*HEADER    PROTEIN FIBRIL, IMMUNE SYSTEM           19-JAN-07   2E8D              
*TITLE     3D STRUCTURE OF AMYLOID PROTOFILAMENTS OF BETA2-                      
*TITLE    2 MICROGLOBULIN FRAGMENT PROBED BY SOLID-STATE NMR                     
*COMPND    MOL_ID: 1;                                                            
*COMPND   2 MOLECULE: BETA-2-MICROGLOBULIN;                                      
*COMPND   3 CHAIN: A, B, C, D;                                                   
*COMPND   4 FRAGMENT: RESIDUES 40-61 (IN UNIPROT NUMBERING);                     
*COMPND   5 SYNONYM: K3 PEPTIDE OF BETA2-MICROGLOBULIN;                          
*COMPND   6 ENGINEERED: YES                                                      
*SOURCE    MOL_ID: 1;                                                            
*SOURCE   2 ORGANISM_SCIENTIFIC: HOMO SAPIENS;                                   
*SOURCE   3 ORGANISM_COMMON: HUMAN;                                              
*SOURCE   4 GENE: B2M;                                                           
*SOURCE   5 EXPRESSION_SYSTEM: ESCHERICHIA COLI;                                 
*SOURCE   6 EXPRESSION_SYSTEM_COMMON: BACTERIA;                                  
*SOURCE   7 EXPRESSION_SYSTEM_VECTOR_TYPE: PLASMID;                              
*SOURCE   8 EXPRESSION_SYSTEM_PLASMID: PAED4                                     
*KEYWDS    BETA2-MICROGLOBULIN                                                   
*EXPDTA    NMR, 10 STRUCTURES                                                    
*AUTHOR    T.FUJIWARA                                                            
*REVDAT   1   13-FEB-07 2E8D    0                                                

!!K3 amyloid fibrils (20% TFE 10 mM HCl) for 4 mol(1)
!!Distance restraints

!Molecular A (1-22)
!Ser20
!Asn21
!Phe22
assign ( resid 3 and name CA ) ( resid 4 and name CD1# ) 4.5 2.0 2.0 !Phe22Ca-Leu23Cd
assign ( resid 3 and name CE1# ) ( resid 5 and name CA ) 3.5 1.0 1.0 !Phe22Ce-Asn24Ca
assign ( resid 3 and name CZ ) ( resid 5 and name CA ) 3.5 1.0 1.0 !Phe22Cz-Asn24Ca
assign ( resid 3 and name CD2# ) ( resid 20 and name CG ) 4.5 2.0 2.0 !Phe22Cd-Leu39Cr
!Leu23
!Asn24
assign ( resid 5 and name CB ) ( resid 18 and name CG1# ) 4.5 2.0 2.0 !Asn24Cb-Val37Cr
!Cys25
!Tyr26
assign ( resid 7 and name CG ) ( resid 7 and name C ) 3.5 1.0 1.0 !Tyr26Cd-Tyr26Co
assign ( resid 7 and name CD2# ) ( resid 8 and name CA ) 4.0 1.5 1.5 !Tyr26Ce-Val27Ca
!Val27
!Ser28
!assign ( resid 9 and name CB ) ( resid 11 and name CA ) 3.5 1.0 1.0 !Ser28Cb-Phe30Ca
!Gly29
!Phe30
assign ( resid 11 and name CE2# ) ( resid 16 and name CG1# ) 4.0 1.5 1.5 !Phe30Ce-Ile35Cg
!His31
!Pro32
!Ser33
!Asp34
!Ile35
!Glu36
assign ( resid 17 and name CA ) ( resid 18 and name CG2# ) 4.0 1.5 1.5 !Glu36Ca-Val37Cg
!Val37
assign ( resid 18 and name CA ) ( resid 17 and name CG ) 4.0 1.5 1.5 !Val37Ca-Glu36Cg
assign ( resid 18 and name CG1# ) ( resid 19 and name CA ) 3.5 1.0 1.0 !Val37Cg-Asp38Ca
!Asp38
assign ( resid 19 and name CA ) ( resid 20 and name CD1# ) 4.5 2.0 2.0 !Asp38Ca-Leu39Cd
!Leu39
!Leu40
!Lys41

!Molecular B (23-44)
!Ser20
!Asn21
!Phe22
assign ( resid 25 and name CA ) ( resid 26 and name CD1# ) 4.5 2.0 2.0 !Phe22Ca-Leu23Cd
assign ( resid 25 and name CE1# ) ( resid 27 and name CA ) 3.5 1.0 1.0 !Phe22Ce-Asn24Ca
assign ( resid 25 and name CZ ) ( resid 27 and name CA ) 3.5 1.0 1.0 !Phe22Cz-Asn24Ca
assign ( resid 25 and name CD2# ) ( resid 42 and name CG ) 4.5 2.0 2.0 !Phe22Cd-Leu39Cr
!Leu23
!Asn24
assign ( resid 27 and name CB ) ( resid 40 and name CG1# ) 4.5 2.0 2.0 !Asn24Cb-Val37Cr
!Cys25
!Tyr26
assign ( resid 29 and name CG ) ( resid 29 and name C ) 3.5 1.0 1.0 !Tyr26Cd-Tyr26Co
assign ( resid 29 and name CD2# ) ( resid 30 and name CA ) 4.0 1.5 1.5 !Tyr26Ce-Val27Ca
!Val27
!Ser28
!assign ( resid 31 and name CB ) ( resid 33 and name CA ) 3.5 1.0 1.0 !Ser28Cb-Phe30Ca
!Gly29
!Phe30
assign ( resid 33 and name CE2# ) ( resid 38 and name CG1# ) 4.0 1.5 1.5 !Phe30Ce-Ile35Cg
!His31
!Pro32
!Ser33
!Asp34
!Ile35
!Glu36
assign ( resid 39 and name CA ) ( resid 40 and name CG2# ) 4.0 1.5 1.5 !Glu36Ca-Val37Cg
!Val37
assign ( resid 40 and name CA ) ( resid 39 and name CG ) 4.0 1.5 1.5 !Val37Ca-Glu36Cg
assign ( resid 40 and name CG1# ) ( resid 41 and name CA ) 3.5 1.0 1.0 !Val37Cg-Asp38Ca
!Asp38
assign ( resid 41 and name CA ) ( resid 42 and name CD1# ) 4.5 2.0 2.0 !Asp38Ca-Leu39Cd
!Leu39
!Leu40
!Lys41

!Molecular C (45-66)
!Ser20
!Asn21
!Phe22
assign ( resid 47 and name CA ) ( resid 48 and name CD1# ) 4.5 2.0 2.0 !Phe22Ca-Leu23Cd
assign ( resid 47 and name CE1# ) ( resid 49 and name CA ) 3.5 1.0 1.0 !Phe22Ce-Asn24Ca
assign ( resid 47 and name CZ ) ( resid 49 and name CA ) 3.5 1.0 1.0 !Phe22Cz-Asn24Ca
assign ( resid 47 and name CD2# ) ( resid 64 and name CG ) 4.5 2.0 2.0 !Phe22Cd-Leu39Cr
!Leu23
!Asn24
assign ( resid 49 and name CB ) ( resid 62 and name CG1# ) 4.5 2.0 2.0 !Asn24Cb-Val37Cr
!Cys25
!Tyr26
assign ( resid 51 and name CG ) ( resid 51 and name C ) 3.5 1.0 1.0 !Tyr26Ce-Val27Co
assign ( resid 51 and name CD2# ) ( resid 52 and name CA ) 4.0 1.5 1.5 !Tyr26Ce-Val27Ca
!Val27
!Ser28
!assign ( resid 53 and name CB ) ( resid 55 and name CA ) 3.5 1.0 1.0 !Ser28Cb-Phe30Ca
!Gly29
!Phe30
assign ( resid 55 and name CE2# ) ( resid 60 and name CG1# ) 4.0 1.5 1.5 !Phe30Ce-Ile35Cg
!His31
!Pro32
!Ser33
!Asp34
!Ile35
!Glu36
assign ( resid 61 and name CA ) ( resid 62 and name CG2# ) 4.0 1.5 1.5 !Glu36Ca-Val37Cg
!Val37
assign ( resid 62 and name CA ) ( resid 61 and name CG ) 4.0 1.5 1.5 !Val37Ca-Glu36Cg
assign ( resid 62 and name CG1# ) ( resid 63 and name CA ) 3.5 1.0 1.0 !Val37Cg-Asp38Ca
!Asp38
assign ( resid 63 and name CA ) ( resid 64 and name CD1# ) 4.5 2.0 2.0 !Asp38Ca-Leu39Cd
!Leu39
!Leu40
!Lys41

!Molecular D (67-88)
!Ser20
!Asn21
!Phe22
assign ( resid 69 and name CA ) ( resid 70 and name CD1# ) 4.5 2.0 2.0 !Phe22Ca-Leu23Cd
assign ( resid 69 and name CE1# ) ( resid 71 and name CA ) 3.5 1.0 1.0 !Phe22Ca-Asn24Ca
assign ( resid 69 and name CZ ) ( resid 71 and name CA ) 3.5 1.0 1.0 !Phe22Cz-Asn24Ca
assign ( resid 69 and name CD2# ) ( resid 86 and name CG ) 4.5 2.0 2.0 !Phe22Cd-Leu39Cr
!Leu23
!Asn24
assign ( resid 71 and name CB ) ( resid 84 and name CG1# ) 4.5 2.0 2.0 !Asn24Cb-Val37Cr
!Cys25
!Tyr26
assign ( resid 73 and name CG ) ( resid 71 and name C ) 3.5 1.0 1.0 !Tyr26Ce-Tyr26Co
assign ( resid 73 and name CD2# ) ( resid 74 and name CA ) 4.0 1.5 1.5 !Tyr26Ce-Val27Ca
!Val27
!Ser28
!assign ( resid 75 and name CB ) ( resid 77 and name CA ) 3.5 1.0 1.0 !Ser28Cb-Phe30Ca
!Gly29
!Phe30
assign ( resid 77 and name CE2# ) ( resid 82 and name CG1# ) 4.0 1.5 1.5 !Phe30Ce-Ile35Cg
!His31
!Pro32
!Ser33
!Asp34
!Ile35
!Glu36
assign ( resid 83 and name CA ) ( resid 84 and name CG2# ) 4.0 1.5 1.5 !Glu36Ca-Val37Cg
!Val37
assign ( resid 84 and name CA ) ( resid 83 and name CG ) 4.0 1.5 1.5 !Val37Ca-Glu36Cg
assign ( resid 84 and name CG1# ) ( resid 85 and name CA ) 3.5 1.0 1.0 !Val37Cg-Asp38Ca
!Asp38
assign ( resid 85 and name CA ) ( resid 86 and name CD1# ) 4.5 2.0 2.0 !Asp38Ca-Leu39Cd
!Leu39
!Leu40
!Lys41

!!Inter-molecular (Mol A-Mol B)

!!Sidechain

assign ( resid 3 and name CZ ) ( resid 42 and name CD1# ) 2.5 0.5 0.5 !Phe22Cz-Leu39Cd
assign ( resid 3 and name CZ ) ( resid 42 and name CG ) 3.5 1.0 1.0 !Phe22Cz-Leu39Cg
assign ( resid 3 and name CE2# ) ( resid 42 and name CG )  3.5 1.0 1.0 !Phe22Ce-Leu39Cg
assign ( resid 3 and name CE1# ) ( resid 40 and name CG1# ) 4.0 1.5 1.5 !Phe22Ce-Val37Cg
assign ( resid 7 and name CE1# ) ( resid 33 and name CE1# ) 3.5 1.0 1.0 !Tyr26Ce-Phe30Ce
assign ( resid 7 and name CZ ) ( resid 33 and name CZ ) 3.5 1.0 1.0 !Tyr26Cz-Phe30Cz
assign ( resid 11 and name CE2# ) ( resid 36 and name CB ) 3.5 1.0 1.0 !Phe30Ce-Ser33Cb

!!Hydrogen Bond

assign ( resid 3 and name HN ) ( resid 24 and name O ) 1.8 0.5 0.5 !Phe22HN-Asn21CO
assign ( resid 5 and name HN ) ( resid 26 and name O ) 1.8 0.5 0.5 !Asn24HN-Leu23CO
assign ( resid 7 and name HN ) ( resid 28 and name O ) 1.8 0.5 0.5 !Tyr26HN-Cys25CO
assign ( resid 9 and name HN ) ( resid 30 and name O ) 1.8 0.5 0.5 !Ser28HN-Val27CO
assign ( resid 26 and name HN ) ( resid 3 and name O ) 1.8 0.5 0.5 !Phe22CO-Leu23NH
assign ( resid 28 and name HN ) ( resid 5 and name O ) 1.8 0.5 0.5 !Asn24CO-Cys25NH
assign ( resid 30 and name HN ) ( resid 7 and name O ) 1.8 0.5 0.5 !Tyr26CO-Val27NH

assign ( resid 16 and name HN ) ( resid 37 and name O ) 1.8 0.5 0.5 !Ile35HN-Asp34CO
assign ( resid 18 and name HN ) ( resid 39 and name O ) 1.8 0.5 0.5 !Val37HN-Glu36CO
assign ( resid 20 and name HN ) ( resid 41 and name O ) 1.8 0.5 0.5 !Leu39HN-Asp38CO
assign ( resid 37 and name HN ) ( resid 14 and name O ) 1.8 0.5 0.5 !Ser33CO-Asn34NH
assign ( resid 39 and name HN ) ( resid 16 and name O ) 1.8 0.5 0.5 !Ile35CO-Glu36NH
assign ( resid 41 and name HN ) ( resid 18 and name O ) 1.8 0.5 0.5 !Val37CO-Asn38NH
assign ( resid 43 and name HN ) ( resid 20 and name O ) 1.8 0.5 0.5 !Leu39CO-Leu40NH

!!Inter-molecular (Mol B-Mol C)

!!Sidechain

assign ( resid 25 and name CZ ) ( resid 64 and name CD1# ) 2.5 0.5 0.5 !Phe22Cz-Leu39Cd
assign ( resid 25 and name CZ ) ( resid 64 and name CG ) 3.5 1.0 1.0 !Phe22Cz-Leu39Cg
assign ( resid 25 and name CE2# ) ( resid 64 and name CG )  3.5 1.0 1.0 !Phe22Ce-Leu39Cg
assign ( resid 25 and name CE1# ) ( resid 62 and name CG1# ) 4.0 1.5 1.5 !Phe22Ce-Val37Cg
assign ( resid 29 and name CE1# ) ( resid 55 and name CE1# ) 3.5 1.0 1.0 !Tyr26Ce-Phe30Ce
assign ( resid 29 and name CZ ) ( resid 55 and name CZ ) 3.5 1.0 1.0 !Tyr26Cz-Phe30Cz
assign ( resid 33 and name CE2# ) ( resid 58 and name CB ) 3.5 1.0 1.0 !Phe30Ce-Ser33Cb

!!Hydrogen Bond

assign ( resid 25 and name HN ) ( resid 46 and name O ) 1.8 0.5 0.5 !Phe22HN-Asn21CO
assign ( resid 27 and name HN ) ( resid 48 and name O ) 1.8 0.5 0.5 !Asn24HN-Leu23CO
assign ( resid 29 and name HN ) ( resid 50 and name O ) 1.8 0.5 0.5 !Tyr26HN-Cys25CO
assign ( resid 31 and name HN ) ( resid 52 and name O ) 1.8 0.5 0.5 !Ser28HN-Val27CO
assign ( resid 48 and name HN ) ( resid 25 and name O ) 1.8 0.5 0.5 !Phe22CO-Leu23NH
assign ( resid 50 and name HN ) ( resid 27 and name O ) 1.8 0.5 0.5 !Asn24CO-Cys25NH
assign ( resid 52 and name HN ) ( resid 29 and name O ) 1.8 0.5 0.5 !Tyr26CO-Val27NH

assign ( resid 38 and name HN ) ( resid 59 and name O ) 1.8 0.5 0.5 !Ile35HN-Asp34CO
assign ( resid 40 and name HN ) ( resid 61 and name O ) 1.8 0.5 0.5 !Val37HN-Glu36CO
assign ( resid 42 and name HN ) ( resid 63 and name O ) 1.8 0.5 0.5 !Leu39HN-Asp38CO
assign ( resid 59 and name HN ) ( resid 36 and name O ) 1.8 0.5 0.5 !Ser33CO-Asn34NH
assign ( resid 61 and name HN ) ( resid 38 and name O ) 1.8 0.5 0.5 !Ile35CO-Glu36NH
assign ( resid 63 and name HN ) ( resid 40 and name O ) 1.8 0.5 0.5 !Val37CO-Asn38NH
assign ( resid 65 and name HN ) ( resid 42 and name O ) 1.8 0.5 0.5 !Leu39CO-Leu40NH

!!Inter-molecular (Mol C-Mol D)

!!Sidechain

assign ( resid 47 and name CZ ) ( resid 86 and name CD1# ) 2.5 0.5 0.5 !Phe22Cz-Leu39Cd
assign ( resid 47 and name CZ ) ( resid 86 and name CG ) 3.5 1.0 1.0 !Phe22Cz-Leu39Cg
assign ( resid 47 and name CE2# ) ( resid 86 and name CG )  3.5 1.0 1.0 !Phe22Ce-Leu39Cg
assign ( resid 47 and name CE1# ) ( resid 84 and name CG1# ) 4.0 1.5 1.5 !Phe22Ce-Val37Cg
assign ( resid 51 and name CE1# ) ( resid 77 and name CE1# ) 3.5 1.0 1.0 !Tyr26Ce-Phe30Ce
assign ( resid 51 and name CZ ) ( resid 77 and name CZ ) 3.5 1.0 1.0 !Tyr26Cz-Phe30Cz
assign ( resid 55 and name CE2# ) ( resid 80 and name CB ) 3.5 1.0 1.0 !Phe30Ce-Ser33Cb


!!Hydrogen Bond

assign ( resid 47 and name HN ) ( resid 68 and name O ) 1.8 0.5 0.5 !Phe22HN-Asn21CO
assign ( resid 49 and name HN ) ( resid 70 and name O ) 1.8 0.5 0.5 !Asn24HN-Leu23CO
assign ( resid 51 and name HN ) ( resid 72 and name O ) 1.8 0.5 0.5 !Tyr26HN-Cys25CO
assign ( resid 53 and name HN ) ( resid 74 and name O ) 1.8 0.5 0.5 !Ser28HN-Val27CO
assign ( resid 70 and name HN ) ( resid 47 and name O ) 1.8 0.5 0.5 !Phe22CO-Leu23NH
assign ( resid 72 and name HN ) ( resid 49 and name O ) 1.8 0.5 0.5 !Asn24CO-Cys25NH
assign ( resid 74 and name HN ) ( resid 51 and name O ) 1.8 0.5 0.5 !Tyr26CO-Val27NH

assign ( resid 60 and name HN ) ( resid 81 and name O ) 1.8 0.5 0.5 !Ile35HN-Asp34CO
assign ( resid 62 and name HN ) ( resid 83 and name O ) 1.8 0.5 0.5 !Val37HN-Glu36CO
assign ( resid 64 and name HN ) ( resid 85 and name O ) 1.8 0.5 0.5 !Leu39HN-Asp38CO
assign ( resid 81 and name HN ) ( resid 58 and name O ) 1.8 0.5 0.5 !Ser33CO-Asn34NH
assign ( resid 83 and name HN ) ( resid 60 and name O ) 1.8 0.5 0.5 !Ile35CO-Glu36NH
assign ( resid 85 and name HN ) ( resid 62 and name O ) 1.8 0.5 0.5 !Val37CO-Asn38NH
assign ( resid 87 and name HN ) ( resid 64 and name O ) 1.8 0.5 0.5 !Leu39CO-Leu40NH





!! PHI restraints

!!Molecular A (1-22)
 
!! N21 
assign ( resid 1 and name c)   ( resid 2 and name n)
       ( resid 2 and name ca)    ( resid 2 and name c) 1.0 -125.000 7.000 2
!! F22 
assign ( resid 2 and name c)   ( resid 3 and name n)
       ( resid 3 and name ca)    ( resid 3 and name c) 1.0 -123.000 9.000 2
!! L23 
assign ( resid 3 and name c)   ( resid 4 and name n)
       ( resid 4 and name ca)    ( resid 4 and name c) 1.0 -122.000 19.000 2
!! N24 
assign ( resid 4 and name c)   ( resid 5 and name n)
       ( resid 5 and name ca)    ( resid 5 and name c) 1.0 -118.000 21.000 2
!! C25 
assign ( resid 5 and name c)   ( resid 6 and name n)
       ( resid 6 and name ca)    ( resid 6 and name c) 1.0 -108.000 18.000 2
!! Y26 
assign ( resid 6 and name c)   ( resid 7 and name n)
       ( resid 7 and name ca)    ( resid 7 and name c) 1.0 -115.000 9.000 2
!! V27 
assign ( resid 7 and name c)   ( resid 8 and name n)
       ( resid 8 and name ca)    ( resid 8 and name c) 1.0 -121.000 8.000 2
!! S28 
assign ( resid 8 and name c)   ( resid 9 and name n)
       ( resid 9 and name ca)    ( resid 9 and name c) 1.0 -119.000 12.000 2
!! G29 
!!assign ( resid 9 and name c)   ( resid 10 and name n)
       !!( resid 10 and name ca)    ( resid 10 and name c) 1.0 72.000 9.000 2
!! F30 
assign ( resid 10 and name c)   ( resid 11 and name n)
       ( resid 11 and name ca)    ( resid 11 and name c) 1.0 -105.0 20.0 2
!! H31 
!!assign ( resid 11 and name c)   ( resid 12 and name n)
       !!( resid 12 and name ca)    ( resid 12 and name c) 1.0 -88.0 37.0 2
!! P32 
!!assign ( resid 12 and name c)   ( resid 13 and name n)
       !!( resid 13 and name ca)    ( resid 13 and name c) 1.0 -78.0 25.0 2
!! S33 
assign ( resid 13 and name c)   ( resid 14 and name n)
       ( resid 14 and name ca)    ( resid 14 and name c) 1.0 -103.0 23.0 2
!! D34
assign ( resid 14 and name c)   ( resid 15 and name n)
       ( resid 15 and name ca)    ( resid 15 and name c) 1.0 -97.0 13.0 2
!! I35 
assign ( resid 15 and name c)   ( resid 16 and name n)
       ( resid 16 and name ca)    ( resid 16 and name c) 1.0 -126.0 13.0 2
!! E36 
assign ( resid 16 and name c)   ( resid 17 and name n)
       ( resid 17 and name ca)    ( resid 17 and name c) 1.0 -110.0 19.0 2
!! V37 
assign ( resid 17 and name c)   ( resid 18 and name n)
       ( resid 18 and name ca)    ( resid 18 and name c) 1.0 -112.0 10.0 2
!! D38 
assign ( resid 18 and name c)   ( resid 19 and name n)
       ( resid 19 and name ca)    ( resid 19 and name c) 1.0 -107.0 19.0 2
!! L39 
assign ( resid 19 and name c)   ( resid 20 and name n)
       ( resid 20 and name ca)    ( resid 20 and name c) 1.0 -121.0 20.0 2
!! L40 
assign ( resid 20 and name c)   ( resid 21 and name n)
       ( resid 21 and name ca)    ( resid 21 and name c) 1.0 -117.0 18.0 2

!!Molecular B (23-44)


!! N21 
assign ( resid 23 and name c)   ( resid 24 and name n)
       ( resid 24 and name ca)    ( resid 24 and name c) 1.0 -125.000 7.000 2
!! F22 
assign ( resid 24 and name c)   ( resid 25 and name n)
       ( resid 25 and name ca)    ( resid 25 and name c) 1.0 -123.000 9.000 2
!! L23 
assign ( resid 25 and name c)   ( resid 26 and name n)
       ( resid 26 and name ca)    ( resid 26 and name c) 1.0 -122.000 19.000 2
!! N24 
assign ( resid 26 and name c)   ( resid 27 and name n)
       ( resid 27 and name ca)    ( resid 27 and name c) 1.0 -118.000 21.000 2
!! C25 
assign ( resid 27 and name c)   ( resid 28 and name n)
       ( resid 28 and name ca)    ( resid 28 and name c) 1.0 -108.000 18.000 2
!! Y26 
assign ( resid 28 and name c)   ( resid 29 and name n)
       ( resid 29 and name ca)    ( resid 29 and name c) 1.0 -115.000 9.000 2
!! V27 
assign ( resid 29 and name c)   ( resid 30 and name n)
       ( resid 30 and name ca)    ( resid 30 and name c) 1.0 -121.000 8.000 2
!! S28 
assign ( resid 30 and name c)   ( resid 31 and name n)
       ( resid 31 and name ca)    ( resid 31 and name c) 1.0 -119.000 12.000 2
!! G29 
!!assign ( resid 31 and name c)   ( resid 32 and name n)
       !!( resid 32 and name ca)    ( resid 32 and name c) 1.0 72.000 9.000 2
!! F30 
assign ( resid 32 and name c)   ( resid 33 and name n)
       ( resid 33 and name ca)    ( resid 33 and name c) 1.0 -105.0 20.0 2
!! H31 
!!assign ( resid 33 and name c)   ( resid 34 and name n)
       !!( resid 34 and name ca)    ( resid 34 and name c) 1.0 -88.0 37.0 2
!! P32 
!!assign ( resid 34 and name c)   ( resid 35 and name n)
       !!( resid 35 and name ca)    ( resid 35 and name c) 1.0 -78.0 25.0 2
!! S33 
assign ( resid 35 and name c)   ( resid 36 and name n)
       ( resid 36 and name ca)    ( resid 36 and name c) 1.0 -103.0 23.0 2
!! D34
assign ( resid 36 and name c)   ( resid 37 and name n)
       ( resid 37 and name ca)    ( resid 37 and name c) 1.0 -97.0 13.0 2
!! I35 
assign ( resid 37 and name c)   ( resid 38 and name n)
       ( resid 38 and name ca)    ( resid 38 and name c) 1.0 -126.0 13.0 2
!! E36 
assign ( resid 38 and name c)   ( resid 39 and name n)
       ( resid 39 and name ca)    ( resid 39 and name c) 1.0 -110.0 19.0 2
!! V37 
assign ( resid 39 and name c)   ( resid 40 and name n)
       ( resid 40 and name ca)    ( resid 40 and name c) 1.0 -112.0 10.0 2
!! D38 
assign ( resid 40 and name c)   ( resid 41 and name n)
       ( resid 41 and name ca)    ( resid 41 and name c) 1.0 -107.0 19.0 2
!! L39 
assign ( resid 41 and name c)   ( resid 42 and name n)
       ( resid 42 and name ca)    ( resid 42 and name c) 1.0 -121.0 20.0 2
!! L40 
assign ( resid 42 and name c)   ( resid 43 and name n)
       ( resid 43 and name ca)    ( resid 43 and name c) 1.0 -117.0 18.0 2

!!Molecular C (45-66)


!! N21 
assign ( resid 45 and name c)   ( resid 46 and name n)
       ( resid 46 and name ca)    ( resid 46 and name c) 1.0 -125.000 7.000 2
!! F22 
assign ( resid 46 and name c)   ( resid 47 and name n)
       ( resid 47 and name ca)    ( resid 47 and name c) 1.0 -123.000 9.000 2
!! L23 
assign ( resid 47 and name c)   ( resid 48 and name n)
       ( resid 48 and name ca)    ( resid 48 and name c) 1.0 -122.000 19.000 2
!! N24 
assign ( resid 48 and name c)   ( resid 49 and name n)
       ( resid 49 and name ca)    ( resid 49 and name c) 1.0 -118.000 21.000 2
!! C25 
assign ( resid 49 and name c)   ( resid 50 and name n)
       ( resid 50 and name ca)    ( resid 50 and name c) 1.0 -108.000 18.000 2
!! Y26 
assign ( resid 50 and name c)   ( resid 51 and name n)
       ( resid 51 and name ca)    ( resid 51 and name c) 1.0 -115.000 9.000 2
!! V27 
assign ( resid 51 and name c)   ( resid 52 and name n)
       ( resid 52 and name ca)    ( resid 52 and name c) 1.0 -121.000 8.000 2
!! S28 
assign ( resid 52 and name c)   ( resid 53 and name n)
       ( resid 53 and name ca)    ( resid 53 and name c) 1.0 -119.000 12.000 2
!! G29 
!!assign ( resid 53 and name c)   ( resid 54 and name n)
       !!( resid 54 and name ca)    ( resid 54 and name c) 1.0 72.000 9.000 2
!! F30 
assign ( resid 54 and name c)   ( resid 55 and name n)
       ( resid 55 and name ca)    ( resid 55 and name c) 1.0 -105.0 20.0 2
!! H31 
!!assign ( resid 55 and name c)   ( resid 56 and name n)
       !!( resid 56 and name ca)    ( resid 56 and name c) 1.0 -88.0 37.0 2
!! P32 
!!assign ( resid 56 and name c)   ( resid 57 and name n)
       !!( resid 57 and name ca)    ( resid 57 and name c) 1.0 -78.0 25.0 2
!! S33 
assign ( resid 57 and name c)   ( resid 58 and name n)
       ( resid 58 and name ca)    ( resid 58 and name c) 1.0 -103.0 23.0 2
!! D34
assign ( resid 58 and name c)   ( resid 59 and name n)
       ( resid 59 and name ca)    ( resid 59 and name c) 1.0 -97.0 13.0 2
!! I35 
assign ( resid 59 and name c)   ( resid 60 and name n)
       ( resid 60 and name ca)    ( resid 60 and name c) 1.0 -126.0 13.0 2
!! E36 
assign ( resid 60 and name c)   ( resid 61 and name n)
       ( resid 61 and name ca)    ( resid 61 and name c) 1.0 -110.0 19.0 2
!! V37 
assign ( resid 61 and name c)   ( resid 62 and name n)
       ( resid 62 and name ca)    ( resid 62 and name c) 1.0 -112.0 10.0 2
!! D38 
assign ( resid 62 and name c)   ( resid 63 and name n)
       ( resid 63 and name ca)    ( resid 63 and name c) 1.0 -107.0 19.0 2
!! L39 
assign ( resid 63 and name c)   ( resid 64 and name n)
       ( resid 64 and name ca)    ( resid 64 and name c) 1.0 -121.0 20.0 2
!! L40 
assign ( resid 64 and name c)   ( resid 65 and name n)
       ( resid 65 and name ca)    ( resid 65 and name c) 1.0 -117.0 18.0 2

!!Molecular D (67-88)


!! N21 
assign ( resid 67 and name c)   ( resid 68 and name n)
       ( resid 68 and name ca)    ( resid 68 and name c) 1.0 -125.000 7.000 2
!! F22 
assign ( resid 68 and name c)   ( resid 69 and name n)
       ( resid 69 and name ca)    ( resid 69 and name c) 1.0 -123.000 9.000 2
!! L23 
assign ( resid 69 and name c)   ( resid 70 and name n)
       ( resid 70 and name ca)    ( resid 70 and name c) 1.0 -122.000 19.000 2
!! N24 
assign ( resid 70 and name c)   ( resid 71 and name n)
       ( resid 71 and name ca)    ( resid 71 and name c) 1.0 -118.000 21.000 2
!! C25 
assign ( resid 71 and name c)   ( resid 72 and name n)
       ( resid 72 and name ca)    ( resid 72 and name c) 1.0 -108.000 18.000 2
!! Y26 
assign ( resid 72 and name c)   ( resid 73 and name n)
       ( resid 73 and name ca)    ( resid 73 and name c) 1.0 -115.000 9.000 2
!! V27 
assign ( resid 73 and name c)   ( resid 74 and name n)
       ( resid 74 and name ca)    ( resid 74 and name c) 1.0 -121.000 8.000 2
!! S28 
assign ( resid 74 and name c)   ( resid 75 and name n)
       ( resid 75 and name ca)    ( resid 75 and name c) 1.0 -119.000 12.000 2
!! G29 
!!assign ( resid 75 and name c)   ( resid 76 and name n)
       !!( resid 76 and name ca)    ( resid 76 and name c) 1.0 72.000 9.000 2
!! F30 
assign ( resid 76 and name c)   ( resid 77 and name n)
       ( resid 77 and name ca)    ( resid 77 and name c) 1.0 -105.0 20.0 2
!! H31 
!!assign ( resid 77 and name c)   ( resid 78 and name n)
       !!( resid 78 and name ca)    ( resid 78 and name c) 1.0 -88.0 37.0 2
!! P32 
!!assign ( resid 78 and name c)   ( resid 79 and name n)
       !!( resid 79 and name ca)    ( resid 79 and name c) 1.0 -78.0 25.0 2
!! S33 
assign ( resid 79 and name c)   ( resid 80 and name n)
       ( resid 80 and name ca)    ( resid 80 and name c) 1.0 -103.0 23.0 2
!! D34
assign ( resid 80 and name c)   ( resid 81 and name n)
       ( resid 81 and name ca)    ( resid 81 and name c) 1.0 -97.0 13.0 2
!! I35 
assign ( resid 81 and name c)   ( resid 82 and name n)
       ( resid 82 and name ca)    ( resid 82 and name c) 1.0 -126.0 13.0 2
!! E36 
assign ( resid 82 and name c)   ( resid 83 and name n)
       ( resid 83 and name ca)    ( resid 83 and name c) 1.0 -110.0 19.0 2
!! V37 
assign ( resid 83 and name c)   ( resid 84 and name n)
       ( resid 84 and name ca)    ( resid 84 and name c) 1.0 -112.0 10.0 2
!! D38 
assign ( resid 84 and name c)   ( resid 85 and name n)
       ( resid 85 and name ca)    ( resid 85 and name c) 1.0 -107.0 19.0 2
!! L39 
assign ( resid 85 and name c)   ( resid 86 and name n)
       ( resid 86 and name ca)    ( resid 86 and name c) 1.0 -121.0 20.0 2
!! L40 
assign ( resid 86 and name c)   ( resid 87 and name n)
       ( resid 88 and name ca)    ( resid 87 and name c) 1.0 -117.0 18.0 2


!! PSI restraints 


!!Molecular A (1-22)
 
!! N21 
assign ( resid 2 and name n)     ( resid 2 and name ca)
       ( resid 2 and name c)    ( resid 3 and name n) 1.0 143.0 18.0 2 
!! F22 
assign ( resid 3 and name n)     ( resid 3 and name ca)
       ( resid 3 and name c)    ( resid 4 and name n) 1.0 140.0 14.0 2 
!! L23 
assign ( resid 4 and name n)     ( resid 4 and name ca)
       ( resid 4 and name c)    ( resid 5 and name n) 1.0 127.0 8.0 2 
!! N24 
assign ( resid 5 and name n)     ( resid 5 and name ca)
       ( resid 5 and name c)    ( resid 6 and name n) 1.0 127.0 10.0 2 
!! C25 
assign ( resid 6 and name n)     ( resid 6 and name ca)
       ( resid 6 and name c)    ( resid 7 and name n) 1.0 123.0 9.0 2 
!! Y26 
assign ( resid 7 and name n)     ( resid 7 and name ca)
       ( resid 7 and name c)    ( resid 8 and name n) 1.0 126.0 10.0 2 
!! V27 
assign ( resid 8 and name n)     ( resid 8 and name ca)
       ( resid 8 and name c)    ( resid 9 and name n) 1.0 134.0 11.0 2 
!! S28 
assign ( resid 9 and name n)     ( resid 9 and name ca)
       ( resid 9 and name c)    ( resid 10 and name n) 1.0 146.0 16.0 2 
!! G29 
!!assign ( resid 10 and name n)     ( resid 10 and name ca)
       !!( resid 10 and name c)    ( resid 11 and name n) 1.0 18.0 5.0 2 
!! F30 
assign ( resid 11 and name n)     ( resid 11 and name ca)
       ( resid 11 and name c)    ( resid 12 and name n) 1.0 117.0 22.0 2 
!! H31 
!!assign ( resid 12 and name n)     ( resid 12 and name ca)
       !!( resid 12 and name c)    ( resid 13 and name n) 1.0 136.0 11.0 2 
!! P32 
!!assign ( resid 13 and name n)     ( resid 13 and name ca)
       !!( resid 13 and name c)    ( resid 14 and name n) 1.0 132.0 13.0 2 
!! S33 
assign ( resid 14 and name n)     ( resid 14 and name ca)
       ( resid 14 and name c)    ( resid 15 and name n) 1.0 117.0 22.0 2
!! D34 
assign ( resid 15 and name n)     ( resid 15 and name ca)
       ( resid 15 and name c)    ( resid 16 and name n) 1.0 117.0 13.0 2
!! I35 
assign ( resid 16 and name n)     ( resid 16 and name ca)
       ( resid 16 and name c)    ( resid 17 and name n) 1.0 136.0 12.0 2
!! E36 
assign ( resid 17 and name n)     ( resid 17 and name ca)
       ( resid 17 and name c)    ( resid 18 and name n) 1.0 130.0 8.0 2
!! V37 
assign ( resid 18 and name n)     ( resid 18 and name ca)
       ( resid 18 and name c)    ( resid 19 and name n) 1.0 128.0 12.0 2
!! D38 
assign ( resid 19 and name n)     ( resid 19 and name ca)
       ( resid 19 and name c)    ( resid 20 and name n) 1.0 124.0 16.0 2
!! L39 
assign ( resid 20 and name n)     ( resid 20 and name ca)
       ( resid 20 and name c)    ( resid 21 and name n) 1.0 136.0 14.0 2
!! L40 
assign ( resid 21 and name n)     ( resid 21 and name ca)
       ( resid 21 and name c)    ( resid 22 and name n) 1.0 139.0 26.0 2

!!Molecular B (23-44)


!! N21 
assign ( resid 24 and name n)     ( resid 24 and name ca)
       ( resid 24 and name c)    ( resid 25 and name n) 1.0 143.0 18.0 2 
!! F22 
assign ( resid 25 and name n)     ( resid 25 and name ca)
       ( resid 25 and name c)    ( resid 26 and name n) 1.0 140.0 14.0 2 
!! L23 
assign ( resid 26 and name n)     ( resid 26 and name ca)
       ( resid 26 and name c)    ( resid 27 and name n) 1.0 127.0 8.0 2 
!! N24 
assign ( resid 27 and name n)     ( resid 27 and name ca)
       ( resid 27 and name c)    ( resid 28 and name n) 1.0 127.0 10.0 2 
!! C25 
assign ( resid 28 and name n)     ( resid 28 and name ca)
       ( resid 28 and name c)    ( resid 29 and name n) 1.0 123.0 9.0 2 
!! Y26 
assign ( resid 29 and name n)     ( resid 29 and name ca)
       ( resid 29 and name c)    ( resid 30 and name n) 1.0 126.0 10.0 2 
!! V27 
assign ( resid 30 and name n)     ( resid 30 and name ca)
       ( resid 30 and name c)    ( resid 31 and name n) 1.0 134.0 11.0 2 
!! S28 
assign ( resid 31 and name n)     ( resid 31 and name ca)
       ( resid 31 and name c)    ( resid 32 and name n) 1.0 146.0 16.0 2 
!! G29 
!!assign ( resid 32 and name n)     ( resid 32 and name ca)
       !!( resid 32 and name c)    ( resid 33 and name n) 1.0 18.0 5.0 2 
!! F30 
assign ( resid 33 and name n)     ( resid 33 and name ca)
       ( resid 33 and name c)    ( resid 34 and name n) 1.0 117.0 22.0 2 
!! H31 
!!assign ( resid 34 and name n)     ( resid 34 and name ca)
       !!( resid 34 and name c)    ( resid 35 and name n) 1.0 136.0 11.0 2 
!! P32 
!!assign ( resid 35 and name n)     ( resid 35 and name ca)
       !!( resid 35 and name c)    ( resid 36 and name n) 1.0 132.0 13.0 2 
!! S33 
assign ( resid 36 and name n)     ( resid 36 and name ca)
       ( resid 36 and name c)    ( resid 37 and name n) 1.0 117.0 22.0 2
!! D34 
assign ( resid 37 and name n)     ( resid 37 and name ca)
       ( resid 37 and name c)    ( resid 38 and name n) 1.0 117.0 13.0 2
!! I35 
assign ( resid 38 and name n)     ( resid 38 and name ca)
       ( resid 38 and name c)    ( resid 39 and name n) 1.0 136.0 12.0 2
!! E36 
assign ( resid 39 and name n)     ( resid 39 and name ca)
       ( resid 39 and name c)    ( resid 40 and name n) 1.0 130.0 8.0 2
!! V37 
assign ( resid 40 and name n)     ( resid 40 and name ca)
       ( resid 40 and name c)    ( resid 41 and name n) 1.0 128.0 12.0 2
!! D38 
assign ( resid 41 and name n)     ( resid 41 and name ca)
       ( resid 41 and name c)    ( resid 42 and name n) 1.0 124.0 16.0 2
!! L39 
assign ( resid 42 and name n)     ( resid 42 and name ca)
       ( resid 42 and name c)    ( resid 43 and name n) 1.0 136.0 14.0 2
!! L40 
assign ( resid 43 and name n)     ( resid 43 and name ca)
       ( resid 43 and name c)    ( resid 44 and name n) 1.0 139.0 26.0 2

!!Molecular C (45-66)


!! N21 
assign ( resid 46 and name n)     ( resid 46 and name ca)
       ( resid 46 and name c)    ( resid 47 and name n) 1.0 143.0 18.0 2 
!! F22 
assign ( resid 47 and name n)     ( resid 47 and name ca)
       ( resid 47 and name c)    ( resid 48 and name n) 1.0 140.0 14.0 2 
!! L23 
assign ( resid 48 and name n)     ( resid 48 and name ca)
       ( resid 48 and name c)    ( resid 49 and name n) 1.0 127.0 8.0 2 
!! N24 
assign ( resid 49 and name n)     ( resid 49 and name ca)
       ( resid 49 and name c)    ( resid 50 and name n) 1.0 127.0 10.0 2 
!! C25 
assign ( resid 50 and name n)     ( resid 50 and name ca)
       ( resid 50 and name c)    ( resid 51 and name n) 1.0 123.0 9.0 2 
!! Y26 
assign ( resid 51 and name n)     ( resid 51 and name ca)
       ( resid 51 and name c)    ( resid 52 and name n) 1.0 126.0 10.0 2 
!! V27 
assign ( resid 52 and name n)     ( resid 52 and name ca)
       ( resid 52 and name c)    ( resid 53 and name n) 1.0 134.0 11.0 2 
!! S28 
assign ( resid 53 and name n)     ( resid 53 and name ca)
       ( resid 53 and name c)    ( resid 54 and name n) 1.0 146.0 16.0 2 
!! G29 
!!assign ( resid 54 and name n)     ( resid 54 and name ca)
       !!( resid 54 and name c)    ( resid 55 and name n) 1.0 18.0 5.0 2 
!! F30 
assign ( resid 55 and name n)     ( resid 55 and name ca)
       ( resid 55 and name c)    ( resid 56 and name n) 1.0 117.0 22.0 2 
!! H31 
!!assign ( resid 56 and name n)     ( resid 56 and name ca)
       !!( resid 56 and name c)    ( resid 57 and name n) 1.0 136.0 11.0 2 
!! P32 
!!assign ( resid 57 and name n)     ( resid 57 and name ca)
       !!( resid 57 and name c)    ( resid 58 and name n) 1.0 132.0 13.0 2 
!! S33 
assign ( resid 58 and name n)     ( resid 58 and name ca)
       ( resid 58 and name c)    ( resid 59 and name n) 1.0 117.0 22.0 2
!! D34 
assign ( resid 59 and name n)     ( resid 59 and name ca)
       ( resid 59 and name c)    ( resid 60 and name n) 1.0 117.0 13.0 2
!! I35 
assign ( resid 60 and name n)     ( resid 60 and name ca)
       ( resid 60 and name c)    ( resid 61 and name n) 1.0 136.0 12.0 2
!! E36 
assign ( resid 61 and name n)     ( resid 61 and name ca)
       ( resid 61 and name c)    ( resid 62 and name n) 1.0 130.0 8.0 2
!! V37 
assign ( resid 62 and name n)     ( resid 62 and name ca)
       ( resid 62 and name c)    ( resid 63 and name n) 1.0 128.0 12.0 2
!! D38 
assign ( resid 63 and name n)     ( resid 63 and name ca)
       ( resid 63 and name c)    ( resid 64 and name n) 1.0 124.0 16.0 2
!! L39 
assign ( resid 64 and name n)     ( resid 64 and name ca)
       ( resid 64 and name c)    ( resid 65 and name n) 1.0 136.0 14.0 2
!! L40 
assign ( resid 65 and name n)     ( resid 65 and name ca)
       ( resid 65 and name c)    ( resid 66 and name n) 1.0 139.0 26.0 2

!!Molecular D (67-88)


!! N21 
assign ( resid 68 and name n)     ( resid 68 and name ca)
       ( resid 68 and name c)    ( resid 69 and name n) 1.0 143.0 18.0 2 
!! F22 
assign ( resid 69 and name n)     ( resid 69 and name ca)
       ( resid 69 and name c)    ( resid 70 and name n) 1.0 140.0 14.0 2 
!! L23 
assign ( resid 70 and name n)     ( resid 70 and name ca)
       ( resid 70 and name c)    ( resid 71 and name n) 1.0 127.0 8.0 2 
!! N24 
assign ( resid 71 and name n)     ( resid 71 and name ca)
       ( resid 71 and name c)    ( resid 72 and name n) 1.0 127.0 10.0 2 
!! C25 
assign ( resid 72 and name n)     ( resid 72 and name ca)
       ( resid 72 and name c)    ( resid 73 and name n) 1.0 123.0 9.0 2 
!! Y26 
assign ( resid 73 and name n)     ( resid 73 and name ca)
       ( resid 73 and name c)    ( resid 74 and name n) 1.0 126.0 10.0 2 
!! V27 
assign ( resid 74 and name n)     ( resid 74 and name ca)
       ( resid 74 and name c)    ( resid 75 and name n) 1.0 134.0 11.0 2 
!! S28 
assign ( resid 75 and name n)     ( resid 75 and name ca)
       ( resid 75 and name c)    ( resid 76 and name n) 1.0 146.0 16.0 2 
!! G29 
!!assign ( resid 76 and name n)     ( resid 76 and name ca)
       !!( resid 76 and name c)    ( resid 77 and name n) 1.0 18.0 5.0 2 
!! F30 
assign ( resid 77 and name n)     ( resid 77 and name ca)
       ( resid 77 and name c)    ( resid 78 and name n) 1.0 117.0 22.0 2 
!! H31 
!!assign ( resid 78 and name n)     ( resid 78 and name ca)
       !!( resid 78 and name c)    ( resid 79 and name n) 1.0 136.0 11.0 2 
!! P32 
!!assign ( resid 79 and name n)     ( resid 79 and name ca)
       !!( resid 79 and name c)    ( resid 80 and name n) 1.0 132.0 13.0 2 
!! S33 
assign ( resid 80 and name n)     ( resid 80 and name ca)
       ( resid 80 and name c)    ( resid 81 and name n) 1.0 117.0 22.0 2
!! D34 
assign ( resid 81 and name n)     ( resid 81 and name ca)
       ( resid 81 and name c)    ( resid 82 and name n) 1.0 117.0 13.0 2
!! I35 
assign ( resid 82 and name n)     ( resid 82 and name ca)
       ( resid 82 and name c)    ( resid 83 and name n) 1.0 136.0 12.0 2
!! E36 
assign ( resid 83 and name n)     ( resid 83 and name ca)
       ( resid 83 and name c)    ( resid 84 and name n) 1.0 130.0 8.0 2
!! V37 
assign ( resid 84 and name n)     ( resid 84 and name ca)
       ( resid 84 and name c)    ( resid 85 and name n) 1.0 128.0 12.0 2
!! D38 
assign ( resid 85 and name n)     ( resid 85 and name ca)
       ( resid 85 and name c)    ( resid 86 and name n) 1.0 124.0 16.0 2
!! L39 
assign ( resid 86 and name n)     ( resid 86 and name ca)
       ( resid 86 and name c)    ( resid 87 and name n) 1.0 136.0 14.0 2
!! L40 
assign ( resid 87 and name n)     ( resid 87 and name ca)
       ( resid 87 and name c)    ( resid 88 and name n) 1.0 139.0 26.0 2


