265  -0.718   2.484
  182    HA   TRP  89           HA       TRP  89 -23.063  -3.476   3.427
  183   1HB   TRP  89          HB2       TRP  89 -22.008  -2.214   5.582
  184   2HB   TRP  89          HB3       TRP  89 -21.039  -2.985   4.332
  185    HD1  TRP  89           HD1      TRP  89 -20.483  -1.112   2.182
  186    HE1  TRP  89           HE1      TRP  89 -19.552   1.262   2.463
  187    HE3  TRP  89           HE3      TRP  89 -21.772  -0.321   7.062
  188    HZ2  TRP  89           HZ2      TRP  89 -19.377   3.220   4.495
  189    HZ3  TRP  89           HZ3      TRP  89 -21.184   1.831   8.102
  190    HH2  TRP  89           HH2      TRP  89 -20.011   3.563   6.843
  191    H    GLY  90           H        GLY  90 -23.367  -0.420   5.178
  192   1HA   GLY  90          HA2       GLY  90 -26.048  -1.300   6.050
  193   2HA   GLY  90          HA3       GLY  90 -24.952  -0.345   7.038
  194    H    GLN  91           H        GLN  91 -24.278   1.211   4.484
  195    HA   GLN  91           HA       GLN  91 -25.969   3.397   4.952
  196   1HB   GLN  91          HB2       GLN  91 -25.043   4.233   2.738
  197   2HB   GLN  91          HB3       GLN  91 -23.863   3.849   3.981
  198   1HG   GLN  91          HG2       GLN  91 -23.035   2.064   2.846
  199   2HG   GLN  91          HG3       GLN  91 -24.572   1.711   2.058
  200   1HE2  GLN  91          HE21      GLN  91 -23.772   1.580   0.006
  201   2HE2  GLN  91          HE22      GLN  91 -23.137   2.934  -0.858