  Entry H atom name         Submitted Coord H atom name
  Start of MODEL    1
    1   1H    SER   1          1HT       SER   1  15.144   4.912  -8.472
    2   2H    SER   1          2HT       SER   1  16.619   5.454  -9.161
    3   3H    SER   1          3HT       SER   1  15.398   6.585  -8.739
    4    HA   SER   1           HA       SER   1  16.645   4.814  -6.765
    5   1HB   SER   1          2HB       SER   1  18.266   6.543  -6.306
    6   2HB   SER   1          1HB       SER   1  18.356   6.160  -8.026
    7    HG   SER   1           HG       SER   1  16.893   8.004  -8.309
    8    H    ASN   2           H        ASN   2  13.903   5.720  -7.144
    9    HA   ASN   2           HA       ASN   2  13.330   6.594  -4.545
   10   1HB   ASN   2          2HB       ASN   2  12.508   8.869  -4.981
   11   2HB   ASN   2          1HB       ASN   2  14.235   8.743  -5.301
   12   1HD2  ASN   2          1HD2      ASN   2  14.927   8.599  -7.502
   13   2HD2  ASN   2          2HD2      ASN   2  13.964   9.286  -8.761
   14    H    PHE   3           H        PHE   3  11.596   5.329  -4.343
   15    HA   PHE   3           HA       PHE   3   9.660   5.157  -6.523
   16   1HB   PHE   3          2HB       PHE   3  10.582   3.116  -5.293
   17   2HB   PHE   3          1HB       PHE   3   9.584   3.617  -3.932
   18    HD1  PHE   3           1HD      PHE   3   7.055   4.127  -4.605
   19    HD2  PHE   3           2HD      PHE   3   9.705   1.574  -6.742
   20    HE1  PHE   3           1HE      PHE   3   5.130   2.954  -5.589
   21    HE2  PHE   3           2HE      PHE   3   7.781   0.397  -7.724
   22    HZ   PHE   3           HZ       PHE   3   5.490   1.088  -7.145
   23    H    LEU   4           H        LEU   4   7.569   5.832  -6.387
   24    HA   LEU   4           HA       LEU   4   6.698   7.081  -3.876
   25   1HB   LEU   4          2HB       LEU   4   7.433   8.485  -6.169
   26   2HB   LEU   4          1HB       LEU   4   5.680   8.467  -6.214
   27    HG   LEU   4           HG       LEU   4   5.999   9.214  -3.669
   28   1HD1  LEU   4          1HD1      LEU   4   7.891  10.477  -3.239
   29   2HD1  LEU   4          2HD1      LEU   4   8.303  10.629  -4.947
   30   3HD1  LEU   4          3HD1      LEU   4   8.543   9.092  -4.115
   31   1HD2  LEU   4          1HD2      LEU   4   6.195  11.043  -6.058
   32   2HD2  LEU   4          2HD2      LEU   4   5.718  11.526  -4.430
   33   3HD2  LEU   4          3HD2      LEU   4   4.710  10.409  -5.349
   34    H    ASN   5           H        ASN   5   5.552   5.028  -3.670
   35    HA   ASN   5           HA       ASN   5   3.557   4.229  -5.518
   36   1HB   ASN   5          2HB       ASN   5   4.566   2.722  -3.806
   37   2HB   ASN   5          1HB       ASN   5   3.710   3.618  -2.557
   38   1HD2  ASN   5          1HD2      ASN   5   2.353   2.092  -1.833
   39   2HD2  ASN   5          2HD2      ASN   5   1.147   1.316  -2.797
   40    H    CYS   6           H        CYS   6   1.977   5.633  -6.045
   41    HA   CYS   6           HA       CYS   6   0.515   6.933  -3.839
   42   1HB   CYS   6          2HB       CYS   6  -0.119   8.680  -5.486
   43   2HB   CYS   6          1HB       CYS   6   1.618   8.592  -5.213
   44    HG   CYS   6           HG       CYS   6   0.731   8.720  -7.831
   45    H    TYR   7           H        TYR   7  -1.770   7.161  -4.065
   46    HA   TYR   7           HA       TYR   7  -3.321   6.145  -6.141
   47   1HB   TYR   7          2HB       TYR   7  -2.452   3.955  -5.660
   48   2HB   TYR   7          1HB       TYR   7  -2.757   4.153  -3.938
   49    HD1  TYR   7           1HD      TYR   7  -4.162   2.284  -3.573
   50    HD2  TYR   7           2HD      TYR   7  -5.103   5.054  -6.662
   51    HE1  TYR   7           1HE      TYR   7  -6.367   1.230  -3.838
   52    HE2  TYR   7           2HE      TYR   7  -7.311   4.009  -6.934
   53    HH   TYR   7           HH       TYR   7  -8.109   1.015  -5.570
   54    H    VAL   8           H        VAL   8  -5.061   7.366  -5.862
   55    HA   VAL   8           HA       VAL   8  -6.225   7.555  -3.162
   56    HB   VAL   8           HB       VAL   8  -5.146   9.679  -3.696
   57   1HG1  VAL   8          1HG1      VAL   8  -5.399  10.853  -5.628
   58   2HG1  VAL   8          2HG1      VAL   8  -7.033  10.253  -5.912
   59   3HG1  VAL   8          3HG1      VAL   8  -5.643   9.225  -6.260
   60   1HG2  VAL   8          1HG2      VAL   8  -6.790  10.792  -2.678
   61   2HG2  VAL   8          2HG2      VAL   8  -7.760   9.329  -2.850
   62   3HG2  VAL   8          3HG2      VAL   8  -7.872  10.609  -4.059
   63    H    SER   9           H        SER   9  -7.847   6.084  -3.459
   64    HA   SER   9           HA       SER   9  -9.829   5.215  -4.165
   65   1HB   SER   9          2HB       SER   9 -10.424   7.678  -3.629
   66   2HB   SER   9          1HB       SER   9 -10.490   7.889  -5.379
   67    HG   SER   9           HG       SER   9 -12.429   7.079  -3.925
   68    H    GLY  10           H        GLY  10 -11.258   4.842  -6.137
   69   1HA   GLY  10          2HA       GLY  10 -11.499   4.738  -8.496
   70   2HA   GLY  10          1HA       GLY  10  -9.818   5.221  -8.664
   71    H    PHE  11           H        PHE  11  -8.671   3.660  -9.570
   72    HA   PHE  11           HA       PHE  11  -7.777   1.621 -10.036
   73   1HB   PHE  11          2HB       PHE  11  -7.378   1.496  -7.619
   74   2HB   PHE  11          1HB       PHE  11  -8.994   0.844  -7.377
   75    HD1  PHE  11           1HD      PHE  11  -5.718   0.152  -8.953
   76    HD2  PHE  11           2HD      PHE  11  -9.411  -1.450  -7.573
   77    HE1  PHE  11           1HE      PHE  11  -4.837  -2.125  -9.256
   78    HE2  PHE  11           2HE      PHE  11  -8.537  -3.731  -7.872
   79    HZ   PHE  11           HZ       PHE  11  -6.248  -4.071  -8.713
   80    H    HIS  12           H        HIS  12  -8.365  -0.076 -11.285
   81    HA   HIS  12           HA       HIS  12 -11.215  -0.468 -11.706
   82   1HB   HIS  12          2HB       HIS  12  -8.755  -1.337 -13.217
   83   2HB   HIS  12          1HB       HIS  12 -10.364  -1.920 -13.631
   84    HD1  HIS  12           1HD      HIS  12 -11.437  -0.607 -15.420
   85    HD2  HIS  12           2HD      HIS  12  -8.786   1.700 -13.202
   86    HE1  HIS  12           1HE      HIS  12 -11.471   1.669 -16.488
   87    HE2  HIS  12           2HE      HIS  12  -9.908   3.066 -15.090
   88    HA   PRO  13           HA       PRO  13 -11.554  -4.284  -9.528
   89   1HB   PRO  13          2HB       PRO  13 -13.328  -5.638 -11.098
   90   2HB   PRO  13          1HB       PRO  13 -13.792  -4.313 -10.023
   91   1HG   PRO  13          2HG       PRO  13 -13.285  -4.272 -12.974
   92   2HG   PRO  13          1HG       PRO  13 -14.576  -3.482 -12.047
   93   1HD   PRO  13          2HD       PRO  13 -12.402  -2.140 -12.914
   94   2HD   PRO  13          1HD       PRO  13 -13.207  -1.744 -11.383
   95    H    SER  14           H        SER  14  -9.509  -5.200  -9.739
   96    HA   SER  14           HA       SER  14  -9.331  -7.606 -11.175
   97   1HB   SER  14          2HB       SER  14  -9.040  -5.840 -13.029
   98   2HB   SER  14          1HB       SER  14  -7.459  -5.536 -12.308
   99    HG   SER  14           HG       SER  14  -8.422  -7.991 -13.355
  100    H    ASP  15           H        ASP  15  -6.741  -8.137 -11.378
  101    HA   ASP  15           HA       ASP  15  -5.698  -7.592  -8.680
  102   1HB   ASP  15          2HB       ASP  15  -6.192  -9.952  -9.088
  103   2HB   ASP  15          1HB       ASP  15  -5.169  -9.935 -10.522
  104    H    ILE  16           H        ILE  16  -4.623  -5.664  -9.230
  105    HA   ILE  16           HA       ILE  16  -2.014  -6.076 -10.403
  106    HB   ILE  16           HB       ILE  16  -2.205  -4.269 -12.058
  107   1HG1  ILE  16          2HG1      ILE  16  -5.178  -4.370 -11.513
  108   2HG1  ILE  16          1HG1      ILE  16  -4.110  -3.099 -10.927
  109   1HG2  ILE  16          1HG2      ILE  16  -4.317  -6.353 -12.553
  110   2HG2  ILE  16          2HG2      ILE  16  -2.585  -6.670 -12.649
  111   3HG2  ILE  16          3HG2      ILE  16  -3.332  -5.509 -13.747
  112   1HD1  ILE  16          1HD1      ILE  16  -3.776  -3.442 -13.753
  113   2HD1  ILE  16          2HD1      ILE  16  -4.273  -2.013 -12.845
  114   3HD1  ILE  16          3HD1      ILE  16  -5.477  -3.197 -13.358
  115    H    GLU  17           H        GLU  17  -1.057  -3.629 -10.686
  116    HA   GLU  17           HA       GLU  17  -1.698  -1.498  -9.170
  117   1HB   GLU  17          2HB       GLU  17  -1.081  -3.697  -7.415
  118   2HB   GLU  17          1HB       GLU  17   0.107  -2.422  -7.201
  119   1HG   GLU  17          2HG       GLU  17  -2.870  -2.246  -6.863
  120   2HG   GLU  17          1HG       GLU  17  -1.615  -2.027  -5.645
  121    H    VAL  18           H        VAL  18   1.290  -3.283  -8.514
  122    HA   VAL  18           HA       VAL  18   2.912  -2.513 -10.565
  123    HB   VAL  18           HB       VAL  18   2.284  -0.225  -8.847
  124   1HG1  VAL  18          1HG1      VAL  18   4.609   0.705  -8.944
  125   2HG1  VAL  18          2HG1      VAL  18   5.173  -0.917  -9.345
  126   3HG1  VAL  18          3HG1      VAL  18   4.387  -0.614  -7.795
  127   1HG2  VAL  18          1HG2      VAL  18   3.940   0.099 -11.255
  128   2HG2  VAL  18          2HG2      VAL  18   2.444   0.907 -10.784
  129   3HG2  VAL  18          3HG2      VAL  18   2.389  -0.704 -11.501
  130    H    ASP  19           H        ASP  19   4.567  -3.853 -10.281
  131    HA   ASP  19           HA       ASP  19   5.795  -4.052  -7.626
  132   1HB   ASP  19          2HB       ASP  19   5.994  -6.550  -7.991
  133   2HB   ASP  19          1HB       ASP  19   4.372  -5.959  -7.642
  134    H    LEU  20           H        LEU  20   7.980  -4.372  -7.618
  135    HA   LEU  20           HA       LEU  20   9.377  -5.063 -10.056
  136   1HB   LEU  20          2HB       LEU  20  10.646  -3.077 -10.272
  137   2HB   LEU  20          1HB       LEU  20   8.967  -2.586 -10.169
  138    HG   LEU  20           HG       LEU  20  11.047  -2.382  -7.993
  139   1HD1  LEU  20          1HD1      LEU  20   9.469  -0.231  -9.386
  140   2HD1  LEU  20          2HD1      LEU  20  11.112  -0.700  -9.825
  141   3HD1  LEU  20          3HD1      LEU  20  10.784  -0.021  -8.230
  142   1HD2  LEU  20          1HD2      LEU  20   9.139  -2.868  -6.774
  143   2HD2  LEU  20          2HD2      LEU  20   8.074  -2.074  -7.934
  144   3HD2  LEU  20          3HD2      LEU  20   9.091  -1.107  -6.867
  145    H    LEU  21           H        LEU  21  10.672  -6.613  -9.341
  146    HA   LEU  21           HA       LEU  21  11.772  -6.486  -6.650
  147   1HB   LEU  21          2HB       LEU  21  11.734  -8.619  -8.770
  148   2HB   LEU  21          1HB       LEU  21  12.693  -8.776  -7.311
  149    HG   LEU  21           HG       LEU  21   9.700  -8.392  -7.332
  150   1HD1  LEU  21          1HD1      LEU  21  10.592 -10.557  -8.346
  151   2HD1  LEU  21          2HD1      LEU  21   9.431 -10.696  -7.025
  152   3HD1  LEU  21          3HD1      LEU  21  11.150 -10.945  -6.718
  153   1HD2  LEU  21          1HD2      LEU  21  10.194  -9.443  -4.962
  154   2HD2  LEU  21          2HD2      LEU  21  10.306  -7.705  -5.242
  155   3HD2  LEU  21          3HD2      LEU  21  11.769  -8.691  -5.219
  156    H    LYS  22           H        LYS  22  12.770  -6.140  -9.964
  157    HA   LYS  22           HA       LYS  22  14.707  -5.422 -10.912
  158   1HB   LYS  22          2HB       LYS  22  14.542  -3.816  -8.889
  159   2HB   LYS  22          1HB       LYS  22  15.802  -4.816  -8.178
  160   1HG   LYS  22          2HG       LYS  22  16.800  -4.304 -10.674
  161   2HG   LYS  22          1HG       LYS  22  15.964  -2.802 -10.279
  162   1HD   LYS  22          2HD       LYS  22  17.184  -2.813  -8.085
  163   2HD   LYS  22          1HD       LYS  22  18.131  -4.171  -8.694
  164   1HE   LYS  22          2HE       LYS  22  19.477  -2.348  -9.187
  165   2HE   LYS  22          1HE       LYS  22  18.622  -2.624 -10.704
  166   1HZ   LYS  22          1HZ       LYS  22  18.219  -0.434 -10.530
  167   2HZ   LYS  22          2HZ       LYS  22  18.438  -0.397  -8.854
  168   3HZ   LYS  22          3HZ       LYS  22  16.967  -0.923  -9.501
  169   1H    SER  23          1HT       SER  23  16.351   2.276  -0.543
  170   2H    SER  23          2HT       SER  23  14.931   2.617  -1.446
  171   3H    SER  23          3HT       SER  23  14.975   2.929   0.241
  172    HA   SER  23           HA       SER  23  16.444   4.672   0.005
  173   1HB   SER  23          2HB       SER  23  17.079   5.082  -2.592
  174   2HB   SER  23          1HB       SER  23  18.084   4.137  -1.492
  175    HG   SER  23           HG       SER  23  17.389   2.304  -2.399
  176    H    ASN  24           H        ASN  24  14.711   5.952   0.463
  177    HA   ASN  24           HA       ASN  24  13.031   7.447   0.130
  178   1HB   ASN  24          2HB       ASN  24  14.809   7.958  -1.845
  179   2HB   ASN  24          1HB       ASN  24  13.385   7.568  -2.807
  180   1HD2  ASN  24          1HD2      ASN  24  14.249   9.450   0.077
  181   2HD2  ASN  24          2HD2      ASN  24  13.279  10.822  -0.320
  182    H    PHE  25           H        PHE  25  11.167   6.398   0.529
  183    HA   PHE  25           HA       PHE  25   9.688   5.380  -1.770
  184   1HB   PHE  25          2HB       PHE  25  10.293   3.270  -1.163
  185   2HB   PHE  25          1HB       PHE  25  10.676   3.741   0.488
  186    HD1  PHE  25           1HD      PHE  25   8.152   2.404  -1.745
  187    HD2  PHE  25           2HD      PHE  25   8.898   3.865   2.182
  188    HE1  PHE  25           1HE      PHE  25   6.056   1.374  -0.966
  189    HE2  PHE  25           2HE      PHE  25   6.806   2.838   2.965
  190    HZ   PHE  25           HZ       PHE  25   5.383   1.590   1.393
  191    H    LEU  26           H        LEU  26   7.621   6.005  -1.735
  192    HA   LEU  26           HA       LEU  26   6.451   6.847   0.831
  193   1HB   LEU  26          2HB       LEU  26   6.276   8.298  -1.810
  194   2HB   LEU  26          1HB       LEU  26   5.320   8.699  -0.395
  195    HG   LEU  26           HG       LEU  26   7.518   9.088   0.820
  196   1HD1  LEU  26          1HD1      LEU  26   9.189   9.829  -1.210
  197   2HD1  LEU  26          2HD1      LEU  26   8.492   8.332  -1.830
  198   3HD1  LEU  26          3HD1      LEU  26   9.321   8.341  -0.273
  199   1HD2  LEU  26          1HD2      LEU  26   7.877  11.269  -0.665
  200   2HD2  LEU  26          2HD2      LEU  26   6.490  11.069   0.404
  201   3HD2  LEU  26          3HD2      LEU  26   6.325  10.751  -1.322
  202    H    ASN  27           H        ASN  27   4.712   5.673   1.258
  203    HA   ASN  27           HA       ASN  27   3.167   4.558  -0.981
  204   1HB   ASN  27          2HB       ASN  27   4.057   2.884   0.560
  205   2HB   ASN  27          1HB       ASN  27   3.289   3.697   1.919
  206   1HD2  ASN  27          1HD2      ASN  27   0.936   3.816   1.893
  207   2HD2  ASN  27          2HD2      ASN  27   0.043   2.519   1.182
  208    H    CYS  28           H        CYS  28   1.906   6.386  -1.405
  209    HA   CYS  28           HA       CYS  28   0.207   7.389   0.752
  210   1HB   CYS  28          2HB       CYS  28   1.415   8.979  -0.762
  211   2HB   CYS  28          1HB       CYS  28   0.424   8.390  -2.092
  212    HG   CYS  28           HG       CYS  28  -1.032   9.666   0.318
  213    H    TYR  29           H        TYR  29  -1.573   6.230   1.088
  214    HA   TYR  29           HA       TYR  29  -3.265   5.597  -1.223
  215   1HB   TYR  29          2HB       TYR  29  -2.099   3.530  -0.602
  216   2HB   TYR  29          1HB       TYR  29  -2.661   3.701   1.056
  217    HD1  TYR  29           1HD      TYR  29  -3.726   1.515   1.037
  218    HD2  TYR  29           2HD      TYR  29  -4.859   4.511  -1.765
  219    HE1  TYR  29           1HE      TYR  29  -5.744   0.225   0.483
  220    HE2  TYR  29           2HE      TYR  29  -6.882   3.229  -2.325
  221    HH   TYR  29           HH       TYR  29  -7.330   0.008  -1.412
  222    H    VAL  30           H        VAL  30  -5.292   6.295  -0.970
  223    HA   VAL  30           HA       VAL  30  -6.413   6.508   1.724
  224    HB   VAL  30           HB       VAL  30  -5.476   8.715   1.288
  225   1HG1  VAL  30          1HG1      VAL  30  -5.681   9.871  -0.635
  226   2HG1  VAL  30          2HG1      VAL  30  -7.339   9.337  -0.905
  227   3HG1  VAL  30          3HG1      VAL  30  -5.992   8.276  -1.320
  228   1HG2  VAL  30          1HG2      VAL  30  -8.462   8.902   0.965
  229   2HG2  VAL  30          2HG2      VAL  30  -7.383  10.007   1.817
  230   3HG2  VAL  30          3HG2      VAL  30  -7.692   8.398   2.469
  231    H    SER  31           H        SER  31  -8.708   6.665   1.789
  232    HA   SER  31           HA       SER  31 -10.852   6.301   1.102
  233   1HB   SER  31          2HB       SER  31 -10.106   7.790  -0.877
  234   2HB   SER  31          1HB       SER  31  -9.972   6.276  -1.776
  235    HG   SER  31           HG       SER  31 -12.148   7.695  -1.310
  236    H    GLY  32           H        GLY  32 -12.200   4.576   0.250
  237   1HA   GLY  32          2HA       GLY  32 -10.660   2.111  -0.290
  238   2HA   GLY  32          1HA       GLY  32 -12.033   2.140   0.806
  239    H    PHE  33           H        PHE  33 -12.685   0.356  -0.708
  240    HA   PHE  33           HA       PHE  33 -14.783   1.195  -2.353
  241   1HB   PHE  33          2HB       PHE  33 -13.891   0.547  -4.581
  242   2HB   PHE  33          1HB       PHE  33 -13.086   1.961  -3.908
  243    HD1  PHE  33           1HD      PHE  33 -10.797   1.782  -3.028
  244    HD2  PHE  33           2HD      PHE  33 -12.713  -1.483  -4.971
  245    HE1  PHE  33           1HE      PHE  33  -8.616   0.680  -3.320
  246    HE2  PHE  33           2HE      PHE  33 -10.538  -2.589  -5.267
  247    HZ   PHE  33           HZ       PHE  33  -8.485  -1.509  -4.442
  248    H    HIS  34           H        HIS  34 -15.253  -0.781  -4.043
  249    HA   HIS  34           HA       HIS  34 -15.942  -2.966  -2.434
  250   1HB   HIS  34          2HB       HIS  34 -15.626  -3.100  -5.431
  251   2HB   HIS  34          1HB       HIS  34 -16.744  -4.004  -4.418
  252    HD1  HIS  34           1HD      HIS  34 -17.797  -1.488  -2.808
  253    HD2  HIS  34           2HD      HIS  34 -17.545  -1.819  -6.942
  254    HE1  HIS  34           1HE      HIS  34 -19.472   0.152  -3.717
  255    HE2  HIS  34           2HE      HIS  34 -19.376  -0.142  -6.217
  256    HA   PRO  35           HA       PRO  35 -12.599  -5.814  -2.203
  257   1HB   PRO  35          2HB       PRO  35 -14.126  -7.727  -3.907
  258   2HB   PRO  35          1HB       PRO  35 -13.369  -7.981  -2.330
  259   1HG   PRO  35          2HG       PRO  35 -16.005  -7.705  -2.524
  260   2HG   PRO  35          1HG       PRO  35 -15.114  -6.964  -1.181
  261   1HD   PRO  35          2HD       PRO  35 -16.259  -5.695  -3.628
  262   2HD   PRO  35          1HD       PRO  35 -16.152  -5.061  -1.974
  263    H    SER  36           H        SER  36 -10.833  -6.663  -3.358
  264    HA   SER  36           HA       SER  36 -10.692  -6.997  -6.130
  265   1HB   SER  36          2HB       SER  36  -9.801  -5.018  -6.978
  266   2HB   SER  36          1HB       SER  36 -11.013  -4.417  -5.847
  267    HG   SER  36           HG       SER  36  -8.520  -3.772  -5.863
  268    H    ASP  37           H        ASP  37  -8.205  -6.660  -6.833
  269    HA   ASP  37           HA       ASP  37  -6.601  -7.830  -4.655
  270   1HB   ASP  37          2HB       ASP  37  -6.936  -8.619  -7.499
  271   2HB   ASP  37          1HB       ASP  37  -5.321  -8.765  -6.816
  272    H    ILE  38           H        ILE  38  -5.530  -6.050  -3.958
  273    HA   ILE  38           HA       ILE  38  -4.095  -4.396  -5.906
  274    HB   ILE  38           HB       ILE  38  -4.455  -3.990  -2.930
  275   1HG1  ILE  38          2HG1      ILE  38  -5.861  -2.731  -5.294
  276   2HG1  ILE  38          1HG1      ILE  38  -6.579  -3.813  -4.104
  277   1HG2  ILE  38          1HG2      ILE  38  -2.416  -2.970  -4.100
  278   2HG2  ILE  38          2HG2      ILE  38  -3.443  -1.899  -3.148
  279   3HG2  ILE  38          3HG2      ILE  38  -3.578  -1.914  -4.905
  280   1HD1  ILE  38          1HD1      ILE  38  -5.350  -1.492  -2.878
  281   2HD1  ILE  38          2HD1      ILE  38  -6.979  -2.143  -2.699
  282   3HD1  ILE  38          3HD1      ILE  38  -6.603  -1.064  -4.043
  283    H    GLU  39           H        GLU  39  -2.115  -5.097  -6.422
  284    HA   GLU  39           HA       GLU  39  -0.496  -6.372  -4.311
  285   1HB   GLU  39          2HB       GLU  39  -1.202  -7.623  -6.501
  286   2HB   GLU  39          1HB       GLU  39   0.108  -6.699  -7.224
  287   1HG   GLU  39          2HG       GLU  39   1.683  -7.963  -6.275
  288   2HG   GLU  39          1HG       GLU  39   0.839  -8.025  -4.728
  289    H    VAL  40           H        VAL  40   0.906  -4.962  -3.486
  290    HA   VAL  40           HA       VAL  40   2.396  -3.234  -5.358
  291    HB   VAL  40           HB       VAL  40   1.766  -2.598  -2.472
  292   1HG1  VAL  40          1HG1      VAL  40   3.350  -1.258  -4.606
  293   2HG1  VAL  40          2HG1      VAL  40   3.675  -1.401  -2.878
  294   3HG1  VAL  40          3HG1      VAL  40   2.462  -0.258  -3.457
  295   1HG2  VAL  40          1HG2      VAL  40  -0.066  -1.432  -3.091
  296   2HG2  VAL  40          2HG2      VAL  40  -0.064  -2.555  -4.450
  297   3HG2  VAL  40          3HG2      VAL  40   0.632  -0.946  -4.635
  298    H    ASP  41           H        ASP  41   4.510  -3.620  -5.446
  299    HA   ASP  41           HA       ASP  41   5.891  -4.633  -3.072
  300   1HB   ASP  41          2HB       ASP  41   5.221  -6.544  -4.612
  301   2HB   ASP  41          1HB       ASP  41   6.335  -5.864  -5.794
  302    H    LEU  42           H        LEU  42   7.611  -3.420  -2.682
  303    HA   LEU  42           HA       LEU  42   8.932  -2.081  -4.951
  304   1HB   LEU  42          2HB       LEU  42   9.049  -0.998  -2.165
  305   2HB   LEU  42          1HB       LEU  42   9.278  -0.159  -3.686
  306    HG   LEU  42           HG       LEU  42   7.233   0.622  -2.797
  307   1HD1  LEU  42          1HD1      LEU  42   6.004  -1.363  -4.588
  308   2HD1  LEU  42          2HD1      LEU  42   7.364  -0.463  -5.258
  309   3HD1  LEU  42          3HD1      LEU  42   5.957   0.398  -4.634
  310   1HD2  LEU  42          1HD2      LEU  42   5.860  -1.973  -2.646
  311   2HD2  LEU  42          2HD2      LEU  42   5.756  -0.566  -1.588
  312   3HD2  LEU  42          3HD2      LEU  42   7.099  -1.697  -1.422
  313    H    LEU  43           H        LEU  43  10.844  -2.982  -5.341
  314    HA   LEU  43           HA       LEU  43  12.580  -3.617  -3.058
  315   1HB   LEU  43          2HB       LEU  43  11.363  -5.584  -4.448
  316   2HB   LEU  43          1HB       LEU  43  12.804  -5.374  -5.425
  317    HG   LEU  43           HG       LEU  43  13.907  -5.505  -2.950
  318   1HD1  LEU  43          1HD1      LEU  43  11.887  -7.675  -2.774
  319   2HD1  LEU  43          2HD1      LEU  43  11.425  -6.058  -2.242
  320   3HD1  LEU  43          3HD1      LEU  43  12.802  -6.871  -1.499
  321   1HD2  LEU  43          1HD2      LEU  43  13.367  -7.490  -5.093
  322   2HD2  LEU  43          2HD2      LEU  43  14.048  -8.069  -3.573
  323   3HD2  LEU  43          3HD2      LEU  43  14.899  -6.842  -4.510
  324    H    LYS  44           H        LYS  44  13.659  -1.646  -3.483
  325    HA   LYS  44           HA       LYS  44  15.627  -1.871  -5.622
  326   1HB   LYS  44          2HB       LYS  44  13.519   0.209  -5.461
  327   2HB   LYS  44          1HB       LYS  44  15.139   0.768  -5.853
  328   1HG   LYS  44          2HG       LYS  44  15.229  -0.586  -7.800
  329   2HG   LYS  44          1HG       LYS  44  13.759  -1.449  -7.341
  330   1HD   LYS  44          2HD       LYS  44  12.760   0.009  -8.736
  331   2HD   LYS  44          1HD       LYS  44  12.864   1.109  -7.360
  332   1HE   LYS  44          2HE       LYS  44  14.768   0.902  -9.687
  333   2HE   LYS  44          1HE       LYS  44  13.681   2.240  -9.313
  334   1HZ   LYS  44          1HZ       LYS  44  15.942   1.365  -7.597
  335   2HZ   LYS  44          2HZ       LYS  44  14.943   2.705  -7.334
  336   3HZ   LYS  44          3HZ       LYS  44  15.990   2.679  -8.662
  337   1H    SER  45          1HT       SER  45  14.710   2.242   4.505
  338   2H    SER  45          2HT       SER  45  15.364   3.208   5.765
  339   3H    SER  45          3HT       SER  45  16.326   1.998   5.019
  340    HA   SER  45           HA       SER  45  16.831   4.270   4.319
  341   1HB   SER  45          2HB       SER  45  15.754   2.582   2.061
  342   2HB   SER  45          1HB       SER  45  17.201   3.592   2.080
  343    HG   SER  45           HG       SER  45  16.801   1.027   3.080
  344    H    ASN  46           H        ASN  46  15.041   5.613   5.188
  345    HA   ASN  46           HA       ASN  46  13.405   7.167   4.907
  346   1HB   ASN  46          2HB       ASN  46  14.599   6.837   2.237
  347   2HB   ASN  46          1HB       ASN  46  12.976   7.518   2.227
  348   1HD2  ASN  46          1HD2      ASN  46  16.232   7.918   3.463
  349   2HD2  ASN  46          2HD2      ASN  46  16.116   9.618   3.749
  350    H    PHE  47           H        PHE  47  12.114   5.239   5.740
  351    HA   PHE  47           HA       PHE  47  10.255   4.139   3.783
  352   1HB   PHE  47          2HB       PHE  47  10.998   2.490   5.293
  353   2HB   PHE  47          1HB       PHE  47  10.828   3.558   6.681
  354    HD1  PHE  47           1HD      PHE  47   8.525   2.461   3.951
  355    HD2  PHE  47           2HD      PHE  47   9.236   2.796   8.129
  356    HE1  PHE  47           1HE      PHE  47   6.292   1.533   4.401
  357    HE2  PHE  47           2HE      PHE  47   7.006   1.867   8.588
  358    HZ   PHE  47           HZ       PHE  47   5.530   1.232   6.723
  359    H    LEU  48           H        LEU  48   8.702   5.532   3.218
  360    HA   LEU  48           HA       LEU  48   7.276   6.957   5.366
  361   1HB   LEU  48          2HB       LEU  48   8.579   8.189   3.429
  362   2HB   LEU  48          1HB       LEU  48   7.122   7.836   2.520
  363    HG   LEU  48           HG       LEU  48   6.572   9.031   5.130
  364   1HD1  LEU  48          1HD1      LEU  48   8.561  10.267   4.856
  365   2HD1  LEU  48          2HD1      LEU  48   7.255  11.324   4.318
  366   3HD1  LEU  48          3HD1      LEU  48   8.269  10.500   3.132
  367   1HD2  LEU  48          1HD2      LEU  48   5.789  10.341   2.610
  368   2HD2  LEU  48          2HD2      LEU  48   4.821   9.925   4.024
  369   3HD2  LEU  48          3HD2      LEU  48   5.216   8.687   2.831
  370    H    ASN  49           H        ASN  49   5.577   5.671   5.820
  371    HA   ASN  49           HA       ASN  49   3.867   4.839   3.568
  372   1HB   ASN  49          2HB       ASN  49   4.798   2.905   4.715
  373   2HB   ASN  49          1HB       ASN  49   4.232   3.517   6.266
  374   1HD2  ASN  49          1HD2      ASN  49   3.275   2.147   3.202
  375   2HD2  ASN  49          2HD2      ASN  49   1.702   1.637   3.700
  376    H    CYS  50           H        CYS  50   2.089   6.026   3.422
  377    HA   CYS  50           HA       CYS  50   0.788   6.914   5.909
  378   1HB   CYS  50          2HB       CYS  50   0.021   8.926   4.514
  379   2HB   CYS  50          1HB       CYS  50   1.694   8.906   5.057
  380    HG   CYS  50           HG       CYS  50   2.088   9.429   2.674
  381    H    TYR  51           H        TYR  51  -1.273   6.339   6.113
  382    HA   TYR  51           HA       TYR  51  -2.839   5.754   3.702
  383   1HB   TYR  51          2HB       TYR  51  -2.021   3.606   4.552
  384   2HB   TYR  51          1HB       TYR  51  -2.679   3.972   6.142
  385    HD1  TYR  51           1HD      TYR  51  -4.664   2.932   6.674
  386    HD2  TYR  51           2HD      TYR  51  -3.887   3.880   2.601
  387    HE1  TYR  51           1HE      TYR  51  -6.801   1.898   6.032
  388    HE2  TYR  51           2HE      TYR  51  -6.020   2.848   1.946
  389    HH   TYR  51           HH       TYR  51  -7.737   0.809   3.851
  390    H    VAL  52           H        VAL  52  -4.693   6.831   3.716
  391    HA   VAL  52           HA       VAL  52  -5.800   7.685   6.311
  392    HB   VAL  52           HB       VAL  52  -6.221   9.051   3.654
  393   1HG1  VAL  52          1HG1      VAL  52  -6.577  10.486   6.200
  394   2HG1  VAL  52          2HG1      VAL  52  -7.756   9.217   5.866
  395   3HG1  VAL  52          3HG1      VAL  52  -7.536  10.539   4.720
  396   1HG2  VAL  52          1HG2      VAL  52  -4.735  10.813   4.980
  397   2HG2  VAL  52          2HG2      VAL  52  -4.025   9.571   3.948
  398   3HG2  VAL  52          3HG2      VAL  52  -4.087   9.336   5.694
  399    H    SER  53           H        SER  53  -7.800   7.067   6.830
  400    HA   SER  53           HA       SER  53  -9.909   6.217   6.694
  401   1HB   SER  53          2HB       SER  53  -9.744   6.468   3.689
  402   2HB   SER  53          1HB       SER  53 -11.189   6.460   4.700
  403    HG   SER  53           HG       SER  53  -9.305   8.499   4.293
  404    H    GLY  54           H        GLY  54 -10.600   4.160   6.821
  405   1HA   GLY  54          2HA       GLY  54  -9.038   2.142   5.333
  406   2HA   GLY  54          1HA       GLY  54  -9.716   1.886   6.933
  407    H    PHE  55           H        PHE  55 -10.380  -0.071   5.474
  408    HA   PHE  55           HA       PHE  55 -13.191   0.319   4.889
  409   1HB   PHE  55          2HB       PHE  55 -12.862  -0.979   2.677
  410   2HB   PHE  55          1HB       PHE  55 -12.489   0.742   2.698
  411    HD1  PHE  55           1HD      PHE  55 -10.483   1.449   1.823
  412    HD2  PHE  55           2HD      PHE  55 -10.836  -2.561   3.201
  413    HE1  PHE  55           1HE      PHE  55  -8.221   0.968   0.988
  414    HE2  PHE  55           2HE      PHE  55  -8.574  -3.051   2.368
  415    HZ   PHE  55           HZ       PHE  55  -7.262  -1.284   1.260
  416    H    HIS  56           H        HIS  56 -14.192  -1.870   4.234
  417    HA   HIS  56           HA       HIS  56 -13.216  -3.835   6.147
  418   1HB   HIS  56          2HB       HIS  56 -15.761  -2.986   5.386
  419   2HB   HIS  56          1HB       HIS  56 -15.615  -4.597   4.692
  420    HD1  HIS  56           1HD      HIS  56 -15.077  -2.921   8.068
  421    HD2  HIS  56           2HD      HIS  56 -16.235  -6.564   6.439
  422    HE1  HIS  56           1HE      HIS  56 -15.727  -4.358  10.026
  423    HE2  HIS  56           2HE      HIS  56 -16.536  -6.514   9.007
  424    HA   PRO  57           HA       PRO  57 -13.102  -6.494   2.213
  425   1HB   PRO  57          2HB       PRO  57 -14.047  -5.616  -0.119
  426   2HB   PRO  57          1HB       PRO  57 -15.144  -6.136   1.165
  427   1HG   PRO  57          2HG       PRO  57 -14.400  -3.375   0.311
  428   2HG   PRO  57          1HG       PRO  57 -15.973  -4.003   0.831
  429   1HD   PRO  57          2HD       PRO  57 -14.176  -2.591   2.431
  430   2HD   PRO  57          1HD       PRO  57 -15.520  -3.587   3.020
  431    H    SER  58           H        SER  58 -12.246  -6.281  -0.333
  432    HA   SER  58           HA       SER  58 -10.576  -5.621  -1.744
  433   1HB   SER  58          2HB       SER  58  -9.653  -3.417   0.051
  434   2HB   SER  58          1HB       SER  58  -9.740  -3.471  -1.710
  435    HG   SER  58           HG       SER  58 -11.648  -2.726   0.134
  436    H    ASP  59           H        ASP  59  -8.362  -6.013  -1.957
  437    HA   ASP  59           HA       ASP  59  -7.022  -6.937   0.499
  438   1HB   ASP  59          2HB       ASP  59  -7.003  -8.191  -2.252
  439   2HB   ASP  59          1HB       ASP  59  -5.910  -8.663  -0.955
  440    H    ILE  60           H        ILE  60  -5.221  -5.857   0.931
  441    HA   ILE  60           HA       ILE  60  -3.670  -4.754  -1.315
  442    HB   ILE  60           HB       ILE  60  -2.996  -2.908   0.319
  443   1HG1  ILE  60          2HG1      ILE  60  -4.077  -4.105   2.286
  444   2HG1  ILE  60          1HG1      ILE  60  -4.429  -2.389   2.137
  445   1HG2  ILE  60          1HG2      ILE  60  -4.188  -1.921  -1.290
  446   2HG2  ILE  60          2HG2      ILE  60  -5.497  -1.905  -0.110
  447   3HG2  ILE  60          3HG2      ILE  60  -5.405  -3.198  -1.306
  448   1HD1  ILE  60          1HD1      ILE  60  -6.226  -4.593   2.258
  449   2HD1  ILE  60          2HD1      ILE  60  -6.441  -3.757   0.721
  450   3HD1  ILE  60          3HD1      ILE  60  -6.582  -2.867   2.237
  451    H    GLU  61           H        GLU  61  -1.845  -5.863  -1.422
  452    HA   GLU  61           HA       GLU  61  -0.540  -6.702   1.075
  453   1HB   GLU  61          2HB       GLU  61  -1.087  -8.510  -0.505
  454   2HB   GLU  61          1HB       GLU  61  -0.124  -7.715  -1.743
  455   1HG   GLU  61          2HG       GLU  61   1.887  -8.060  -0.478
  456   2HG   GLU  61          1HG       GLU  61   0.967  -8.709   0.879
  457    H    VAL  62           H        VAL  62   0.568  -4.843   1.593
  458    HA   VAL  62           HA       VAL  62   2.319  -3.618  -0.383
  459    HB   VAL  62           HB       VAL  62   1.924  -2.880   2.520
  460   1HG1  VAL  62          1HG1      VAL  62   3.755  -1.654   2.131
  461   2HG1  VAL  62          2HG1      VAL  62   2.690  -0.622   1.178
  462   3HG1  VAL  62          3HG1      VAL  62   3.648  -1.873   0.385
  463   1HG2  VAL  62          1HG2      VAL  62   0.770  -1.285   0.291
  464   2HG2  VAL  62          2HG2      VAL  62   0.211  -1.476   1.952
  465   3HG2  VAL  62          3HG2      VAL  62  -0.057  -2.765   0.778
  466    H    ASP  63           H        ASP  63   4.379  -4.179  -0.621
  467    HA   ASP  63           HA       ASP  63   5.814  -5.310   1.678
  468   1HB   ASP  63          2HB       ASP  63   5.629  -6.455  -1.103
  469   2HB   ASP  63          1HB       ASP  63   6.956  -6.857  -0.015
  470    H    LEU  64           H        LEU  64   7.642  -4.273   2.069
  471    HA   LEU  64           HA       LEU  64   9.119  -3.077  -0.163
  472   1HB   LEU  64          2HB       LEU  64   9.549  -1.294   1.906
  473   2HB   LEU  64          1HB       LEU  64   8.550  -1.025   0.493
  474    HG   LEU  64           HG       LEU  64   7.485  -2.180   3.066
  475   1HD1  LEU  64          1HD1      LEU  64   7.774  -0.145   3.931
  476   2HD1  LEU  64          2HD1      LEU  64   6.479   0.362   2.847
  477   3HD1  LEU  64          3HD1      LEU  64   8.164   0.565   2.365
  478   1HD2  LEU  64          1HD2      LEU  64   5.699  -2.585   1.801
  479   2HD2  LEU  64          2HD2      LEU  64   6.400  -1.732   0.426
  480   3HD2  LEU  64          3HD2      LEU  64   5.497  -0.840   1.649
  481    H    LEU  65           H        LEU  65  11.119  -3.812  -0.166
  482    HA   LEU  65           HA       LEU  65  12.213  -5.439   1.796
  483   1HB   LEU  65          2HB       LEU  65  14.073  -5.593   0.475
  484   2HB   LEU  65          1HB       LEU  65  12.892  -5.035  -0.688
  485    HG   LEU  65           HG       LEU  65  14.824  -3.801  -1.154
  486   1HD1  LEU  65          1HD1      LEU  65  13.824  -1.654   0.528
  487   2HD1  LEU  65          2HD1      LEU  65  12.547  -2.498  -0.344
  488   3HD1  LEU  65          3HD1      LEU  65  13.893  -1.785  -1.228
  489   1HD2  LEU  65          1HD2      LEU  65  16.425  -3.198   0.306
  490   2HD2  LEU  65          2HD2      LEU  65  15.638  -4.382   1.349
  491   3HD2  LEU  65          3HD2      LEU  65  15.266  -2.667   1.524
  492    H    LYS  66           H        LYS  66  12.025  -2.008   1.720
  493    HA   LYS  66           HA       LYS  66  14.044  -1.799   3.845
  494   1HB   LYS  66          2HB       LYS  66  14.119   0.572   3.390
  495   2HB   LYS  66          1HB       LYS  66  14.327  -0.311   1.884
  496   1HG   LYS  66          2HG       LYS  66  11.584   0.118   2.086
  497   2HG   LYS  66          1HG       LYS  66  12.324   1.625   2.624
  498   1HD   LYS  66          2HD       LYS  66  13.195   2.084   0.579
  499   2HD   LYS  66          1HD       LYS  66  13.463   0.383   0.194
  500   1HE   LYS  66          2HE       LYS  66  10.709   1.570   0.328
  501   2HE   LYS  66          1HE       LYS  66  11.679   1.635  -1.143
  502   1HZ   LYS  66          1HZ       LYS  66  10.029  -0.348  -0.611
  503   2HZ   LYS  66          2HZ       LYS  66  11.408  -0.964   0.149
  504   3HZ   LYS  66          3HZ       LYS  66  11.452  -0.573  -1.497
  505   1H    SER  67          1HT       SER  67  11.868   8.415  12.209
  506   2H    SER  67          2HT       SER  67  12.086  10.029  12.748
  507   3H    SER  67          3HT       SER  67  13.431   9.116  12.196
  508    HA   SER  67           HA       SER  67  11.213  10.265  10.671
  509   1HB   SER  67          2HB       SER  67  13.701  11.186  11.281
  510   2HB   SER  67          1HB       SER  67  14.028  10.338   9.769
  511    HG   SER  67           HG       SER  67  12.915  12.721  10.103
  512    H    ASN  68           H        ASN  68  13.648   7.720  10.734
  513    HA   ASN  68           HA       ASN  68  13.417   6.879   8.064
  514   1HB   ASN  68          2HB       ASN  68  14.047   5.100  10.424
  515   2HB   ASN  68          1HB       ASN  68  14.543   4.874   8.750
  516   1HD2  ASN  68          1HD2      ASN  68  15.310   7.507   8.182
  517   2HD2  ASN  68          2HD2      ASN  68  16.737   7.863   9.087
  518    H    PHE  69           H        PHE  69  11.769   5.753  11.005
  519    HA   PHE  69           HA       PHE  69  10.012   4.062   9.407
  520   1HB   PHE  69          2HB       PHE  69  10.850   3.061  11.435
  521   2HB   PHE  69          1HB       PHE  69  10.309   4.434  12.393
  522    HD1  PHE  69           1HD      PHE  69   8.749   2.123   9.904
  523    HD2  PHE  69           2HD      PHE  69   8.516   3.970  13.730
  524    HE1  PHE  69           1HE      PHE  69   6.604   0.988  10.317
  525    HE2  PHE  69           2HE      PHE  69   6.373   2.839  14.150
  526    HZ   PHE  69           HZ       PHE  69   5.414   1.345  12.442
  527    H    LEU  70           H        LEU  70   8.365   5.078   8.452
  528    HA   LEU  70           HA       LEU  70   6.753   6.917  10.090
  529   1HB   LEU  70          2HB       LEU  70   8.036   7.385   7.486
  530   2HB   LEU  70          1HB       LEU  70   6.346   7.847   7.553
  531    HG   LEU  70           HG       LEU  70   6.760   9.387   9.348
  532   1HD1  LEU  70          1HD1      LEU  70   9.399   8.008   9.467
  533   2HD1  LEU  70          2HD1      LEU  70   8.312   8.481  10.773
  534   3HD1  LEU  70          3HD1      LEU  70   9.288   9.700   9.954
  535   1HD2  LEU  70          1HD2      LEU  70   8.767   9.586   7.113
  536   2HD2  LEU  70          2HD2      LEU  70   8.455  10.886   8.263
  537   3HD2  LEU  70          3HD2      LEU  70   7.167  10.321   7.199
  538    H    ASN  71           H        ASN  71   5.469   4.985  10.477
  539    HA   ASN  71           HA       ASN  71   3.984   3.947   8.190
  540   1HB   ASN  71          2HB       ASN  71   3.117   2.274   9.727
  541   2HB   ASN  71          1HB       ASN  71   4.868   2.371   9.892
  542   1HD2  ASN  71          1HD2      ASN  71   2.360   1.762  11.656
  543   2HD2  ASN  71          2HD2      ASN  71   2.754   2.557  13.139
  544    H    CYS  72           H        CYS  72   3.408   6.572   8.548
  545    HA   CYS  72           HA       CYS  72   1.445   7.394  10.261
  546   1HB   CYS  72          2HB       CYS  72   2.502   8.863   8.604
  547   2HB   CYS  72          1HB       CYS  72   1.634   8.041   7.311
  548    HG   CYS  72           HG       CYS  72  -0.154   9.390   9.404
  549    H    TYR  73           H        TYR  73  -0.111   5.942  10.832
  550    HA   TYR  73           HA       TYR  73  -1.947   5.094   8.690
  551   1HB   TYR  73          2HB       TYR  73  -0.690   3.585  10.881
  552   2HB   TYR  73          1HB       TYR  73  -2.416   3.295  10.685
  553    HD1  TYR  73           1HD      TYR  73   0.719   2.165   9.738
  554    HD2  TYR  73           2HD      TYR  73  -3.113   3.012   8.096
  555    HE1  TYR  73           1HE      TYR  73   1.187   0.634   7.872
  556    HE2  TYR  73           2HE      TYR  73  -2.656   1.482   6.225
  557    HH   TYR  73           HH       TYR  73  -0.727   0.517   5.065
  558    H    VAL  74           H        VAL  74  -4.019   5.624   8.879
  559    HA   VAL  74           HA       VAL  74  -5.128   6.292  11.491
  560    HB   VAL  74           HB       VAL  74  -6.192   8.366  10.513
  561   1HG1  VAL  74          1HG1      VAL  74  -4.188   9.763  10.896
  562   2HG1  VAL  74          2HG1      VAL  74  -3.199   8.303  10.875
  563   3HG1  VAL  74          3HG1      VAL  74  -4.413   8.528  12.135
  564   1HG2  VAL  74          1HG2      VAL  74  -5.673   9.154   8.472
  565   2HG2  VAL  74          2HG2      VAL  74  -5.198   7.487   8.149
  566   3HG2  VAL  74          3HG2      VAL  74  -3.980   8.676   8.605
  567    H    SER  75           H        SER  75  -6.401   4.446  11.269
  568    HA   SER  75           HA       SER  75  -8.908   4.808  10.043
  569   1HB   SER  75          2HB       SER  75  -8.458   2.605   8.553
  570   2HB   SER  75          1HB       SER  75  -8.278   4.243   7.924
  571    HG   SER  75           HG       SER  75  -6.193   3.962   7.805
  572    H    GLY  76           H        GLY  76  -6.615   2.194  10.843
  573   1HA   GLY  76          2HA       GLY  76  -6.769   0.680  12.609
  574   2HA   GLY  76          1HA       GLY  76  -8.367   1.307  12.978
  575    H    PHE  77           H        PHE  77  -8.575   0.795   9.794
  576    HA   PHE  77           HA       PHE  77 -10.313  -1.326   9.900
  577   1HB   PHE  77          2HB       PHE  77 -10.180  -1.450   7.529
  578   2HB   PHE  77          1HB       PHE  77  -9.927   0.235   7.957
  579    HD1  PHE  77           1HD      PHE  77  -9.099  -1.696   5.505
  580    HD2  PHE  77           2HD      PHE  77  -7.063   0.199   8.727
  581    HE1  PHE  77           1HE      PHE  77  -7.021  -1.693   4.188
  582    HE2  PHE  77           2HE      PHE  77  -4.984   0.206   7.415
  583    HZ   PHE  77           HZ       PHE  77  -4.961  -0.740   5.142
  584    H    HIS  78           H        HIS  78  -9.793  -3.129  10.986
  585    HA   HIS  78           HA       HIS  78  -7.253  -4.443  10.588
  586   1HB   HIS  78          2HB       HIS  78  -8.516  -4.268  12.802
  587   2HB   HIS  78          1HB       HIS  78  -9.570  -5.530  12.171
  588    HD1  HIS  78           1HD      HIS  78  -8.917  -7.617  13.328
  589    HD2  HIS  78           2HD      HIS  78  -5.607  -5.397  12.155
  590    HE1  HIS  78           1HE      HIS  78  -6.919  -9.025  13.920
  591    HE2  HIS  78           2HE      HIS  78  -4.933  -7.706  13.105
  592    HA   PRO  79           HA       PRO  79 -10.315  -7.691   8.641
  593   1HB   PRO  79          2HB       PRO  79 -12.289  -6.583   7.116
  594   2HB   PRO  79          1HB       PRO  79 -12.513  -7.087   8.794
  595   1HG   PRO  79          2HG       PRO  79 -12.035  -4.359   7.680
  596   2HG   PRO  79          1HG       PRO  79 -13.119  -4.864   8.989
  597   1HD   PRO  79          2HD       PRO  79 -10.717  -3.699   9.427
  598   2HD   PRO  79          1HD       PRO  79 -11.430  -4.872  10.551
  599    H    SER  80           H        SER  80 -11.047  -7.920   6.116
  600    HA   SER  80           HA       SER  80 -10.347  -7.938   3.952
  601   1HB   SER  80          2HB       SER  80 -10.224  -5.878   3.068
  602   2HB   SER  80          1HB       SER  80 -10.206  -5.232   4.708
  603    HG   SER  80           HG       SER  80  -8.157  -5.489   2.883
  604    H    ASP  81           H        ASP  81  -8.088  -7.517   2.638
  605    HA   ASP  81           HA       ASP  81  -6.129  -9.066   4.180
  606   1HB   ASP  81          2HB       ASP  81  -6.316  -8.621   1.193
  607   2HB   ASP  81          1HB       ASP  81  -5.151  -9.660   2.005
  608    H    ILE  82           H        ILE  82  -5.413  -7.165   5.333
  609    HA   ILE  82           HA       ILE  82  -3.758  -5.351   3.710
  610    HB   ILE  82           HB       ILE  82  -3.858  -3.763   5.552
  611   1HG1  ILE  82          2HG1      ILE  82  -5.848  -4.553   7.249
  612   2HG1  ILE  82          1HG1      ILE  82  -5.024  -6.080   6.951
  613   1HG2  ILE  82          1HG2      ILE  82  -5.569  -3.149   4.224
  614   2HG2  ILE  82          2HG2      ILE  82  -6.553  -3.698   5.580
  615   3HG2  ILE  82          3HG2      ILE  82  -6.273  -4.765   4.205
  616   1HD1  ILE  82          1HD1      ILE  82  -3.736  -5.431   8.660
  617   2HD1  ILE  82          2HD1      ILE  82  -4.158  -3.729   8.467
  618   3HD1  ILE  82          3HD1      ILE  82  -2.923  -4.452   7.439
  619    H    GLU  83           H        GLU  83  -1.642  -5.672   3.779
  620    HA   GLU  83           HA       GLU  83  -0.379  -6.443   6.291
  621   1HB   GLU  83          2HB       GLU  83  -0.918  -8.536   4.953
  622   2HB   GLU  83          1HB       GLU  83   0.244  -7.964   3.763
  623   1HG   GLU  83          2HG       GLU  83   1.997  -8.583   4.997
  624   2HG   GLU  83          1HG       GLU  83   1.276  -7.992   6.493
  625    H    VAL  84           H        VAL  84   1.491  -5.415   6.609
  626    HA   VAL  84           HA       VAL  84   2.732  -4.063   4.300
  627    HB   VAL  84           HB       VAL  84   2.680  -3.126   7.174
  628   1HG1  VAL  84          1HG1      VAL  84   3.501  -0.992   5.742
  629   2HG1  VAL  84          2HG1      VAL  84   4.232  -2.299   4.810
  630   3HG1  VAL  84          3HG1      VAL  84   4.597  -2.129   6.527
  631   1HG2  VAL  84          1HG2      VAL  84   0.959  -1.747   6.681
  632   2HG2  VAL  84          2HG2      VAL  84   0.618  -2.967   5.454
  633   3HG2  VAL  84          3HG2      VAL  84   1.493  -1.499   5.018
  634    H    ASP  85           H        ASP  85   4.658  -4.855   3.794
  635    HA   ASP  85           HA       ASP  85   6.137  -6.433   5.736
  636   1HB   ASP  85          2HB       ASP  85   5.747  -6.768   3.068
  637   2HB   ASP  85          1HB       ASP  85   7.314  -5.967   3.066
  638    H    LEU  86           H        LEU  86   6.829  -4.804   7.161
  639    HA   LEU  86           HA       LEU  86   8.360  -2.563   6.239
  640   1HB   LEU  86          2HB       LEU  86   7.079  -3.316   8.621
  641   2HB   LEU  86          1HB       LEU  86   8.781  -3.193   9.026
  642    HG   LEU  86           HG       LEU  86   8.550  -0.881   7.736
  643   1HD1  LEU  86          1HD1      LEU  86   5.769  -1.668   8.454
  644   2HD1  LEU  86          2HD1      LEU  86   6.366  -0.787   7.047
  645   3HD1  LEU  86          3HD1      LEU  86   6.250   0.021   8.611
  646   1HD2  LEU  86          1HD2      LEU  86   7.395  -0.831  10.462
  647   2HD2  LEU  86          2HD2      LEU  86   8.736   0.089   9.778
  648   3HD2  LEU  86          3HD2      LEU  86   8.976  -1.588  10.269
  649    H    LEU  87           H        LEU  87  10.117  -3.326   5.083
  650    HA   LEU  87           HA       LEU  87  12.300  -3.924   4.815
  651   1HB   LEU  87          2HB       LEU  87  12.107  -3.259   7.554
  652   2HB   LEU  87          1HB       LEU  87  13.025  -4.750   7.470
  653    HG   LEU  87           HG       LEU  87  13.763  -2.444   5.708
  654   1HD1  LEU  87          1HD1      LEU  87  13.644  -1.459   7.902
  655   2HD1  LEU  87          2HD1      LEU  87  15.334  -1.703   7.465
  656   3HD1  LEU  87          3HD1      LEU  87  14.548  -2.806   8.595
  657   1HD2  LEU  87          1HD2      LEU  87  15.218  -4.790   6.908
  658   2HD2  LEU  87          2HD2      LEU  87  16.027  -3.469   6.065
  659   3HD2  LEU  87          3HD2      LEU  87  14.871  -4.487   5.206
  660    H    LYS  88           H        LYS  88  10.136  -5.817   4.636
  661    HA   LYS  88           HA       LYS  88   9.816  -8.040   4.280
  662   1HB   LYS  88          2HB       LYS  88  12.508  -7.565   3.706
  663   2HB   LYS  88          1HB       LYS  88  12.520  -8.991   4.734
  664   1HG   LYS  88          2HG       LYS  88  10.823  -8.712   2.266
  665   2HG   LYS  88          1HG       LYS  88  12.414  -9.473   2.298
  666   1HD   LYS  88          2HD       LYS  88  10.710 -10.527   4.380
  667   2HD   LYS  88          1HD       LYS  88   9.952 -10.689   2.796
  668   1HE   LYS  88          2HE       LYS  88  11.188 -12.654   3.033
  669   2HE   LYS  88          1HE       LYS  88  12.209 -11.628   2.026
  670   1HZ   LYS  88          1HZ       LYS  88  12.611 -11.461   4.907
  671   2HZ   LYS  88          2HZ       LYS  88  13.742 -11.402   3.652
  672   3HZ   LYS  88          3HZ       LYS  88  13.116 -12.891   4.154
  Start of MODEL    2
    1   1H    SER   1          1HT       SER   1  17.096   6.815  -6.589
    2   2H    SER   1          2HT       SER   1  16.044   6.843  -5.234
    3   3H    SER   1          3HT       SER   1  16.225   8.242  -6.211
    4    HA   SER   1           HA       SER   1  15.272   7.090  -8.063
    5   1HB   SER   1          2HB       SER   1  16.067   4.836  -7.138
    6   2HB   SER   1          1HB       SER   1  14.636   4.876  -6.111
    7    HG   SER   1           HG       SER   1  14.836   4.193  -8.699
    8    H    ASN   2           H        ASN   2  13.880   8.808  -7.878
    9    HA   ASN   2           HA       ASN   2  12.119   9.270  -5.738
   10   1HB   ASN   2          2HB       ASN   2  12.294  10.226  -8.566
   11   2HB   ASN   2          1HB       ASN   2  10.833  10.567  -7.644
   12   1HD2  ASN   2          1HD2      ASN   2  10.894  12.032  -5.991
   13   2HD2  ASN   2          2HD2      ASN   2  12.258  13.039  -5.669
   14    H    PHE   3           H        PHE   3  10.858   7.581  -5.120
   15    HA   PHE   3           HA       PHE   3   9.180   6.288  -7.152
   16   1HB   PHE   3          2HB       PHE   3  10.485   4.764  -5.760
   17   2HB   PHE   3          1HB       PHE   3   9.791   5.471  -4.304
   18    HD1  PHE   3           1HD      PHE   3   7.490   5.012  -3.672
   19    HD2  PHE   3           2HD      PHE   3   9.228   3.236  -7.127
   20    HE1  PHE   3           1HE      PHE   3   5.649   3.382  -3.754
   21    HE2  PHE   3           2HE      PHE   3   7.389   1.603  -7.216
   22    HZ   PHE   3           HZ       PHE   3   5.597   1.675  -5.528
   23    H    LEU   4           H        LEU   4   7.230   7.135  -7.411
   24    HA   LEU   4           HA       LEU   4   5.826   8.175  -5.037
   25   1HB   LEU   4          2HB       LEU   4   5.107   9.091  -7.784
   26   2HB   LEU   4          1HB       LEU   4   4.925   9.920  -6.251
   27    HG   LEU   4           HG       LEU   4   6.582  11.119  -7.405
   28   1HD1  LEU   4          1HD1      LEU   4   7.165   9.893  -5.017
   29   2HD1  LEU   4          2HD1      LEU   4   8.071  11.219  -5.749
   30   3HD1  LEU   4          3HD1      LEU   4   8.592   9.552  -5.997
   31   1HD2  LEU   4          1HD2      LEU   4   6.947   8.984  -8.939
   32   2HD2  LEU   4          2HD2      LEU   4   8.358   8.796  -7.899
   33   3HD2  LEU   4          3HD2      LEU   4   8.141  10.278  -8.830
   34    H    ASN   5           H        ASN   5   4.541   6.502  -4.471
   35    HA   ASN   5           HA       ASN   5   2.748   5.426  -6.549
   36   1HB   ASN   5          2HB       ASN   5   4.334   3.726  -5.748
   37   2HB   ASN   5          1HB       ASN   5   3.795   3.999  -4.094
   38   1HD2  ASN   5          1HD2      ASN   5   3.047   1.956  -3.747
   39   2HD2  ASN   5          2HD2      ASN   5   1.667   1.298  -4.551
   40    H    CYS   6           H        CYS   6   1.235   7.096  -6.080
   41    HA   CYS   6           HA       CYS   6   0.076   7.163  -3.411
   42   1HB   CYS   6          2HB       CYS   6  -1.250   9.043  -4.251
   43   2HB   CYS   6          1HB       CYS   6   0.462   9.286  -4.583
   44    HG   CYS   6           HG       CYS   6  -0.051   9.441  -6.966
   45    H    TYR   7           H        TYR   7  -2.494   7.515  -3.604
   46    HA   TYR   7           HA       TYR   7  -3.884   5.925  -5.487
   47   1HB   TYR   7          2HB       TYR   7  -2.622   4.224  -3.978
   48   2HB   TYR   7          1HB       TYR   7  -3.831   4.641  -2.770
   49    HD1  TYR   7           1HD      TYR   7  -3.561   1.887  -3.658
   50    HD2  TYR   7           2HD      TYR   7  -5.826   5.056  -5.374
   51    HE1  TYR   7           1HE      TYR   7  -5.105   0.247  -4.643
   52    HE2  TYR   7           2HE      TYR   7  -7.374   3.424  -6.360
   53    HH   TYR   7           HH       TYR   7  -6.704   0.193  -6.643
   54    H    VAL   8           H        VAL   8  -5.627   7.172  -5.620
   55    HA   VAL   8           HA       VAL   8  -6.815   8.246  -3.159
   56    HB   VAL   8           HB       VAL   8  -6.261   9.900  -4.888
   57   1HG1  VAL   8          1HG1      VAL   8  -6.490   8.519  -6.864
   58   2HG1  VAL   8          2HG1      VAL   8  -7.526   9.940  -6.999
   59   3HG1  VAL   8          3HG1      VAL   8  -8.227   8.374  -6.591
   60   1HG2  VAL   8          1HG2      VAL   8  -9.245   9.757  -4.873
   61   2HG2  VAL   8          2HG2      VAL   8  -8.186  11.150  -4.650
   62   3HG2  VAL   8          3HG2      VAL   8  -8.371   9.965  -3.356
   63    H    SER   9           H        SER   9  -8.831   7.698  -2.510
   64    HA   SER   9           HA       SER   9 -10.033   5.343  -3.115
   65   1HB   SER   9          2HB       SER   9 -12.016   6.145  -2.031
   66   2HB   SER   9          1HB       SER   9 -10.641   6.917  -1.241
   67    HG   SER   9           HG       SER   9 -12.714   8.059  -2.488
   68    H    GLY  10           H        GLY  10 -10.196   4.765  -5.235
   69   1HA   GLY  10          2HA       GLY  10 -12.500   5.326  -6.662
   70   2HA   GLY  10          1HA       GLY  10 -11.277   6.433  -7.270
   71    H    PHE  11           H        PHE  11 -12.441   3.199  -7.248
   72    HA   PHE  11           HA       PHE  11 -10.176   2.347  -8.925
   73   1HB   PHE  11          2HB       PHE  11 -10.933   1.132  -6.694
   74   2HB   PHE  11          1HB       PHE  11 -12.098   0.375  -7.774
   75    HD1  PHE  11           1HD      PHE  11 -11.458  -1.750  -8.325
   76    HD2  PHE  11           2HD      PHE  11  -8.491   1.291  -8.084
   77    HE1  PHE  11           1HE      PHE  11  -9.749  -3.366  -9.046
   78    HE2  PHE  11           2HE      PHE  11  -6.776  -0.320  -8.804
   79    HZ   PHE  11           HZ       PHE  11  -7.405  -2.652  -9.287
   80    H    HIS  12           H        HIS  12 -11.052   0.315 -10.305
   81    HA   HIS  12           HA       HIS  12 -13.632   0.515 -11.433
   82   1HB   HIS  12          2HB       HIS  12 -11.977   2.507 -12.364
   83   2HB   HIS  12          1HB       HIS  12 -11.773   1.253 -13.581
   84    HD1  HIS  12           1HD      HIS  12 -14.949   0.414 -12.930
   85    HD2  HIS  12           2HD      HIS  12 -13.372   3.961 -14.415
   86    HE1  HIS  12           1HE      HIS  12 -16.837   1.524 -14.164
   87    HE2  HIS  12           2HE      HIS  12 -15.831   3.616 -15.142
   88    HA   PRO  13           HA       PRO  13 -10.883  -2.509 -14.127
   89   1HB   PRO  13          2HB       PRO  13  -8.329  -2.821 -13.101
   90   2HB   PRO  13          1HB       PRO  13  -8.741  -1.826 -14.500
   91   1HG   PRO  13          2HG       PRO  13  -8.310  -1.017 -11.655
   92   2HG   PRO  13          1HG       PRO  13  -7.802  -0.199 -13.144
   93   1HD   PRO  13          2HD       PRO  13  -9.913   0.655 -11.750
   94   2HD   PRO  13          1HD       PRO  13  -9.912   0.688 -13.524
   95    H    SER  14           H        SER  14  -9.240  -4.513 -13.167
   96    HA   SER  14           HA       SER  14 -10.603  -5.369 -10.698
   97   1HB   SER  14          2HB       SER  14 -10.039  -7.733 -11.952
   98   2HB   SER  14          1HB       SER  14 -11.594  -6.905 -12.030
   99    HG   SER  14           HG       SER  14  -9.487  -6.885 -13.910
  100    H    ASP  15           H        ASP  15  -7.908  -6.492 -12.758
  101    HA   ASP  15           HA       ASP  15  -6.386  -7.100 -10.338
  102   1HB   ASP  15          2HB       ASP  15  -4.871  -8.325 -11.877
  103   2HB   ASP  15          1HB       ASP  15  -6.536  -8.895 -11.956
  104    H    ILE  16           H        ILE  16  -5.211  -5.472  -9.576
  105    HA   ILE  16           HA       ILE  16  -3.565  -3.941 -11.476
  106    HB   ILE  16           HB       ILE  16  -5.436  -2.952  -9.434
  107   1HG1  ILE  16          2HG1      ILE  16  -5.177  -0.881 -10.900
  108   2HG1  ILE  16          1HG1      ILE  16  -4.116  -1.854 -11.914
  109   1HG2  ILE  16          1HG2      ILE  16  -3.523  -2.418  -8.146
  110   2HG2  ILE  16          2HG2      ILE  16  -4.000  -0.930  -8.963
  111   3HG2  ILE  16          3HG2      ILE  16  -2.633  -1.866  -9.565
  112   1HD1  ILE  16          1HD1      ILE  16  -5.939  -3.423 -12.311
  113   2HD1  ILE  16          2HD1      ILE  16  -6.366  -1.787 -12.805
  114   3HD1  ILE  16          3HD1      ILE  16  -6.999  -2.447 -11.298
  115    H    GLU  17           H        GLU  17  -1.468  -3.493 -10.856
  116    HA   GLU  17           HA       GLU  17  -0.396  -3.786  -8.288
  117   1HB   GLU  17          2HB       GLU  17   0.877  -5.922  -8.643
  118   2HB   GLU  17          1HB       GLU  17  -0.854  -6.129  -8.420
  119   1HG   GLU  17          2HG       GLU  17  -0.707  -7.450 -10.210
  120   2HG   GLU  17          1HG       GLU  17  -0.697  -5.939 -11.119
  121    H    VAL  18           H        VAL  18   1.943  -3.577  -8.257
  122    HA   VAL  18           HA       VAL  18   3.533  -3.466 -10.554
  123    HB   VAL  18           HB       VAL  18   1.801  -1.434 -10.726
  124   1HG1  VAL  18          1HG1      VAL  18   2.455   0.565  -9.803
  125   2HG1  VAL  18          2HG1      VAL  18   4.128   0.047  -9.594
  126   3HG1  VAL  18          3HG1      VAL  18   2.875  -0.561  -8.511
  127   1HG2  VAL  18          1HG2      VAL  18   2.995  -1.429 -12.601
  128   2HG2  VAL  18          2HG2      VAL  18   4.442  -2.006 -11.775
  129   3HG2  VAL  18          3HG2      VAL  18   4.067  -0.283 -11.798
  130    H    ASP  19           H        ASP  19   5.348  -1.565 -10.061
  131    HA   ASP  19           HA       ASP  19   6.544  -0.539  -8.173
  132   1HB   ASP  19          2HB       ASP  19   6.096  -3.285  -7.014
  133   2HB   ASP  19          1HB       ASP  19   7.376  -2.229  -6.436
  134    H    LEU  20           H        LEU  20   8.470  -3.055  -7.403
  135    HA   LEU  20           HA       LEU  20   9.763  -3.354  -9.981
  136   1HB   LEU  20          2HB       LEU  20  11.144  -2.042  -7.639
  137   2HB   LEU  20          1HB       LEU  20  11.941  -2.562  -9.111
  138    HG   LEU  20           HG       LEU  20  10.090  -0.944 -10.188
  139   1HD1  LEU  20          1HD1      LEU  20  10.218  -0.251  -7.340
  140   2HD1  LEU  20          2HD1      LEU  20   8.982   0.110  -8.546
  141   3HD1  LEU  20          3HD1      LEU  20  10.433   1.106  -8.446
  142   1HD2  LEU  20          1HD2      LEU  20  12.405  -0.739 -10.679
  143   2HD2  LEU  20          2HD2      LEU  20  12.773  -0.214  -9.037
  144   3HD2  LEU  20          3HD2      LEU  20  11.855   0.838 -10.114
  145    H    LEU  21           H        LEU  21  11.489  -4.922  -9.963
  146    HA   LEU  21           HA       LEU  21  11.104  -6.931  -7.859
  147   1HB   LEU  21          2HB       LEU  21  10.982  -7.194 -10.565
  148   2HB   LEU  21          1HB       LEU  21  12.653  -7.634 -10.269
  149    HG   LEU  21           HG       LEU  21  11.049  -9.556 -10.353
  150   1HD1  LEU  21          1HD1      LEU  21  13.141  -9.951  -9.340
  151   2HD1  LEU  21          2HD1      LEU  21  11.933 -10.610  -8.237
  152   3HD1  LEU  21          3HD1      LEU  21  12.691  -9.059  -7.888
  153   1HD2  LEU  21          1HD2      LEU  21  10.155  -8.659  -7.631
  154   2HD2  LEU  21          2HD2      LEU  21   9.494  -9.944  -8.641
  155   3HD2  LEU  21          3HD2      LEU  21   9.255  -8.256  -9.094
  156    H    LYS  22           H        LYS  22  12.735  -7.556  -6.557
  157    HA   LYS  22           HA       LYS  22  15.490  -6.960  -7.231
  158   1HB   LYS  22          2HB       LYS  22  14.232  -5.817  -4.730
  159   2HB   LYS  22          1HB       LYS  22  15.929  -5.708  -5.177
  160   1HG   LYS  22          2HG       LYS  22  15.156  -4.480  -7.255
  161   2HG   LYS  22          1HG       LYS  22  13.575  -4.373  -6.476
  162   1HD   LYS  22          2HD       LYS  22  14.262  -2.789  -5.034
  163   2HD   LYS  22          1HD       LYS  22  15.824  -3.566  -4.775
  164   1HE   LYS  22          2HE       LYS  22  15.020  -1.792  -7.074
  165   2HE   LYS  22          1HE       LYS  22  16.195  -1.434  -5.809
  166   1HZ   LYS  22          1HZ       LYS  22  16.475  -3.078  -8.190
  167   2HZ   LYS  22          2HZ       LYS  22  17.222  -3.671  -6.793
  168   3HZ   LYS  22          3HZ       LYS  22  17.625  -2.137  -7.381
  169   1H    SER  23          1HT       SER  23  12.585  11.748  -3.463
  170   2H    SER  23          2HT       SER  23  12.109  12.585  -2.041
  171   3H    SER  23          3HT       SER  23  11.699  10.930  -2.244
  172    HA   SER  23           HA       SER  23  14.467  11.903  -2.161
  173   1HB   SER  23          2HB       SER  23  12.788  10.822   0.118
  174   2HB   SER  23          1HB       SER  23  14.479  11.314   0.206
  175    HG   SER  23           HG       SER  23  13.640  13.439  -0.529
  176    H    ASN  24           H        ASN  24  12.290   9.225  -1.242
  177    HA   ASN  24           HA       ASN  24  13.964   7.373  -2.748
  178   1HB   ASN  24          2HB       ASN  24  13.405   7.101   0.211
  179   2HB   ASN  24          1HB       ASN  24  14.006   5.786  -0.795
  180   1HD2  ASN  24          1HD2      ASN  24  14.729   8.937   0.531
  181   2HD2  ASN  24          2HD2      ASN  24  16.444   8.831   0.354
  182    H    PHE  25           H        PHE  25  11.488   6.866  -0.252
  183    HA   PHE  25           HA       PHE  25   9.692   5.831  -2.341
  184   1HB   PHE  25          2HB       PHE  25  10.537   3.872  -1.302
  185   2HB   PHE  25          1HB       PHE  25  10.409   4.575   0.306
  186    HD1  PHE  25           1HD      PHE  25   8.511   3.127  -2.495
  187    HD2  PHE  25           2HD      PHE  25   8.377   4.491   1.532
  188    HE1  PHE  25           1HE      PHE  25   6.296   2.090  -2.220
  189    HE2  PHE  25           2HE      PHE  25   6.165   3.456   1.814
  190    HZ   PHE  25           HZ       PHE  25   5.121   2.255  -0.063
  191    H    LEU  26           H        LEU  26   7.708   6.652  -2.305
  192    HA   LEU  26           HA       LEU  26   6.617   7.724   0.187
  193   1HB   LEU  26          2HB       LEU  26   7.672   9.354  -1.856
  194   2HB   LEU  26          1HB       LEU  26   5.929   9.479  -1.987
  195    HG   LEU  26           HG       LEU  26   7.200   9.813   0.694
  196   1HD1  LEU  26          1HD1      LEU  26   6.824  12.259  -0.908
  197   2HD1  LEU  26          2HD1      LEU  26   8.218  11.261  -1.325
  198   3HD1  LEU  26          3HD1      LEU  26   8.033  11.875   0.318
  199   1HD2  LEU  26          1HD2      LEU  26   4.862  11.222  -0.573
  200   2HD2  LEU  26          2HD2      LEU  26   5.293  11.156   1.136
  201   3HD2  LEU  26          3HD2      LEU  26   4.716   9.705   0.315
  202    H    ASN  27           H        ASN  27   5.131   6.045   0.222
  203    HA   ASN  27           HA       ASN  27   3.268   5.891  -2.046
  204   1HB   ASN  27          2HB       ASN  27   4.301   3.766  -1.483
  205   2HB   ASN  27          1HB       ASN  27   3.796   3.929   0.196
  206   1HD2  ASN  27          1HD2      ASN  27   3.083   1.676  -0.836
  207   2HD2  ASN  27          2HD2      ASN  27   1.418   1.635  -1.295
  208    H    CYS  28           H        CYS  28   1.399   6.894  -1.844
  209    HA   CYS  28           HA       CYS  28   0.298   7.312   0.858
  210   1HB   CYS  28          2HB       CYS  28  -0.306   8.975  -1.591
  211   2HB   CYS  28          1HB       CYS  28  -0.729   9.335   0.079
  212    HG   CYS  28           HG       CYS  28   2.079   9.689  -1.166
  213    H    TYR  29           H        TYR  29  -1.247   5.853   1.218
  214    HA   TYR  29           HA       TYR  29  -3.000   5.079  -1.008
  215   1HB   TYR  29          2HB       TYR  29  -1.806   3.242   0.102
  216   2HB   TYR  29          1HB       TYR  29  -2.527   3.700   1.641
  217    HD1  TYR  29           1HD      TYR  29  -4.613   2.843   2.279
  218    HD2  TYR  29           2HD      TYR  29  -3.372   2.512  -1.776
  219    HE1  TYR  29           1HE      TYR  29  -6.539   1.386   1.814
  220    HE2  TYR  29           2HE      TYR  29  -5.295   1.055  -2.251
  221    HH   TYR  29           HH       TYR  29  -7.708   0.767  -1.114
  222    H    VAL  30           H        VAL  30  -5.018   5.759  -1.066
  223    HA   VAL  30           HA       VAL  30  -6.319   6.603   1.438
  224    HB   VAL  30           HB       VAL  30  -6.784   7.925  -1.234
  225   1HG1  VAL  30          1HG1      VAL  30  -8.635   8.516  -0.084
  226   2HG1  VAL  30          2HG1      VAL  30  -7.547   9.709   0.626
  227   3HG1  VAL  30          3HG1      VAL  30  -7.891   8.209   1.485
  228   1HG2  VAL  30          1HG2      VAL  30  -4.733   8.433   0.834
  229   2HG2  VAL  30          2HG2      VAL  30  -5.564   9.845   0.182
  230   3HG2  VAL  30          3HG2      VAL  30  -4.700   8.753  -0.900
  231    H    SER  31           H        SER  31  -7.090   4.369   1.372
  232    HA   SER  31           HA       SER  31  -8.618   3.252  -0.658
  233   1HB   SER  31          2HB       SER  31  -8.402   1.570   0.807
  234   2HB   SER  31          1HB       SER  31  -8.055   2.687   2.125
  235    HG   SER  31           HG       SER  31 -10.265   2.911   2.468
  236    H    GLY  32           H        GLY  32 -11.017   2.630  -0.283
  237   1HA   GLY  32          2HA       GLY  32 -13.025   3.790   0.906
  238   2HA   GLY  32          1HA       GLY  32 -12.485   5.160  -0.054
  239    H    PHE  33           H        PHE  33 -12.681   1.709  -0.884
  240    HA   PHE  33           HA       PHE  33 -14.873   2.244  -2.720
  241   1HB   PHE  33          2HB       PHE  33 -13.559   1.043  -4.566
  242   2HB   PHE  33          1HB       PHE  33 -13.128   2.715  -4.224
  243    HD1  PHE  33           1HD      PHE  33 -10.889   3.157  -4.276
  244    HD2  PHE  33           2HD      PHE  33 -12.189  -0.661  -2.920
  245    HE1  PHE  33           1HE      PHE  33  -8.547   2.483  -3.939
  246    HE2  PHE  33           2HE      PHE  33  -9.851  -1.342  -2.581
  247    HZ   PHE  33           HZ       PHE  33  -8.026   0.231  -3.089
  248    H    HIS  34           H        HIS  34 -15.158   0.016  -4.068
  249    HA   HIS  34           HA       HIS  34 -15.696  -1.962  -2.019
  250   1HB   HIS  34          2HB       HIS  34 -16.847  -1.208  -4.534
  251   2HB   HIS  34          1HB       HIS  34 -16.457  -2.922  -4.579
  252    HD1  HIS  34           1HD      HIS  34 -19.369  -2.213  -4.639
  253    HD2  HIS  34           2HD      HIS  34 -17.280  -2.758  -1.088
  254    HE1  HIS  34           1HE      HIS  34 -21.112  -2.755  -2.909
  255    HE2  HIS  34           2HE      HIS  34 -19.820  -3.136  -0.780
  256    HA   PRO  35           HA       PRO  35 -12.881  -5.310  -2.732
  257   1HB   PRO  35          2HB       PRO  35 -14.683  -6.422  -4.855
  258   2HB   PRO  35          1HB       PRO  35 -13.817  -7.267  -3.566
  259   1HG   PRO  35          2HG       PRO  35 -16.414  -6.713  -3.328
  260   2HG   PRO  35          1HG       PRO  35 -15.323  -6.606  -1.938
  261   1HD   PRO  35          2HD       PRO  35 -16.623  -4.451  -3.479
  262   2HD   PRO  35          1HD       PRO  35 -16.032  -4.440  -1.808
  263    H    SER  36           H        SER  36 -11.021  -5.262  -3.798
  264    HA   SER  36           HA       SER  36 -10.881  -5.063  -6.665
  265   1HB   SER  36          2HB       SER  36  -9.305  -3.014  -6.450
  266   2HB   SER  36          1HB       SER  36 -11.045  -2.737  -6.397
  267    HG   SER  36           HG       SER  36 -10.917  -2.584  -4.161
  268    H    ASP  37           H        ASP  37  -8.783  -5.534  -7.483
  269    HA   ASP  37           HA       ASP  37  -7.063  -6.838  -5.493
  270   1HB   ASP  37          2HB       ASP  37  -8.082  -7.868  -7.782
  271   2HB   ASP  37          1HB       ASP  37  -6.532  -7.274  -8.369
  272    H    ILE  38           H        ILE  38  -5.518  -5.518  -4.786
  273    HA   ILE  38           HA       ILE  38  -3.902  -4.084  -6.786
  274    HB   ILE  38           HB       ILE  38  -4.518  -3.006  -4.039
  275   1HG1  ILE  38          2HG1      ILE  38  -5.641  -1.362  -6.056
  276   2HG1  ILE  38          1HG1      ILE  38  -6.162  -3.010  -6.392
  277   1HG2  ILE  38          1HG2      ILE  38  -3.754  -0.904  -5.574
  278   2HG2  ILE  38          2HG2      ILE  38  -2.775  -2.203  -6.256
  279   3HG2  ILE  38          3HG2      ILE  38  -2.672  -1.831  -4.535
  280   1HD1  ILE  38          1HD1      ILE  38  -6.977  -3.179  -4.067
  281   2HD1  ILE  38          2HD1      ILE  38  -7.787  -1.925  -5.007
  282   3HD1  ILE  38          3HD1      ILE  38  -6.549  -1.484  -3.831
  283    H    GLU  39           H        GLU  39  -1.761  -4.439  -6.638
  284    HA   GLU  39           HA       GLU  39  -0.707  -5.541  -4.124
  285   1HB   GLU  39          2HB       GLU  39  -1.106  -7.232  -6.056
  286   2HB   GLU  39          1HB       GLU  39   0.314  -6.492  -6.780
  287   1HG   GLU  39          2HG       GLU  39   1.342  -8.159  -5.660
  288   2HG   GLU  39          1HG       GLU  39   1.313  -6.961  -4.367
  289    H    VAL  40           H        VAL  40   1.058  -4.588  -3.395
  290    HA   VAL  40           HA       VAL  40   2.666  -2.941  -5.238
  291    HB   VAL  40           HB       VAL  40   1.907  -2.283  -2.384
  292   1HG1  VAL  40          1HG1      VAL  40   3.614  -0.674  -4.276
  293   2HG1  VAL  40          2HG1      VAL  40   4.240  -1.658  -2.952
  294   3HG1  VAL  40          3HG1      VAL  40   3.204  -0.273  -2.609
  295   1HG2  VAL  40          1HG2      VAL  40   0.728  -0.395  -3.317
  296   2HG2  VAL  40          2HG2      VAL  40   0.141  -1.881  -4.063
  297   3HG2  VAL  40          3HG2      VAL  40   1.251  -0.831  -4.943
  298    H    ASP  41           H        ASP  41   4.644  -3.832  -5.408
  299    HA   ASP  41           HA       ASP  41   5.893  -4.815  -2.932
  300   1HB   ASP  41          2HB       ASP  41   6.870  -6.715  -4.293
  301   2HB   ASP  41          1HB       ASP  41   5.147  -6.824  -3.943
  302    H    LEU  42           H        LEU  42   7.481  -3.377  -2.653
  303    HA   LEU  42           HA       LEU  42   9.070  -2.460  -4.916
  304   1HB   LEU  42          2HB       LEU  42   9.434  -1.793  -1.996
  305   2HB   LEU  42          1HB       LEU  42  10.135  -0.953  -3.362
  306    HG   LEU  42           HG       LEU  42   8.395   0.419  -2.525
  307   1HD1  LEU  42          1HD1      LEU  42   6.627   0.154  -4.439
  308   2HD1  LEU  42          2HD1      LEU  42   7.804  -0.993  -5.074
  309   3HD1  LEU  42          3HD1      LEU  42   8.272   0.682  -4.790
  310   1HD2  LEU  42          1HD2      LEU  42   6.239  -0.255  -1.954
  311   2HD2  LEU  42          2HD2      LEU  42   7.267  -1.550  -1.339
  312   3HD2  LEU  42          3HD2      LEU  42   6.374  -1.771  -2.841
  313    H    LEU  43           H        LEU  43   9.504  -4.988  -4.951
  314    HA   LEU  43           HA       LEU  43  12.201  -5.433  -4.631
  315   1HB   LEU  43          2HB       LEU  43  12.387  -6.830  -2.661
  316   2HB   LEU  43          1HB       LEU  43  11.795  -5.248  -2.207
  317    HG   LEU  43           HG       LEU  43   9.727  -7.299  -2.723
  318   1HD1  LEU  43          1HD1      LEU  43  10.865  -7.435  -0.016
  319   2HD1  LEU  43          2HD1      LEU  43  11.839  -8.179  -1.284
  320   3HD1  LEU  43          3HD1      LEU  43  10.175  -8.704  -1.028
  321   1HD2  LEU  43          1HD2      LEU  43   8.724  -5.429  -1.934
  322   2HD2  LEU  43          2HD2      LEU  43  10.155  -4.901  -1.048
  323   3HD2  LEU  43          3HD2      LEU  43   9.118  -6.163  -0.380
  324    H    LYS  44           H        LYS  44  12.290  -8.162  -3.963
  325    HA   LYS  44           HA       LYS  44  11.487  -9.373  -6.343
  326   1HB   LYS  44          2HB       LYS  44  13.172 -10.114  -4.451
  327   2HB   LYS  44          1HB       LYS  44  11.779 -11.006  -3.856
  328   1HG   LYS  44          2HG       LYS  44  12.416 -12.636  -5.222
  329   2HG   LYS  44          1HG       LYS  44  11.819 -11.625  -6.538
  330   1HD   LYS  44          2HD       LYS  44  14.027 -12.249  -7.127
  331   2HD   LYS  44          1HD       LYS  44  14.115 -10.568  -6.597
  332   1HE   LYS  44          2HE       LYS  44  15.773 -11.239  -5.259
  333   2HE   LYS  44          1HE       LYS  44  14.511 -11.967  -4.266
  334   1HZ   LYS  44          1HZ       LYS  44  14.845 -14.053  -5.293
  335   2HZ   LYS  44          2HZ       LYS  44  16.385 -13.474  -4.899
  336   3HZ   LYS  44          3HZ       LYS  44  15.836 -13.398  -6.498
  337   1H    SER  45          1HT       SER  45  14.803  10.723   5.022
  338   2H    SER  45          2HT       SER  45  15.055   9.153   5.668
  339   3H    SER  45          3HT       SER  45  14.338  10.377   6.634
  340    HA   SER  45           HA       SER  45  12.602   9.047   5.989
  341   1HB   SER  45          2HB       SER  45  12.684  11.280   3.948
  342   2HB   SER  45          1HB       SER  45  11.259  10.572   4.709
  343    HG   SER  45           HG       SER  45  11.714  12.477   5.761
  344    H    ASN  46           H        ASN  46  13.357   7.063   5.141
  345    HA   ASN  46           HA       ASN  46  13.731   6.942   2.237
  346   1HB   ASN  46          2HB       ASN  46  14.297   4.924   4.417
  347   2HB   ASN  46          1HB       ASN  46  14.498   4.596   2.698
  348   1HD2  ASN  46          1HD2      ASN  46  15.441   6.968   5.158
  349   2HD2  ASN  46          2HD2      ASN  46  17.049   7.194   4.569
  350    H    PHE  47           H        PHE  47  12.039   5.079   4.773
  351    HA   PHE  47           HA       PHE  47  10.114   4.186   2.754
  352   1HB   PHE  47          2HB       PHE  47  10.953   2.359   4.005
  353   2HB   PHE  47          1HB       PHE  47  10.785   3.221   5.529
  354    HD1  PHE  47           1HD      PHE  47   8.887   1.590   2.804
  355    HD2  PHE  47           2HD      PHE  47   8.804   3.100   6.781
  356    HE1  PHE  47           1HE      PHE  47   6.687   0.544   3.152
  357    HE2  PHE  47           2HE      PHE  47   6.606   2.055   7.137
  358    HZ   PHE  47           HZ       PHE  47   5.545   0.774   5.322
  359    H    LEU  48           H        LEU  48   8.878   6.058   2.522
  360    HA   LEU  48           HA       LEU  48   7.453   7.000   4.906
  361   1HB   LEU  48          2HB       LEU  48   8.668   8.399   2.876
  362   2HB   LEU  48          1HB       LEU  48   6.984   8.430   2.391
  363    HG   LEU  48           HG       LEU  48   6.809   9.116   5.036
  364   1HD1  LEU  48          1HD1      LEU  48   8.500  10.684   5.578
  365   2HD1  LEU  48          2HD1      LEU  48   9.220  10.566   3.973
  366   3HD1  LEU  48          3HD1      LEU  48   9.320   9.203   5.086
  367   1HD2  LEU  48          1HD2      LEU  48   6.792  11.523   4.012
  368   2HD2  LEU  48          2HD2      LEU  48   5.546  10.355   3.570
  369   3HD2  LEU  48          3HD2      LEU  48   6.902  10.653   2.482
  370    H    ASN  49           H        ASN  49   6.159   5.028   4.888
  371    HA   ASN  49           HA       ASN  49   4.175   4.860   2.744
  372   1HB   ASN  49          2HB       ASN  49   5.371   2.796   3.513
  373   2HB   ASN  49          1HB       ASN  49   4.589   2.982   5.079
  374   1HD2  ASN  49          1HD2      ASN  49   4.406   0.817   3.138
  375   2HD2  ASN  49          2HD2      ASN  49   2.730   0.663   2.751
  376    H    CYS  50           H        CYS  50   2.040   5.306   3.037
  377    HA   CYS  50           HA       CYS  50   0.992   5.704   5.715
  378   1HB   CYS  50          2HB       CYS  50   0.096   7.986   5.055
  379   2HB   CYS  50          1HB       CYS  50   1.823   7.897   5.379
  380    HG   CYS  50           HG       CYS  50   1.493   9.264   3.209
  381    H    TYR  51           H        TYR  51  -0.963   4.838   5.806
  382    HA   TYR  51           HA       TYR  51  -2.610   4.823   3.361
  383   1HB   TYR  51          2HB       TYR  51  -3.239   2.625   3.681
  384   2HB   TYR  51          1HB       TYR  51  -1.589   2.575   4.284
  385    HD1  TYR  51           1HD      TYR  51  -5.101   2.235   5.122
  386    HD2  TYR  51           2HD      TYR  51  -1.172   2.505   6.730
  387    HE1  TYR  51           1HE      TYR  51  -5.922   1.345   7.263
  388    HE2  TYR  51           2HE      TYR  51  -1.982   1.615   8.873
  389    HH   TYR  51           HH       TYR  51  -4.184   0.014   9.490
  390    H    VAL  52           H        VAL  52  -4.807   5.238   3.590
  391    HA   VAL  52           HA       VAL  52  -5.799   5.830   6.281
  392    HB   VAL  52           HB       VAL  52  -4.939   7.954   5.384
  393   1HG1  VAL  52          1HG1      VAL  52  -5.136   7.625   3.033
  394   2HG1  VAL  52          2HG1      VAL  52  -6.159   8.995   3.463
  395   3HG1  VAL  52          3HG1      VAL  52  -6.883   7.418   3.149
  396   1HG2  VAL  52          1HG2      VAL  52  -6.888   9.294   5.812
  397   2HG2  VAL  52          2HG2      VAL  52  -6.923   7.891   6.879
  398   3HG2  VAL  52          3HG2      VAL  52  -7.953   7.937   5.449
  399    H    SER  53           H        SER  53  -8.115   6.071   6.408
  400    HA   SER  53           HA       SER  53 -10.299   5.691   5.824
  401   1HB   SER  53          2HB       SER  53  -9.520   6.390   3.457
  402   2HB   SER  53          1HB       SER  53  -9.484   4.660   3.117
  403    HG   SER  53           HG       SER  53 -11.511   5.843   2.663
  404    H    GLY  54           H        GLY  54  -8.561   3.181   3.968
  405   1HA   GLY  54          2HA       GLY  54  -8.397   0.909   4.349
  406   2HA   GLY  54          1HA       GLY  54  -9.077   1.169   5.947
  407    H    PHE  55           H        PHE  55 -10.046  -0.984   5.152
  408    HA   PHE  55           HA       PHE  55 -12.797  -0.573   4.679
  409   1HB   PHE  55          2HB       PHE  55 -12.796  -1.910   2.460
  410   2HB   PHE  55          1HB       PHE  55 -12.412  -0.194   2.404
  411    HD1  PHE  55           1HD      PHE  55 -11.170  -0.182   0.399
  412    HD2  PHE  55           2HD      PHE  55 -10.090  -2.841   3.544
  413    HE1  PHE  55           1HE      PHE  55  -9.058  -0.691  -0.752
  414    HE2  PHE  55           2HE      PHE  55  -7.981  -3.351   2.397
  415    HZ   PHE  55           HZ       PHE  55  -7.461  -2.275   0.245
  416    H    HIS  56           H        HIS  56 -13.766  -2.871   3.893
  417    HA   HIS  56           HA       HIS  56 -12.472  -4.859   5.629
  418   1HB   HIS  56          2HB       HIS  56 -14.599  -4.356   6.541
  419   2HB   HIS  56          1HB       HIS  56 -15.379  -4.402   4.969
  420    HD1  HIS  56           1HD      HIS  56 -15.187  -6.972   3.832
  421    HD2  HIS  56           2HD      HIS  56 -15.038  -6.595   7.967
  422    HE1  HIS  56           1HE      HIS  56 -15.768  -9.246   4.734
  423    HE2  HIS  56           2HE      HIS  56 -15.608  -9.011   7.238
  424    HA   PRO  57           HA       PRO  57 -13.461  -7.337   1.740
  425   1HB   PRO  57          2HB       PRO  57 -15.261  -6.582  -0.044
  426   2HB   PRO  57          1HB       PRO  57 -15.776  -7.101   1.565
  427   1HG   PRO  57          2HG       PRO  57 -15.588  -4.352   0.432
  428   2HG   PRO  57          1HG       PRO  57 -16.770  -5.019   1.570
  429   1HD   PRO  57          2HD       PRO  57 -14.471  -3.493   2.206
  430   2HD   PRO  57          1HD       PRO  57 -15.523  -4.359   3.338
  431    H    SER  58           H        SER  58 -11.289  -6.750   1.127
  432    HA   SER  58           HA       SER  58 -10.991  -5.972  -1.547
  433   1HB   SER  58          2HB       SER  58 -11.504  -3.717  -0.799
  434   2HB   SER  58          1HB       SER  58 -10.269  -3.821   0.457
  435    HG   SER  58           HG       SER  58  -8.700  -3.740  -1.065
  436    H    ASP  59           H        ASP  59  -8.596  -5.509  -2.071
  437    HA   ASP  59           HA       ASP  59  -6.825  -6.875  -0.169
  438   1HB   ASP  59          2HB       ASP  59  -6.747  -7.463  -3.126
  439   2HB   ASP  59          1HB       ASP  59  -5.927  -8.323  -1.828
  440    H    ILE  60           H        ILE  60  -4.972  -5.827   0.146
  441    HA   ILE  60           HA       ILE  60  -3.745  -4.277  -1.980
  442    HB   ILE  60           HB       ILE  60  -3.526  -2.244  -0.580
  443   1HG1  ILE  60          2HG1      ILE  60  -5.724  -2.495   1.157
  444   2HG1  ILE  60          1HG1      ILE  60  -4.783  -3.966   1.374
  445   1HG2  ILE  60          1HG2      ILE  60  -5.808  -1.421  -0.950
  446   2HG2  ILE  60          2HG2      ILE  60  -6.355  -3.076  -1.208
  447   3HG2  ILE  60          3HG2      ILE  60  -5.208  -2.342  -2.327
  448   1HD1  ILE  60          1HD1      ILE  60  -4.337  -1.622   2.659
  449   2HD1  ILE  60          2HD1      ILE  60  -3.188  -1.517   1.325
  450   3HD1  ILE  60          3HD1      ILE  60  -3.136  -2.891   2.429
  451    H    GLU  61           H        GLU  61  -1.861  -5.386  -1.909
  452    HA   GLU  61           HA       GLU  61  -0.561  -5.807   0.681
  453   1HB   GLU  61          2HB       GLU  61  -0.853  -7.652  -1.086
  454   2HB   GLU  61          1HB       GLU  61   0.428  -6.832  -1.969
  455   1HG   GLU  61          2HG       GLU  61   1.844  -8.087  -0.813
  456   2HG   GLU  61          1HG       GLU  61   1.463  -7.062   0.570
  457    H    VAL  62           H        VAL  62   1.351  -4.895   1.244
  458    HA   VAL  62           HA       VAL  62   2.824  -3.309  -0.716
  459    HB   VAL  62           HB       VAL  62   1.931  -2.130   1.916
  460   1HG1  VAL  62          1HG1      VAL  62   3.861  -0.998   1.528
  461   2HG1  VAL  62          2HG1      VAL  62   2.789  -0.038   0.508
  462   3HG1  VAL  62          3HG1      VAL  62   3.810  -1.284  -0.212
  463   1HG2  VAL  62          1HG2      VAL  62   1.023  -1.385  -0.861
  464   2HG2  VAL  62          2HG2      VAL  62   0.471  -0.687   0.662
  465   3HG2  VAL  62          3HG2      VAL  62   0.086  -2.363   0.269
  466    H    ASP  63           H        ASP  63   4.900  -3.836  -0.546
  467    HA   ASP  63           HA       ASP  63   6.076  -4.189   2.103
  468   1HB   ASP  63          2HB       ASP  63   6.444  -6.252  -0.076
  469   2HB   ASP  63          1HB       ASP  63   7.124  -6.298   1.547
  470    H    LEU  64           H        LEU  64   8.083  -3.375   2.260
  471    HA   LEU  64           HA       LEU  64   9.457  -2.637  -0.243
  472   1HB   LEU  64          2HB       LEU  64   8.925  -1.093   2.234
  473   2HB   LEU  64          1HB       LEU  64  10.488  -0.862   1.478
  474    HG   LEU  64           HG       LEU  64   8.825  -0.590  -0.662
  475   1HD1  LEU  64          1HD1      LEU  64   6.997  -0.669   1.267
  476   2HD1  LEU  64          2HD1      LEU  64   6.823   0.345  -0.165
  477   3HD1  LEU  64          3HD1      LEU  64   7.400   1.046   1.347
  478   1HD2  LEU  64          1HD2      LEU  64   9.709   1.477  -0.760
  479   2HD2  LEU  64          2HD2      LEU  64  10.682   0.910   0.597
  480   3HD2  LEU  64          3HD2      LEU  64   9.234   1.873   0.892
  481    H    LEU  65           H        LEU  65  11.472  -3.394  -0.503
  482    HA   LEU  65           HA       LEU  65  13.007  -4.166   1.874
  483   1HB   LEU  65          2HB       LEU  65  11.924  -6.201   1.094
  484   2HB   LEU  65          1HB       LEU  65  12.554  -5.942  -0.520
  485    HG   LEU  65           HG       LEU  65  14.628  -6.046   1.550
  486   1HD1  LEU  65          1HD1      LEU  65  14.322  -8.691   1.335
  487   2HD1  LEU  65          2HD1      LEU  65  12.628  -8.206   1.298
  488   3HD1  LEU  65          3HD1      LEU  65  13.645  -7.751   2.665
  489   1HD2  LEU  65          1HD2      LEU  65  15.867  -6.799  -0.159
  490   2HD2  LEU  65          2HD2      LEU  65  14.523  -6.259  -1.163
  491   3HD2  LEU  65          3HD2      LEU  65  14.636  -7.950  -0.676
  492    H    LYS  66           H        LYS  66  13.016  -3.626  -1.625
  493    HA   LYS  66           HA       LYS  66  14.653  -2.987  -3.072
  494   1HB   LYS  66          2HB       LYS  66  15.673  -0.931  -2.555
  495   2HB   LYS  66          1HB       LYS  66  14.165  -0.927  -1.657
  496   1HG   LYS  66          2HG       LYS  66  16.408  -1.989  -0.124
  497   2HG   LYS  66          1HG       LYS  66  16.641  -0.325  -0.653
  498   1HD   LYS  66          2HD       LYS  66  14.379   0.199   0.282
  499   2HD   LYS  66          1HD       LYS  66  14.348  -1.428   0.963
  500   1HE   LYS  66          2HE       LYS  66  15.107  -0.064   2.712
  501   2HE   LYS  66          1HE       LYS  66  16.562  -0.826   2.072
  502   1HZ   LYS  66          1HZ       LYS  66  15.645   1.960   1.735
  503   2HZ   LYS  66          2HZ       LYS  66  16.761   1.276   0.664
  504   3HZ   LYS  66          3HZ       LYS  66  17.134   1.398   2.310
  505   1H    SER  67          1HT       SER  67  15.280   6.825  13.678
  506   2H    SER  67          2HT       SER  67  13.760   7.302  13.041
  507   3H    SER  67          3HT       SER  67  15.210   7.894  12.341
  508    HA   SER  67           HA       SER  67  15.807   5.661  11.708
  509   1HB   SER  67          2HB       SER  67  14.417   4.648  13.571
  510   2HB   SER  67          1HB       SER  67  12.995   4.955  12.573
  511    HG   SER  67           HG       SER  67  15.223   3.487  11.632
  512    H    ASN  68           H        ASN  68  14.745   4.559   9.766
  513    HA   ASN  68           HA       ASN  68  13.361   6.628   8.204
  514   1HB   ASN  68          2HB       ASN  68  14.739   4.206   7.059
  515   2HB   ASN  68          1HB       ASN  68  14.331   5.715   6.250
  516   1HD2  ASN  68          1HD2      ASN  68  16.771   3.969   7.609
  517   2HD2  ASN  68          2HD2      ASN  68  17.908   5.238   7.889
  518    H    PHE  69           H        PHE  69  12.086   4.699  10.068
  519    HA   PHE  69           HA       PHE  69  10.477   3.137   8.168
  520   1HB   PHE  69          2HB       PHE  69  11.443   1.737   9.861
  521   2HB   PHE  69          1HB       PHE  69  10.915   2.824  11.141
  522    HD1  PHE  69           1HD      PHE  69   8.878   1.719   8.262
  523    HD2  PHE  69           2HD      PHE  69   9.635   1.327  12.430
  524    HE1  PHE  69           1HE      PHE  69   6.808   0.415   8.510
  525    HE2  PHE  69           2HE      PHE  69   7.566   0.020  12.686
  526    HZ   PHE  69           HZ       PHE  69   6.149  -0.437  10.724
  527    H    LEU  70           H        LEU  70   9.172   4.890   7.506
  528    HA   LEU  70           HA       LEU  70   7.534   6.211   9.523
  529   1HB   LEU  70          2HB       LEU  70   8.513   6.898   6.943
  530   2HB   LEU  70          1HB       LEU  70   6.761   6.903   6.861
  531    HG   LEU  70           HG       LEU  70   7.495   9.119   7.388
  532   1HD1  LEU  70          1HD1      LEU  70   5.980   9.518   9.007
  533   2HD1  LEU  70          2HD1      LEU  70   6.676   8.324  10.103
  534   3HD1  LEU  70          3HD1      LEU  70   5.616   7.805   8.793
  535   1HD2  LEU  70          1HD2      LEU  70   8.804   8.186   9.910
  536   2HD2  LEU  70          2HD2      LEU  70   9.021   9.698   9.029
  537   3HD2  LEU  70          3HD2      LEU  70   9.700   8.202   8.391
  538    H    ASN  71           H        ASN  71   6.134   4.636  10.245
  539    HA   ASN  71           HA       ASN  71   4.479   3.240   8.278
  540   1HB   ASN  71          2HB       ASN  71   3.620   2.049  10.389
  541   2HB   ASN  71          1HB       ASN  71   5.276   1.724   9.889
  542   1HD2  ASN  71          1HD2      ASN  71   3.437   3.953  11.948
  543   2HD2  ASN  71          2HD2      ASN  71   4.594   3.991  13.230
  544    H    CYS  72           H        CYS  72   3.729   5.682   8.012
  545    HA   CYS  72           HA       CYS  72   1.955   6.811   9.860
  546   1HB   CYS  72          2HB       CYS  72   2.719   7.263   7.091
  547   2HB   CYS  72          1HB       CYS  72   1.010   7.586   7.354
  548    HG   CYS  72           HG       CYS  72   1.723   9.749   8.227
  549    H    TYR  73           H        TYR  73   0.062   6.095  10.574
  550    HA   TYR  73           HA       TYR  73  -1.630   4.543   8.734
  551   1HB   TYR  73          2HB       TYR  73  -2.390   3.398  10.997
  552   2HB   TYR  73          1HB       TYR  73  -1.003   2.806  10.093
  553    HD1  TYR  73           1HD      TYR  73   0.892   2.324  11.304
  554    HD2  TYR  73           2HD      TYR  73  -1.737   5.340  12.752
  555    HE1  TYR  73           1HE      TYR  73   2.307   2.596  13.296
  556    HE2  TYR  73           2HE      TYR  73  -0.327   5.623  14.744
  557    HH   TYR  73           HH       TYR  73   2.792   4.240  15.002
  558    H    VAL  74           H        VAL  74  -3.746   5.039   8.692
  559    HA   VAL  74           HA       VAL  74  -4.985   6.566  10.809
  560    HB   VAL  74           HB       VAL  74  -5.829   8.244   8.969
  561   1HG1  VAL  74          1HG1      VAL  74  -4.146   8.429  11.071
  562   2HG1  VAL  74          2HG1      VAL  74  -4.595   9.791  10.044
  563   3HG1  VAL  74          3HG1      VAL  74  -3.079   8.934   9.760
  564   1HG2  VAL  74          1HG2      VAL  74  -3.092   7.548   7.908
  565   2HG2  VAL  74          2HG2      VAL  74  -4.167   8.813   7.312
  566   3HG2  VAL  74          3HG2      VAL  74  -4.617   7.117   7.132
  567    H    SER  75           H        SER  75  -5.757   4.169  10.358
  568    HA   SER  75           HA       SER  75  -8.429   4.216   9.730
  569   1HB   SER  75          2HB       SER  75  -8.502   4.353   7.486
  570   2HB   SER  75          1HB       SER  75  -6.763   4.113   7.346
  571    HG   SER  75           HG       SER  75  -7.464   2.315   6.443
  572    H    GLY  76           H        GLY  76  -9.237   1.857   9.122
  573   1HA   GLY  76          2HA       GLY  76  -7.446  -0.111  10.388
  574   2HA   GLY  76          1HA       GLY  76  -9.089   0.083  10.978
  575    H    PHE  77           H        PHE  77  -7.682  -2.232   9.744
  576    HA   PHE  77           HA       PHE  77  -9.840  -3.091   8.078
  577   1HB   PHE  77          2HB       PHE  77  -8.215  -3.676   6.148
  578   2HB   PHE  77          1HB       PHE  77  -8.829  -2.033   6.264
  579    HD1  PHE  77           1HD      PHE  77  -6.264  -3.097   8.625
  580    HD2  PHE  77           2HD      PHE  77  -6.990  -1.278   4.845
  581    HE1  PHE  77           1HE      PHE  77  -3.961  -2.240   8.599
  582    HE2  PHE  77           2HE      PHE  77  -4.686  -0.416   4.815
  583    HZ   PHE  77           HZ       PHE  77  -3.169  -0.897   6.693
  584    H    HIS  78           H        HIS  78  -9.724  -4.531   9.977
  585    HA   HIS  78           HA       HIS  78  -7.533  -6.305  10.315
  586   1HB   HIS  78          2HB       HIS  78 -10.267  -6.039  11.430
  587   2HB   HIS  78          1HB       HIS  78  -9.544  -7.642  11.510
  588    HD1  HIS  78           1HD      HIS  78  -9.931  -6.688  14.172
  589    HD2  HIS  78           2HD      HIS  78  -6.664  -5.366  11.971
  590    HE1  HIS  78           1HE      HIS  78  -8.276  -5.844  15.867
  591    HE2  HIS  78           2HE      HIS  78  -6.346  -4.964  14.507
  592    HA   PRO  79           HA       PRO  79 -10.044  -9.590   7.954
  593   1HB   PRO  79          2HB       PRO  79 -12.576  -9.175   7.212
  594   2HB   PRO  79          1HB       PRO  79 -12.176  -9.595   8.884
  595   1HG   PRO  79          2HG       PRO  79 -12.768  -6.905   7.699
  596   2HG   PRO  79          1HG       PRO  79 -13.363  -7.613   9.213
  597   1HD   PRO  79          2HD       PRO  79 -11.274  -5.850   9.084
  598   2HD   PRO  79          1HD       PRO  79 -11.457  -7.072  10.358
  599    H    SER  80           H        SER  80  -8.510  -8.875   6.331
  600    HA   SER  80           HA       SER  80  -9.653  -8.496   3.789
  601   1HB   SER  80          2HB       SER  80 -10.048  -6.210   4.390
  602   2HB   SER  80          1HB       SER  80  -8.421  -6.039   5.049
  603    HG   SER  80           HG       SER  80  -9.054  -6.525   2.324
  604    H    ASP  81           H        ASP  81  -8.094  -8.507   2.082
  605    HA   ASP  81           HA       ASP  81  -5.666  -9.868   2.825
  606   1HB   ASP  81          2HB       ASP  81  -7.036 -10.500   0.828
  607   2HB   ASP  81          1HB       ASP  81  -6.564  -8.980   0.075
  608    H    ILE  82           H        ILE  82  -5.136  -7.744   4.056
  609    HA   ILE  82           HA       ILE  82  -3.595  -5.981   2.272
  610    HB   ILE  82           HB       ILE  82  -3.858  -4.179   3.765
  611   1HG1  ILE  82          2HG1      ILE  82  -3.490  -5.458   5.872
  612   2HG1  ILE  82          1HG1      ILE  82  -4.823  -4.317   5.984
  613   1HG2  ILE  82          1HG2      ILE  82  -6.583  -5.295   4.100
  614   2HG2  ILE  82          2HG2      ILE  82  -5.942  -5.174   2.462
  615   3HG2  ILE  82          3HG2      ILE  82  -6.063  -3.732   3.470
  616   1HD1  ILE  82          1HD1      ILE  82  -4.865  -7.286   5.964
  617   2HD1  ILE  82          2HD1      ILE  82  -6.258  -6.406   5.335
  618   3HD1  ILE  82          3HD1      ILE  82  -5.728  -6.146   6.997
  619    H    GLU  83           H        GLU  83  -1.506  -5.313   2.925
  620    HA   GLU  83           HA       GLU  83  -0.286  -6.408   5.280
  621   1HB   GLU  83          2HB       GLU  83  -0.266  -8.387   3.827
  622   2HB   GLU  83          1HB       GLU  83   0.567  -7.469   2.580
  623   1HG   GLU  83          2HG       GLU  83   2.052  -8.951   3.877
  624   2HG   GLU  83          1HG       GLU  83   2.515  -7.251   3.951
  625    H    VAL  84           H        VAL  84   0.316  -4.305   5.723
  626    HA   VAL  84           HA       VAL  84   2.162  -3.019   3.826
  627    HB   VAL  84           HB       VAL  84   0.665  -1.817   6.162
  628   1HG1  VAL  84          1HG1      VAL  84   1.532   0.297   4.730
  629   2HG1  VAL  84          2HG1      VAL  84   2.872  -0.821   4.481
  630   3HG1  VAL  84          3HG1      VAL  84   2.395  -0.367   6.117
  631   1HG2  VAL  84          1HG2      VAL  84  -0.868  -2.251   4.397
  632   2HG2  VAL  84          2HG2      VAL  84   0.257  -1.640   3.184
  633   3HG2  VAL  84          3HG2      VAL  84  -0.487  -0.531   4.336
  634    H    ASP  85           H        ASP  85   4.256  -3.248   4.261
  635    HA   ASP  85           HA       ASP  85   5.383  -2.673   6.780
  636   1HB   ASP  85          2HB       ASP  85   4.471  -5.364   6.457
  637   2HB   ASP  85          1HB       ASP  85   6.231  -5.374   6.515
  638    H    LEU  86           H        LEU  86   7.762  -3.785   6.786
  639    HA   LEU  86           HA       LEU  86   9.026  -4.189   4.310
  640   1HB   LEU  86          2HB       LEU  86  10.237  -2.093   4.050
  641   2HB   LEU  86          1HB       LEU  86   8.510  -1.843   3.925
  642    HG   LEU  86           HG       LEU  86   9.452  -0.014   5.140
  643   1HD1  LEU  86          1HD1      LEU  86   8.179  -1.778   7.210
  644   2HD1  LEU  86          2HD1      LEU  86   7.275  -1.000   5.911
  645   3HD1  LEU  86          3HD1      LEU  86   8.138  -0.021   7.097
  646   1HD2  LEU  86          1HD2      LEU  86  11.465  -1.463   5.888
  647   2HD2  LEU  86          2HD2      LEU  86  10.470  -1.802   7.305
  648   3HD2  LEU  86          3HD2      LEU  86  10.916  -0.141   6.916
  649    H    LEU  87           H        LEU  87  11.564  -3.373   4.726
  650    HA   LEU  87           HA       LEU  87  12.664  -5.202   6.432
  651   1HB   LEU  87          2HB       LEU  87  13.969  -3.978   4.789
  652   2HB   LEU  87          1HB       LEU  87  13.763  -2.491   5.695
  653    HG   LEU  87           HG       LEU  87  15.057  -4.786   7.080
  654   1HD1  LEU  87          1HD1      LEU  87  17.093  -4.613   6.038
  655   2HD1  LEU  87          2HD1      LEU  87  16.755  -3.003   5.401
  656   3HD1  LEU  87          3HD1      LEU  87  15.999  -4.418   4.667
  657   1HD2  LEU  87          1HD2      LEU  87  15.176  -1.796   7.151
  658   2HD2  LEU  87          2HD2      LEU  87  16.472  -2.766   7.852
  659   3HD2  LEU  87          3HD2      LEU  87  14.822  -2.931   8.453
  660    H    LYS  88           H        LYS  88  11.987  -5.451   8.485
  661    HA   LYS  88           HA       LYS  88  11.831  -5.084  10.727
  662   1HB   LYS  88          2HB       LYS  88  14.066  -3.761  10.104
  663   2HB   LYS  88          1HB       LYS  88  13.078  -2.384  10.574
  664   1HG   LYS  88          2HG       LYS  88  13.800  -4.768  12.260
  665   2HG   LYS  88          1HG       LYS  88  14.333  -3.100  12.472
  666   1HD   LYS  88          2HD       LYS  88  11.460  -4.002  12.648
  667   2HD   LYS  88          1HD       LYS  88  12.525  -3.800  14.040
  668   1HE   LYS  88          2HE       LYS  88  12.887  -1.411  13.029
  669   2HE   LYS  88          1HE       LYS  88  11.352  -1.740  12.229
  670   1HZ   LYS  88          1HZ       LYS  88  11.643  -2.124  15.139
  671   2HZ   LYS  88          2HZ       LYS  88  10.237  -1.856  14.239
  672   3HZ   LYS  88          3HZ       LYS  88  11.327  -0.589  14.501
  Start of MODEL    3
    1   1H    SER   1          1HT       SER   1  17.746   4.814  -1.811
    2   2H    SER   1          2HT       SER   1  16.430   5.629  -1.070
    3   3H    SER   1          3HT       SER   1  17.488   6.479  -2.120
    4    HA   SER   1           HA       SER   1  16.745   5.318  -3.975
    5   1HB   SER   1          2HB       SER   1  15.196   3.455  -3.811
    6   2HB   SER   1          1HB       SER   1  16.582   3.133  -2.769
    7    HG   SER   1           HG       SER   1  15.306   3.149  -1.103
    8    H    ASN   2           H        ASN   2  14.643   5.628  -5.051
    9    HA   ASN   2           HA       ASN   2  12.928   7.516  -3.572
   10   1HB   ASN   2          2HB       ASN   2  14.304   8.648  -5.283
   11   2HB   ASN   2          1HB       ASN   2  13.622   7.592  -6.517
   12   1HD2  ASN   2          1HD2      ASN   2  12.523   9.008  -7.727
   13   2HD2  ASN   2          2HD2      ASN   2  11.240  10.010  -7.151
   14    H    PHE   3           H        PHE   3  10.736   7.312  -3.775
   15    HA   PHE   3           HA       PHE   3   9.502   5.677  -5.765
   16   1HB   PHE   3          2HB       PHE   3  10.438   3.942  -4.244
   17   2HB   PHE   3          1HB       PHE   3   9.481   4.619  -2.931
   18    HD1  PHE   3           1HD      PHE   3   7.526   3.544  -2.439
   19    HD2  PHE   3           2HD      PHE   3   8.958   3.459  -6.443
   20    HE1  PHE   3           1HE      PHE   3   5.633   2.110  -3.079
   21    HE2  PHE   3           2HE      PHE   3   7.066   2.027  -7.094
   22    HZ   PHE   3           HZ       PHE   3   5.400   1.349  -5.409
   23    H    LEU   4           H        LEU   4   7.558   6.508  -6.123
   24    HA   LEU   4           HA       LEU   4   6.111   7.748  -3.881
   25   1HB   LEU   4          2HB       LEU   4   6.004   8.880  -6.657
   26   2HB   LEU   4          1HB       LEU   4   5.530   9.635  -5.147
   27    HG   LEU   4           HG       LEU   4   8.357   9.086  -6.052
   28   1HD1  LEU   4          1HD1      LEU   4   7.407  11.810  -5.445
   29   2HD1  LEU   4          2HD1      LEU   4   6.762  11.070  -6.910
   30   3HD1  LEU   4          3HD1      LEU   4   8.505  11.240  -6.703
   31   1HD2  LEU   4          1HD2      LEU   4   8.490  10.792  -3.913
   32   2HD2  LEU   4          2HD2      LEU   4   8.813   9.058  -3.862
   33   3HD2  LEU   4          3HD2      LEU   4   7.218   9.672  -3.428
   34    H    ASN   5           H        ASN   5   4.720   6.005  -3.660
   35    HA   ASN   5           HA       ASN   5   3.000   5.423  -5.978
   36   1HB   ASN   5          2HB       ASN   5   4.403   3.576  -4.749
   37   2HB   ASN   5          1HB       ASN   5   3.101   3.651  -3.568
   38   1HD2  ASN   5          1HD2      ASN   5   0.865   3.560  -4.569
   39   2HD2  ASN   5          2HD2      ASN   5   0.636   2.394  -5.823
   40    H    CYS   6           H        CYS   6   1.712   7.287  -5.533
   41    HA   CYS   6           HA       CYS   6   0.208   7.293  -3.035
   42   1HB   CYS   6          2HB       CYS   6  -0.709   9.452  -3.897
   43   2HB   CYS   6          1HB       CYS   6   1.044   9.439  -3.731
   44    HG   CYS   6           HG       CYS   6  -0.350   9.172  -6.502
   45    H    TYR   7           H        TYR   7  -1.793   6.541  -2.845
   46    HA   TYR   7           HA       TYR   7  -3.265   5.854  -5.303
   47   1HB   TYR   7          2HB       TYR   7  -2.464   4.112  -3.404
   48   2HB   TYR   7          1HB       TYR   7  -4.027   4.577  -2.743
   49    HD1  TYR   7           1HD      TYR   7  -5.767   3.181  -3.272
   50    HD2  TYR   7           2HD      TYR   7  -2.630   3.688  -6.096
   51    HE1  TYR   7           1HE      TYR   7  -6.878   1.589  -4.779
   52    HE2  TYR   7           2HE      TYR   7  -3.731   2.095  -7.614
   53    HH   TYR   7           HH       TYR   7  -5.327   0.306  -7.562
   54    H    VAL   8           H        VAL   8  -5.618   5.997  -5.180
   55    HA   VAL   8           HA       VAL   8  -6.981   7.250  -3.076
   56    HB   VAL   8           HB       VAL   8  -5.641   9.209  -3.654
   57   1HG1  VAL   8          1HG1      VAL   8  -7.006   9.375  -6.310
   58   2HG1  VAL   8          2HG1      VAL   8  -5.506   8.467  -6.126
   59   3HG1  VAL   8          3HG1      VAL   8  -5.545  10.189  -5.748
   60   1HG2  VAL   8          1HG2      VAL   8  -7.348  10.679  -3.386
   61   2HG2  VAL   8          2HG2      VAL   8  -8.254   9.190  -3.116
   62   3HG2  VAL   8          3HG2      VAL   8  -8.304   9.980  -4.693
   63    H    SER   9           H        SER   9  -8.771   6.115  -3.397
   64    HA   SER   9           HA       SER   9 -10.466   5.000  -4.512
   65   1HB   SER   9          2HB       SER   9 -11.301   7.269  -3.888
   66   2HB   SER   9          1HB       SER   9 -10.913   7.813  -5.520
   67    HG   SER   9           HG       SER   9 -12.326   5.992  -6.194
   68    H    GLY  10           H        GLY  10  -9.760   3.583  -6.056
   69   1HA   GLY  10          2HA       GLY  10 -10.396   3.998  -8.720
   70   2HA   GLY  10          1HA       GLY  10  -8.691   4.390  -8.568
   71    H    PHE  11           H        PHE  11 -10.695   2.025  -9.486
   72    HA   PHE  11           HA       PHE  11  -8.734   0.044  -9.649
   73   1HB   PHE  11          2HB       PHE  11  -8.985  -0.152  -7.224
   74   2HB   PHE  11          1HB       PHE  11 -10.717  -0.398  -7.408
   75    HD1  PHE  11           1HD      PHE  11  -7.416  -1.871  -8.220
   76    HD2  PHE  11           2HD      PHE  11 -11.591  -2.536  -7.745
   77    HE1  PHE  11           1HE      PHE  11  -7.047  -4.298  -8.391
   78    HE2  PHE  11           2HE      PHE  11 -11.228  -4.965  -7.913
   79    HZ   PHE  11           HZ       PHE  11  -8.954  -5.848  -8.237
   80    H    HIS  12           H        HIS  12  -9.604  -2.047 -10.438
   81    HA   HIS  12           HA       HIS  12 -12.355  -2.246 -11.168
   82   1HB   HIS  12          2HB       HIS  12 -10.597  -0.865 -12.972
   83   2HB   HIS  12          1HB       HIS  12 -11.139  -2.363 -13.719
   84    HD1  HIS  12           1HD      HIS  12 -13.369  -0.443 -11.394
   85    HD2  HIS  12           2HD      HIS  12 -12.869  -1.068 -15.472
   86    HE1  HIS  12           1HE      HIS  12 -15.423   0.520 -12.479
   87    HE2  HIS  12           2HE      HIS  12 -15.134   0.062 -14.940
   88    HA   PRO  13           HA       PRO  13 -10.063  -6.056 -13.034
   89   1HB   PRO  13          2HB       PRO  13  -7.341  -6.045 -13.014
   90   2HB   PRO  13          1HB       PRO  13  -8.299  -5.436 -14.369
   91   1HG   PRO  13          2HG       PRO  13  -6.997  -3.920 -12.138
   92   2HG   PRO  13          1HG       PRO  13  -7.030  -3.546 -13.871
   93   1HD   PRO  13          2HD       PRO  13  -8.657  -2.317 -12.116
   94   2HD   PRO  13          1HD       PRO  13  -9.176  -2.691 -13.771
   95    H    SER  14           H        SER  14 -10.509  -7.454 -11.455
   96    HA   SER  14           HA       SER  14 -10.117  -7.365  -8.803
   97   1HB   SER  14          2HB       SER  14 -10.249  -9.641 -10.716
   98   2HB   SER  14          1HB       SER  14  -9.785  -9.998  -9.053
   99    HG   SER  14           HG       SER  14 -11.786  -9.743  -8.499
  100    H    ASP  15           H        ASP  15  -7.766  -8.954 -10.980
  101    HA   ASP  15           HA       ASP  15  -5.841  -9.130  -8.828
  102   1HB   ASP  15          2HB       ASP  15  -6.297 -10.541 -11.217
  103   2HB   ASP  15          1HB       ASP  15  -4.740  -9.747 -11.428
  104    H    ILE  16           H        ILE  16  -4.390  -7.637  -8.341
  105    HA   ILE  16           HA       ILE  16  -3.257  -5.952 -10.429
  106    HB   ILE  16           HB       ILE  16  -4.848  -4.880  -8.111
  107   1HG1  ILE  16          2HG1      ILE  16  -5.962  -5.226 -10.296
  108   2HG1  ILE  16          1HG1      ILE  16  -5.907  -3.527  -9.834
  109   1HG2  ILE  16          1HG2      ILE  16  -3.018  -3.540  -7.789
  110   2HG2  ILE  16          2HG2      ILE  16  -3.865  -2.615  -9.027
  111   3HG2  ILE  16          3HG2      ILE  16  -2.505  -3.646  -9.472
  112   1HD1  ILE  16          1HD1      ILE  16  -4.949  -4.771 -12.202
  113   2HD1  ILE  16          2HD1      ILE  16  -3.586  -4.051 -11.346
  114   3HD1  ILE  16          3HD1      ILE  16  -4.978  -3.060 -11.782
  115    H    GLU  17           H        GLU  17  -1.158  -5.517 -10.087
  116    HA   GLU  17           HA       GLU  17  -0.043  -5.663  -7.403
  117   1HB   GLU  17          2HB       GLU  17   1.818  -7.165  -8.311
  118   2HB   GLU  17          1HB       GLU  17   0.266  -7.921  -7.973
  119   1HG   GLU  17          2HG       GLU  17  -0.253  -8.162 -10.219
  120   2HG   GLU  17          1HG       GLU  17   0.909  -6.934 -10.719
  121    H    VAL  18           H        VAL  18   1.798  -4.448  -7.128
  122    HA   VAL  18           HA       VAL  18   2.614  -2.839  -9.456
  123    HB   VAL  18           HB       VAL  18   3.005  -2.121  -6.552
  124   1HG1  VAL  18          1HG1      VAL  18   4.500  -0.825  -7.731
  125   2HG1  VAL  18          2HG1      VAL  18   3.071   0.210  -7.726
  126   3HG1  VAL  18          3HG1      VAL  18   3.468  -0.741  -9.158
  127   1HG2  VAL  18          1HG2      VAL  18   0.813  -1.208  -8.414
  128   2HG2  VAL  18          2HG2      VAL  18   1.081  -0.648  -6.763
  129   3HG2  VAL  18          3HG2      VAL  18   0.611  -2.320  -7.061
  130    H    ASP  19           H        ASP  19   4.878  -2.165  -9.545
  131    HA   ASP  19           HA       ASP  19   6.769  -3.807  -8.059
  132   1HB   ASP  19          2HB       ASP  19   5.952  -4.732 -10.478
  133   2HB   ASP  19          1HB       ASP  19   7.320  -3.732 -10.960
  134    H    LEU  20           H        LEU  20   8.791  -2.905  -7.855
  135    HA   LEU  20           HA       LEU  20   9.217  -0.311  -9.179
  136   1HB   LEU  20          2HB       LEU  20   8.558   0.138  -6.908
  137   2HB   LEU  20          1HB       LEU  20   9.724  -1.017  -6.294
  138    HG   LEU  20           HG       LEU  20  11.553   0.431  -7.164
  139   1HD1  LEU  20          1HD1      LEU  20  10.569   2.895  -7.475
  140   2HD1  LEU  20          2HD1      LEU  20   9.219   1.967  -8.128
  141   3HD1  LEU  20          3HD1      LEU  20  10.830   1.788  -8.823
  142   1HD2  LEU  20          1HD2      LEU  20   9.639   1.209  -5.044
  143   2HD2  LEU  20          2HD2      LEU  20  10.848   2.404  -5.509
  144   3HD2  LEU  20          3HD2      LEU  20  11.355   0.815  -4.936
  145    H    LEU  21           H        LEU  21  11.261   0.148  -9.850
  146    HA   LEU  21           HA       LEU  21  13.483  -0.104 -10.307
  147   1HB   LEU  21          2HB       LEU  21  13.237  -1.455  -7.864
  148   2HB   LEU  21          1HB       LEU  21  14.073  -2.573  -8.924
  149    HG   LEU  21           HG       LEU  21  15.007   0.266  -8.653
  150   1HD1  LEU  21          1HD1      LEU  21  16.375  -1.764  -7.030
  151   2HD1  LEU  21          2HD1      LEU  21  14.776  -1.293  -6.454
  152   3HD1  LEU  21          3HD1      LEU  21  16.027  -0.071  -6.679
  153   1HD2  LEU  21          1HD2      LEU  21  16.893  -0.438  -9.703
  154   2HD2  LEU  21          2HD2      LEU  21  15.767  -1.615 -10.378
  155   3HD2  LEU  21          3HD2      LEU  21  16.802  -2.061  -9.021
  156    H    LYS  22           H        LYS  22  13.190  -0.584 -12.437
  157    HA   LYS  22           HA       LYS  22  12.255  -3.044 -13.438
  158   1HB   LYS  22          2HB       LYS  22  12.811  -0.599 -14.527
  159   2HB   LYS  22          1HB       LYS  22  14.126  -1.573 -15.170
  160   1HG   LYS  22          2HG       LYS  22  12.787  -2.531 -16.652
  161   2HG   LYS  22          1HG       LYS  22  11.621  -2.973 -15.404
  162   1HD   LYS  22          2HD       LYS  22  10.258  -1.275 -15.930
  163   2HD   LYS  22          1HD       LYS  22  11.592  -0.126 -16.039
  164   1HE   LYS  22          2HE       LYS  22  11.099  -2.159 -18.189
  165   2HE   LYS  22          1HE       LYS  22  10.232  -0.624 -18.163
  166   1HZ   LYS  22          1HZ       LYS  22  13.014  -1.169 -18.785
  167   2HZ   LYS  22          2HZ       LYS  22  12.737   0.216 -17.855
  168   3HZ   LYS  22          3HZ       LYS  22  11.992   0.050 -19.364
  169   1H    SER  23          1HT       SER  23  11.472  10.784   2.519
  170   2H    SER  23          2HT       SER  23  10.136  10.227   1.600
  171   3H    SER  23          3HT       SER  23  10.230  11.877   2.069
  172    HA   SER  23           HA       SER  23  10.838  11.889  -0.116
  173   1HB   SER  23          2HB       SER  23  12.968  12.080   1.923
  174   2HB   SER  23          1HB       SER  23  13.539  11.951   0.258
  175    HG   SER  23           HG       SER  23  12.403  14.053   1.522
  176    H    ASN  24           H        ASN  24  12.108   9.118   1.589
  177    HA   ASN  24           HA       ASN  24  13.285   7.965  -0.791
  178   1HB   ASN  24          2HB       ASN  24  13.164   7.257   2.094
  179   2HB   ASN  24          1HB       ASN  24  13.360   5.930   0.954
  180   1HD2  ASN  24          1HD2      ASN  24  14.597   9.252   1.042
  181   2HD2  ASN  24          2HD2      ASN  24  16.265   8.816   0.915
  182    H    PHE  25           H        PHE  25  11.134   6.334   1.510
  183    HA   PHE  25           HA       PHE  25   9.685   5.198  -0.773
  184   1HB   PHE  25          2HB       PHE  25  10.657   3.580   0.794
  185   2HB   PHE  25          1HB       PHE  25   9.761   4.313   2.121
  186    HD1  PHE  25           1HD      PHE  25   7.676   3.490   2.688
  187    HD2  PHE  25           2HD      PHE  25   9.254   2.662  -1.174
  188    HE1  PHE  25           1HE      PHE  25   5.775   1.998   2.239
  189    HE2  PHE  25           2HE      PHE  25   7.356   1.165  -1.631
  190    HZ   PHE  25           HZ       PHE  25   5.614   0.832   0.076
  191    H    LEU  26           H        LEU  26   7.918   6.295  -1.317
  192    HA   LEU  26           HA       LEU  26   6.216   7.350   0.843
  193   1HB   LEU  26          2HB       LEU  26   7.073   8.518  -1.745
  194   2HB   LEU  26          1HB       LEU  26   5.422   8.833  -1.241
  195    HG   LEU  26           HG       LEU  26   7.490   9.311   0.812
  196   1HD1  LEU  26          1HD1      LEU  26   7.246  11.057  -1.631
  197   2HD1  LEU  26          2HD1      LEU  26   8.673  10.163  -1.108
  198   3HD1  LEU  26          3HD1      LEU  26   8.072  11.509  -0.140
  199   1HD2  LEU  26          1HD2      LEU  26   4.974  10.644  -0.143
  200   2HD2  LEU  26          2HD2      LEU  26   6.057  11.409   1.020
  201   3HD2  LEU  26          3HD2      LEU  26   5.292   9.868   1.408
  202    H    ASN  27           H        ASN  27   4.862   5.600   1.031
  203    HA   ASN  27           HA       ASN  27   3.143   5.083  -1.302
  204   1HB   ASN  27          2HB       ASN  27   4.785   3.198  -0.670
  205   2HB   ASN  27          1HB       ASN  27   3.764   2.963   0.746
  206   1HD2  ASN  27          1HD2      ASN  27   3.740   0.814  -0.498
  207   2HD2  ASN  27          2HD2      ASN  27   2.410   0.596  -1.579
  208    H    CYS  28           H        CYS  28   0.960   4.967  -0.924
  209    HA   CYS  28           HA       CYS  28  -0.287   4.513   1.519
  210   1HB   CYS  28          2HB       CYS  28  -1.024   6.905   2.013
  211   2HB   CYS  28          1HB       CYS  28   0.635   6.492   2.435
  212    HG   CYS  28           HG       CYS  28   1.159   8.536   1.180
  213    H    TYR  29           H        TYR  29  -2.607   5.077   1.510
  214    HA   TYR  29           HA       TYR  29  -3.598   5.637  -1.204
  215   1HB   TYR  29          2HB       TYR  29  -5.509   3.952  -0.468
  216   2HB   TYR  29          1HB       TYR  29  -4.039   3.396  -1.252
  217    HD1  TYR  29           1HD      TYR  29  -2.228   2.366   0.129
  218    HD2  TYR  29           2HD      TYR  29  -6.058   3.281   1.738
  219    HE1  TYR  29           1HE      TYR  29  -1.801   0.835   2.005
  220    HE2  TYR  29           2HE      TYR  29  -5.637   1.757   3.620
  221    HH   TYR  29           HH       TYR  29  -4.262  -0.129   4.191
  222    H    VAL  30           H        VAL  30  -5.699   6.527  -1.359
  223    HA   VAL  30           HA       VAL  30  -6.637   7.784   1.137
  224    HB   VAL  30           HB       VAL  30  -6.802   8.999  -1.621
  225   1HG1  VAL  30          1HG1      VAL  30  -7.516   9.963   1.130
  226   2HG1  VAL  30          2HG1      VAL  30  -8.522   9.910  -0.318
  227   3HG1  VAL  30          3HG1      VAL  30  -7.209  11.081  -0.198
  228   1HG2  VAL  30          1HG2      VAL  30  -5.104  10.612  -0.318
  229   2HG2  VAL  30          2HG2      VAL  30  -4.573   9.258  -1.315
  230   3HG2  VAL  30          3HG2      VAL  30  -4.681   9.075   0.436
  231    H    SER  31           H        SER  31  -8.381   6.616   1.674
  232    HA   SER  31           HA       SER  31 -10.356   5.461   1.504
  233   1HB   SER  31          2HB       SER  31 -10.729   8.121   1.297
  234   2HB   SER  31          1HB       SER  31 -11.481   7.600  -0.211
  235    HG   SER  31           HG       SER  31 -13.108   6.915   0.909
  236    H    GLY  32           H        GLY  32 -12.390   5.444  -0.365
  237   1HA   GLY  32          2HA       GLY  32 -13.044   4.103  -2.120
  238   2HA   GLY  32          1HA       GLY  32 -11.903   5.089  -3.016
  239    H    PHE  33           H        PHE  33 -11.465   2.554  -0.544
  240    HA   PHE  33           HA       PHE  33  -9.809   1.115  -2.509
  241   1HB   PHE  33          2HB       PHE  33  -8.855   2.241  -0.230
  242   2HB   PHE  33          1HB       PHE  33  -9.246   0.624   0.346
  243    HD1  PHE  33           1HD      PHE  33  -6.793   2.612  -1.172
  244    HD2  PHE  33           2HD      PHE  33  -8.390  -1.330  -1.186
  245    HE1  PHE  33           1HE      PHE  33  -4.696   1.770  -2.145
  246    HE2  PHE  33           2HE      PHE  33  -6.298  -2.180  -2.162
  247    HZ   PHE  33           HZ       PHE  33  -4.447  -0.628  -2.643
  248    H    HIS  34           H        HIS  34 -11.981   0.142  -2.989
  249    HA   HIS  34           HA       HIS  34 -12.584  -2.025  -1.098
  250   1HB   HIS  34          2HB       HIS  34 -14.825  -2.033  -1.838
  251   2HB   HIS  34          1HB       HIS  34 -14.403  -0.335  -1.649
  252    HD1  HIS  34           1HD      HIS  34 -16.474  -2.016  -3.694
  253    HD2  HIS  34           2HD      HIS  34 -13.120   0.276  -4.567
  254    HE1  HIS  34           1HE      HIS  34 -16.753  -1.300  -6.088
  255    HE2  HIS  34           2HE      HIS  34 -14.676   0.025  -6.616
  256    HA   PRO  35           HA       PRO  35 -11.325  -3.538  -5.651
  257   1HB   PRO  35          2HB       PRO  35  -8.675  -3.970  -4.373
  258   2HB   PRO  35          1HB       PRO  35  -9.062  -3.514  -6.032
  259   1HG   PRO  35          2HG       PRO  35  -8.120  -1.723  -4.305
  260   2HG   PRO  35          1HG       PRO  35  -9.362  -1.288  -5.495
  261   1HD   PRO  35          2HD       PRO  35  -9.628  -1.777  -2.568
  262   2HD   PRO  35          1HD       PRO  35 -10.495  -0.644  -3.619
  263    H    SER  36           H        SER  36  -9.735  -5.713  -5.730
  264    HA   SER  36           HA       SER  36 -11.035  -7.550  -3.840
  265   1HB   SER  36          2HB       SER  36 -11.673  -8.175  -6.023
  266   2HB   SER  36          1HB       SER  36 -10.056  -7.894  -6.668
  267    HG   SER  36           HG       SER  36  -9.371  -9.767  -5.818
  268    H    ASP  37           H        ASP  37  -8.085  -7.756  -5.831
  269    HA   ASP  37           HA       ASP  37  -6.563  -8.338  -3.383
  270   1HB   ASP  37          2HB       ASP  37  -7.093 -10.449  -4.550
  271   2HB   ASP  37          1HB       ASP  37  -6.315  -9.830  -6.004
  272    H    ILE  38           H        ILE  38  -5.081  -6.814  -3.154
  273    HA   ILE  38           HA       ILE  38  -3.614  -5.897  -5.539
  274    HB   ILE  38           HB       ILE  38  -4.848  -4.284  -3.347
  275   1HG1  ILE  38          2HG1      ILE  38  -5.187  -2.733  -5.333
  276   2HG1  ILE  38          1HG1      ILE  38  -4.542  -4.028  -6.337
  277   1HG2  ILE  38          1HG2      ILE  38  -2.243  -3.672  -4.691
  278   2HG2  ILE  38          2HG2      ILE  38  -2.687  -3.512  -2.992
  279   3HG2  ILE  38          3HG2      ILE  38  -3.321  -2.373  -4.179
  280   1HD1  ILE  38          1HD1      ILE  38  -7.110  -3.736  -5.994
  281   2HD1  ILE  38          2HD1      ILE  38  -6.804  -4.627  -4.504
  282   3HD1  ILE  38          3HD1      ILE  38  -6.389  -5.342  -6.062
  283    H    GLU  39           H        GLU  39  -1.429  -5.725  -5.361
  284    HA   GLU  39           HA       GLU  39  -0.167  -5.995  -2.747
  285   1HB   GLU  39          2HB       GLU  39   1.240  -7.858  -3.453
  286   2HB   GLU  39          1HB       GLU  39  -0.459  -8.305  -3.526
  287   1HG   GLU  39          2HG       GLU  39  -0.461  -8.492  -5.784
  288   2HG   GLU  39          1HG       GLU  39   0.763  -7.242  -6.001
  289    H    VAL  40           H        VAL  40   2.114  -5.484  -2.771
  290    HA   VAL  40           HA       VAL  40   3.034  -4.108  -5.200
  291    HB   VAL  40           HB       VAL  40   3.366  -2.959  -2.428
  292   1HG1  VAL  40          1HG1      VAL  40   4.639  -1.354  -3.342
  293   2HG1  VAL  40          2HG1      VAL  40   3.633  -1.239  -4.786
  294   3HG1  VAL  40          3HG1      VAL  40   4.857  -2.503  -4.662
  295   1HG2  VAL  40          1HG2      VAL  40   1.187  -2.692  -4.393
  296   2HG2  VAL  40          2HG2      VAL  40   1.787  -1.183  -3.703
  297   3HG2  VAL  40          3HG2      VAL  40   1.178  -2.456  -2.645
  298    H    ASP  41           H        ASP  41   5.040  -4.659  -5.768
  299    HA   ASP  41           HA       ASP  41   6.787  -5.862  -3.721
  300   1HB   ASP  41          2HB       ASP  41   6.304  -6.663  -6.581
  301   2HB   ASP  41          1HB       ASP  41   7.784  -7.119  -5.744
  302    H    LEU  42           H        LEU  42   8.110  -4.182  -3.244
  303    HA   LEU  42           HA       LEU  42   9.343  -2.686  -5.439
  304   1HB   LEU  42          2HB       LEU  42   9.597  -2.172  -2.477
  305   2HB   LEU  42          1HB       LEU  42  10.064  -1.096  -3.779
  306    HG   LEU  42           HG       LEU  42   8.055  -0.251  -2.815
  307   1HD1  LEU  42          1HD1      LEU  42   6.408  -0.656  -4.777
  308   2HD1  LEU  42          2HD1      LEU  42   7.761  -1.528  -5.496
  309   3HD1  LEU  42          3HD1      LEU  42   7.935   0.175  -5.074
  310   1HD2  LEU  42          1HD2      LEU  42   7.468  -2.720  -2.030
  311   2HD2  LEU  42          2HD2      LEU  42   6.431  -2.643  -3.455
  312   3HD2  LEU  42          3HD2      LEU  42   6.247  -1.456  -2.163
  313    H    LEU  43           H        LEU  43  11.102  -3.666  -6.245
  314    HA   LEU  43           HA       LEU  43  13.473  -3.904  -4.812
  315   1HB   LEU  43          2HB       LEU  43  13.754  -6.308  -4.584
  316   2HB   LEU  43          1HB       LEU  43  12.398  -5.747  -3.628
  317    HG   LEU  43           HG       LEU  43  12.132  -7.075  -6.325
  318   1HD1  LEU  43          1HD1      LEU  43  13.005  -8.722  -4.877
  319   2HD1  LEU  43          2HD1      LEU  43  11.264  -8.993  -4.942
  320   3HD1  LEU  43          3HD1      LEU  43  11.980  -8.195  -3.542
  321   1HD2  LEU  43          1HD2      LEU  43  10.208  -5.796  -5.994
  322   2HD2  LEU  43          2HD2      LEU  43  10.182  -6.117  -4.260
  323   3HD2  LEU  43          3HD2      LEU  43   9.761  -7.395  -5.399
  324    H    LYS  44           H        LYS  44  11.605  -5.495  -7.378
  325    HA   LYS  44           HA       LYS  44  13.585  -4.711  -9.330
  326   1HB   LYS  44          2HB       LYS  44  13.508  -7.400  -8.234
  327   2HB   LYS  44          1HB       LYS  44  13.247  -7.404  -9.973
  328   1HG   LYS  44          2HG       LYS  44  15.516  -7.560  -9.906
  329   2HG   LYS  44          1HG       LYS  44  15.336  -5.805  -9.956
  330   1HD   LYS  44          2HD       LYS  44  16.228  -5.559  -7.918
  331   2HD   LYS  44          1HD       LYS  44  15.250  -6.864  -7.246
  332   1HE   LYS  44          2HE       LYS  44  17.242  -7.899  -7.040
  333   2HE   LYS  44          1HE       LYS  44  16.990  -8.282  -8.742
  334   1HZ   LYS  44          1HZ       LYS  44  18.385  -6.518  -9.397
  335   2HZ   LYS  44          2HZ       LYS  44  19.213  -7.317  -8.157
  336   3HZ   LYS  44          3HZ       LYS  44  18.426  -5.852  -7.842
  337   1H    SER  45          1HT       SER  45  14.776   2.806   7.469
  338   2H    SER  45          2HT       SER  45  15.232   4.312   8.151
  339   3H    SER  45          3HT       SER  45  16.398   3.345   7.346
  340    HA   SER  45           HA       SER  45  15.822   5.071   5.915
  341   1HB   SER  45          2HB       SER  45  15.264   3.779   4.030
  342   2HB   SER  45          1HB       SER  45  15.944   2.596   5.147
  343    HG   SER  45           HG       SER  45  13.953   1.815   5.558
  344    H    ASN  46           H        ASN  46  14.311   6.424   4.930
  345    HA   ASN  46           HA       ASN  46  12.062   7.125   6.421
  346   1HB   ASN  46          2HB       ASN  46  13.366   8.029   4.024
  347   2HB   ASN  46          1HB       ASN  46  11.623   8.014   3.768
  348   1HD2  ASN  46          1HD2      ASN  46  12.995  10.363   3.747
  349   2HD2  ASN  46          2HD2      ASN  46  12.593  11.295   5.145
  350    H    PHE  47           H        PHE  47  10.562   5.565   6.804
  351    HA   PHE  47           HA       PHE  47   9.396   4.173   4.498
  352   1HB   PHE  47          2HB       PHE  47  10.161   2.705   6.285
  353   2HB   PHE  47          1HB       PHE  47   9.188   3.585   7.459
  354    HD1  PHE  47           1HD      PHE  47   7.289   2.504   8.133
  355    HD2  PHE  47           2HD      PHE  47   8.644   1.970   4.135
  356    HE1  PHE  47           1HE      PHE  47   5.394   0.997   7.696
  357    HE2  PHE  47           2HE      PHE  47   6.751   0.462   3.693
  358    HZ   PHE  47           HZ       PHE  47   5.124  -0.025   5.473
  359    H    LEU  48           H        LEU  48   7.665   5.099   3.656
  360    HA   LEU  48           HA       LEU  48   5.721   6.364   5.470
  361   1HB   LEU  48          2HB       LEU  48   7.161   7.595   3.450
  362   2HB   LEU  48          1HB       LEU  48   5.609   7.274   2.702
  363    HG   LEU  48           HG       LEU  48   5.468   9.457   3.587
  364   1HD1  LEU  48          1HD1      LEU  48   3.631   9.324   5.041
  365   2HD1  LEU  48          2HD1      LEU  48   4.178   7.796   5.730
  366   3HD1  LEU  48          3HD1      LEU  48   3.566   7.849   4.077
  367   1HD2  LEU  48          1HD2      LEU  48   5.891   9.822   6.075
  368   2HD2  LEU  48          2HD2      LEU  48   7.302   9.620   5.037
  369   3HD2  LEU  48          3HD2      LEU  48   6.742   8.278   6.037
  370    H    ASN  49           H        ASN  49   4.557   4.404   5.646
  371    HA   ASN  49           HA       ASN  49   3.005   3.730   3.233
  372   1HB   ASN  49          2HB       ASN  49   4.706   1.965   3.933
  373   2HB   ASN  49          1HB       ASN  49   3.721   1.728   5.372
  374   1HD2  ASN  49          1HD2      ASN  49   3.902   1.352   1.925
  375   2HD2  ASN  49          2HD2      ASN  49   2.551   0.288   1.766
  376    H    CYS  50           H        CYS  50   1.423   5.239   3.976
  377    HA   CYS  50           HA       CYS  50  -0.237   4.139   6.146
  378   1HB   CYS  50          2HB       CYS  50  -0.757   6.638   6.653
  379   2HB   CYS  50          1HB       CYS  50   0.727   5.928   7.274
  380    HG   CYS  50           HG       CYS  50   0.782   7.677   4.705
  381    H    TYR  51           H        TYR  51  -2.321   5.833   6.142
  382    HA   TYR  51           HA       TYR  51  -3.271   6.531   3.565
  383   1HB   TYR  51          2HB       TYR  51  -4.742   4.825   3.040
  384   2HB   TYR  51          1HB       TYR  51  -3.385   3.925   3.699
  385    HD1  TYR  51           1HD      TYR  51  -3.598   2.705   5.767
  386    HD2  TYR  51           2HD      TYR  51  -6.825   5.060   4.306
  387    HE1  TYR  51           1HE      TYR  51  -5.115   1.604   7.360
  388    HE2  TYR  51           2HE      TYR  51  -8.350   3.969   5.895
  389    HH   TYR  51           HH       TYR  51  -8.307   2.749   7.948
  390    H    VAL  52           H        VAL  52  -5.796   6.862   3.718
  391    HA   VAL  52           HA       VAL  52  -6.482   7.787   6.418
  392    HB   VAL  52           HB       VAL  52  -7.261   9.922   5.630
  393   1HG1  VAL  52          1HG1      VAL  52  -4.651   9.241   5.894
  394   2HG1  VAL  52          2HG1      VAL  52  -5.231  10.891   5.657
  395   3HG1  VAL  52          3HG1      VAL  52  -4.652   9.952   4.280
  396   1HG2  VAL  52          1HG2      VAL  52  -6.623   8.802   2.926
  397   2HG2  VAL  52          2HG2      VAL  52  -6.625  10.545   3.197
  398   3HG2  VAL  52          3HG2      VAL  52  -8.091   9.606   3.484
  399    H    SER  53           H        SER  53  -8.641   7.862   6.925
  400    HA   SER  53           HA       SER  53 -10.948   7.753   6.519
  401   1HB   SER  53          2HB       SER  53 -10.441   7.868   3.996
  402   2HB   SER  53          1HB       SER  53 -10.470   6.106   4.043
  403    HG   SER  53           HG       SER  53 -12.547   6.325   3.869
  404    H    GLY  54           H        GLY  54 -12.424   5.591   5.922
  405   1HA   GLY  54          2HA       GLY  54 -11.587   3.742   7.979
  406   2HA   GLY  54          1HA       GLY  54 -13.121   3.730   7.126
  407    H    PHE  55           H        PHE  55 -11.350   3.868   4.564
  408    HA   PHE  55           HA       PHE  55 -10.529   2.397   3.032
  409   1HB   PHE  55          2HB       PHE  55  -8.846   2.022   4.897
  410   2HB   PHE  55          1HB       PHE  55  -9.793   0.610   5.352
  411    HD1  PHE  55           1HD      PHE  55  -7.629   2.076   2.775
  412    HD2  PHE  55           2HD      PHE  55  -9.726  -1.396   4.062
  413    HE1  PHE  55           1HE      PHE  55  -6.389   0.724   1.133
  414    HE2  PHE  55           2HE      PHE  55  -8.491  -2.755   2.424
  415    HZ   PHE  55           HZ       PHE  55  -6.818  -1.695   0.958
  416    H    HIS  56           H        HIS  56 -11.819   1.249   1.757
  417    HA   HIS  56           HA       HIS  56 -14.041  -0.221   2.824
  418   1HB   HIS  56          2HB       HIS  56 -13.051   0.495   0.105
  419   2HB   HIS  56          1HB       HIS  56 -14.152  -0.872   0.246
  420    HD1  HIS  56           1HD      HIS  56 -14.119   2.650   1.713
  421    HD2  HIS  56           2HD      HIS  56 -16.670  -0.021  -0.193
  422    HE1  HIS  56           1HE      HIS  56 -16.327   3.840   1.532
  423    HE2  HIS  56           2HE      HIS  56 -17.874   2.177   0.443
  424    HA   PRO  57           HA       PRO  57 -12.572  -4.354   3.042
  425   1HB   PRO  57          2HB       PRO  57 -14.356  -5.722   1.422
  426   2HB   PRO  57          1HB       PRO  57 -14.650  -5.281   3.106
  427   1HG   PRO  57          2HG       PRO  57 -15.547  -3.917   0.606
  428   2HG   PRO  57          1HG       PRO  57 -16.428  -4.173   2.123
  429   1HD   PRO  57          2HD       PRO  57 -15.350  -1.795   1.522
  430   2HD   PRO  57          1HD       PRO  57 -15.354  -2.412   3.188
  431    H    SER  58           H        SER  58 -10.660  -4.706   2.089
  432    HA   SER  58           HA       SER  58 -10.557  -5.808  -0.545
  433   1HB   SER  58          2HB       SER  58 -10.540  -3.601  -1.377
  434   2HB   SER  58          1HB       SER  58  -9.514  -3.024  -0.064
  435    HG   SER  58           HG       SER  58  -7.775  -3.853  -1.028
  436    H    ASP  59           H        ASP  59  -8.385  -6.562  -1.111
  437    HA   ASP  59           HA       ASP  59  -6.851  -7.155   1.313
  438   1HB   ASP  59          2HB       ASP  59  -7.678  -9.056  -0.064
  439   2HB   ASP  59          1HB       ASP  59  -6.690  -8.478  -1.402
  440    H    ILE  60           H        ILE  60  -4.935  -6.254   1.667
  441    HA   ILE  60           HA       ILE  60  -3.474  -5.113  -0.624
  442    HB   ILE  60           HB       ILE  60  -2.687  -3.295   0.825
  443   1HG1  ILE  60          2HG1      ILE  60  -4.557  -3.264   2.911
  444   2HG1  ILE  60          1HG1      ILE  60  -3.952  -4.917   2.868
  445   1HG2  ILE  60          1HG2      ILE  60  -5.666  -3.592   0.532
  446   2HG2  ILE  60          2HG2      ILE  60  -4.543  -2.790  -0.566
  447   3HG2  ILE  60          3HG2      ILE  60  -4.881  -2.089   1.018
  448   1HD1  ILE  60          1HD1      ILE  60  -1.706  -4.170   3.160
  449   2HD1  ILE  60          2HD1      ILE  60  -2.710  -3.401   4.390
  450   3HD1  ILE  60          3HD1      ILE  60  -2.189  -2.484   2.976
  451    H    GLU  61           H        GLU  61  -1.624  -6.150  -0.903
  452    HA   GLU  61           HA       GLU  61  -0.261  -7.277   1.451
  453   1HB   GLU  61          2HB       GLU  61  -1.086  -8.647  -0.706
  454   2HB   GLU  61          1HB       GLU  61   0.500  -8.152  -1.281
  455   1HG   GLU  61          2HG       GLU  61   1.610  -9.331   0.391
  456   2HG   GLU  61          1HG       GLU  61   0.162  -9.462   1.388
  457    H    VAL  62           H        VAL  62   0.823  -5.331   1.957
  458    HA   VAL  62           HA       VAL  62   2.550  -4.084   0.011
  459    HB   VAL  62           HB       VAL  62   2.410  -3.632   2.997
  460   1HG1  VAL  62          1HG1      VAL  62   3.436  -1.442   2.423
  461   2HG1  VAL  62          2HG1      VAL  62   3.653  -2.022   0.771
  462   3HG1  VAL  62          3HG1      VAL  62   4.487  -2.822   2.104
  463   1HG2  VAL  62          1HG2      VAL  62   0.976  -2.282   0.717
  464   2HG2  VAL  62          2HG2      VAL  62   1.077  -1.615   2.347
  465   3HG2  VAL  62          3HG2      VAL  62   0.262  -3.155   2.072
  466    H    ASP  63           H        ASP  63   4.520  -4.775  -0.492
  467    HA   ASP  63           HA       ASP  63   6.195  -5.975   1.578
  468   1HB   ASP  63          2HB       ASP  63   5.887  -7.285  -1.126
  469   2HB   ASP  63          1HB       ASP  63   6.769  -7.896   0.269
  470    H    LEU  64           H        LEU  64   8.036  -4.886   1.594
  471    HA   LEU  64           HA       LEU  64   9.277  -4.160  -0.961
  472   1HB   LEU  64          2HB       LEU  64   9.991  -2.042   0.630
  473   2HB   LEU  64          1HB       LEU  64   8.772  -2.009  -0.628
  474    HG   LEU  64           HG       LEU  64   8.132  -2.638   2.250
  475   1HD1  LEU  64          1HD1      LEU  64   7.146  -0.185   1.941
  476   2HD1  LEU  64          2HD1      LEU  64   8.548  -0.048   0.883
  477   3HD1  LEU  64          3HD1      LEU  64   8.762  -0.487   2.578
  478   1HD2  LEU  64          1HD2      LEU  64   6.235  -3.284   1.231
  479   2HD2  LEU  64          2HD2      LEU  64   6.614  -2.412  -0.254
  480   3HD2  LEU  64          3HD2      LEU  64   5.918  -1.552   1.119
  481    H    LEU  65           H        LEU  65  11.247  -4.976  -1.039
  482    HA   LEU  65           HA       LEU  65  13.094  -4.715   1.135
  483   1HB   LEU  65          2HB       LEU  65  13.433  -7.009   1.658
  484   2HB   LEU  65          1HB       LEU  65  11.714  -6.696   1.802
  485    HG   LEU  65           HG       LEU  65  12.905  -7.902  -0.684
  486   1HD1  LEU  65          1HD1      LEU  65  11.734  -9.416   1.642
  487   2HD1  LEU  65          2HD1      LEU  65  13.462  -9.276   1.316
  488   3HD1  LEU  65          3HD1      LEU  65  12.409 -10.085   0.156
  489   1HD2  LEU  65          1HD2      LEU  65  10.560  -8.788  -0.865
  490   2HD2  LEU  65          2HD2      LEU  65  10.720  -7.040  -1.033
  491   3HD2  LEU  65          3HD2      LEU  65  10.134  -7.730   0.480
  492    H    LYS  66           H        LYS  66  14.956  -6.620   0.442
  493    HA   LYS  66           HA       LYS  66  16.707  -6.941  -0.976
  494   1HB   LYS  66          2HB       LYS  66  14.350  -6.998  -2.835
  495   2HB   LYS  66          1HB       LYS  66  15.985  -7.160  -3.462
  496   1HG   LYS  66          2HG       LYS  66  15.428  -8.914  -1.199
  497   2HG   LYS  66          1HG       LYS  66  14.395  -9.207  -2.598
  498   1HD   LYS  66          2HD       LYS  66  16.092 -10.019  -3.835
  499   2HD   LYS  66          1HD       LYS  66  17.237  -8.821  -3.228
  500   1HE   LYS  66          2HE       LYS  66  17.757 -11.195  -2.610
  501   2HE   LYS  66          1HE       LYS  66  17.630 -10.080  -1.250
  502   1HZ   LYS  66          1HZ       LYS  66  15.185 -11.457  -2.010
  503   2HZ   LYS  66          2HZ       LYS  66  15.792 -11.097  -0.472
  504   3HZ   LYS  66          3HZ       LYS  66  16.396 -12.424  -1.329
  505   1H    SER  67          1HT       SER  67  10.654   9.232  13.465
  506   2H    SER  67          2HT       SER  67  11.329  10.489  14.420
  507   3H    SER  67          3HT       SER  67  12.352   9.324  13.683
  508    HA   SER  67           HA       SER  67  10.602  11.133  12.170
  509   1HB   SER  67          2HB       SER  67  12.534  12.075  13.755
  510   2HB   SER  67          1HB       SER  67  13.541  11.588  12.392
  511    HG   SER  67           HG       SER  67  11.225  13.183  12.077
  512    H    ASN  68           H        ASN  68  10.821   8.430  11.626
  513    HA   ASN  68           HA       ASN  68  12.115   8.515   9.041
  514   1HB   ASN  68          2HB       ASN  68  13.451   6.491   9.396
  515   2HB   ASN  68          1HB       ASN  68  13.947   7.771  10.500
  516   1HD2  ASN  68          1HD2      ASN  68  13.138   7.671  12.693
  517   2HD2  ASN  68          2HD2      ASN  68  12.824   6.131  13.410
  518    H    PHE  69           H        PHE  69  10.411   6.529  11.436
  519    HA   PHE  69           HA       PHE  69   9.182   4.974   9.299
  520   1HB   PHE  69          2HB       PHE  69   9.984   3.691  11.176
  521   2HB   PHE  69          1HB       PHE  69   9.084   4.697  12.307
  522    HD1  PHE  69           1HD      PHE  69   6.581   4.621  12.270
  523    HD2  PHE  69           2HD      PHE  69   8.988   1.832  10.142
  524    HE1  PHE  69           1HE      PHE  69   4.658   3.096  12.105
  525    HE2  PHE  69           2HE      PHE  69   7.069   0.301   9.971
  526    HZ   PHE  69           HZ       PHE  69   4.900   0.933  10.954
  527    H    LEU  70           H        LEU  70   7.030   4.944   8.842
  528    HA   LEU  70           HA       LEU  70   5.101   6.415  10.387
  529   1HB   LEU  70          2HB       LEU  70   6.049   7.423   7.713
  530   2HB   LEU  70          1HB       LEU  70   4.460   7.815   8.339
  531    HG   LEU  70           HG       LEU  70   7.111   8.553   9.578
  532   1HD1  LEU  70          1HD1      LEU  70   6.778  10.049   7.846
  533   2HD1  LEU  70          2HD1      LEU  70   6.040  10.877   9.217
  534   3HD1  LEU  70          3HD1      LEU  70   5.026  10.042   8.040
  535   1HD2  LEU  70          1HD2      LEU  70   5.125   9.961  10.876
  536   2HD2  LEU  70          2HD2      LEU  70   6.014   8.582  11.520
  537   3HD2  LEU  70          3HD2      LEU  70   4.454   8.336  10.735
  538    H    ASN  71           H        ASN  71   3.323   5.176  10.308
  539    HA   ASN  71           HA       ASN  71   2.617   3.895   7.769
  540   1HB   ASN  71          2HB       ASN  71   3.897   2.408   9.534
  541   2HB   ASN  71          1HB       ASN  71   2.306   2.310  10.282
  542   1HD2  ASN  71          1HD2      ASN  71   0.811   0.986   9.438
  543   2HD2  ASN  71          2HD2      ASN  71   1.043   0.022   8.023
  544    H    CYS  72           H        CYS  72   0.426   2.754   7.992
  545    HA   CYS  72           HA       CYS  72  -1.824   3.231   7.953
  546   1HB   CYS  72          2HB       CYS  72  -2.577   3.400  10.540
  547   2HB   CYS  72          1HB       CYS  72  -2.159   1.890   9.744
  548    HG   CYS  72           HG       CYS  72  -0.330   3.387  11.759
  549    H    TYR  73           H        TYR  73  -1.050   5.111  10.839
  550    HA   TYR  73           HA       TYR  73  -1.223   7.314  11.317
  551   1HB   TYR  73          2HB       TYR  73  -0.781   7.288   8.479
  552   2HB   TYR  73          1HB       TYR  73  -1.886   8.592   8.899
  553    HD1  TYR  73           1HD      TYR  73   1.476   7.766   8.514
  554    HD2  TYR  73           2HD      TYR  73  -1.151   9.930  11.065
  555    HE1  TYR  73           1HE      TYR  73   3.363   9.146   9.275
  556    HE2  TYR  73           2HE      TYR  73   0.728  11.316  11.836
  557    HH   TYR  73           HH       TYR  73   3.557  10.737  11.855
  558    H    VAL  74           H        VAL  74  -3.465   7.601   8.589
  559    HA   VAL  74           HA       VAL  74  -5.559   8.180  10.558
  560    HB   VAL  74           HB       VAL  74  -5.540   8.820   7.607
  561   1HG1  VAL  74          1HG1      VAL  74  -7.677   8.698   9.332
  562   2HG1  VAL  74          2HG1      VAL  74  -7.610   9.634   7.839
  563   3HG1  VAL  74          3HG1      VAL  74  -7.230  10.403   9.379
  564   1HG2  VAL  74          1HG2      VAL  74  -5.170  11.173   8.429
  565   2HG2  VAL  74          2HG2      VAL  74  -3.792  10.085   8.582
  566   3HG2  VAL  74          3HG2      VAL  74  -4.769  10.475   9.997
  567    H    SER  75           H        SER  75  -5.148   5.560  10.423
  568    HA   SER  75           HA       SER  75  -6.984   4.387   8.488
  569   1HB   SER  75          2HB       SER  75  -5.452   2.905  10.621
  570   2HB   SER  75          1HB       SER  75  -6.077   2.282   9.097
  571    HG   SER  75           HG       SER  75  -3.920   2.611   8.795
  572    H    GLY  76           H        GLY  76  -7.830   2.182  10.069
  573   1HA   GLY  76          2HA       GLY  76  -8.939   2.395  12.465
  574   2HA   GLY  76          1HA       GLY  76  -9.953   3.510  11.566
  575    H    PHE  77           H        PHE  77  -9.174   1.281   9.323
  576    HA   PHE  77           HA       PHE  77 -11.654   0.179   9.010
  577   1HB   PHE  77          2HB       PHE  77 -10.317  -1.811   7.944
  578   2HB   PHE  77          1HB       PHE  77 -10.265  -0.215   7.207
  579    HD1  PHE  77           1HD      PHE  77  -8.201  -0.345   6.102
  580    HD2  PHE  77           2HD      PHE  77  -8.433  -1.259  10.252
  581    HE1  PHE  77           1HE      PHE  77  -5.745  -0.360   6.232
  582    HE2  PHE  77           2HE      PHE  77  -5.979  -1.274  10.390
  583    HZ   PHE  77           HZ       PHE  77  -4.631  -0.824   8.379
  584    H    HIS  78           H        HIS  78 -12.171  -2.246   9.151
  585    HA   HIS  78           HA       HIS  78 -11.460  -3.189  11.847
  586   1HB   HIS  78          2HB       HIS  78 -14.046  -2.833  10.556
  587   2HB   HIS  78          1HB       HIS  78 -13.837  -4.466  11.179
  588    HD1  HIS  78           1HD      HIS  78 -15.943  -3.021  12.583
  589    HD2  HIS  78           2HD      HIS  78 -11.958  -2.555  13.662
  590    HE1  HIS  78           1HE      HIS  78 -15.983  -2.173  14.950
  591    HE2  HIS  78           2HE      HIS  78 -13.561  -1.820  15.553
  592    HA   PRO  79           HA       PRO  79 -11.491  -7.164   9.311
  593   1HB   PRO  79          2HB       PRO  79 -12.799  -7.431   7.012
  594   2HB   PRO  79          1HB       PRO  79 -13.681  -7.339   8.539
  595   1HG   PRO  79          2HG       PRO  79 -13.238  -5.210   6.483
  596   2HG   PRO  79          1HG       PRO  79 -14.706  -5.598   7.395
  597   1HD   PRO  79          2HD       PRO  79 -12.907  -3.581   8.038
  598   2HD   PRO  79          1HD       PRO  79 -14.076  -4.307   9.158
  599    H    SER  80           H        SER  80 -11.765  -6.388   6.003
  600    HA   SER  80           HA       SER  80 -10.234  -6.290   4.330
  601   1HB   SER  80          2HB       SER  80 -10.071  -3.983   4.910
  602   2HB   SER  80          1HB       SER  80  -9.065  -4.336   6.313
  603    HG   SER  80           HG       SER  80  -8.381  -4.525   3.573
  604    H    ASP  81           H        ASP  81  -7.748  -6.409   3.848
  605    HA   ASP  81           HA       ASP  81  -6.578  -8.432   5.646
  606   1HB   ASP  81          2HB       ASP  81  -6.099  -8.339   2.670
  607   2HB   ASP  81          1HB       ASP  81  -5.740  -9.650   3.790
  608    H    ILE  82           H        ILE  82  -5.635  -6.462   6.637
  609    HA   ILE  82           HA       ILE  82  -3.692  -4.949   5.186
  610    HB   ILE  82           HB       ILE  82  -4.912  -4.048   7.137
  611   1HG1  ILE  82          2HG1      ILE  82  -2.680  -3.155   6.358
  612   2HG1  ILE  82          1HG1      ILE  82  -3.104  -2.776   8.022
  613   1HG2  ILE  82          1HG2      ILE  82  -3.199  -5.246   9.160
  614   2HG2  ILE  82          2HG2      ILE  82  -4.257  -6.412   8.366
  615   3HG2  ILE  82          3HG2      ILE  82  -4.942  -4.990   9.152
  616   1HD1  ILE  82          1HD1      ILE  82  -0.904  -3.365   8.229
  617   2HD1  ILE  82          2HD1      ILE  82  -0.997  -4.593   6.967
  618   3HD1  ILE  82          3HD1      ILE  82  -1.694  -4.907   8.556
  619    H    GLU  83           H        GLU  83  -1.902  -5.889   4.454
  620    HA   GLU  83           HA       GLU  83  -0.303  -7.476   6.344
  621   1HB   GLU  83          2HB       GLU  83  -1.599  -8.582   4.187
  622   2HB   GLU  83          1HB       GLU  83  -0.001  -8.256   3.533
  623   1HG   GLU  83          2HG       GLU  83   0.945  -9.900   4.703
  624   2HG   GLU  83          1HG       GLU  83   0.048  -9.502   6.168
  625    H    VAL  84           H        VAL  84   1.361  -6.155   6.763
  626    HA   VAL  84           HA       VAL  84   2.770  -4.965   4.463
  627    HB   VAL  84           HB       VAL  84   2.654  -3.762   7.229
  628   1HG1  VAL  84          1HG1      VAL  84   3.999  -2.116   6.473
  629   2HG1  VAL  84          2HG1      VAL  84   3.313  -2.152   4.848
  630   3HG1  VAL  84          3HG1      VAL  84   4.511  -3.354   5.327
  631   1HG2  VAL  84          1HG2      VAL  84   1.294  -2.010   5.703
  632   2HG2  VAL  84          2HG2      VAL  84   0.523  -3.277   6.658
  633   3HG2  VAL  84          3HG2      VAL  84   0.813  -3.525   4.936
  634    H    ASP  85           H        ASP  85   4.869  -5.419   4.276
  635    HA   ASP  85           HA       ASP  85   6.342  -6.400   6.616
  636   1HB   ASP  85          2HB       ASP  85   7.444  -8.083   5.018
  637   2HB   ASP  85          1HB       ASP  85   5.814  -8.447   5.573
  638    H    LEU  86           H        LEU  86   7.834  -4.861   6.874
  639    HA   LEU  86           HA       LEU  86   9.184  -3.788   4.492
  640   1HB   LEU  86          2HB       LEU  86   9.397  -2.622   7.248
  641   2HB   LEU  86          1HB       LEU  86   9.683  -1.843   5.706
  642    HG   LEU  86           HG       LEU  86   7.674  -0.927   6.518
  643   1HD1  LEU  86          1HD1      LEU  86   5.950  -1.761   4.941
  644   2HD1  LEU  86          2HD1      LEU  86   7.022  -3.102   4.539
  645   3HD1  LEU  86          3HD1      LEU  86   7.510  -1.446   4.182
  646   1HD2  LEU  86          1HD2      LEU  86   6.289  -3.534   6.846
  647   2HD2  LEU  86          2HD2      LEU  86   6.044  -2.005   7.690
  648   3HD2  LEU  86          3HD2      LEU  86   7.421  -3.029   8.101
  649    H    LEU  87           H        LEU  87  11.319  -4.063   4.180
  650    HA   LEU  87           HA       LEU  87  12.836  -5.409   6.321
  651   1HB   LEU  87          2HB       LEU  87  12.480  -6.072   3.487
  652   2HB   LEU  87          1HB       LEU  87  14.153  -6.079   4.010
  653    HG   LEU  87           HG       LEU  87  13.077  -8.305   4.139
  654   1HD1  LEU  87          1HD1      LEU  87  14.966  -7.605   5.621
  655   2HD1  LEU  87          2HD1      LEU  87  13.953  -8.893   6.275
  656   3HD1  LEU  87          3HD1      LEU  87  13.773  -7.241   6.868
  657   1HD2  LEU  87          1HD2      LEU  87  10.844  -7.175   4.882
  658   2HD2  LEU  87          2HD2      LEU  87  11.514  -7.369   6.502
  659   3HD2  LEU  87          3HD2      LEU  87  11.265  -8.781   5.475
  660    H    LYS  88           H        LYS  88  15.350  -5.295   5.380
  661    HA   LYS  88           HA       LYS  88  17.185  -3.969   5.143
  662   1HB   LYS  88          2HB       LYS  88  15.368  -1.867   3.966
  663   2HB   LYS  88          1HB       LYS  88  17.097  -2.063   3.707
  664   1HG   LYS  88          2HG       LYS  88  16.823  -3.719   2.180
  665   2HG   LYS  88          1HG       LYS  88  15.346  -4.323   2.932
  666   1HD   LYS  88          2HD       LYS  88  14.008  -2.816   1.834
  667   2HD   LYS  88          1HD       LYS  88  15.301  -1.626   1.668
  668   1HE   LYS  88          2HE       LYS  88  15.712  -4.175   0.247
  669   2HE   LYS  88          1HE       LYS  88  14.395  -3.170  -0.355
  670   1HZ   LYS  88          1HZ       LYS  88  17.263  -2.715  -0.438
  671   2HZ   LYS  88          2HZ       LYS  88  16.317  -1.354  -0.100
  672   3HZ   LYS  88          3HZ       LYS  88  16.057  -2.232  -1.522
  Start of MODEL    4
    1   1H    SER   1          1HT       SER   1  12.251  -0.125  -2.588
    2   2H    SER   1          2HT       SER   1  12.765   1.306  -1.795
    3   3H    SER   1          3HT       SER   1  13.566  -0.180  -1.490
    4    HA   SER   1           HA       SER   1  14.986   0.848  -2.894
    5   1HB   SER   1          2HB       SER   1  14.462  -0.263  -5.186
    6   2HB   SER   1          1HB       SER   1  14.686  -1.305  -3.781
    7    HG   SER   1           HG       SER   1  12.371  -0.710  -5.214
    8    H    ASN   2           H        ASN   2  13.575   3.010  -2.430
    9    HA   ASN   2           HA       ASN   2  12.951   5.033  -3.260
   10   1HB   ASN   2          2HB       ASN   2  13.809   4.238  -6.017
   11   2HB   ASN   2          1HB       ASN   2  13.989   5.785  -5.197
   12   1HD2  ASN   2          1HD2      ASN   2  15.092   4.769  -2.785
   13   2HD2  ASN   2          2HD2      ASN   2  16.693   4.221  -3.134
   14    H    PHE   3           H        PHE   3  11.797   5.979  -5.443
   15    HA   PHE   3           HA       PHE   3  10.013   5.945  -6.880
   16   1HB   PHE   3          2HB       PHE   3   9.386   3.990  -7.758
   17   2HB   PHE   3          1HB       PHE   3  10.445   3.199  -6.607
   18    HD1  PHE   3           1HD      PHE   3   7.506   2.731  -8.015
   19    HD2  PHE   3           2HD      PHE   3   9.010   3.369  -4.084
   20    HE1  PHE   3           1HE      PHE   3   5.565   1.545  -7.081
   21    HE2  PHE   3           2HE      PHE   3   7.074   2.182  -3.147
   22    HZ   PHE   3           HZ       PHE   3   5.348   1.268  -4.645
   23    H    LEU   4           H        LEU   4   7.468   5.591  -6.619
   24    HA   LEU   4           HA       LEU   4   6.568   5.849  -3.889
   25   1HB   LEU   4          2HB       LEU   4   5.448   8.111  -4.566
   26   2HB   LEU   4          1HB       LEU   4   7.091   8.079  -3.954
   27    HG   LEU   4           HG       LEU   4   6.800   7.890  -6.893
   28   1HD1  LEU   4          1HD1      LEU   4   6.603  10.619  -5.730
   29   2HD1  LEU   4          2HD1      LEU   4   5.131   9.658  -5.872
   30   3HD1  LEU   4          3HD1      LEU   4   6.089  10.018  -7.308
   31   1HD2  LEU   4          1HD2      LEU   4   8.881   8.190  -5.198
   32   2HD2  LEU   4          2HD2      LEU   4   8.546   9.874  -5.601
   33   3HD2  LEU   4          3HD2      LEU   4   8.895   8.713  -6.883
   34    H    ASN   5           H        ASN   5   4.587   5.032  -3.711
   35    HA   ASN   5           HA       ASN   5   3.024   4.641  -6.168
   36   1HB   ASN   5          2HB       ASN   5   3.651   2.598  -4.918
   37   2HB   ASN   5          1HB       ASN   5   2.796   3.214  -3.507
   38   1HD2  ASN   5          1HD2      ASN   5   2.500   0.924  -5.584
   39   2HD2  ASN   5          2HD2      ASN   5   0.806   0.939  -5.923
   40    H    CYS   6           H        CYS   6   1.567   6.203  -6.446
   41    HA   CYS   6           HA       CYS   6   0.328   7.479  -4.140
   42   1HB   CYS   6          2HB       CYS   6   1.208   8.529  -6.460
   43   2HB   CYS   6          1HB       CYS   6  -0.477   8.255  -6.886
   44    HG   CYS   6           HG       CYS   6  -1.203  10.025  -5.273
   45    H    TYR   7           H        TYR   7  -1.617   6.969  -3.399
   46    HA   TYR   7           HA       TYR   7  -3.590   5.774  -5.198
   47   1HB   TYR   7          2HB       TYR   7  -2.143   4.272  -3.299
   48   2HB   TYR   7          1HB       TYR   7  -3.755   4.485  -2.626
   49    HD1  TYR   7           1HD      TYR   7  -2.149   2.002  -3.888
   50    HD2  TYR   7           2HD      TYR   7  -5.347   4.501  -5.164
   51    HE1  TYR   7           1HE      TYR   7  -2.982   0.190  -5.328
   52    HE2  TYR   7           2HE      TYR   7  -6.189   2.697  -6.607
   53    HH   TYR   7           HH       TYR   7  -5.480  -0.374  -6.317
   54    H    VAL   8           H        VAL   8  -5.451   6.826  -5.020
   55    HA   VAL   8           HA       VAL   8  -6.376   7.748  -2.418
   56    HB   VAL   8           HB       VAL   8  -6.942  10.014  -3.393
   57   1HG1  VAL   8          1HG1      VAL   8  -5.086  10.888  -2.438
   58   2HG1  VAL   8          2HG1      VAL   8  -3.991   9.867  -3.371
   59   3HG1  VAL   8          3HG1      VAL   8  -4.820   9.212  -1.958
   60   1HG2  VAL   8          1HG2      VAL   8  -5.040   9.038  -5.512
   61   2HG2  VAL   8          2HG2      VAL   8  -5.385  10.746  -5.240
   62   3HG2  VAL   8          3HG2      VAL   8  -6.680   9.648  -5.721
   63    H    SER   9           H        SER   9  -8.556   7.713  -2.226
   64    HA   SER   9           HA       SER   9 -10.760   7.458  -2.748
   65   1HB   SER   9          2HB       SER   9 -10.220   9.207  -4.529
   66   2HB   SER   9          1HB       SER   9 -10.072   7.863  -5.660
   67    HG   SER   9           HG       SER   9 -12.371   8.278  -4.060
   68    H    GLY  10           H        GLY  10  -9.099   6.125  -5.621
   69   1HA   GLY  10          2HA       GLY  10  -8.771   3.587  -5.361
   70   2HA   GLY  10          1HA       GLY  10 -10.508   3.592  -5.107
   71    H    PHE  11           H        PHE  11 -10.892   2.273  -6.897
   72    HA   PHE  11           HA       PHE  11 -11.370   3.615  -9.324
   73   1HB   PHE  11          2HB       PHE  11  -9.730   2.786 -10.786
   74   2HB   PHE  11          1HB       PHE  11  -8.820   3.279  -9.364
   75    HD1  PHE  11           1HD      PHE  11  -9.322   0.724 -11.703
   76    HD2  PHE  11           2HD      PHE  11  -8.424   1.365  -7.593
   77    HE1  PHE  11           1HE      PHE  11  -8.338  -1.525 -11.573
   78    HE2  PHE  11           2HE      PHE  11  -7.437  -0.886  -7.453
   79    HZ   PHE  11           HZ       PHE  11  -7.392  -2.335  -9.446
   80    H    HIS  12           H        HIS  12 -11.341   1.523 -11.130
   81    HA   HIS  12           HA       HIS  12 -13.659   0.086 -10.367
   82   1HB   HIS  12          2HB       HIS  12 -11.833  -0.654 -12.650
   83   2HB   HIS  12          1HB       HIS  12 -13.567  -0.920 -12.519
   84    HD1  HIS  12           1HD      HIS  12 -11.081   1.474 -13.737
   85    HD2  HIS  12           2HD      HIS  12 -15.123   1.516 -12.775
   86    HE1  HIS  12           1HE      HIS  12 -12.001   3.563 -14.792
   87    HE2  HIS  12           2HE      HIS  12 -14.431   3.609 -14.130
   88    HA   PRO  13           HA       PRO  13 -12.080  -3.495  -8.346
   89   1HB   PRO  13          2HB       PRO  13 -13.685  -5.460  -9.375
   90   2HB   PRO  13          1HB       PRO  13 -14.208  -4.315  -8.135
   91   1HG   PRO  13          2HG       PRO  13 -14.681  -4.255 -11.089
   92   2HG   PRO  13          1HG       PRO  13 -15.806  -3.892  -9.768
   93   1HD   PRO  13          2HD       PRO  13 -14.599  -1.945 -11.175
   94   2HD   PRO  13          1HD       PRO  13 -14.937  -1.772  -9.440
   95    H    SER  14           H        SER  14 -10.170  -4.367  -8.800
   96    HA   SER  14           HA       SER  14  -9.820  -6.288 -10.856
   97   1HB   SER  14          2HB       SER  14  -8.507  -5.180 -12.426
   98   2HB   SER  14          1HB       SER  14  -9.703  -3.947 -12.026
   99    HG   SER  14           HG       SER  14  -7.433  -3.268 -12.019
  100    H    ASP  15           H        ASP  15  -7.073  -6.202 -11.182
  101    HA   ASP  15           HA       ASP  15  -6.099  -6.449  -8.412
  102   1HB   ASP  15          2HB       ASP  15  -4.660  -8.297  -9.198
  103   2HB   ASP  15          1HB       ASP  15  -6.369  -8.651  -9.424
  104    H    ILE  16           H        ILE  16  -4.932  -4.621  -8.147
  105    HA   ILE  16           HA       ILE  16  -3.189  -3.669 -10.269
  106    HB   ILE  16           HB       ILE  16  -4.496  -2.058  -8.916
  107   1HG1  ILE  16          2HG1      ILE  16  -1.503  -1.774  -8.577
  108   2HG1  ILE  16          1HG1      ILE  16  -2.392  -1.400 -10.051
  109   1HG2  ILE  16          1HG2      ILE  16  -3.942  -1.595  -6.629
  110   2HG2  ILE  16          2HG2      ILE  16  -2.643  -2.787  -6.656
  111   3HG2  ILE  16          3HG2      ILE  16  -4.324  -3.310  -6.777
  112   1HD1  ILE  16          1HD1      ILE  16  -3.481   0.428  -9.041
  113   2HD1  ILE  16          2HD1      ILE  16  -1.781   0.552  -8.588
  114   3HD1  ILE  16          3HD1      ILE  16  -2.962  -0.058  -7.427
  115    H    GLU  17           H        GLU  17  -0.974  -3.690 -10.237
  116    HA   GLU  17           HA       GLU  17   0.394  -4.794  -7.905
  117   1HB   GLU  17          2HB       GLU  17  -0.119  -6.743  -9.287
  118   2HB   GLU  17          1HB       GLU  17   0.621  -5.970 -10.682
  119   1HG   GLU  17          2HG       GLU  17   2.781  -6.135  -9.749
  120   2HG   GLU  17          1HG       GLU  17   2.143  -6.562  -8.163
  121    H    VAL  18           H        VAL  18   2.765  -4.619  -8.083
  122    HA   VAL  18           HA       VAL  18   3.817  -2.825 -10.084
  123    HB   VAL  18           HB       VAL  18   2.716  -1.601  -7.906
  124   1HG1  VAL  18          1HG1      VAL  18   4.453  -0.840  -6.428
  125   2HG1  VAL  18          2HG1      VAL  18   5.671  -1.745  -7.327
  126   3HG1  VAL  18          3HG1      VAL  18   4.426  -2.603  -6.418
  127   1HG2  VAL  18          1HG2      VAL  18   3.798  -0.794 -10.169
  128   2HG2  VAL  18          2HG2      VAL  18   5.127  -0.344  -9.101
  129   3HG2  VAL  18          3HG2      VAL  18   3.517   0.322  -8.832
  130    H    ASP  19           H        ASP  19   5.907  -3.259 -10.464
  131    HA   ASP  19           HA       ASP  19   7.431  -4.689  -8.393
  132   1HB   ASP  19          2HB       ASP  19   8.486  -5.995 -10.296
  133   2HB   ASP  19          1HB       ASP  19   6.812  -6.398  -9.924
  134    H    LEU  20           H        LEU  20   9.242  -3.670  -7.886
  135    HA   LEU  20           HA       LEU  20  10.369  -1.755  -9.811
  136   1HB   LEU  20          2HB       LEU  20  10.371  -1.920  -6.826
  137   2HB   LEU  20          1HB       LEU  20  11.661  -1.055  -7.639
  138    HG   LEU  20           HG       LEU  20   9.795   0.398  -6.864
  139   1HD1  LEU  20          1HD1      LEU  20  11.282   1.053  -8.711
  140   2HD1  LEU  20          2HD1      LEU  20   9.654   1.707  -8.893
  141   3HD1  LEU  20          3HD1      LEU  20  10.158   0.319  -9.855
  142   1HD2  LEU  20          1HD2      LEU  20   8.093  -0.476  -9.115
  143   2HD2  LEU  20          2HD2      LEU  20   7.648   0.157  -7.530
  144   3HD2  LEU  20          3HD2      LEU  20   8.133  -1.529  -7.702
  145    H    LEU  21           H        LEU  21  12.351  -2.037 -10.643
  146    HA   LEU  21           HA       LEU  21  14.141  -4.009  -9.411
  147   1HB   LEU  21          2HB       LEU  21  12.972  -5.166 -11.204
  148   2HB   LEU  21          1HB       LEU  21  13.396  -3.894 -12.333
  149    HG   LEU  21           HG       LEU  21  15.862  -4.675 -11.440
  150   1HD1  LEU  21          1HD1      LEU  21  14.432  -7.259 -11.891
  151   2HD1  LEU  21          2HD1      LEU  21  14.535  -6.571 -10.270
  152   3HD1  LEU  21          3HD1      LEU  21  16.009  -6.962 -11.157
  153   1HD2  LEU  21          1HD2      LEU  21  15.749  -4.422 -13.693
  154   2HD2  LEU  21          2HD2      LEU  21  14.190  -5.237 -13.819
  155   3HD2  LEU  21          3HD2      LEU  21  15.666  -6.182 -13.626
  156    H    LYS  22           H        LYS  22  13.974  -1.768 -12.183
  157    HA   LYS  22           HA       LYS  22  16.633  -0.764 -11.403
  158   1HB   LYS  22          2HB       LYS  22  16.980  -0.188 -13.765
  159   2HB   LYS  22          1HB       LYS  22  16.683  -1.909 -13.558
  160   1HG   LYS  22          2HG       LYS  22  14.168  -0.971 -14.001
  161   2HG   LYS  22          1HG       LYS  22  15.139   0.108 -15.005
  162   1HD   LYS  22          2HD       LYS  22  15.276  -2.906 -15.074
  163   2HD   LYS  22          1HD       LYS  22  14.369  -1.910 -16.213
  164   1HE   LYS  22          2HE       LYS  22  17.331  -1.632 -15.750
  165   2HE   LYS  22          1HE       LYS  22  16.634  -2.659 -17.003
  166   1HZ   LYS  22          1HZ       LYS  22  15.701   0.094 -16.936
  167   2HZ   LYS  22          2HZ       LYS  22  16.069  -0.893 -18.260
  168   3HZ   LYS  22          3HZ       LYS  22  17.312  -0.128 -17.404
  169   1H    SER  23          1HT       SER  23  15.656   6.827  -4.544
  170   2H    SER  23          2HT       SER  23  17.350   6.559  -4.502
  171   3H    SER  23          3HT       SER  23  16.735   8.152  -4.668
  172    HA   SER  23           HA       SER  23  16.583   6.374  -2.333
  173   1HB   SER  23          2HB       SER  23  17.659   9.182  -2.485
  174   2HB   SER  23          1HB       SER  23  18.034   7.918  -1.314
  175    HG   SER  23           HG       SER  23  19.684   8.313  -2.937
  176    H    ASN  24           H        ASN  24  14.172   6.523  -2.775
  177    HA   ASN  24           HA       ASN  24  12.991   8.305  -0.957
  178   1HB   ASN  24          2HB       ASN  24  13.545   9.767  -3.067
  179   2HB   ASN  24          1HB       ASN  24  12.108   8.998  -3.733
  180   1HD2  ASN  24          1HD2      ASN  24  12.763  11.793  -2.847
  181   2HD2  ASN  24          2HD2      ASN  24  11.469  12.221  -1.785
  182    H    PHE  25           H        PHE  25  11.507   6.984  -0.159
  183    HA   PHE  25           HA       PHE  25   9.876   5.399  -2.032
  184   1HB   PHE  25          2HB       PHE  25  11.277   3.957  -0.652
  185   2HB   PHE  25          1HB       PHE  25  10.679   4.736   0.809
  186    HD1  PHE  25           1HD      PHE  25   8.453   4.282   1.641
  187    HD2  PHE  25           2HD      PHE  25   9.919   2.372  -1.867
  188    HE1  PHE  25           1HE      PHE  25   6.619   2.649   1.770
  189    HE2  PHE  25           2HE      PHE  25   8.086   0.734  -1.745
  190    HZ   PHE  25           HZ       PHE  25   6.432   0.872   0.074
  191    H    LEU  26           H        LEU  26   7.814   5.988  -2.139
  192    HA   LEU  26           HA       LEU  26   6.531   7.097   0.260
  193   1HB   LEU  26          2HB       LEU  26   7.280   8.708  -1.756
  194   2HB   LEU  26          1HB       LEU  26   5.709   8.214  -2.357
  195    HG   LEU  26           HG       LEU  26   5.616   9.043   0.437
  196   1HD1  LEU  26          1HD1      LEU  26   5.940  11.422   0.030
  197   2HD1  LEU  26          2HD1      LEU  26   6.440  11.080  -1.626
  198   3HD1  LEU  26          3HD1      LEU  26   7.426  10.522  -0.274
  199   1HD2  LEU  26          1HD2      LEU  26   3.571   9.779  -0.160
  200   2HD2  LEU  26          2HD2      LEU  26   3.845   8.763  -1.575
  201   3HD2  LEU  26          3HD2      LEU  26   4.150  10.498  -1.663
  202    H    ASN  27           H        ASN  27   5.280   5.346   0.713
  203    HA   ASN  27           HA       ASN  27   3.511   4.347  -1.418
  204   1HB   ASN  27          2HB       ASN  27   4.943   3.054   0.767
  205   2HB   ASN  27          1HB       ASN  27   3.233   2.638   0.761
  206   1HD2  ASN  27          1HD2      ASN  27   5.300   3.390  -1.992
  207   2HD2  ASN  27          2HD2      ASN  27   5.164   1.841  -2.746
  208    H    CYS  28           H        CYS  28   2.047   6.114  -1.203
  209    HA   CYS  28           HA       CYS  28   0.545   6.192   1.321
  210   1HB   CYS  28          2HB       CYS  28  -0.354   8.363   0.428
  211   2HB   CYS  28          1HB       CYS  28   1.381   8.357   0.727
  212    HG   CYS  28           HG       CYS  28   1.204   7.758  -2.094
  213    H    TYR  29           H        TYR  29  -1.536   5.594   1.415
  214    HA   TYR  29           HA       TYR  29  -3.140   5.422  -0.989
  215   1HB   TYR  29          2HB       TYR  29  -3.059   3.205  -1.286
  216   2HB   TYR  29          1HB       TYR  29  -1.768   3.145  -0.098
  217    HD1  TYR  29           1HD      TYR  29  -5.461   2.928  -0.468
  218    HD2  TYR  29           2HD      TYR  29  -2.071   2.014   1.935
  219    HE1  TYR  29           1HE      TYR  29  -6.873   1.525   0.979
  220    HE2  TYR  29           2HE      TYR  29  -3.472   0.609   3.388
  221    HH   TYR  29           HH       TYR  29  -5.614  -0.652   3.218
  222    H    VAL  30           H        VAL  30  -4.948   6.421  -0.458
  223    HA   VAL  30           HA       VAL  30  -6.075   5.974   2.228
  224    HB   VAL  30           HB       VAL  30  -7.019   8.238   2.148
  225   1HG1  VAL  30          1HG1      VAL  30  -4.133   8.677   1.588
  226   2HG1  VAL  30          2HG1      VAL  30  -4.572   7.598   2.911
  227   3HG1  VAL  30          3HG1      VAL  30  -5.131   9.270   2.914
  228   1HG2  VAL  30          1HG2      VAL  30  -5.799   9.728   0.328
  229   2HG2  VAL  30          2HG2      VAL  30  -7.324   8.908  -0.013
  230   3HG2  VAL  30          3HG2      VAL  30  -5.803   8.206  -0.563
  231    H    SER  31           H        SER  31  -8.114   5.263   2.325
  232    HA   SER  31           HA       SER  31 -10.190   4.574   1.703
  233   1HB   SER  31          2HB       SER  31  -9.916   6.605  -0.528
  234   2HB   SER  31          1HB       SER  31 -11.417   5.875   0.042
  235    HG   SER  31           HG       SER  31 -11.468   7.277   1.599
  236    H    GLY  32           H        GLY  32  -9.960   2.506   1.081
  237   1HA   GLY  32          2HA       GLY  32  -8.529   1.578  -1.134
  238   2HA   GLY  32          1HA       GLY  32  -9.781   0.679  -0.292
  239    H    PHE  33           H        PHE  33 -11.439   0.077  -1.502
  240    HA   PHE  33           HA       PHE  33 -12.922   1.727  -3.175
  241   1HB   PHE  33          2HB       PHE  33 -12.148   0.375  -5.363
  242   2HB   PHE  33          1HB       PHE  33 -11.452   1.920  -4.902
  243    HD1  PHE  33           1HD      PHE  33  -9.334   1.703  -5.887
  244    HD2  PHE  33           2HD      PHE  33 -10.753  -1.328  -3.260
  245    HE1  PHE  33           1HE      PHE  33  -7.095   0.694  -5.849
  246    HE2  PHE  33           2HE      PHE  33  -8.512  -2.341  -3.220
  247    HZ   PHE  33           HZ       PHE  33  -6.680  -1.331  -4.514
  248    H    HIS  34           H        HIS  34 -12.185  -1.348  -4.608
  249    HA   HIS  34           HA       HIS  34 -14.369  -2.639  -3.156
  250   1HB   HIS  34          2HB       HIS  34 -14.560  -1.648  -5.818
  251   2HB   HIS  34          1HB       HIS  34 -14.534  -3.406  -5.909
  252    HD1  HIS  34           1HD      HIS  34 -17.091  -2.293  -6.765
  253    HD2  HIS  34           2HD      HIS  34 -16.285  -2.936  -2.740
  254    HE1  HIS  34           1HE      HIS  34 -19.337  -2.429  -5.642
  255    HE2  HIS  34           2HE      HIS  34 -18.824  -2.941  -3.230
  256    HA   PRO  35           HA       PRO  35 -12.336  -6.570  -3.248
  257   1HB   PRO  35          2HB       PRO  35 -13.844  -7.379  -5.709
  258   2HB   PRO  35          1HB       PRO  35 -13.549  -8.291  -4.222
  259   1HG   PRO  35          2HG       PRO  35 -15.902  -7.136  -4.630
  260   2HG   PRO  35          1HG       PRO  35 -15.152  -7.108  -3.023
  261   1HD   PRO  35          2HD       PRO  35 -15.421  -4.928  -5.027
  262   2HD   PRO  35          1HD       PRO  35 -15.400  -4.838  -3.255
  263    H    SER  36           H        SER  36 -10.358  -5.530  -3.850
  264    HA   SER  36           HA       SER  36  -9.434  -6.315  -6.522
  265   1HB   SER  36          2HB       SER  36  -9.326  -3.589  -5.287
  266   2HB   SER  36          1HB       SER  36  -7.998  -4.104  -6.326
  267    HG   SER  36           HG       SER  36  -9.970  -2.997  -7.271
  268    H    ASP  37           H        ASP  37  -7.076  -6.522  -6.656
  269    HA   ASP  37           HA       ASP  37  -5.920  -7.193  -4.030
  270   1HB   ASP  37          2HB       ASP  37  -5.385  -8.427  -6.738
  271   2HB   ASP  37          1HB       ASP  37  -4.499  -8.824  -5.269
  272    H    ILE  38           H        ILE  38  -4.525  -5.694  -3.404
  273    HA   ILE  38           HA       ILE  38  -2.922  -4.283  -5.411
  274    HB   ILE  38           HB       ILE  38  -3.126  -3.656  -2.467
  275   1HG1  ILE  38          2HG1      ILE  38  -4.634  -2.326  -4.723
  276   2HG1  ILE  38          1HG1      ILE  38  -5.336  -3.556  -3.676
  277   1HG2  ILE  38          1HG2      ILE  38  -2.341  -1.834  -4.723
  278   2HG2  ILE  38          2HG2      ILE  38  -1.171  -2.808  -3.832
  279   3HG2  ILE  38          3HG2      ILE  38  -2.125  -1.587  -2.990
  280   1HD1  ILE  38          1HD1      ILE  38  -6.052  -1.684  -2.614
  281   2HD1  ILE  38          2HD1      ILE  38  -4.647  -0.734  -3.097
  282   3HD1  ILE  38          3HD1      ILE  38  -4.510  -1.909  -1.789
  283    H    GLU  39           H        GLU  39  -1.292  -5.718  -5.883
  284    HA   GLU  39           HA       GLU  39   0.316  -6.727  -3.650
  285   1HB   GLU  39          2HB       GLU  39  -0.501  -8.368  -5.312
  286   2HB   GLU  39          1HB       GLU  39   0.385  -7.515  -6.567
  287   1HG   GLU  39          2HG       GLU  39   2.030  -8.948  -6.143
  288   2HG   GLU  39          1HG       GLU  39   2.326  -7.982  -4.698
  289    H    VAL  40           H        VAL  40   1.454  -4.835  -3.164
  290    HA   VAL  40           HA       VAL  40   3.104  -3.639  -5.250
  291    HB   VAL  40           HB       VAL  40   2.779  -2.889  -2.340
  292   1HG1  VAL  40          1HG1      VAL  40   4.306  -1.537  -4.560
  293   2HG1  VAL  40          2HG1      VAL  40   4.970  -2.240  -3.086
  294   3HG1  VAL  40          3HG1      VAL  40   3.954  -0.802  -2.996
  295   1HG2  VAL  40          1HG2      VAL  40   0.950  -2.542  -4.289
  296   2HG2  VAL  40          2HG2      VAL  40   1.903  -1.072  -4.489
  297   3HG2  VAL  40          3HG2      VAL  40   1.157  -1.435  -2.932
  298    H    ASP  41           H        ASP  41   5.014  -4.519  -5.676
  299    HA   ASP  41           HA       ASP  41   6.586  -5.580  -3.426
  300   1HB   ASP  41          2HB       ASP  41   5.521  -7.277  -5.107
  301   2HB   ASP  41          1HB       ASP  41   6.829  -6.762  -6.169
  302    H    LEU  42           H        LEU  42   8.264  -4.302  -3.128
  303    HA   LEU  42           HA       LEU  42   9.529  -3.020  -5.445
  304   1HB   LEU  42          2HB       LEU  42   8.978  -2.198  -2.734
  305   2HB   LEU  42          1HB       LEU  42  10.691  -2.052  -3.078
  306    HG   LEU  42           HG       LEU  42   9.994  -0.756  -5.171
  307   1HD1  LEU  42          1HD1      LEU  42   7.530  -1.574  -4.703
  308   2HD1  LEU  42          2HD1      LEU  42   7.859  -0.008  -5.444
  309   3HD1  LEU  42          3HD1      LEU  42   7.482  -0.107  -3.723
  310   1HD2  LEU  42          1HD2      LEU  42  10.842   0.818  -3.846
  311   2HD2  LEU  42          2HD2      LEU  42  10.195   0.048  -2.398
  312   3HD2  LEU  42          3HD2      LEU  42   9.191   1.158  -3.329
  313    H    LEU  43           H        LEU  43  11.265  -3.997  -6.235
  314    HA   LEU  43           HA       LEU  43  13.322  -4.987  -6.335
  315   1HB   LEU  43          2HB       LEU  43  13.293  -3.901  -3.752
  316   2HB   LEU  43          1HB       LEU  43  13.780  -5.568  -3.530
  317    HG   LEU  43           HG       LEU  43  15.144  -3.492  -5.240
  318   1HD1  LEU  43          1HD1      LEU  43  17.027  -4.437  -3.593
  319   2HD1  LEU  43          2HD1      LEU  43  15.609  -4.664  -2.570
  320   3HD1  LEU  43          3HD1      LEU  43  15.999  -3.061  -3.192
  321   1HD2  LEU  43          1HD2      LEU  43  16.676  -5.126  -5.969
  322   2HD2  LEU  43          2HD2      LEU  43  15.079  -5.828  -6.229
  323   3HD2  LEU  43          3HD2      LEU  43  16.049  -6.330  -4.845
  324    H    LYS  44           H        LYS  44  14.241  -7.106  -4.491
  325    HA   LYS  44           HA       LYS  44  13.980  -9.335  -4.115
  326   1HB   LYS  44          2HB       LYS  44  11.267  -8.287  -3.904
  327   2HB   LYS  44          1HB       LYS  44  11.292  -9.945  -4.486
  328   1HG   LYS  44          2HG       LYS  44  11.764 -10.736  -2.469
  329   2HG   LYS  44          1HG       LYS  44  13.086  -9.590  -2.252
  330   1HD   LYS  44          2HD       LYS  44  11.854  -8.402  -0.830
  331   2HD   LYS  44          1HD       LYS  44  10.612  -8.179  -2.061
  332   1HE   LYS  44          2HE       LYS  44  10.587 -10.838  -0.860
  333   2HE   LYS  44          1HE       LYS  44  10.309  -9.544   0.304
  334   1HZ   LYS  44          1HZ       LYS  44   8.205  -9.699  -0.395
  335   2HZ   LYS  44          2HZ       LYS  44   8.614 -10.499  -1.828
  336   3HZ   LYS  44          3HZ       LYS  44   8.725  -8.813  -1.741
  337   1H    SER  45          1HT       SER  45  11.026  11.094   1.157
  338   2H    SER  45          2HT       SER  45  11.056  12.354   2.321
  339   3H    SER  45          3HT       SER  45  10.947  10.717   2.827
  340    HA   SER  45           HA       SER  45  13.212  11.816   1.314
  341   1HB   SER  45          2HB       SER  45  13.245  13.037   3.329
  342   2HB   SER  45          1HB       SER  45  12.651  11.669   4.270
  343    HG   SER  45           HG       SER  45  15.155  11.630   2.955
  344    H    ASN  46           H        ASN  46  12.386   9.467   3.871
  345    HA   ASN  46           HA       ASN  46  14.058   7.492   2.471
  346   1HB   ASN  46          2HB       ASN  46  14.048   8.300   5.147
  347   2HB   ASN  46          1HB       ASN  46  13.265   6.723   5.155
  348   1HD2  ASN  46          1HD2      ASN  46  16.066   8.035   5.749
  349   2HD2  ASN  46          2HD2      ASN  46  17.153   6.829   5.158
  350    H    PHE  47           H        PHE  47  11.370   7.193   4.786
  351    HA   PHE  47           HA       PHE  47   9.893   5.616   2.804
  352   1HB   PHE  47          2HB       PHE  47  11.070   3.981   4.164
  353   2HB   PHE  47          1HB       PHE  47  10.486   4.743   5.639
  354    HD1  PHE  47           1HD      PHE  47   7.970   4.763   6.046
  355    HD2  PHE  47           2HD      PHE  47   9.849   2.284   3.141
  356    HE1  PHE  47           1HE      PHE  47   5.993   3.299   6.023
  357    HE2  PHE  47           2HE      PHE  47   7.873   0.816   3.112
  358    HZ   PHE  47           HZ       PHE  47   5.941   1.325   4.553
  359    H    LEU  48           H        LEU  48   7.817   6.158   2.693
  360    HA   LEU  48           HA       LEU  48   6.528   7.380   5.030
  361   1HB   LEU  48          2HB       LEU  48   5.956   8.450   2.296
  362   2HB   LEU  48          1HB       LEU  48   5.702   9.208   3.856
  363    HG   LEU  48           HG       LEU  48   8.365   8.803   2.493
  364   1HD1  LEU  48          1HD1      LEU  48   6.518  10.664   1.883
  365   2HD1  LEU  48          2HD1      LEU  48   8.258  10.929   1.763
  366   3HD1  LEU  48          3HD1      LEU  48   7.377  11.488   3.185
  367   1HD2  LEU  48          1HD2      LEU  48   7.706   9.231   5.255
  368   2HD2  LEU  48          2HD2      LEU  48   8.581  10.622   4.616
  369   3HD2  LEU  48          3HD2      LEU  48   9.285   9.009   4.503
  370    H    ASN  49           H        ASN  49   4.914   6.054   5.538
  371    HA   ASN  49           HA       ASN  49   3.368   4.821   3.354
  372   1HB   ASN  49          2HB       ASN  49   4.497   3.144   4.690
  373   2HB   ASN  49          1HB       ASN  49   3.854   3.839   6.174
  374   1HD2  ASN  49          1HD2      ASN  49   2.308   2.650   6.999
  375   2HD2  ASN  49          2HD2      ASN  49   1.113   1.767   6.119
  376    H    CYS  50           H        CYS  50   1.182   5.007   3.323
  377    HA   CYS  50           HA       CYS  50  -0.144   6.369   5.556
  378   1HB   CYS  50          2HB       CYS  50   0.505   7.688   3.216
  379   2HB   CYS  50          1HB       CYS  50  -1.162   7.196   2.939
  380    HG   CYS  50           HG       CYS  50  -0.292   9.455   4.698
  381    H    TYR  51           H        TYR  51  -1.571   4.902   6.238
  382    HA   TYR  51           HA       TYR  51  -3.190   3.498   4.215
  383   1HB   TYR  51          2HB       TYR  51  -1.907   1.792   5.165
  384   2HB   TYR  51          1HB       TYR  51  -1.958   2.512   6.768
  385    HD1  TYR  51           1HD      TYR  51  -2.681   0.595   7.969
  386    HD2  TYR  51           2HD      TYR  51  -4.923   1.964   4.624
  387    HE1  TYR  51           1HE      TYR  51  -4.519  -0.917   8.590
  388    HE2  TYR  51           2HE      TYR  51  -6.766   0.458   5.235
  389    HH   TYR  51           HH       TYR  51  -7.172  -1.541   6.500
  390    H    VAL  52           H        VAL  52  -4.922   4.890   4.220
  391    HA   VAL  52           HA       VAL  52  -6.237   5.457   6.777
  392    HB   VAL  52           HB       VAL  52  -6.905   6.530   4.032
  393   1HG1  VAL  52          1HG1      VAL  52  -8.832   6.980   5.124
  394   2HG1  VAL  52          2HG1      VAL  52  -7.895   8.332   5.758
  395   3HG1  VAL  52          3HG1      VAL  52  -8.084   6.864   6.716
  396   1HG2  VAL  52          1HG2      VAL  52  -5.417   7.906   6.263
  397   2HG2  VAL  52          2HG2      VAL  52  -5.754   8.544   4.655
  398   3HG2  VAL  52          3HG2      VAL  52  -4.648   7.185   4.849
  399    H    SER  53           H        SER  53  -7.588   3.903   7.420
  400    HA   SER  53           HA       SER  53  -8.718   1.920   5.839
  401   1HB   SER  53          2HB       SER  53 -10.248   2.810   8.230
  402   2HB   SER  53          1HB       SER  53  -9.751   1.191   7.748
  403    HG   SER  53           HG       SER  53  -7.656   1.678   8.434
  404    H    GLY  54           H        GLY  54 -11.335   1.673   6.087
  405   1HA   GLY  54          2HA       GLY  54 -13.434   2.788   5.714
  406   2HA   GLY  54          1HA       GLY  54 -12.550   4.117   4.977
  407    H    PHE  55           H        PHE  55 -12.787   0.593   4.509
  408    HA   PHE  55           HA       PHE  55 -13.919   0.790   1.916
  409   1HB   PHE  55          2HB       PHE  55 -12.010   0.076   0.579
  410   2HB   PHE  55          1HB       PHE  55 -11.628   1.590   1.394
  411    HD1  PHE  55           1HD      PHE  55 -10.272  -1.406   0.475
  412    HD2  PHE  55           2HD      PHE  55 -10.635   1.083   3.906
  413    HE1  PHE  55           1HE      PHE  55  -8.271  -2.457   1.451
  414    HE2  PHE  55           2HE      PHE  55  -8.641   0.037   4.882
  415    HZ   PHE  55           HZ       PHE  55  -7.457  -1.732   3.661
  416    H    HIS  56           H        HIS  56 -14.256  -0.658   4.385
  417    HA   HIS  56           HA       HIS  56 -13.966  -2.846   5.273
  418   1HB   HIS  56          2HB       HIS  56 -15.988  -3.970   3.705
  419   2HB   HIS  56          1HB       HIS  56 -16.166  -3.108   5.223
  420    HD1  HIS  56           1HD      HIS  56 -16.078  -0.268   4.642
  421    HD2  HIS  56           2HD      HIS  56 -17.709  -2.933   1.901
  422    HE1  HIS  56           1HE      HIS  56 -17.575   1.113   3.167
  423    HE2  HIS  56           2HE      HIS  56 -18.496  -0.509   1.475
  424    HA   PRO  57           HA       PRO  57 -13.145  -6.104   1.916
  425   1HB   PRO  57          2HB       PRO  57 -13.666  -5.622  -0.684
  426   2HB   PRO  57          1HB       PRO  57 -14.926  -6.147   0.440
  427   1HG   PRO  57          2HG       PRO  57 -14.269  -3.370  -0.494
  428   2HG   PRO  57          1HG       PRO  57 -15.852  -4.169  -0.406
  429   1HD   PRO  57          2HD       PRO  57 -15.016  -2.467   1.505
  430   2HD   PRO  57          1HD       PRO  57 -16.008  -3.890   1.879
  431    H    SER  58           H        SER  58 -11.893  -6.169  -0.503
  432    HA   SER  58           HA       SER  58 -10.053  -5.573  -1.715
  433   1HB   SER  58          2HB       SER  58  -9.472  -3.138  -0.098
  434   2HB   SER  58          1HB       SER  58  -9.354  -3.393  -1.839
  435    HG   SER  58           HG       SER  58 -11.718  -3.454  -1.798
  436    H    ASP  59           H        ASP  59  -7.761  -5.641  -1.540
  437    HA   ASP  59           HA       ASP  59  -6.750  -6.273   1.149
  438   1HB   ASP  59          2HB       ASP  59  -7.153  -8.367  -0.082
  439   2HB   ASP  59          1HB       ASP  59  -6.131  -7.792  -1.395
  440    H    ILE  60           H        ILE  60  -4.610  -5.702   1.565
  441    HA   ILE  60           HA       ILE  60  -3.221  -4.212  -0.559
  442    HB   ILE  60           HB       ILE  60  -3.255  -3.315   2.318
  443   1HG1  ILE  60          2HG1      ILE  60  -4.732  -1.434   1.360
  444   2HG1  ILE  60          1HG1      ILE  60  -5.034  -2.530   0.015
  445   1HG2  ILE  60          1HG2      ILE  60  -2.673  -1.501   0.054
  446   2HG2  ILE  60          2HG2      ILE  60  -1.458  -2.717   0.447
  447   3HG2  ILE  60          3HG2      ILE  60  -1.974  -1.559   1.672
  448   1HD1  ILE  60          1HD1      ILE  60  -6.290  -2.434   2.546
  449   2HD1  ILE  60          2HD1      ILE  60  -5.454  -3.975   2.404
  450   3HD1  ILE  60          3HD1      ILE  60  -6.634  -3.495   1.184
  451    H    GLU  61           H        GLU  61  -1.394  -5.251  -0.966
  452    HA   GLU  61           HA       GLU  61   0.095  -6.431   1.286
  453   1HB   GLU  61          2HB       GLU  61  -0.683  -8.111  -0.312
  454   2HB   GLU  61          1HB       GLU  61   0.086  -7.236  -1.630
  455   1HG   GLU  61          2HG       GLU  61   2.212  -7.849  -0.978
  456   2HG   GLU  61          1HG       GLU  61   1.719  -8.176   0.683
  457    H    VAL  62           H        VAL  62   1.080  -4.345   1.662
  458    HA   VAL  62           HA       VAL  62   2.861  -3.342  -0.418
  459    HB   VAL  62           HB       VAL  62   2.414  -2.255   2.365
  460   1HG1  VAL  62          1HG1      VAL  62   3.237  -0.139   1.045
  461   2HG1  VAL  62          2HG1      VAL  62   3.986  -1.348   0.002
  462   3HG1  VAL  62          3HG1      VAL  62   4.392  -1.289   1.717
  463   1HG2  VAL  62          1HG2      VAL  62   1.057  -1.658  -0.249
  464   2HG2  VAL  62          2HG2      VAL  62   1.079  -0.503   1.084
  465   3HG2  VAL  62          3HG2      VAL  62   0.326  -2.084   1.299
  466    H    ASP  63           H        ASP  63   4.910  -3.959  -0.561
  467    HA   ASP  63           HA       ASP  63   6.461  -4.468   1.838
  468   1HB   ASP  63          2HB       ASP  63   5.434  -6.663   1.293
  469   2HB   ASP  63          1HB       ASP  63   6.193  -6.597  -0.295
  470    H    LEU  64           H        LEU  64   8.429  -3.639   1.605
  471    HA   LEU  64           HA       LEU  64   9.606  -3.504  -1.077
  472   1HB   LEU  64          2HB       LEU  64  10.528  -1.199  -0.295
  473   2HB   LEU  64          1HB       LEU  64   8.921  -1.314  -0.981
  474    HG   LEU  64           HG       LEU  64   9.094   0.174   1.012
  475   1HD1  LEU  64          1HD1      LEU  64   7.049  -1.331   0.238
  476   2HD1  LEU  64          2HD1      LEU  64   6.976  -0.296   1.663
  477   3HD1  LEU  64          3HD1      LEU  64   7.290  -2.022   1.842
  478   1HD2  LEU  64          1HD2      LEU  64   9.566  -0.602   3.136
  479   2HD2  LEU  64          2HD2      LEU  64  10.724  -1.490   2.147
  480   3HD2  LEU  64          3HD2      LEU  64   9.253  -2.284   2.708
  481    H    LEU  65           H        LEU  65  11.832  -3.647  -1.170
  482    HA   LEU  65           HA       LEU  65  13.093  -4.607   1.293
  483   1HB   LEU  65          2HB       LEU  65  13.387  -5.175  -1.566
  484   2HB   LEU  65          1HB       LEU  65  14.917  -5.004  -0.727
  485    HG   LEU  65           HG       LEU  65  12.723  -6.887   0.133
  486   1HD1  LEU  65          1HD1      LEU  65  14.183  -8.656  -0.777
  487   2HD1  LEU  65          2HD1      LEU  65  15.217  -7.409  -1.475
  488   3HD1  LEU  65          3HD1      LEU  65  13.549  -7.581  -2.023
  489   1HD2  LEU  65          1HD2      LEU  65  14.048  -7.522   1.844
  490   2HD2  LEU  65          2HD2      LEU  65  14.716  -5.902   1.651
  491   3HD2  LEU  65          3HD2      LEU  65  15.534  -7.286   0.925
  492    H    LYS  66           H        LYS  66  13.895  -2.929   2.421
  493    HA   LYS  66           HA       LYS  66  15.189  -1.147   2.988
  494   1HB   LYS  66          2HB       LYS  66  16.801  -2.782   1.587
  495   2HB   LYS  66          1HB       LYS  66  16.871  -1.362   0.553
  496   1HG   LYS  66          2HG       LYS  66  18.067  -0.166   2.042
  497   2HG   LYS  66          1HG       LYS  66  17.245  -0.873   3.434
  498   1HD   LYS  66          2HD       LYS  66  18.953  -2.708   1.883
  499   2HD   LYS  66          1HD       LYS  66  19.797  -1.426   2.750
  500   1HE   LYS  66          2HE       LYS  66  18.056  -2.278   4.647
  501   2HE   LYS  66          1HE       LYS  66  18.358  -3.778   3.772
  502   1HZ   LYS  66          1HZ       LYS  66  19.996  -3.726   5.396
  503   2HZ   LYS  66          2HZ       LYS  66  20.286  -2.069   5.214
  504   3HZ   LYS  66          3HZ       LYS  66  20.806  -3.154   4.025
  505   1H    SER  67          1HT       SER  67  16.829   5.926  10.744
  506   2H    SER  67          2HT       SER  67  15.137   5.872  11.024
  507   3H    SER  67          3HT       SER  67  16.049   7.236  11.527
  508    HA   SER  67           HA       SER  67  16.400   7.954   9.392
  509   1HB   SER  67          2HB       SER  67  16.178   6.616   7.470
  510   2HB   SER  67          1HB       SER  67  16.851   5.509   8.667
  511    HG   SER  67           HG       SER  67  14.552   4.954   9.079
  512    H    ASN  68           H        ASN  68  14.669   8.407   7.582
  513    HA   ASN  68           HA       ASN  68  12.379   9.427   8.910
  514   1HB   ASN  68          2HB       ASN  68  13.635  10.182   6.695
  515   2HB   ASN  68          1HB       ASN  68  12.417   9.161   5.939
  516   1HD2  ASN  68          1HD2      ASN  68  11.117  10.622   5.021
  517   2HD2  ASN  68          2HD2      ASN  68  10.284  11.875   5.870
  518    H    PHE  69           H        PHE  69  11.071   7.885   9.780
  519    HA   PHE  69           HA       PHE  69   9.816   6.014   7.881
  520   1HB   PHE  69          2HB       PHE  69  11.228   4.742   9.384
  521   2HB   PHE  69          1HB       PHE  69  10.516   5.536  10.785
  522    HD1  PHE  69           1HD      PHE  69   8.617   4.316   7.864
  523    HD2  PHE  69           2HD      PHE  69   9.739   3.608  11.908
  524    HE1  PHE  69           1HE      PHE  69   6.931   2.532   8.015
  525    HE2  PHE  69           2HE      PHE  69   8.056   1.820  12.065
  526    HZ   PHE  69           HZ       PHE  69   6.648   1.281  10.118
  527    H    LEU  70           H        LEU  70   7.794   6.624   7.521
  528    HA   LEU  70           HA       LEU  70   6.213   7.642   9.791
  529   1HB   LEU  70          2HB       LEU  70   6.897   9.097   7.588
  530   2HB   LEU  70          1HB       LEU  70   5.349   8.439   7.092
  531    HG   LEU  70           HG       LEU  70   4.257   9.440   9.015
  532   1HD1  LEU  70          1HD1      LEU  70   5.855  11.164  10.254
  533   2HD1  LEU  70          2HD1      LEU  70   7.055   9.935   9.853
  534   3HD1  LEU  70          3HD1      LEU  70   5.639   9.506  10.814
  535   1HD2  LEU  70          1HD2      LEU  70   6.035  11.432   7.613
  536   2HD2  LEU  70          2HD2      LEU  70   4.512  11.782   8.431
  537   3HD2  LEU  70          3HD2      LEU  70   4.524  10.784   6.977
  538    H    ASN  71           H        ASN  71   5.101   5.839  10.347
  539    HA   ASN  71           HA       ASN  71   3.813   4.242   8.271
  540   1HB   ASN  71          2HB       ASN  71   3.216   2.734  10.182
  541   2HB   ASN  71          1HB       ASN  71   4.947   2.966   9.965
  542   1HD2  ASN  71          1HD2      ASN  71   2.622   2.737  12.214
  543   2HD2  ASN  71          2HD2      ASN  71   3.332   3.662  13.487
  544    H    CYS  72           H        CYS  72   2.665   6.625   8.198
  545    HA   CYS  72           HA       CYS  72   0.578   7.167   9.976
  546   1HB   CYS  72          2HB       CYS  72   0.920   7.825   7.049
  547   2HB   CYS  72          1HB       CYS  72  -0.426   8.423   8.011
  548    HG   CYS  72           HG       CYS  72   2.202   9.177   9.279
  549    H    TYR  73           H        TYR  73  -1.258   6.128  10.386
  550    HA   TYR  73           HA       TYR  73  -2.935   5.029   8.415
  551   1HB   TYR  73          2HB       TYR  73  -2.668   2.676   8.730
  552   2HB   TYR  73          1HB       TYR  73  -1.076   3.337   8.386
  553    HD1  TYR  73           1HD      TYR  73  -2.055   0.708   9.862
  554    HD2  TYR  73           2HD      TYR  73  -0.493   4.444  11.170
  555    HE1  TYR  73           1HE      TYR  73  -1.187  -0.372  11.892
  556    HE2  TYR  73           2HE      TYR  73   0.376   3.374  13.203
  557    HH   TYR  73           HH       TYR  73  -0.511   0.205  14.139
  558    H    VAL  74           H        VAL  74  -4.952   4.784   9.197
  559    HA   VAL  74           HA       VAL  74  -5.647   3.928  11.772
  560    HB   VAL  74           HB       VAL  74  -4.620   6.045  12.496
  561   1HG1  VAL  74          1HG1      VAL  74  -6.771   7.714  11.385
  562   2HG1  VAL  74          2HG1      VAL  74  -5.592   7.120  10.216
  563   3HG1  VAL  74          3HG1      VAL  74  -5.056   8.064  11.606
  564   1HG2  VAL  74          1HG2      VAL  74  -6.681   4.993  13.589
  565   2HG2  VAL  74          2HG2      VAL  74  -7.590   6.304  12.838
  566   3HG2  VAL  74          3HG2      VAL  74  -6.307   6.668  13.993
  567    H    SER  75           H        SER  75  -7.936   4.172  12.238
  568    HA   SER  75           HA       SER  75 -10.125   4.970  11.572
  569   1HB   SER  75          2HB       SER  75  -9.119   4.379   8.779
  570   2HB   SER  75          1HB       SER  75 -10.793   4.757   9.173
  571    HG   SER  75           HG       SER  75  -9.896   6.742  10.129
  572    H    GLY  76           H        GLY  76 -11.883   3.507  10.312
  573   1HA   GLY  76          2HA       GLY  76 -11.419   0.831  11.411
  574   2HA   GLY  76          1HA       GLY  76 -12.980   1.525  11.004
  575    H    PHE  77           H        PHE  77 -11.940  -1.071  10.311
  576    HA   PHE  77           HA       PHE  77 -12.608  -1.067   7.523
  577   1HB   PHE  77          2HB       PHE  77 -10.516  -2.214   6.789
  578   2HB   PHE  77          1HB       PHE  77 -10.275  -0.534   7.252
  579    HD1  PHE  77           1HD      PHE  77  -8.884   0.053   9.088
  580    HD2  PHE  77           2HD      PHE  77  -9.771  -4.030   8.280
  581    HE1  PHE  77           1HE      PHE  77  -7.123  -0.636  10.661
  582    HE2  PHE  77           2HE      PHE  77  -8.012  -4.727   9.853
  583    HZ   PHE  77           HZ       PHE  77  -6.686  -3.029  11.047
  584    H    HIS  78           H        HIS  78 -11.584  -2.762  10.395
  585    HA   HIS  78           HA       HIS  78 -11.668  -4.965  11.003
  586   1HB   HIS  78          2HB       HIS  78 -14.424  -3.993  10.442
  587   2HB   HIS  78          1HB       HIS  78 -14.208  -5.684  10.885
  588    HD1  HIS  78           1HD      HIS  78 -15.716  -4.641  12.975
  589    HD2  HIS  78           2HD      HIS  78 -11.670  -3.708  12.818
  590    HE1  HIS  78           1HE      HIS  78 -15.106  -3.905  15.300
  591    HE2  HIS  78           2HE      HIS  78 -12.668  -3.279  15.165
  592    HA   PRO  79           HA       PRO  79 -13.048  -7.994   7.690
  593   1HB   PRO  79          2HB       PRO  79 -14.935  -7.368   5.849
  594   2HB   PRO  79          1HB       PRO  79 -15.337  -7.967   7.464
  595   1HG   PRO  79          2HG       PRO  79 -15.282  -5.143   6.456
  596   2HG   PRO  79          1HG       PRO  79 -16.524  -5.956   7.429
  597   1HD   PRO  79          2HD       PRO  79 -14.697  -4.333   8.546
  598   2HD   PRO  79          1HD       PRO  79 -15.292  -5.784   9.375
  599    H    SER  80           H        SER  80 -10.935  -6.416   7.289
  600    HA   SER  80           HA       SER  80 -10.802  -6.207   4.366
  601   1HB   SER  80          2HB       SER  80  -9.934  -4.068   4.339
  602   2HB   SER  80          1HB       SER  80 -11.026  -3.937   5.717
  603    HG   SER  80           HG       SER  80  -8.219  -4.231   5.705
  604    H    ASP  81           H        ASP  81  -8.640  -6.425   3.497
  605    HA   ASP  81           HA       ASP  81  -6.884  -7.936   5.318
  606   1HB   ASP  81          2HB       ASP  81  -7.979  -8.936   3.121
  607   2HB   ASP  81          1HB       ASP  81  -6.608  -8.140   2.353
  608    H    ILE  82           H        ILE  82  -5.471  -6.451   6.086
  609    HA   ILE  82           HA       ILE  82  -3.905  -4.953   4.088
  610    HB   ILE  82           HB       ILE  82  -3.470  -3.430   6.225
  611   1HG1  ILE  82          2HG1      ILE  82  -5.649  -3.106   7.428
  612   2HG1  ILE  82          1HG1      ILE  82  -6.234  -4.582   6.666
  613   1HG2  ILE  82          1HG2      ILE  82  -4.820  -1.832   5.233
  614   2HG2  ILE  82          2HG2      ILE  82  -6.043  -3.011   4.758
  615   3HG2  ILE  82          3HG2      ILE  82  -4.500  -2.948   3.906
  616   1HD1  ILE  82          1HD1      ILE  82  -3.753  -4.526   8.350
  617   2HD1  ILE  82          2HD1      ILE  82  -4.717  -5.918   7.856
  618   3HD1  ILE  82          3HD1      ILE  82  -5.361  -4.773   9.033
  619    H    GLU  83           H        GLU  83  -1.698  -4.859   4.345
  620    HA   GLU  83           HA       GLU  83  -0.407  -5.930   6.683
  621   1HB   GLU  83          2HB       GLU  83   0.810  -7.712   5.456
  622   2HB   GLU  83          1HB       GLU  83  -0.916  -8.020   5.586
  623   1HG   GLU  83          2HG       GLU  83  -1.224  -7.222   3.292
  624   2HG   GLU  83          1HG       GLU  83   0.513  -6.943   3.166
  625    H    VAL  84           H        VAL  84   1.369  -4.775   7.000
  626    HA   VAL  84           HA       VAL  84   2.618  -3.458   4.678
  627    HB   VAL  84           HB       VAL  84   2.775  -2.566   7.558
  628   1HG1  VAL  84          1HG1      VAL  84   3.196  -0.421   5.830
  629   2HG1  VAL  84          2HG1      VAL  84   4.101  -1.759   5.123
  630   3HG1  VAL  84          3HG1      VAL  84   4.409  -1.269   6.789
  631   1HG2  VAL  84          1HG2      VAL  84   1.223  -0.724   6.731
  632   2HG2  VAL  84          2HG2      VAL  84   0.506  -2.311   7.005
  633   3HG2  VAL  84          3HG2      VAL  84   0.878  -1.783   5.363
  634    H    ASP  85           H        ASP  85   4.705  -3.832   4.240
  635    HA   ASP  85           HA       ASP  85   6.339  -5.206   6.267
  636   1HB   ASP  85          2HB       ASP  85   6.393  -5.811   3.305
  637   2HB   ASP  85          1HB       ASP  85   7.299  -6.636   4.569
  638    H    LEU  86           H        LEU  86   7.765  -3.688   6.855
  639    HA   LEU  86           HA       LEU  86   9.049  -2.080   4.752
  640   1HB   LEU  86          2HB       LEU  86   9.347  -1.438   7.650
  641   2HB   LEU  86          1HB       LEU  86   9.372  -0.366   6.266
  642    HG   LEU  86           HG       LEU  86   7.396   0.173   7.398
  643   1HD1  LEU  86          1HD1      LEU  86   7.232  -0.497   4.876
  644   2HD1  LEU  86          2HD1      LEU  86   5.779  -0.121   5.803
  645   3HD1  LEU  86          3HD1      LEU  86   6.221  -1.800   5.502
  646   1HD2  LEU  86          1HD2      LEU  86   6.243  -2.541   7.486
  647   2HD2  LEU  86          2HD2      LEU  86   6.123  -1.214   8.642
  648   3HD2  LEU  86          3HD2      LEU  86   7.574  -2.218   8.599
  649    H    LEU  87           H        LEU  87  10.773  -3.264   4.089
  650    HA   LEU  87           HA       LEU  87  12.812  -4.278   4.128
  651   1HB   LEU  87          2HB       LEU  87  13.541  -2.193   5.104
  652   2HB   LEU  87          1HB       LEU  87  13.010  -2.705   6.694
  653    HG   LEU  87           HG       LEU  87  14.743  -4.442   6.722
  654   1HD1  LEU  87          1HD1      LEU  87  16.551  -4.157   4.907
  655   2HD1  LEU  87          2HD1      LEU  87  15.264  -3.406   3.964
  656   3HD1  LEU  87          3HD1      LEU  87  15.095  -5.072   4.518
  657   1HD2  LEU  87          1HD2      LEU  87  16.326  -3.017   7.462
  658   2HD2  LEU  87          2HD2      LEU  87  15.068  -1.811   7.193
  659   3HD2  LEU  87          3HD2      LEU  87  16.317  -2.067   5.976
  660    H    LYS  88           H        LYS  88  12.569  -6.427   4.303
  661    HA   LYS  88           HA       LYS  88  12.793  -7.611   6.954
  662   1HB   LYS  88          2HB       LYS  88  10.428  -7.904   5.159
  663   2HB   LYS  88          1HB       LYS  88  10.953  -9.307   6.081
  664   1HG   LYS  88          2HG       LYS  88  10.239  -8.457   8.036
  665   2HG   LYS  88          1HG       LYS  88  10.704  -6.808   7.612
  666   1HD   LYS  88          2HD       LYS  88   8.485  -6.474   7.448
  667   2HD   LYS  88          1HD       LYS  88   8.672  -7.238   5.868
  668   1HE   LYS  88          2HE       LYS  88   8.304  -9.058   8.163
  669   2HE   LYS  88          1HE       LYS  88   6.914  -8.064   7.733
  670   1HZ   LYS  88          1HZ       LYS  88   8.196 -10.217   6.234
  671   2HZ   LYS  88          2HZ       LYS  88   7.572  -8.923   5.340
  672   3HZ   LYS  88          3HZ       LYS  88   6.557  -9.811   6.360
  Start of MODEL    5
    1   1H    SER   1          1HT       SER   1  14.535   7.621 -10.350
    2   2H    SER   1          2HT       SER   1  13.647   9.003  -9.852
    3   3H    SER   1          3HT       SER   1  12.829   7.535 -10.203
    4    HA   SER   1           HA       SER   1  14.136   6.506  -8.389
    5   1HB   SER   1          2HB       SER   1  15.522   8.877  -8.533
    6   2HB   SER   1          1HB       SER   1  14.486   9.140  -7.130
    7    HG   SER   1           HG       SER   1  16.706   7.689  -7.289
    8    H    ASN   2           H        ASN   2  13.482   7.491  -5.911
    9    HA   ASN   2           HA       ASN   2  11.694   7.396  -4.493
   10   1HB   ASN   2          2HB       ASN   2  10.187   9.332  -4.674
   11   2HB   ASN   2          1HB       ASN   2  11.872   9.796  -4.892
   12   1HD2  ASN   2          1HD2      ASN   2  12.603  10.353  -6.965
   13   2HD2  ASN   2          2HD2      ASN   2  11.504  10.836  -8.206
   14    H    PHE   3           H        PHE   3  10.704   5.452  -4.786
   15    HA   PHE   3           HA       PHE   3   8.888   4.962  -6.959
   16   1HB   PHE   3          2HB       PHE   3  10.296   3.208  -5.804
   17   2HB   PHE   3          1HB       PHE   3   9.222   3.350  -4.422
   18    HD1  PHE   3           1HD      PHE   3   6.700   3.715  -6.327
   19    HD2  PHE   3           2HD      PHE   3   9.835   0.848  -6.034
   20    HE1  PHE   3           1HE      PHE   3   5.221   2.013  -7.284
   21    HE2  PHE   3           2HE      PHE   3   8.347  -0.861  -6.994
   22    HZ   PHE   3           HZ       PHE   3   6.044  -0.277  -7.620
   23    H    LEU   4           H        LEU   4   7.041   6.080  -6.998
   24    HA   LEU   4           HA       LEU   4   5.571   6.544  -4.509
   25   1HB   LEU   4          2HB       LEU   4   4.707   7.612  -7.165
   26   2HB   LEU   4          1HB       LEU   4   4.473   8.293  -5.568
   27    HG   LEU   4           HG       LEU   4   7.173   8.424  -5.756
   28   1HD1  LEU   4          1HD1      LEU   4   6.064   8.457  -8.527
   29   2HD1  LEU   4          2HD1      LEU   4   7.557   7.740  -7.923
   30   3HD1  LEU   4          3HD1      LEU   4   7.435   9.488  -8.118
   31   1HD2  LEU   4          1HD2      LEU   4   5.416  10.189  -5.212
   32   2HD2  LEU   4          2HD2      LEU   4   5.424  10.560  -6.936
   33   3HD2  LEU   4          3HD2      LEU   4   6.900  10.741  -5.988
   34    H    ASN   5           H        ASN   5   5.190   4.114  -4.607
   35    HA   ASN   5           HA       ASN   5   3.435   3.030  -6.544
   36   1HB   ASN   5          2HB       ASN   5   3.445   1.070  -5.254
   37   2HB   ASN   5          1HB       ASN   5   5.010   1.798  -4.917
   38   1HD2  ASN   5          1HD2      ASN   5   5.569   2.014  -2.872
   39   2HD2  ASN   5          2HD2      ASN   5   4.499   1.947  -1.517
   40    H    CYS   6           H        CYS   6   1.384   1.812  -5.483
   41    HA   CYS   6           HA       CYS   6  -0.767   1.996  -4.803
   42   1HB   CYS   6          2HB       CYS   6   0.661   3.789  -2.904
   43   2HB   CYS   6          1HB       CYS   6  -1.094   3.884  -2.954
   44    HG   CYS   6           HG       CYS   6  -0.009   2.055  -1.222
   45    H    TYR   7           H        TYR   7  -2.406   4.134  -4.173
   46    HA   TYR   7           HA       TYR   7  -2.082   6.108  -6.300
   47   1HB   TYR   7          2HB       TYR   7  -4.224   5.642  -7.303
   48   2HB   TYR   7          1HB       TYR   7  -3.301   4.140  -7.265
   49    HD1  TYR   7           1HD      TYR   7  -4.110   2.243  -6.094
   50    HD2  TYR   7           2HD      TYR   7  -6.021   6.009  -5.588
   51    HE1  TYR   7           1HE      TYR   7  -5.942   1.145  -4.874
   52    HE2  TYR   7           2HE      TYR   7  -7.858   4.923  -4.371
   53    HH   TYR   7           HH       TYR   7  -7.675   1.694  -3.273
   54    H    VAL   8           H        VAL   8  -3.410   7.965  -6.059
   55    HA   VAL   8           HA       VAL   8  -4.322   8.371  -3.310
   56    HB   VAL   8           HB       VAL   8  -2.766  10.030  -4.187
   57   1HG1  VAL   8          1HG1      VAL   8  -4.382   9.818  -6.535
   58   2HG1  VAL   8          2HG1      VAL   8  -2.832  10.629  -6.319
   59   3HG1  VAL   8          3HG1      VAL   8  -4.333  11.500  -6.007
   60   1HG2  VAL   8          1HG2      VAL   8  -5.436  11.392  -4.047
   61   2HG2  VAL   8          2HG2      VAL   8  -3.877  11.945  -3.437
   62   3HG2  VAL   8          3HG2      VAL   8  -4.718  10.620  -2.633
   63    H    SER   9           H        SER   9  -6.285   7.159  -3.527
   64    HA   SER   9           HA       SER   9  -8.530   6.949  -3.820
   65   1HB   SER   9          2HB       SER   9  -9.822   8.879  -3.721
   66   2HB   SER   9          1HB       SER   9  -8.280   9.458  -3.091
   67    HG   SER   9           HG       SER   9  -9.186  10.838  -4.707
   68    H    GLY  10           H        GLY  10  -9.297   5.768  -5.439
   69   1HA   GLY  10          2HA       GLY  10 -10.403   5.789  -7.607
   70   2HA   GLY  10          1HA       GLY  10  -9.147   6.880  -8.170
   71    H    PHE  11           H        PHE  11 -10.209   3.964  -8.736
   72    HA   PHE  11           HA       PHE  11  -7.880   3.003  -9.933
   73   1HB   PHE  11          2HB       PHE  11  -6.976   2.571  -7.756
   74   2HB   PHE  11          1HB       PHE  11  -8.468   1.808  -7.221
   75    HD1  PHE  11           1HD      PHE  11  -6.092   1.402 -10.075
   76    HD2  PHE  11           2HD      PHE  11  -8.334  -0.460  -6.976
   77    HE1  PHE  11           1HE      PHE  11  -5.215  -0.790 -10.763
   78    HE2  PHE  11           2HE      PHE  11  -7.458  -2.657  -7.653
   79    HZ   PHE  11           HZ       PHE  11  -5.897  -2.822  -9.552
   80    H    HIS  12           H        HIS  12  -8.218   1.112 -11.123
   81    HA   HIS  12           HA       HIS  12 -11.000   0.478 -11.574
   82   1HB   HIS  12          2HB       HIS  12 -10.032  -1.007 -13.387
   83   2HB   HIS  12          1HB       HIS  12  -9.676   0.710 -13.540
   84    HD1  HIS  12           1HD      HIS  12  -8.031  -2.513 -12.433
   85    HD2  HIS  12           2HD      HIS  12  -7.014   1.326 -13.655
   86    HE1  HIS  12           1HE      HIS  12  -5.530  -2.532 -12.698
   87    HE2  HIS  12           2HE      HIS  12  -4.952  -0.231 -13.545
   88    HA   PRO  13           HA       PRO  13 -11.431  -3.237  -9.263
   89   1HB   PRO  13          2HB       PRO  13 -12.520  -4.945 -11.152
   90   2HB   PRO  13          1HB       PRO  13 -13.430  -3.749 -10.225
   91   1HG   PRO  13          2HG       PRO  13 -12.350  -3.575 -13.005
   92   2HG   PRO  13          1HG       PRO  13 -13.904  -3.006 -12.366
   93   1HD   PRO  13          2HD       PRO  13 -11.881  -1.313 -12.827
   94   2HD   PRO  13          1HD       PRO  13 -12.965  -1.100 -11.435
   95    H    SER  14           H        SER  14 -11.318  -5.876 -10.107
   96    HA   SER  14           HA       SER  14  -9.944  -7.607 -10.596
   97   1HB   SER  14          2HB       SER  14  -8.869  -5.496 -12.353
   98   2HB   SER  14          1HB       SER  14  -7.726  -6.774 -11.944
   99    HG   SER  14           HG       SER  14  -8.728  -7.713 -13.562
  100    H    ASP  15           H        ASP  15  -7.109  -5.537 -10.614
  101    HA   ASP  15           HA       ASP  15  -6.573  -5.517  -7.869
  102   1HB   ASP  15          2HB       ASP  15  -6.361  -7.822  -7.723
  103   2HB   ASP  15          1HB       ASP  15  -5.719  -7.972  -9.353
  104    H    ILE  16           H        ILE  16  -4.348  -4.909  -7.359
  105    HA   ILE  16           HA       ILE  16  -3.177  -3.346  -9.535
  106    HB   ILE  16           HB       ILE  16  -3.327  -3.066  -6.613
  107   1HG1  ILE  16          2HG1      ILE  16  -2.581  -0.684  -8.026
  108   2HG1  ILE  16          1HG1      ILE  16  -3.814  -1.539  -8.946
  109   1HG2  ILE  16          1HG2      ILE  16  -1.200  -1.712  -6.526
  110   2HG2  ILE  16          2HG2      ILE  16  -0.743  -2.496  -8.038
  111   3HG2  ILE  16          3HG2      ILE  16  -0.999  -3.463  -6.586
  112   1HD1  ILE  16          1HD1      ILE  16  -3.976  -0.444  -6.166
  113   2HD1  ILE  16          2HD1      ILE  16  -5.113  -1.656  -6.758
  114   3HD1  ILE  16          3HD1      ILE  16  -4.997  -0.090  -7.559
  115    H    GLU  17           H        GLU  17  -1.510  -4.183 -10.619
  116    HA   GLU  17           HA       GLU  17   0.200  -6.140  -9.245
  117   1HB   GLU  17          2HB       GLU  17   0.552  -7.243 -11.248
  118   2HB   GLU  17          1HB       GLU  17  -1.107  -6.702 -11.429
  119   1HG   GLU  17          2HG       GLU  17  -0.348  -4.822 -12.794
  120   2HG   GLU  17          1HG       GLU  17   1.319  -5.364 -12.607
  121    H    VAL  18           H        VAL  18   2.055  -5.362  -8.538
  122    HA   VAL  18           HA       VAL  18   3.678  -3.683 -10.271
  123    HB   VAL  18           HB       VAL  18   3.101  -2.753  -7.459
  124   1HG1  VAL  18          1HG1      VAL  18   4.109  -0.635  -8.357
  125   2HG1  VAL  18          2HG1      VAL  18   4.565  -1.545  -9.797
  126   3HG1  VAL  18          3HG1      VAL  18   5.223  -1.997  -8.224
  127   1HG2  VAL  18          1HG2      VAL  18   1.062  -2.592  -8.817
  128   2HG2  VAL  18          2HG2      VAL  18   1.950  -1.673 -10.031
  129   3HG2  VAL  18          3HG2      VAL  18   1.710  -1.002  -8.418
  130    H    ASP  19           H        ASP  19   5.836  -4.027  -9.993
  131    HA   ASP  19           HA       ASP  19   6.803  -5.265  -7.546
  132   1HB   ASP  19          2HB       ASP  19   7.314  -6.610 -10.202
  133   2HB   ASP  19          1HB       ASP  19   7.764  -7.190  -8.600
  134    H    LEU  20           H        LEU  20   8.692  -4.442  -7.002
  135    HA   LEU  20           HA       LEU  20  10.705  -3.410  -7.071
  136   1HB   LEU  20          2HB       LEU  20  11.420  -5.123  -8.591
  137   2HB   LEU  20          1HB       LEU  20  10.636  -4.325  -9.939
  138    HG   LEU  20           HG       LEU  20  13.263  -4.166  -9.482
  139   1HD1  LEU  20          1HD1      LEU  20  11.312  -2.597 -10.935
  140   2HD1  LEU  20          2HD1      LEU  20  12.905  -3.164 -11.428
  141   3HD1  LEU  20          3HD1      LEU  20  12.748  -1.662 -10.522
  142   1HD2  LEU  20          1HD2      LEU  20  12.475  -1.526  -8.372
  143   2HD2  LEU  20          2HD2      LEU  20  13.979  -2.430  -8.191
  144   3HD2  LEU  20          3HD2      LEU  20  12.548  -2.905  -7.278
  145    H    LEU  21           H        LEU  21   9.346  -2.646 -10.276
  146    HA   LEU  21           HA       LEU  21   9.226  -0.654 -11.396
  147   1HB   LEU  21          2HB       LEU  21   7.457  -0.741  -9.231
  148   2HB   LEU  21          1HB       LEU  21   8.125   0.880  -9.208
  149    HG   LEU  21           HG       LEU  21   6.097   0.903 -10.488
  150   1HD1  LEU  21          1HD1      LEU  21   8.000   0.955 -12.735
  151   2HD1  LEU  21          2HD1      LEU  21   8.426   1.948 -11.341
  152   3HD1  LEU  21          3HD1      LEU  21   6.884   2.192 -12.160
  153   1HD2  LEU  21          1HD2      LEU  21   5.716  -0.478 -12.414
  154   2HD2  LEU  21          2HD2      LEU  21   6.113  -1.521 -11.048
  155   3HD2  LEU  21          3HD2      LEU  21   7.327  -1.184 -12.283
  156    H    LYS  22           H        LYS  22  11.568  -0.384 -11.390
  157    HA   LYS  22           HA       LYS  22  12.361   2.200 -10.723
  158   1HB   LYS  22          2HB       LYS  22  12.302   0.798  -8.425
  159   2HB   LYS  22          1HB       LYS  22  13.928   0.403  -8.958
  160   1HG   LYS  22          2HG       LYS  22  14.021   2.301  -7.503
  161   2HG   LYS  22          1HG       LYS  22  14.413   2.821  -9.143
  162   1HD   LYS  22          2HD       LYS  22  11.583   3.021  -8.713
  163   2HD   LYS  22          1HD       LYS  22  12.441   3.859  -7.421
  164   1HE   LYS  22          2HE       LYS  22  12.436   5.564  -8.896
  165   2HE   LYS  22          1HE       LYS  22  13.843   4.725  -9.548
  166   1HZ   LYS  22          1HZ       LYS  22  11.773   5.424 -11.031
  167   2HZ   LYS  22          2HZ       LYS  22  11.240   3.892 -10.555
  168   3HZ   LYS  22          3HZ       LYS  22  12.714   4.060 -11.370
  169   1H    SER  23          1HT       SER  23  14.911   8.977   2.382
  170   2H    SER  23          2HT       SER  23  14.164  10.371   3.047
  171   3H    SER  23          3HT       SER  23  15.295  10.528   1.766
  172    HA   SER  23           HA       SER  23  12.570   9.452   1.708
  173   1HB   SER  23          2HB       SER  23  12.597  11.777   1.336
  174   2HB   SER  23          1HB       SER  23  14.098  11.703   0.413
  175    HG   SER  23           HG       SER  23  13.003  10.851  -1.301
  176    H    ASN  24           H        ASN  24  12.139   7.799   0.401
  177    HA   ASN  24           HA       ASN  24  13.510   7.385  -2.073
  178   1HB   ASN  24          2HB       ASN  24  14.993   6.406  -0.139
  179   2HB   ASN  24          1HB       ASN  24  13.827   5.087  -0.179
  180   1HD2  ASN  24          1HD2      ASN  24  13.393   4.224  -2.424
  181   2HD2  ASN  24          2HD2      ASN  24  14.771   4.002  -3.442
  182    H    PHE  25           H        PHE  25  11.479   5.905   0.437
  183    HA   PHE  25           HA       PHE  25   9.903   4.610  -1.676
  184   1HB   PHE  25          2HB       PHE  25  10.581   3.016  -0.048
  185   2HB   PHE  25          1HB       PHE  25  10.136   4.079   1.283
  186    HD1  PHE  25           1HD      PHE  25   7.941   4.113   2.142
  187    HD2  PHE  25           2HD      PHE  25   8.796   1.959  -1.426
  188    HE1  PHE  25           1HE      PHE  25   5.720   3.058   2.253
  189    HE2  PHE  25           2HE      PHE  25   6.577   0.900  -1.321
  190    HZ   PHE  25           HZ       PHE  25   5.037   1.448   0.519
  191    H    LEU  26           H        LEU  26   8.025   5.436  -2.252
  192    HA   LEU  26           HA       LEU  26   6.570   7.144  -0.344
  193   1HB   LEU  26          2HB       LEU  26   7.009   7.531  -3.299
  194   2HB   LEU  26          1HB       LEU  26   5.731   8.354  -2.424
  195    HG   LEU  26           HG       LEU  26   7.424   9.415  -0.973
  196   1HD1  LEU  26          1HD1      LEU  26   9.806   9.233  -2.218
  197   2HD1  LEU  26          2HD1      LEU  26   9.194   7.599  -2.470
  198   3HD1  LEU  26          3HD1      LEU  26   9.342   8.243  -0.835
  199   1HD2  LEU  26          1HD2      LEU  26   8.220  11.002  -2.590
  200   2HD2  LEU  26          2HD2      LEU  26   6.593  10.498  -3.048
  201   3HD2  LEU  26          3HD2      LEU  26   7.991   9.846  -3.902
  202    H    ASN  27           H        ASN  27   4.624   6.379   0.143
  203    HA   ASN  27           HA       ASN  27   3.208   4.733  -1.849
  204   1HB   ASN  27          2HB       ASN  27   4.107   3.287  -0.093
  205   2HB   ASN  27          1HB       ASN  27   3.341   4.275   1.141
  206   1HD2  ASN  27          1HD2      ASN  27   0.943   4.450   0.971
  207   2HD2  ASN  27          2HD2      ASN  27   0.076   3.031   0.505
  208    H    CYS  28           H        CYS  28   1.434   5.772  -2.480
  209    HA   CYS  28           HA       CYS  28  -0.010   7.405  -0.492
  210   1HB   CYS  28          2HB       CYS  28   1.117   8.464  -2.626
  211   2HB   CYS  28          1HB       CYS  28  -0.330   7.864  -3.429
  212    HG   CYS  28           HG       CYS  28  -1.368   9.403  -1.197
  213    H    TYR  29           H        TYR  29  -1.603   6.107   0.223
  214    HA   TYR  29           HA       TYR  29  -3.426   4.987  -1.801
  215   1HB   TYR  29          2HB       TYR  29  -2.306   3.107  -0.837
  216   2HB   TYR  29          1HB       TYR  29  -2.506   3.740   0.792
  217    HD1  TYR  29           1HD      TYR  29  -3.580   1.786   1.683
  218    HD2  TYR  29           2HD      TYR  29  -5.204   3.756  -1.721
  219    HE1  TYR  29           1HE      TYR  29  -5.656   0.488   1.929
  220    HE2  TYR  29           2HE      TYR  29  -7.284   2.465  -1.483
  221    HH   TYR  29           HH       TYR  29  -8.244   0.989   1.138
  222    H    VAL  30           H        VAL  30  -4.778   6.795  -1.676
  223    HA   VAL  30           HA       VAL  30  -6.033   7.318   0.928
  224    HB   VAL  30           HB       VAL  30  -6.292   8.967  -1.587
  225   1HG1  VAL  30          1HG1      VAL  30  -7.867   9.010   0.605
  226   2HG1  VAL  30          2HG1      VAL  30  -7.539  10.422  -0.400
  227   3HG1  VAL  30          3HG1      VAL  30  -6.621  10.164   1.083
  228   1HG2  VAL  30          1HG2      VAL  30  -4.427   9.393   0.747
  229   2HG2  VAL  30          2HG2      VAL  30  -4.633  10.471  -0.634
  230   3HG2  VAL  30          3HG2      VAL  30  -3.948   8.862  -0.866
  231    H    SER  31           H        SER  31  -8.110   6.844   1.312
  232    HA   SER  31           HA       SER  31 -10.231   6.077   1.047
  233   1HB   SER  31          2HB       SER  31 -10.703   7.873  -0.439
  234   2HB   SER  31          1HB       SER  31  -9.773   7.136  -1.742
  235    HG   SER  31           HG       SER  31 -11.352   5.633  -2.026
  236    H    GLY  32           H        GLY  32 -11.398   4.227   0.378
  237   1HA   GLY  32          2HA       GLY  32  -9.651   2.094  -0.576
  238   2HA   GLY  32          1HA       GLY  32 -11.226   1.892   0.174
  239    H    PHE  33           H        PHE  33 -12.246   0.645  -1.307
  240    HA   PHE  33           HA       PHE  33 -13.405   1.813  -3.552
  241   1HB   PHE  33          2HB       PHE  33 -12.185   0.310  -5.293
  242   2HB   PHE  33          1HB       PHE  33 -11.449   1.827  -4.798
  243    HD1  PHE  33           1HD      PHE  33  -9.341   0.892  -5.712
  244    HD2  PHE  33           2HD      PHE  33 -11.318  -0.860  -2.376
  245    HE1  PHE  33           1HE      PHE  33  -7.274  -0.300  -5.117
  246    HE2  PHE  33           2HE      PHE  33  -9.252  -2.047  -1.772
  247    HZ   PHE  33           HZ       PHE  33  -7.227  -1.769  -3.143
  248    H    HIS  34           H        HIS  34 -12.347  -1.364  -4.332
  249    HA   HIS  34           HA       HIS  34 -14.816  -2.488  -3.193
  250   1HB   HIS  34          2HB       HIS  34 -13.857  -3.843  -5.599
  251   2HB   HIS  34          1HB       HIS  34 -15.474  -3.274  -5.202
  252    HD1  HIS  34           1HD      HIS  34 -13.193  -2.871  -7.759
  253    HD2  HIS  34           2HD      HIS  34 -15.270  -0.139  -5.417
  254    HE1  HIS  34           1HE      HIS  34 -13.209  -0.731  -9.078
  255    HE2  HIS  34           2HE      HIS  34 -14.355   0.940  -7.583
  256    HA   PRO  35           HA       PRO  35 -12.652  -6.023  -1.663
  257   1HB   PRO  35          2HB       PRO  35 -13.729  -7.934  -3.640
  258   2HB   PRO  35          1HB       PRO  35 -13.931  -7.896  -1.885
  259   1HG   PRO  35          2HG       PRO  35 -15.945  -7.259  -3.526
  260   2HG   PRO  35          1HG       PRO  35 -15.701  -6.409  -1.987
  261   1HD   PRO  35          2HD       PRO  35 -14.994  -5.537  -4.766
  262   2HD   PRO  35          1HD       PRO  35 -15.708  -4.597  -3.438
  263    H    SER  36           H        SER  36 -12.009  -5.028  -4.794
  264    HA   SER  36           HA       SER  36 -10.466  -6.847  -6.058
  265   1HB   SER  36          2HB       SER  36 -10.637  -4.792  -7.149
  266   2HB   SER  36          1HB       SER  36 -10.140  -3.880  -5.723
  267    HG   SER  36           HG       SER  36  -8.474  -5.560  -7.292
  268    H    ASP  37           H        ASP  37  -8.126  -7.169  -6.180
  269    HA   ASP  37           HA       ASP  37  -6.962  -7.262  -3.485
  270   1HB   ASP  37          2HB       ASP  37  -7.271  -9.370  -4.925
  271   2HB   ASP  37          1HB       ASP  37  -5.930  -8.756  -5.887
  272    H    ILE  38           H        ILE  38  -4.922  -6.458  -3.056
  273    HA   ILE  38           HA       ILE  38  -3.733  -4.811  -5.194
  274    HB   ILE  38           HB       ILE  38  -3.555  -4.214  -2.244
  275   1HG1  ILE  38          2HG1      ILE  38  -5.890  -4.044  -2.909
  276   2HG1  ILE  38          1HG1      ILE  38  -5.224  -2.431  -2.675
  277   1HG2  ILE  38          1HG2      ILE  38  -2.457  -2.284  -2.809
  278   2HG2  ILE  38          2HG2      ILE  38  -3.184  -2.210  -4.414
  279   3HG2  ILE  38          3HG2      ILE  38  -1.887  -3.358  -4.087
  280   1HD1  ILE  38          1HD1      ILE  38  -4.927  -3.277  -5.410
  281   2HD1  ILE  38          2HD1      ILE  38  -5.732  -1.854  -4.748
  282   3HD1  ILE  38          3HD1      ILE  38  -6.608  -3.378  -4.886
  283    H    GLU  39           H        GLU  39  -1.762  -5.376  -5.790
  284    HA   GLU  39           HA       GLU  39  -0.058  -6.805  -3.856
  285   1HB   GLU  39          2HB       GLU  39  -1.016  -8.184  -5.790
  286   2HB   GLU  39          1HB       GLU  39   0.048  -7.251  -6.833
  287   1HG   GLU  39          2HG       GLU  39   1.978  -8.022  -5.524
  288   2HG   GLU  39          1HG       GLU  39   0.893  -8.996  -4.532
  289    H    VAL  40           H        VAL  40   0.962  -4.875  -3.250
  290    HA   VAL  40           HA       VAL  40   2.467  -3.451  -5.325
  291    HB   VAL  40           HB       VAL  40   2.067  -2.706  -2.423
  292   1HG1  VAL  40          1HG1      VAL  40   3.962  -1.548  -2.978
  293   2HG1  VAL  40          2HG1      VAL  40   2.733  -0.408  -3.528
  294   3HG1  VAL  40          3HG1      VAL  40   3.541  -1.462  -4.689
  295   1HG2  VAL  40          1HG2      VAL  40   0.237  -1.488  -2.974
  296   2HG2  VAL  40          2HG2      VAL  40   0.103  -2.708  -4.240
  297   3HG2  VAL  40          3HG2      VAL  40   0.823  -1.139  -4.600
  298    H    ASP  41           H        ASP  41   4.506  -3.991  -5.659
  299    HA   ASP  41           HA       ASP  41   6.139  -4.858  -3.376
  300   1HB   ASP  41          2HB       ASP  41   5.368  -6.481  -5.581
  301   2HB   ASP  41          1HB       ASP  41   7.086  -6.137  -5.757
  302    H    LEU  42           H        LEU  42   7.872  -3.619  -3.143
  303    HA   LEU  42           HA       LEU  42   8.907  -2.201  -5.512
  304   1HB   LEU  42          2HB       LEU  42   9.372  -1.088  -2.799
  305   2HB   LEU  42          1HB       LEU  42   9.166  -0.260  -4.327
  306    HG   LEU  42           HG       LEU  42   7.288   0.317  -3.024
  307   1HD1  LEU  42          1HD1      LEU  42   6.938  -1.384  -5.324
  308   2HD1  LEU  42          2HD1      LEU  42   6.058   0.067  -4.851
  309   3HD1  LEU  42          3HD1      LEU  42   5.564  -1.506  -4.229
  310   1HD2  LEU  42          1HD2      LEU  42   6.169  -1.023  -1.561
  311   2HD2  LEU  42          2HD2      LEU  42   7.734  -1.836  -1.545
  312   3HD2  LEU  42          3HD2      LEU  42   6.416  -2.476  -2.528
  313    H    LEU  43           H        LEU  43  11.131  -2.001  -5.753
  314    HA   LEU  43           HA       LEU  43  13.301  -2.701  -5.633
  315   1HB   LEU  43          2HB       LEU  43  12.699  -1.601  -3.233
  316   2HB   LEU  43          1HB       LEU  43  13.214  -3.199  -2.729
  317    HG   LEU  43           HG       LEU  43  15.106  -1.743  -2.616
  318   1HD1  LEU  43          1HD1      LEU  43  15.174  -3.594  -4.985
  319   2HD1  LEU  43          2HD1      LEU  43  15.719  -3.909  -3.338
  320   3HD1  LEU  43          3HD1      LEU  43  16.607  -2.778  -4.360
  321   1HD2  LEU  43          1HD2      LEU  43  14.076  -0.788  -5.214
  322   2HD2  LEU  43          2HD2      LEU  43  15.830  -0.848  -5.036
  323   3HD2  LEU  43          3HD2      LEU  43  14.860   0.097  -3.906
  324    H    LYS  44           H        LYS  44  11.043  -4.733  -5.720
  325    HA   LYS  44           HA       LYS  44  12.726  -7.057  -5.119
  326   1HB   LYS  44          2HB       LYS  44  10.757  -6.496  -3.426
  327   2HB   LYS  44          1HB       LYS  44   9.792  -7.304  -4.653
  328   1HG   LYS  44          2HG       LYS  44  11.577  -9.174  -4.468
  329   2HG   LYS  44          1HG       LYS  44  11.960  -8.411  -2.924
  330   1HD   LYS  44          2HD       LYS  44   9.517  -8.594  -2.349
  331   2HD   LYS  44          1HD       LYS  44   9.324  -9.583  -3.798
  332   1HE   LYS  44          2HE       LYS  44  10.921 -11.199  -2.931
  333   2HE   LYS  44          1HE       LYS  44  11.187 -10.196  -1.505
  334   1HZ   LYS  44          1HZ       LYS  44   8.432 -10.953  -2.050
  335   2HZ   LYS  44          2HZ       LYS  44   9.256 -10.849  -0.576
  336   3HZ   LYS  44          3HZ       LYS  44   9.462 -12.205  -1.567
  337   1H    SER  45          1HT       SER  45  16.847   4.620   4.061
  338   2H    SER  45          2HT       SER  45  17.052   6.258   3.590
  339   3H    SER  45          3HT       SER  45  17.964   5.022   2.824
  340    HA   SER  45           HA       SER  45  16.326   5.551   1.330
  341   1HB   SER  45          2HB       SER  45  14.821   3.479   1.493
  342   2HB   SER  45          1HB       SER  45  16.562   3.195   1.473
  343    HG   SER  45           HG       SER  45  16.512   2.609   3.533
  344    H    ASN  46           H        ASN  46  14.969   5.159   4.573
  345    HA   ASN  46           HA       ASN  46  13.179   6.119   5.598
  346   1HB   ASN  46          2HB       ASN  46  14.167   8.106   4.001
  347   2HB   ASN  46          1HB       ASN  46  12.501   8.000   3.438
  348   1HD2  ASN  46          1HD2      ASN  46  11.284   7.258   5.842
  349   2HD2  ASN  46          2HD2      ASN  46  11.370   8.594   6.933
  350    H    PHE  47           H        PHE  47  11.310   5.108   5.770
  351    HA   PHE  47           HA       PHE  47   9.876   4.347   3.316
  352   1HB   PHE  47          2HB       PHE  47  10.227   2.323   4.329
  353   2HB   PHE  47          1HB       PHE  47  10.305   3.019   5.940
  354    HD1  PHE  47           1HD      PHE  47   8.005   1.938   3.265
  355    HD2  PHE  47           2HD      PHE  47   8.417   3.050   7.346
  356    HE1  PHE  47           1HE      PHE  47   5.710   1.161   3.701
  357    HE2  PHE  47           2HE      PHE  47   6.127   2.273   7.795
  358    HZ   PHE  47           HZ       PHE  47   4.769   1.327   5.972
  359    H    LEU  48           H        LEU  48   8.422   5.915   2.904
  360    HA   LEU  48           HA       LEU  48   6.773   6.900   5.134
  361   1HB   LEU  48          2HB       LEU  48   7.972   8.166   2.825
  362   2HB   LEU  48          1HB       LEU  48   6.241   8.446   2.858
  363    HG   LEU  48           HG       LEU  48   6.553   9.230   5.261
  364   1HD1  LEU  48          1HD1      LEU  48   9.019  10.198   5.410
  365   2HD1  LEU  48          2HD1      LEU  48   9.363   8.762   4.445
  366   3HD1  LEU  48          3HD1      LEU  48   8.598   8.599   6.025
  367   1HD2  LEU  48          1HD2      LEU  48   7.416  10.617   2.787
  368   2HD2  LEU  48          2HD2      LEU  48   7.757  11.406   4.327
  369   3HD2  LEU  48          3HD2      LEU  48   6.098  10.991   3.898
  370    H    ASN  49           H        ASN  49   4.934   5.796   5.323
  371    HA   ASN  49           HA       ASN  49   3.457   5.131   2.862
  372   1HB   ASN  49          2HB       ASN  49   4.357   3.115   3.982
  373   2HB   ASN  49          1HB       ASN  49   3.479   3.554   5.444
  374   1HD2  ASN  49          1HD2      ASN  49   1.127   3.710   5.260
  375   2HD2  ASN  49          2HD2      ASN  49   0.309   2.635   4.183
  376    H    CYS  50           H        CYS  50   2.048   6.817   2.803
  377    HA   CYS  50           HA       CYS  50   0.384   7.274   5.189
  378   1HB   CYS  50          2HB       CYS  50   0.658   9.137   2.830
  379   2HB   CYS  50          1HB       CYS  50  -0.021   9.493   4.414
  380    HG   CYS  50           HG       CYS  50   2.805   9.915   3.677
  381    H    TYR  51           H        TYR  51  -1.560   6.371   5.107
  382    HA   TYR  51           HA       TYR  51  -3.033   6.415   2.580
  383   1HB   TYR  51          2HB       TYR  51  -3.391   4.157   2.453
  384   2HB   TYR  51          1HB       TYR  51  -1.806   4.140   3.215
  385    HD1  TYR  51           1HD      TYR  51  -1.510   3.216   5.388
  386    HD2  TYR  51           2HD      TYR  51  -5.433   3.805   3.848
  387    HE1  TYR  51           1HE      TYR  51  -2.432   1.889   7.244
  388    HE2  TYR  51           2HE      TYR  51  -6.364   2.483   5.699
  389    HH   TYR  51           HH       TYR  51  -5.120   1.938   8.376
  390    H    VAL  52           H        VAL  52  -5.289   6.393   2.776
  391    HA   VAL  52           HA       VAL  52  -6.280   6.948   5.497
  392    HB   VAL  52           HB       VAL  52  -7.446   7.994   2.912
  393   1HG1  VAL  52          1HG1      VAL  52  -8.223   8.128   5.754
  394   2HG1  VAL  52          2HG1      VAL  52  -9.217   8.199   4.299
  395   3HG1  VAL  52          3HG1      VAL  52  -8.349   9.634   4.844
  396   1HG2  VAL  52          1HG2      VAL  52  -5.074   8.810   3.944
  397   2HG2  VAL  52          2HG2      VAL  52  -6.194   9.882   4.783
  398   3HG2  VAL  52          3HG2      VAL  52  -6.166   9.842   3.021
  399    H    SER  53           H        SER  53  -7.373   5.240   6.223
  400    HA   SER  53           HA       SER  53  -8.370   3.131   4.743
  401   1HB   SER  53          2HB       SER  53  -9.559   4.094   7.349
  402   2HB   SER  53          1HB       SER  53  -9.561   2.450   6.715
  403    HG   SER  53           HG       SER  53  -7.394   3.949   7.728
  404    H    GLY  54           H        GLY  54 -10.844   2.503   4.976
  405   1HA   GLY  54          2HA       GLY  54 -13.041   3.911   4.921
  406   2HA   GLY  54          1HA       GLY  54 -12.281   4.581   3.485
  407    H    PHE  55           H        PHE  55 -12.453   1.258   4.739
  408    HA   PHE  55           HA       PHE  55 -14.366   0.324   2.919
  409   1HB   PHE  55          2HB       PHE  55 -13.046  -0.823   1.269
  410   2HB   PHE  55          1HB       PHE  55 -12.568   0.867   1.274
  411    HD1  PHE  55           1HD      PHE  55 -11.004  -1.427   0.112
  412    HD2  PHE  55           2HD      PHE  55 -10.887   0.402   3.954
  413    HE1  PHE  55           1HE      PHE  55  -8.651  -2.101   0.362
  414    HE2  PHE  55           2HE      PHE  55  -8.539  -0.270   4.207
  415    HZ   PHE  55           HZ       PHE  55  -7.416  -1.522   2.410
  416    H    HIS  56           H        HIS  56 -14.951  -1.770   3.339
  417    HA   HIS  56           HA       HIS  56 -13.734  -2.963   5.686
  418   1HB   HIS  56          2HB       HIS  56 -16.344  -2.927   4.520
  419   2HB   HIS  56          1HB       HIS  56 -15.826  -4.602   4.675
  420    HD1  HIS  56           1HD      HIS  56 -14.536  -4.827   7.289
  421    HD2  HIS  56           2HD      HIS  56 -17.775  -2.289   6.709
  422    HE1  HIS  56           1HE      HIS  56 -15.526  -4.469   9.573
  423    HE2  HIS  56           2HE      HIS  56 -17.538  -3.001   9.183
  424    HA   PRO  57           HA       PRO  57 -13.106  -6.662   2.722
  425   1HB   PRO  57          2HB       PRO  57 -13.927  -6.524   0.160
  426   2HB   PRO  57          1HB       PRO  57 -15.027  -6.958   1.473
  427   1HG   PRO  57          2HG       PRO  57 -14.677  -4.331   0.084
  428   2HG   PRO  57          1HG       PRO  57 -16.173  -5.152   0.566
  429   1HD   PRO  57          2HD       PRO  57 -15.036  -3.123   1.997
  430   2HD   PRO  57          1HD       PRO  57 -16.040  -4.392   2.723
  431    H    SER  58           H        SER  58 -12.097  -6.972   0.209
  432    HA   SER  58           HA       SER  58 -10.425  -6.433  -1.256
  433   1HB   SER  58          2HB       SER  58 -11.329  -3.963  -0.722
  434   2HB   SER  58          1HB       SER  58  -9.739  -3.842   0.030
  435    HG   SER  58           HG       SER  58  -8.790  -4.299  -1.918
  436    H    ASP  59           H        ASP  59  -8.058  -6.211  -1.260
  437    HA   ASP  59           HA       ASP  59  -6.882  -6.751   1.387
  438   1HB   ASP  59          2HB       ASP  59  -6.107  -8.132  -1.191
  439   2HB   ASP  59          1HB       ASP  59  -5.465  -8.462   0.415
  440    H    ILE  60           H        ILE  60  -5.151  -5.554   1.878
  441    HA   ILE  60           HA       ILE  60  -3.848  -4.058  -0.302
  442    HB   ILE  60           HB       ILE  60  -3.136  -2.478   1.589
  443   1HG1  ILE  60          2HG1      ILE  60  -3.995  -4.154   3.349
  444   2HG1  ILE  60          1HG1      ILE  60  -4.341  -2.449   3.601
  445   1HG2  ILE  60          1HG2      ILE  60  -4.552  -1.476   0.117
  446   2HG2  ILE  60          2HG2      ILE  60  -5.578  -1.470   1.551
  447   3HG2  ILE  60          3HG2      ILE  60  -5.804  -2.702   0.311
  448   1HD1  ILE  60          1HD1      ILE  60  -6.445  -3.740   2.106
  449   2HD1  ILE  60          2HD1      ILE  60  -6.524  -2.822   3.610
  450   3HD1  ILE  60          3HD1      ILE  60  -6.148  -4.543   3.648
  451    H    GLU  61           H        GLU  61  -2.169  -5.402  -0.767
  452    HA   GLU  61           HA       GLU  61  -0.403  -6.210   1.436
  453   1HB   GLU  61          2HB       GLU  61  -1.158  -8.051   0.050
  454   2HB   GLU  61          1HB       GLU  61  -0.621  -7.222  -1.404
  455   1HG   GLU  61          2HG       GLU  61   1.661  -7.495  -0.823
  456   2HG   GLU  61          1HG       GLU  61   1.247  -8.039   0.801
  457    H    VAL  62           H        VAL  62   1.521  -5.290   1.689
  458    HA   VAL  62           HA       VAL  62   2.835  -4.000  -0.581
  459    HB   VAL  62           HB       VAL  62   2.413  -2.576   2.049
  460   1HG1  VAL  62          1HG1      VAL  62   3.413  -0.654   0.847
  461   2HG1  VAL  62          2HG1      VAL  62   3.770  -1.726  -0.506
  462   3HG1  VAL  62          3HG1      VAL  62   4.532  -1.999   1.061
  463   1HG2  VAL  62          1HG2      VAL  62   0.366  -2.237   1.131
  464   2HG2  VAL  62          2HG2      VAL  62   0.931  -2.531  -0.512
  465   3HG2  VAL  62          3HG2      VAL  62   1.238  -0.975   0.261
  466    H    ASP  63           H        ASP  63   4.855  -4.696  -0.665
  467    HA   ASP  63           HA       ASP  63   6.262  -5.273   1.854
  468   1HB   ASP  63          2HB       ASP  63   5.444  -7.242   0.193
  469   2HB   ASP  63          1HB       ASP  63   7.015  -6.880  -0.516
  470    H    LEU  64           H        LEU  64   8.089  -4.178   2.073
  471    HA   LEU  64           HA       LEU  64   9.223  -2.846  -0.276
  472   1HB   LEU  64          2HB       LEU  64   8.958  -2.205   2.541
  473   2HB   LEU  64          1HB       LEU  64  10.603  -1.978   1.983
  474    HG   LEU  64           HG       LEU  64   9.146  -0.749   0.006
  475   1HD1  LEU  64          1HD1      LEU  64   7.068  -0.497   0.816
  476   2HD1  LEU  64          2HD1      LEU  64   7.794   0.811   1.747
  477   3HD1  LEU  64          3HD1      LEU  64   7.571  -0.774   2.484
  478   1HD2  LEU  64          1HD2      LEU  64  10.303   1.097   0.632
  479   2HD2  LEU  64          2HD2      LEU  64  11.176  -0.087   1.604
  480   3HD2  LEU  64          3HD2      LEU  64   9.914   0.900   2.341
  481    H    LEU  65           H        LEU  65  10.670  -4.089  -1.289
  482    HA   LEU  65           HA       LEU  65  12.561  -5.275  -1.705
  483   1HB   LEU  65          2HB       LEU  65  13.720  -3.561  -0.459
  484   2HB   LEU  65          1HB       LEU  65  13.292  -4.321   1.062
  485    HG   LEU  65           HG       LEU  65  14.737  -6.200   0.598
  486   1HD1  LEU  65          1HD1      LEU  65  14.684  -5.082  -2.116
  487   2HD1  LEU  65          2HD1      LEU  65  14.878  -6.749  -1.574
  488   3HD1  LEU  65          3HD1      LEU  65  16.261  -5.656  -1.572
  489   1HD2  LEU  65          1HD2      LEU  65  15.852  -3.446   0.359
  490   2HD2  LEU  65          2HD2      LEU  65  16.933  -4.830   0.202
  491   3HD2  LEU  65          3HD2      LEU  65  15.993  -4.609   1.677
  492    H    LYS  66           H        LYS  66  12.359  -5.903   1.787
  493    HA   LYS  66           HA       LYS  66  11.661  -8.694   1.179
  494   1HB   LYS  66          2HB       LYS  66  14.149  -8.260   1.712
  495   2HB   LYS  66          1HB       LYS  66  13.606  -7.993   3.362
  496   1HG   LYS  66          2HG       LYS  66  13.413 -10.171   3.754
  497   2HG   LYS  66          1HG       LYS  66  12.530 -10.443   2.252
  498   1HD   LYS  66          2HD       LYS  66  14.340 -11.293   1.271
  499   2HD   LYS  66          1HD       LYS  66  15.300  -9.877   1.701
  500   1HE   LYS  66          2HE       LYS  66  16.256 -10.908   3.451
  501   2HE   LYS  66          1HE       LYS  66  14.750 -11.682   3.941
  502   1HZ   LYS  66          1HZ       LYS  66  16.748 -13.073   3.024
  503   2HZ   LYS  66          2HZ       LYS  66  16.091 -12.653   1.524
  504   3HZ   LYS  66          3HZ       LYS  66  15.154 -13.499   2.650
  505   1H    SER  67          1HT       SER  67  12.065   3.335  13.088
  506   2H    SER  67          2HT       SER  67  13.249   3.030  14.292
  507   3H    SER  67          3HT       SER  67  12.907   1.841  13.102
  508    HA   SER  67           HA       SER  67  14.305   4.398  12.828
  509   1HB   SER  67          2HB       SER  67  16.036   2.973  11.896
  510   2HB   SER  67          1HB       SER  67  15.516   2.297  13.438
  511    HG   SER  67           HG       SER  67  15.325   1.255  10.914
  512    H    ASN  68           H        ASN  68  13.591   5.623  11.212
  513    HA   ASN  68           HA       ASN  68  12.809   6.296   9.187
  514   1HB   ASN  68          2HB       ASN  68  14.344   3.823   8.580
  515   2HB   ASN  68          1HB       ASN  68  13.290   4.441   7.311
  516   1HD2  ASN  68          1HD2      ASN  68  15.176   6.166   9.750
  517   2HD2  ASN  68          2HD2      ASN  68  16.146   7.051   8.628
  518    H    PHE  69           H        PHE  69  11.024   4.862  10.963
  519    HA   PHE  69           HA       PHE  69   9.236   3.545   9.035
  520   1HB   PHE  69          2HB       PHE  69   9.883   2.199  11.013
  521   2HB   PHE  69          1HB       PHE  69   9.168   3.422  12.058
  522    HD1  PHE  69           1HD      PHE  69   6.671   3.930  11.718
  523    HD2  PHE  69           2HD      PHE  69   8.599   0.446  10.218
  524    HE1  PHE  69           1HE      PHE  69   4.490   2.805  11.537
  525    HE2  PHE  69           2HE      PHE  69   6.422  -0.686  10.034
  526    HZ   PHE  69           HZ       PHE  69   4.363   0.495  10.694
  527    H    LEU  70           H        LEU  70   7.815   4.934   8.201
  528    HA   LEU  70           HA       LEU  70   6.369   6.698  10.054
  529   1HB   LEU  70          2HB       LEU  70   8.063   7.994   8.789
  530   2HB   LEU  70          1HB       LEU  70   7.309   7.478   7.293
  531    HG   LEU  70           HG       LEU  70   5.389   8.793   7.669
  532   1HD1  LEU  70          1HD1      LEU  70   6.348   9.002  10.512
  533   2HD1  LEU  70          2HD1      LEU  70   4.839   8.313   9.915
  534   3HD1  LEU  70          3HD1      LEU  70   5.102  10.054   9.840
  535   1HD2  LEU  70          1HD2      LEU  70   6.328  11.061   8.186
  536   2HD2  LEU  70          2HD2      LEU  70   7.194  10.161   6.941
  537   3HD2  LEU  70          3HD2      LEU  70   7.854  10.267   8.574
  538    H    ASN  71           H        ASN  71   5.148   4.491   9.680
  539    HA   ASN  71           HA       ASN  71   3.598   4.377   7.253
  540   1HB   ASN  71          2HB       ASN  71   4.322   2.354   8.587
  541   2HB   ASN  71          1HB       ASN  71   3.133   2.821   9.800
  542   1HD2  ASN  71          1HD2      ASN  71   1.469   1.507   9.661
  543   2HD2  ASN  71          2HD2      ASN  71   0.686   1.007   8.205
  544    H    CYS  72           H        CYS  72   2.694   6.543   7.430
  545    HA   CYS  72           HA       CYS  72   0.927   7.243   9.542
  546   1HB   CYS  72          2HB       CYS  72   2.086   8.855   7.984
  547   2HB   CYS  72          1HB       CYS  72   0.940   8.372   6.739
  548    HG   CYS  72           HG       CYS  72  -0.165  10.399   7.725
  549    H    TYR  73           H        TYR  73  -1.077   6.582   9.902
  550    HA   TYR  73           HA       TYR  73  -2.691   5.628   7.637
  551   1HB   TYR  73          2HB       TYR  73  -3.644   4.041   9.590
  552   2HB   TYR  73          1HB       TYR  73  -2.343   3.556   8.511
  553    HD1  TYR  73           1HD      TYR  73  -0.644   2.431   9.570
  554    HD2  TYR  73           2HD      TYR  73  -2.606   5.579  11.653
  555    HE1  TYR  73           1HE      TYR  73   0.826   2.058  11.505
  556    HE2  TYR  73           2HE      TYR  73  -1.141   5.215  13.595
  557    HH   TYR  73           HH       TYR  73   1.670   3.466  13.477
  558    H    VAL  74           H        VAL  74  -4.888   6.047   7.741
  559    HA   VAL  74           HA       VAL  74  -5.748   7.768   9.975
  560    HB   VAL  74           HB       VAL  74  -6.727   8.009   7.132
  561   1HG1  VAL  74          1HG1      VAL  74  -7.338  10.336   8.113
  562   2HG1  VAL  74          2HG1      VAL  74  -7.195   9.518   9.670
  563   3HG1  VAL  74          3HG1      VAL  74  -8.360   8.945   8.476
  564   1HG2  VAL  74          1HG2      VAL  74  -5.294   9.909   6.853
  565   2HG2  VAL  74          2HG2      VAL  74  -4.299   8.540   7.351
  566   3HG2  VAL  74          3HG2      VAL  74  -4.728   9.790   8.519
  567    H    SER  75           H        SER  75  -7.958   7.695  10.559
  568    HA   SER  75           HA       SER  75  -9.954   6.725  11.012
  569   1HB   SER  75          2HB       SER  75 -10.842   6.688   8.912
  570   2HB   SER  75          1HB       SER  75  -9.451   5.857   8.220
  571    HG   SER  75           HG       SER  75 -11.312   4.528   8.265
  572    H    GLY  76           H        GLY  76  -8.660   3.901   9.298
  573   1HA   GLY  76          2HA       GLY  76  -7.370   2.461  11.150
  574   2HA   GLY  76          1HA       GLY  76  -9.029   2.324  11.714
  575    H    PHE  77           H        PHE  77  -7.885   0.020  11.174
  576    HA   PHE  77           HA       PHE  77  -9.474  -1.058   9.088
  577   1HB   PHE  77          2HB       PHE  77  -7.770  -1.774   7.543
  578   2HB   PHE  77          1HB       PHE  77  -7.645  -0.030   7.741
  579    HD1  PHE  77           1HD      PHE  77  -6.083   0.332  10.131
  580    HD2  PHE  77           2HD      PHE  77  -5.698  -2.622   7.093
  581    HE1  PHE  77           1HE      PHE  77  -3.698   0.094  10.671
  582    HE2  PHE  77           2HE      PHE  77  -3.308  -2.867   7.630
  583    HZ   PHE  77           HZ       PHE  77  -2.306  -1.506   9.420
  584    H    HIS  78           H        HIS  78  -9.234  -3.400   8.885
  585    HA   HIS  78           HA       HIS  78  -7.505  -4.942  10.448
  586   1HB   HIS  78          2HB       HIS  78  -8.482  -4.122  12.433
  587   2HB   HIS  78          1HB       HIS  78 -10.109  -4.200  11.772
  588    HD1  HIS  78           1HD      HIS  78 -11.185  -5.771  13.402
  589    HD2  HIS  78           2HD      HIS  78  -7.608  -7.250  11.893
  590    HE1  HIS  78           1HE      HIS  78 -11.037  -8.141  14.226
  591    HE2  HIS  78           2HE      HIS  78  -8.909  -9.045  13.226
  592    HA   PRO  79           HA       PRO  79 -11.347  -7.730   9.146
  593   1HB   PRO  79          2HB       PRO  79 -13.009  -6.300   7.406
  594   2HB   PRO  79          1HB       PRO  79 -13.382  -6.736   9.076
  595   1HG   PRO  79          2HG       PRO  79 -12.347  -4.167   7.971
  596   2HG   PRO  79          1HG       PRO  79 -13.489  -4.444   9.300
  597   1HD   PRO  79          2HD       PRO  79 -10.954  -3.751   9.776
  598   2HD   PRO  79          1HD       PRO  79 -11.796  -4.915  10.820
  599    H    SER  80           H        SER  80 -10.116  -5.161   7.051
  600    HA   SER  80           HA       SER  80 -10.121  -6.782   4.690
  601   1HB   SER  80          2HB       SER  80  -9.158  -4.931   3.588
  602   2HB   SER  80          1HB       SER  80 -10.193  -4.213   4.821
  603    HG   SER  80           HG       SER  80  -8.203  -3.203   4.889
  604    H    ASP  81           H        ASP  81  -8.201  -7.439   3.510
  605    HA   ASP  81           HA       ASP  81  -6.297  -8.722   5.238
  606   1HB   ASP  81          2HB       ASP  81  -7.307  -9.308   2.764
  607   2HB   ASP  81          1HB       ASP  81  -5.709  -8.695   2.354
  608    H    ILE  82           H        ILE  82  -4.585  -7.717   6.059
  609    HA   ILE  82           HA       ILE  82  -3.325  -5.587   4.462
  610    HB   ILE  82           HB       ILE  82  -2.870  -4.339   6.329
  611   1HG1  ILE  82          2HG1      ILE  82  -1.634  -6.082   7.568
  612   2HG1  ILE  82          1HG1      ILE  82  -2.702  -5.166   8.623
  613   1HG2  ILE  82          1HG2      ILE  82  -5.385  -5.860   6.952
  614   2HG2  ILE  82          2HG2      ILE  82  -5.220  -4.297   6.154
  615   3HG2  ILE  82          3HG2      ILE  82  -4.862  -4.452   7.873
  616   1HD1  ILE  82          1HD1      ILE  82  -2.714  -7.563   9.115
  617   2HD1  ILE  82          2HD1      ILE  82  -3.313  -7.883   7.489
  618   3HD1  ILE  82          3HD1      ILE  82  -4.302  -6.972   8.628
  619    H    GLU  83           H        GLU  83  -1.094  -5.473   4.304
  620    HA   GLU  83           HA       GLU  83   0.573  -7.439   5.598
  621   1HB   GLU  83          2HB       GLU  83  -0.519  -8.485   3.470
  622   2HB   GLU  83          1HB       GLU  83   0.641  -7.491   2.602
  623   1HG   GLU  83          2HG       GLU  83   2.015  -8.851   4.682
  624   2HG   GLU  83          1HG       GLU  83   1.032 -10.020   3.802
  625    H    VAL  84           H        VAL  84   0.892  -4.923   6.087
  626    HA   VAL  84           HA       VAL  84   2.592  -3.571   4.192
  627    HB   VAL  84           HB       VAL  84   2.088  -2.826   7.074
  628   1HG1  VAL  84          1HG1      VAL  84   2.441  -0.503   5.794
  629   2HG1  VAL  84          2HG1      VAL  84   3.443  -1.542   4.783
  630   3HG1  VAL  84          3HG1      VAL  84   3.768  -1.417   6.512
  631   1HG2  VAL  84          1HG2      VAL  84   0.074  -1.984   6.567
  632   2HG2  VAL  84          2HG2      VAL  84   0.142  -3.049   5.164
  633   3HG2  VAL  84          3HG2      VAL  84   0.623  -1.360   5.011
  634    H    ASP  85           H        ASP  85   4.767  -3.468   4.171
  635    HA   ASP  85           HA       ASP  85   6.310  -4.359   6.465
  636   1HB   ASP  85          2HB       ASP  85   6.379  -5.761   3.791
  637   2HB   ASP  85          1HB       ASP  85   7.671  -5.902   4.980
  638    H    LEU  86           H        LEU  86   8.252  -3.356   6.617
  639    HA   LEU  86           HA       LEU  86   9.148  -1.775   4.304
  640   1HB   LEU  86          2HB       LEU  86  10.067  -0.378   6.516
  641   2HB   LEU  86          1HB       LEU  86   8.761   0.091   5.449
  642    HG   LEU  86           HG       LEU  86   8.116   0.272   7.797
  643   1HD1  LEU  86          1HD1      LEU  86   6.004  -0.384   7.408
  644   2HD1  LEU  86          2HD1      LEU  86   6.478  -2.030   6.989
  645   3HD1  LEU  86          3HD1      LEU  86   6.621  -0.741   5.795
  646   1HD2  LEU  86          1HD2      LEU  86   9.341  -2.344   7.946
  647   2HD2  LEU  86          2HD2      LEU  86   7.717  -2.344   8.632
  648   3HD2  LEU  86          3HD2      LEU  86   8.928  -1.215   9.235
  649    H    LEU  87           H        LEU  87  10.764  -3.157   3.680
  650    HA   LEU  87           HA       LEU  87  12.823  -4.124   3.662
  651   1HB   LEU  87          2HB       LEU  87  13.159  -1.995   5.742
  652   2HB   LEU  87          1HB       LEU  87  14.455  -3.137   5.443
  653    HG   LEU  87           HG       LEU  87  14.700  -0.981   4.222
  654   1HD1  LEU  87          1HD1      LEU  87  14.629  -3.641   2.917
  655   2HD1  LEU  87          2HD1      LEU  87  15.986  -2.551   3.201
  656   3HD1  LEU  87          3HD1      LEU  87  14.854  -2.228   1.886
  657   1HD2  LEU  87          1HD2      LEU  87  12.126  -0.944   3.788
  658   2HD2  LEU  87          2HD2      LEU  87  12.554  -1.876   2.353
  659   3HD2  LEU  87          3HD2      LEU  87  13.237  -0.268   2.595
  660    H    LYS  88           H        LYS  88  12.432  -6.206   4.209
  661    HA   LYS  88           HA       LYS  88  12.495  -8.123   5.420
  662   1HB   LYS  88          2HB       LYS  88  14.225  -8.264   6.846
  663   2HB   LYS  88          1HB       LYS  88  14.507  -6.574   6.462
  664   1HG   LYS  88          2HG       LYS  88  12.882  -6.117   8.434
  665   2HG   LYS  88          1HG       LYS  88  13.257  -7.779   8.892
  666   1HD   LYS  88          2HD       LYS  88  15.536  -7.299   9.190
  667   2HD   LYS  88          1HD       LYS  88  15.418  -5.778   8.302
  668   1HE   LYS  88          2HE       LYS  88  13.654  -5.896  10.622
  669   2HE   LYS  88          1HE       LYS  88  15.358  -6.064  11.040
  670   1HZ   LYS  88          1HZ       LYS  88  15.705  -4.029   9.594
  671   2HZ   LYS  88          2HZ       LYS  88  14.934  -3.781  11.080
  672   3HZ   LYS  88          3HZ       LYS  88  14.027  -3.817   9.654
  Start of MODEL    6
    1   1H    SER   1          1HT       SER   1  14.943   1.574  -3.478
    2   2H    SER   1          2HT       SER   1  13.931   0.187  -3.530
    3   3H    SER   1          3HT       SER   1  13.325   1.671  -2.920
    4    HA   SER   1           HA       SER   1  14.281   1.307  -5.673
    5   1HB   SER   1          2HB       SER   1  11.995   0.181  -4.458
    6   2HB   SER   1          1HB       SER   1  11.419   1.557  -5.399
    7    HG   SER   1           HG       SER   1  12.756   0.626  -7.149
    8    H    ASN   2           H        ASN   2  12.247   2.866  -6.761
    9    HA   ASN   2           HA       ASN   2  12.036   5.371  -5.380
   10   1HB   ASN   2          2HB       ASN   2  14.359   5.531  -6.155
   11   2HB   ASN   2          1HB       ASN   2  13.838   5.209  -7.807
   12   1HD2  ASN   2          1HD2      ASN   2  12.792   6.807  -8.967
   13   2HD2  ASN   2          2HD2      ASN   2  12.768   8.458  -8.456
   14    H    PHE   3           H        PHE   3   9.863   5.357  -5.784
   15    HA   PHE   3           HA       PHE   3   9.015   6.255  -8.346
   16   1HB   PHE   3          2HB       PHE   3   7.804   4.448  -9.168
   17   2HB   PHE   3          1HB       PHE   3   9.259   3.684  -8.550
   18    HD1  PHE   3           1HD      PHE   3   8.176   4.041  -5.557
   19    HD2  PHE   3           2HD      PHE   3   6.657   2.312  -9.139
   20    HE1  PHE   3           1HE      PHE   3   6.785   2.510  -4.227
   21    HE2  PHE   3           2HE      PHE   3   5.267   0.778  -7.812
   22    HZ   PHE   3           HZ       PHE   3   5.328   0.876  -5.353
   23    H    LEU   4           H        LEU   4   6.349   5.864  -8.289
   24    HA   LEU   4           HA       LEU   4   5.527   6.864  -5.646
   25   1HB   LEU   4          2HB       LEU   4   4.195   8.537  -6.585
   26   2HB   LEU   4          1HB       LEU   4   5.693   8.607  -7.491
   27    HG   LEU   4           HG       LEU   4   3.116   7.349  -8.435
   28   1HD1  LEU   4          1HD1      LEU   4   4.383   9.617  -9.836
   29   2HD1  LEU   4          2HD1      LEU   4   3.611   9.972  -8.290
   30   3HD1  LEU   4          3HD1      LEU   4   2.677   9.237  -9.594
   31   1HD2  LEU   4          1HD2      LEU   4   5.887   7.367  -9.523
   32   2HD2  LEU   4          2HD2      LEU   4   4.532   7.476 -10.647
   33   3HD2  LEU   4          3HD2      LEU   4   4.667   6.094  -9.561
   34    H    ASN   5           H        ASN   5   4.107   5.595  -4.707
   35    HA   ASN   5           HA       ASN   5   2.183   4.125  -6.382
   36   1HB   ASN   5          2HB       ASN   5   4.203   2.945  -4.948
   37   2HB   ASN   5          1HB       ASN   5   2.860   2.863  -3.814
   38   1HD2  ASN   5          1HD2      ASN   5   0.807   2.000  -4.718
   39   2HD2  ASN   5          2HD2      ASN   5   0.916   0.682  -5.829
   40    H    CYS   6           H        CYS   6   1.173   6.369  -5.716
   41    HA   CYS   6           HA       CYS   6  -0.544   5.790  -3.417
   42   1HB   CYS   6          2HB       CYS   6  -0.394   8.107  -2.632
   43   2HB   CYS   6          1HB       CYS   6   1.185   7.330  -2.614
   44    HG   CYS   6           HG       CYS   6   0.386   9.367  -4.827
   45    H    TYR   7           H        TYR   7  -2.630   6.571  -3.539
   46    HA   TYR   7           HA       TYR   7  -3.420   8.229  -5.782
   47   1HB   TYR   7          2HB       TYR   7  -5.211   6.556  -6.440
   48   2HB   TYR   7          1HB       TYR   7  -3.563   6.144  -6.898
   49    HD1  TYR   7           1HD      TYR   7  -2.293   4.692  -5.010
   50    HD2  TYR   7           2HD      TYR   7  -6.507   4.868  -5.575
   51    HE1  TYR   7           1HE      TYR   7  -2.528   2.509  -3.904
   52    HE2  TYR   7           2HE      TYR   7  -6.751   2.685  -4.468
   53    HH   TYR   7           HH       TYR   7  -4.057   0.671  -3.769
   54    H    VAL   8           H        VAL   8  -5.058   9.530  -5.248
   55    HA   VAL   8           HA       VAL   8  -6.364   9.072  -2.665
   56    HB   VAL   8           HB       VAL   8  -5.229  11.222  -2.932
   57   1HG1  VAL   8          1HG1      VAL   8  -7.119  12.444  -4.757
   58   2HG1  VAL   8          2HG1      VAL   8  -6.204  11.146  -5.523
   59   3HG1  VAL   8          3HG1      VAL   8  -5.355  12.489  -4.758
   60   1HG2  VAL   8          1HG2      VAL   8  -7.066  11.245  -1.433
   61   2HG2  VAL   8          2HG2      VAL   8  -8.232  11.319  -2.754
   62   3HG2  VAL   8          3HG2      VAL   8  -7.199  12.706  -2.411
   63    H    SER   9           H        SER   9  -8.095   7.781  -3.025
   64    HA   SER   9           HA       SER   9 -10.154   7.115  -3.715
   65   1HB   SER   9          2HB       SER   9 -10.894   9.755  -4.829
   66   2HB   SER   9          1HB       SER   9 -11.749   8.738  -3.669
   67    HG   SER   9           HG       SER   9 -10.695   9.659  -2.056
   68    H    GLY  10           H        GLY  10 -10.007   5.745  -5.389
   69   1HA   GLY  10          2HA       GLY  10 -10.895   6.127  -7.878
   70   2HA   GLY  10          1HA       GLY  10  -9.246   6.716  -8.024
   71    H    PHE  11           H        PHE  11 -10.889   4.259  -8.979
   72    HA   PHE  11           HA       PHE  11  -8.660   2.444  -8.886
   73   1HB   PHE  11          2HB       PHE  11 -10.195   2.127  -6.759
   74   2HB   PHE  11          1HB       PHE  11 -11.211   1.244  -7.895
   75    HD1  PHE  11           1HD      PHE  11  -7.810   1.392  -6.444
   76    HD2  PHE  11           2HD      PHE  11 -10.689  -0.948  -8.525
   77    HE1  PHE  11           1HE      PHE  11  -6.400  -0.602  -6.143
   78    HE2  PHE  11           2HE      PHE  11  -9.285  -2.947  -8.228
   79    HZ   PHE  11           HZ       PHE  11  -7.138  -2.776  -7.034
   80    H    HIS  12           H        HIS  12  -8.655   2.529 -11.106
   81    HA   HIS  12           HA       HIS  12 -11.051   2.004 -12.621
   82   1HB   HIS  12          2HB       HIS  12  -9.080   3.525 -13.299
   83   2HB   HIS  12          1HB       HIS  12  -8.265   2.034 -13.755
   84    HD1  HIS  12           1HD      HIS  12  -9.686   4.560 -15.476
   85    HD2  HIS  12           2HD      HIS  12 -10.637   0.516 -15.342
   86    HE1  HIS  12           1HE      HIS  12 -10.926   4.088 -17.613
   87    HE2  HIS  12           2HE      HIS  12 -11.408   1.617 -17.551
   88    HA   PRO  13           HA       PRO  13  -8.825  -2.133 -13.488
   89   1HB   PRO  13          2HB       PRO  13  -6.578  -2.785 -12.200
   90   2HB   PRO  13          1HB       PRO  13  -6.550  -1.697 -13.593
   91   1HG   PRO  13          2HG       PRO  13  -6.410  -1.047 -10.679
   92   2HG   PRO  13          1HG       PRO  13  -5.503  -0.342 -12.028
   93   1HD   PRO  13          2HD       PRO  13  -7.739   0.793 -10.869
   94   2HD   PRO  13          1HD       PRO  13  -7.162   1.147 -12.507
   95    H    SER  14           H        SER  14  -8.240  -4.256 -12.200
   96    HA   SER  14           HA       SER  14  -9.800  -4.213  -9.699
   97   1HB   SER  14          2HB       SER  14  -9.796  -6.065 -12.021
   98   2HB   SER  14          1HB       SER  14  -9.963  -6.799 -10.427
   99    HG   SER  14           HG       SER  14 -11.719  -5.201 -11.838
  100    H    ASP  15           H        ASP  15  -7.373  -6.247 -11.349
  101    HA   ASP  15           HA       ASP  15  -6.085  -6.658  -8.733
  102   1HB   ASP  15          2HB       ASP  15  -5.159  -8.740  -9.687
  103   2HB   ASP  15          1HB       ASP  15  -6.920  -8.736  -9.700
  104    H    ILE  16           H        ILE  16  -4.496  -5.192  -8.579
  105    HA   ILE  16           HA       ILE  16  -2.651  -4.925 -10.865
  106    HB   ILE  16           HB       ILE  16  -2.044  -2.694  -9.733
  107   1HG1  ILE  16          2HG1      ILE  16  -4.853  -2.797  -8.686
  108   2HG1  ILE  16          1HG1      ILE  16  -3.531  -3.410  -7.699
  109   1HG2  ILE  16          1HG2      ILE  16  -3.436  -1.584 -11.185
  110   2HG2  ILE  16          2HG2      ILE  16  -4.810  -2.637 -10.846
  111   3HG2  ILE  16          3HG2      ILE  16  -3.482  -3.216 -11.852
  112   1HD1  ILE  16          1HD1      ILE  16  -3.891  -1.182  -7.036
  113   2HD1  ILE  16          2HD1      ILE  16  -3.948  -0.615  -8.705
  114   3HD1  ILE  16          3HD1      ILE  16  -2.423  -1.169  -8.014
  115    H    GLU  17           H        GLU  17  -0.735  -5.809 -10.531
  116    HA   GLU  17           HA       GLU  17   0.309  -5.920  -7.777
  117   1HB   GLU  17          2HB       GLU  17   1.607  -7.939  -8.611
  118   2HB   GLU  17          1HB       GLU  17  -0.127  -8.155  -8.410
  119   1HG   GLU  17          2HG       GLU  17   1.020  -7.403 -11.066
  120   2HG   GLU  17          1HG       GLU  17   1.016  -9.080 -10.521
  121    H    VAL  18           H        VAL  18   1.392  -3.930  -8.009
  122    HA   VAL  18           HA       VAL  18   3.189  -3.387 -10.141
  123    HB   VAL  18           HB       VAL  18   3.252  -2.160  -7.384
  124   1HG1  VAL  18          1HG1      VAL  18   5.132  -1.355  -8.414
  125   2HG1  VAL  18          2HG1      VAL  18   3.947  -0.167  -8.959
  126   3HG1  VAL  18          3HG1      VAL  18   4.435  -1.481 -10.029
  127   1HG2  VAL  18          1HG2      VAL  18   1.869  -0.354  -8.713
  128   2HG2  VAL  18          2HG2      VAL  18   1.072  -1.719  -7.930
  129   3HG2  VAL  18          3HG2      VAL  18   1.383  -1.756  -9.666
  130    H    ASP  19           H        ASP  19   5.447  -3.437 -10.177
  131    HA   ASP  19           HA       ASP  19   6.860  -4.703  -7.972
  132   1HB   ASP  19          2HB       ASP  19   6.085  -6.590  -9.366
  133   2HB   ASP  19          1HB       ASP  19   6.896  -5.881 -10.760
  134    H    LEU  20           H        LEU  20   9.102  -4.361  -8.000
  135    HA   LEU  20           HA       LEU  20  10.199  -2.742 -10.172
  136   1HB   LEU  20          2HB       LEU  20   9.280  -1.556  -7.860
  137   2HB   LEU  20          1HB       LEU  20  10.991  -1.755  -7.535
  138    HG   LEU  20           HG       LEU  20  10.679   0.421  -8.456
  139   1HD1  LEU  20          1HD1      LEU  20  11.919   0.200 -10.657
  140   2HD1  LEU  20          2HD1      LEU  20  11.845  -1.543 -10.406
  141   3HD1  LEU  20          3HD1      LEU  20  12.686  -0.520  -9.242
  142   1HD2  LEU  20          1HD2      LEU  20   8.478  -0.482  -9.647
  143   2HD2  LEU  20          2HD2      LEU  20   9.574  -0.551 -11.027
  144   3HD2  LEU  20          3HD2      LEU  20   9.314   0.975 -10.184
  145    H    LEU  21           H        LEU  21  11.933  -3.829 -10.806
  146    HA   LEU  21           HA       LEU  21  13.265  -5.791  -9.328
  147   1HB   LEU  21          2HB       LEU  21  13.328  -5.578 -11.792
  148   2HB   LEU  21          1HB       LEU  21  14.347  -4.161 -11.626
  149    HG   LEU  21           HG       LEU  21  15.846  -5.900 -10.249
  150   1HD1  LEU  21          1HD1      LEU  21  14.069  -7.528 -11.997
  151   2HD1  LEU  21          2HD1      LEU  21  14.715  -7.886 -10.396
  152   3HD1  LEU  21          3HD1      LEU  21  15.759  -8.002 -11.813
  153   1HD2  LEU  21          1HD2      LEU  21  17.299  -5.782 -12.002
  154   2HD2  LEU  21          2HD2      LEU  21  16.173  -4.510 -12.476
  155   3HD2  LEU  21          3HD2      LEU  21  16.052  -6.111 -13.205
  156    H    LYS  22           H        LYS  22  14.709  -2.689 -10.336
  157    HA   LYS  22           HA       LYS  22  16.544  -2.835  -8.082
  158   1HB   LYS  22          2HB       LYS  22  17.686  -0.959  -9.131
  159   2HB   LYS  22          1HB       LYS  22  17.404  -2.234 -10.309
  160   1HG   LYS  22          2HG       LYS  22  15.312  -0.173 -10.161
  161   2HG   LYS  22          1HG       LYS  22  16.887   0.375 -10.740
  162   1HD   LYS  22          2HD       LYS  22  16.767  -0.857 -12.644
  163   2HD   LYS  22          1HD       LYS  22  15.859  -2.159 -11.872
  164   1HE   LYS  22          2HE       LYS  22  14.622  -0.793 -13.613
  165   2HE   LYS  22          1HE       LYS  22  13.825  -0.985 -12.053
  166   1HZ   LYS  22          1HZ       LYS  22  15.509   1.372 -12.601
  167   2HZ   LYS  22          2HZ       LYS  22  14.266   1.196 -11.469
  168   3HZ   LYS  22          3HZ       LYS  22  13.898   1.328 -13.114
  169   1H    SER  23          1HT       SER  23  17.113   8.759  -4.385
  170   2H    SER  23          2HT       SER  23  15.818   8.211  -5.369
  171   3H    SER  23          3HT       SER  23  17.263   7.292  -5.260
  172    HA   SER  23           HA       SER  23  15.763   6.196  -3.935
  173   1HB   SER  23          2HB       SER  23  17.662   7.995  -2.443
  174   2HB   SER  23          1HB       SER  23  16.676   6.812  -1.584
  175    HG   SER  23           HG       SER  23  17.806   5.218  -2.439
  176    H    ASN  24           H        ASN  24  13.608   6.661  -4.033
  177    HA   ASN  24           HA       ASN  24  12.507   8.219  -1.888
  178   1HB   ASN  24          2HB       ASN  24  13.005   9.934  -3.667
  179   2HB   ASN  24          1HB       ASN  24  11.850   9.101  -4.704
  180   1HD2  ASN  24          1HD2      ASN  24  10.841  11.250  -4.673
  181   2HD2  ASN  24          2HD2      ASN  24   9.734  11.617  -3.400
  182    H    PHE  25           H        PHE  25  11.159   6.694  -1.165
  183    HA   PHE  25           HA       PHE  25   9.535   5.200  -3.097
  184   1HB   PHE  25          2HB       PHE  25  10.748   3.765  -1.598
  185   2HB   PHE  25          1HB       PHE  25  10.199   4.674  -0.195
  186    HD1  PHE  25           1HD      PHE  25   8.288   4.025   0.949
  187    HD2  PHE  25           2HD      PHE  25   8.962   2.562  -2.990
  188    HE1  PHE  25           1HE      PHE  25   6.364   2.511   1.186
  189    HE2  PHE  25           2HE      PHE  25   7.038   1.045  -2.759
  190    HZ   PHE  25           HZ       PHE  25   5.736   1.019  -0.670
  191    H    LEU  26           H        LEU  26   7.489   5.751  -3.398
  192    HA   LEU  26           HA       LEU  26   6.104   7.231  -1.256
  193   1HB   LEU  26          2HB       LEU  26   6.395   7.755  -4.104
  194   2HB   LEU  26          1HB       LEU  26   4.713   7.724  -3.610
  195    HG   LEU  26           HG       LEU  26   5.640   9.320  -1.689
  196   1HD1  LEU  26          1HD1      LEU  26   7.305  10.403  -3.866
  197   2HD1  LEU  26          2HD1      LEU  26   7.948   8.994  -3.023
  198   3HD1  LEU  26          3HD1      LEU  26   7.543  10.453  -2.119
  199   1HD2  LEU  26          1HD2      LEU  26   4.878  10.037  -4.508
  200   2HD2  LEU  26          2HD2      LEU  26   5.080  11.241  -3.235
  201   3HD2  LEU  26          3HD2      LEU  26   3.849   9.988  -3.076
  202    H    ASN  27           H        ASN  27   4.459   6.197  -0.353
  203    HA   ASN  27           HA       ASN  27   2.742   4.472  -1.947
  204   1HB   ASN  27          2HB       ASN  27   4.460   2.931  -1.127
  205   2HB   ASN  27          1HB       ASN  27   4.184   3.479   0.524
  206   1HD2  ASN  27          1HD2      ASN  27   1.915   2.671  -2.073
  207   2HD2  ASN  27          2HD2      ASN  27   1.091   1.429  -1.201
  208    H    CYS  28           H        CYS  28   0.914   5.649  -1.590
  209    HA   CYS  28           HA       CYS  28  -0.161   5.629   1.111
  210   1HB   CYS  28          2HB       CYS  28  -0.070   8.265  -0.344
  211   2HB   CYS  28          1HB       CYS  28  -0.509   7.962   1.330
  212    HG   CYS  28           HG       CYS  28   2.421   7.867   0.286
  213    H    TYR  29           H        TYR  29  -2.319   5.338   1.122
  214    HA   TYR  29           HA       TYR  29  -3.815   6.001  -1.318
  215   1HB   TYR  29          2HB       TYR  29  -4.671   3.915  -1.613
  216   2HB   TYR  29          1HB       TYR  29  -3.191   3.436  -0.800
  217    HD1  TYR  29           1HD      TYR  29  -3.390   1.880   0.886
  218    HD2  TYR  29           2HD      TYR  29  -6.689   4.448   0.094
  219    HE1  TYR  29           1HE      TYR  29  -4.718   0.691   2.582
  220    HE2  TYR  29           2HE      TYR  29  -8.021   3.271   1.791
  221    HH   TYR  29           HH       TYR  29  -7.418   1.855   3.948
  222    H    VAL  30           H        VAL  30  -5.636   7.115  -0.979
  223    HA   VAL  30           HA       VAL  30  -6.745   7.154   1.751
  224    HB   VAL  30           HB       VAL  30  -6.508   9.563  -0.054
  225   1HG1  VAL  30          1HG1      VAL  30  -8.128   9.029   2.224
  226   2HG1  VAL  30          2HG1      VAL  30  -7.993  10.518   1.288
  227   3HG1  VAL  30          3HG1      VAL  30  -6.925  10.242   2.664
  228   1HG2  VAL  30          1HG2      VAL  30  -4.964  10.224   1.999
  229   2HG2  VAL  30          2HG2      VAL  30  -4.334   9.362   0.595
  230   3HG2  VAL  30          3HG2      VAL  30  -4.738   8.476   2.066
  231    H    SER  31           H        SER  31  -8.778   6.497   1.786
  232    HA   SER  31           HA       SER  31 -10.883   5.926   1.122
  233   1HB   SER  31          2HB       SER  31 -10.777   8.555  -0.367
  234   2HB   SER  31          1HB       SER  31 -12.214   7.732   0.239
  235    HG   SER  31           HG       SER  31 -11.416   8.069   2.356
  236    H    GLY  32           H        GLY  32 -12.436   5.957  -0.940
  237   1HA   GLY  32          2HA       GLY  32 -12.830   4.811  -2.899
  238   2HA   GLY  32          1HA       GLY  32 -11.588   5.876  -3.536
  239    H    PHE  33           H        PHE  33 -12.344   2.682  -2.433
  240    HA   PHE  33           HA       PHE  33  -9.735   1.771  -3.441
  241   1HB   PHE  33          2HB       PHE  33 -10.516   1.658  -0.783
  242   2HB   PHE  33          1HB       PHE  33 -10.855   0.037  -1.382
  243    HD1  PHE  33           1HD      PHE  33  -8.137   2.563  -1.835
  244    HD2  PHE  33           2HD      PHE  33  -9.195  -1.469  -0.972
  245    HE1  PHE  33           1HE      PHE  33  -5.753   1.988  -1.624
  246    HE2  PHE  33           2HE      PHE  33  -6.815  -2.051  -0.759
  247    HZ   PHE  33           HZ       PHE  33  -5.089  -0.324  -1.084
  248    H    HIS  34           H        HIS  34 -13.086   0.866  -2.709
  249    HA   HIS  34           HA       HIS  34 -14.542  -0.541  -3.742
  250   1HB   HIS  34          2HB       HIS  34 -12.554  -0.330  -6.016
  251   2HB   HIS  34          1HB       HIS  34 -14.142  -1.079  -6.144
  252    HD1  HIS  34           1HD      HIS  34 -15.440   0.490  -7.560
  253    HD2  HIS  34           2HD      HIS  34 -13.308   2.468  -4.593
  254    HE1  HIS  34           1HE      HIS  34 -16.140   2.900  -7.723
  255    HE2  HIS  34           2HE      HIS  34 -14.762   4.094  -5.983
  256    HA   PRO  35           HA       PRO  35 -13.138  -4.550  -2.480
  257   1HB   PRO  35          2HB       PRO  35 -15.145  -5.512  -4.464
  258   2HB   PRO  35          1HB       PRO  35 -14.940  -5.957  -2.766
  259   1HG   PRO  35          2HG       PRO  35 -16.908  -4.329  -3.510
  260   2HG   PRO  35          1HG       PRO  35 -16.022  -4.054  -1.998
  261   1HD   PRO  35          2HD       PRO  35 -15.824  -2.612  -4.604
  262   2HD   PRO  35          1HD       PRO  35 -15.668  -1.986  -2.949
  263    H    SER  36           H        SER  36 -11.072  -4.512  -3.443
  264    HA   SER  36           HA       SER  36 -10.853  -6.194  -5.805
  265   1HB   SER  36          2HB       SER  36  -9.320  -3.601  -5.757
  266   2HB   SER  36          1HB       SER  36  -9.578  -4.699  -7.111
  267    HG   SER  36           HG       SER  36 -11.566  -3.117  -5.843
  268    H    ASP  37           H        ASP  37  -8.153  -5.941  -6.282
  269    HA   ASP  37           HA       ASP  37  -6.821  -6.384  -3.715
  270   1HB   ASP  37          2HB       ASP  37  -7.596  -8.595  -4.478
  271   2HB   ASP  37          1HB       ASP  37  -6.747  -8.362  -6.003
  272    H    ILE  38           H        ILE  38  -4.655  -5.906  -3.695
  273    HA   ILE  38           HA       ILE  38  -3.257  -5.362  -6.172
  274    HB   ILE  38           HB       ILE  38  -2.819  -3.108  -5.899
  275   1HG1  ILE  38          2HG1      ILE  38  -3.827  -2.120  -3.531
  276   2HG1  ILE  38          1HG1      ILE  38  -3.163  -3.674  -3.041
  277   1HG2  ILE  38          1HG2      ILE  38  -5.617  -3.438  -4.831
  278   2HG2  ILE  38          2HG2      ILE  38  -5.142  -3.435  -6.529
  279   3HG2  ILE  38          3HG2      ILE  38  -4.960  -1.973  -5.559
  280   1HD1  ILE  38          1HD1      ILE  38  -1.796  -1.242  -3.998
  281   2HD1  ILE  38          2HD1      ILE  38  -1.109  -2.792  -4.482
  282   3HD1  ILE  38          3HD1      ILE  38  -1.313  -2.413  -2.771
  283    H    GLU  39           H        GLU  39  -1.001  -5.361  -5.951
  284    HA   GLU  39           HA       GLU  39   0.087  -5.733  -3.265
  285   1HB   GLU  39          2HB       GLU  39  -0.454  -7.992  -4.092
  286   2HB   GLU  39          1HB       GLU  39   0.542  -7.704  -5.512
  287   1HG   GLU  39          2HG       GLU  39   2.342  -8.381  -4.429
  288   2HG   GLU  39          1HG       GLU  39   2.087  -7.163  -3.181
  289    H    VAL  40           H        VAL  40   1.967  -4.717  -3.006
  290    HA   VAL  40           HA       VAL  40   3.368  -3.786  -5.425
  291    HB   VAL  40           HB       VAL  40   3.482  -2.577  -2.658
  292   1HG1  VAL  40          1HG1      VAL  40   5.499  -2.100  -3.809
  293   2HG1  VAL  40          2HG1      VAL  40   4.496  -0.656  -3.942
  294   3HG1  VAL  40          3HG1      VAL  40   4.642  -1.757  -5.312
  295   1HG2  VAL  40          1HG2      VAL  40   2.137  -0.750  -3.615
  296   2HG2  VAL  40          2HG2      VAL  40   1.267  -2.285  -3.608
  297   3HG2  VAL  40          3HG2      VAL  40   1.968  -1.674  -5.108
  298    H    ASP  41           H        ASP  41   5.247  -4.711  -5.837
  299    HA   ASP  41           HA       ASP  41   6.789  -5.837  -3.592
  300   1HB   ASP  41          2HB       ASP  41   5.756  -7.455  -5.308
  301   2HB   ASP  41          1HB       ASP  41   6.967  -6.838  -6.427
  302    H    LEU  42           H        LEU  42   8.120  -4.092  -3.238
  303    HA   LEU  42           HA       LEU  42   9.800  -3.233  -5.498
  304   1HB   LEU  42          2HB       LEU  42   8.628  -1.825  -3.194
  305   2HB   LEU  42          1HB       LEU  42  10.298  -1.414  -3.528
  306    HG   LEU  42           HG       LEU  42   9.462  -1.057  -5.969
  307   1HD1  LEU  42          1HD1      LEU  42   6.883  -0.455  -4.571
  308   2HD1  LEU  42          2HD1      LEU  42   7.182  -2.038  -5.290
  309   3HD1  LEU  42          3HD1      LEU  42   7.209  -0.591  -6.299
  310   1HD2  LEU  42          1HD2      LEU  42  10.107   0.611  -4.003
  311   2HD2  LEU  42          2HD2      LEU  42   8.405   1.038  -4.161
  312   3HD2  LEU  42          3HD2      LEU  42   9.480   1.176  -5.550
  313    H    LEU  43           H        LEU  43  11.769  -4.074  -5.529
  314    HA   LEU  43           HA       LEU  43  12.905  -5.218  -3.109
  315   1HB   LEU  43          2HB       LEU  43  13.039  -5.823  -5.855
  316   2HB   LEU  43          1HB       LEU  43  14.658  -5.335  -5.392
  317    HG   LEU  43           HG       LEU  43  14.394  -7.750  -5.215
  318   1HD1  LEU  43          1HD1      LEU  43  14.457  -6.897  -2.372
  319   2HD1  LEU  43          2HD1      LEU  43  15.657  -6.218  -3.472
  320   3HD1  LEU  43          3HD1      LEU  43  15.545  -7.965  -3.260
  321   1HD2  LEU  43          1HD2      LEU  43  11.959  -7.742  -4.780
  322   2HD2  LEU  43          2HD2      LEU  43  12.282  -7.177  -3.141
  323   3HD2  LEU  43          3HD2      LEU  43  12.859  -8.762  -3.656
  324    H    LYS  44           H        LYS  44  14.265  -4.153  -1.843
  325    HA   LYS  44           HA       LYS  44  15.310  -1.587  -2.651
  326   1HB   LYS  44          2HB       LYS  44  14.489  -2.575  -0.262
  327   2HB   LYS  44          1HB       LYS  44  16.230  -2.776  -0.108
  328   1HG   LYS  44          2HG       LYS  44  16.629  -0.536  -0.073
  329   2HG   LYS  44          1HG       LYS  44  15.221  -0.156  -1.065
  330   1HD   LYS  44          2HD       LYS  44  13.823  -0.880   0.943
  331   2HD   LYS  44          1HD       LYS  44  15.324  -0.809   1.868
  332   1HE   LYS  44          2HE       LYS  44  13.904   1.429   0.447
  333   2HE   LYS  44          1HE       LYS  44  14.260   1.282   2.168
  334   1HZ   LYS  44          1HZ       LYS  44  15.957   2.180  -0.005
  335   2HZ   LYS  44          2HZ       LYS  44  16.712   1.177   1.129
  336   3HZ   LYS  44          3HZ       LYS  44  15.971   2.612   1.632
  337   1H    SER  45          1HT       SER  45  14.974   5.216   2.605
  338   2H    SER  45          2HT       SER  45  16.102   6.509   2.585
  339   3H    SER  45          3HT       SER  45  16.542   4.974   1.954
  340    HA   SER  45           HA       SER  45  15.979   6.762   0.327
  341   1HB   SER  45          2HB       SER  45  15.037   3.951   0.481
  342   2HB   SER  45          1HB       SER  45  14.360   4.931  -0.820
  343    HG   SER  45           HG       SER  45  16.194   4.118  -1.662
  344    H    ASN  46           H        ASN  46  14.280   7.315   2.726
  345    HA   ASN  46           HA       ASN  46  12.339   8.389   3.223
  346   1HB   ASN  46          2HB       ASN  46  12.419   8.824   0.237
  347   2HB   ASN  46          1HB       ASN  46  11.177   9.531   1.268
  348   1HD2  ASN  46          1HD2      ASN  46  13.450  10.640  -0.375
  349   2HD2  ASN  46          2HD2      ASN  46  14.279  11.700   0.709
  350    H    PHE  47           H        PHE  47  11.494   6.299   3.884
  351    HA   PHE  47           HA       PHE  47   9.722   4.941   2.025
  352   1HB   PHE  47          2HB       PHE  47  11.022   3.517   3.460
  353   2HB   PHE  47          1HB       PHE  47  10.491   4.385   4.894
  354    HD1  PHE  47           1HD      PHE  47   8.176   4.130   5.704
  355    HD2  PHE  47           2HD      PHE  47   9.697   1.792   2.493
  356    HE1  PHE  47           1HE      PHE  47   6.321   2.543   5.991
  357    HE2  PHE  47           2HE      PHE  47   7.842   0.197   2.774
  358    HZ   PHE  47           HZ       PHE  47   6.150   0.572   4.524
  359    H    LEU  48           H        LEU  48   7.900   6.048   1.640
  360    HA   LEU  48           HA       LEU  48   6.442   7.198   3.915
  361   1HB   LEU  48          2HB       LEU  48   6.537   7.788   0.992
  362   2HB   LEU  48          1HB       LEU  48   5.066   8.160   1.873
  363    HG   LEU  48           HG       LEU  48   6.601  10.095   1.651
  364   1HD1  LEU  48          1HD1      LEU  48   6.121  10.927   3.735
  365   2HD1  LEU  48          2HD1      LEU  48   6.517   9.414   4.551
  366   3HD1  LEU  48          3HD1      LEU  48   5.005   9.563   3.655
  367   1HD2  LEU  48          1HD2      LEU  48   8.398   8.647   3.579
  368   2HD2  LEU  48          2HD2      LEU  48   8.689  10.176   2.751
  369   3HD2  LEU  48          3HD2      LEU  48   8.681   8.667   1.838
  370    H    ASN  49           H        ASN  49   5.172   5.657   4.773
  371    HA   ASN  49           HA       ASN  49   3.319   4.273   2.950
  372   1HB   ASN  49          2HB       ASN  49   5.043   2.716   3.804
  373   2HB   ASN  49          1HB       ASN  49   4.557   3.106   5.450
  374   1HD2  ASN  49          1HD2      ASN  49   2.351   2.599   6.062
  375   2HD2  ASN  49          2HD2      ASN  49   1.571   1.236   5.345
  376    H    CYS  50           H        CYS  50   1.315   4.935   3.304
  377    HA   CYS  50           HA       CYS  50   0.226   4.975   5.962
  378   1HB   CYS  50          2HB       CYS  50  -0.399   7.285   6.067
  379   2HB   CYS  50          1HB       CYS  50   1.332   7.214   5.763
  380    HG   CYS  50           HG       CYS  50   0.274   9.005   4.199
  381    H    TYR  51           H        TYR  51  -2.080   5.285   5.995
  382    HA   TYR  51           HA       TYR  51  -3.551   5.517   3.555
  383   1HB   TYR  51          2HB       TYR  51  -4.500   3.307   3.474
  384   2HB   TYR  51          1HB       TYR  51  -2.747   3.162   3.418
  385    HD1  TYR  51           1HD      TYR  51  -5.432   1.512   4.580
  386    HD2  TYR  51           2HD      TYR  51  -1.848   3.214   6.110
  387    HE1  TYR  51           1HE      TYR  51  -5.506  -0.053   6.477
  388    HE2  TYR  51           2HE      TYR  51  -1.911   1.656   8.005
  389    HH   TYR  51           HH       TYR  51  -3.029  -0.796   8.341
  390    H    VAL  52           H        VAL  52  -5.752   5.809   3.889
  391    HA   VAL  52           HA       VAL  52  -6.672   5.733   6.679
  392    HB   VAL  52           HB       VAL  52  -7.764   7.907   6.424
  393   1HG1  VAL  52          1HG1      VAL  52  -4.939   7.464   6.550
  394   2HG1  VAL  52          2HG1      VAL  52  -5.908   8.696   7.356
  395   3HG1  VAL  52          3HG1      VAL  52  -5.256   9.001   5.747
  396   1HG2  VAL  52          1HG2      VAL  52  -6.774   9.271   4.381
  397   2HG2  VAL  52          2HG2      VAL  52  -8.250   8.317   4.233
  398   3HG2  VAL  52          3HG2      VAL  52  -6.717   7.664   3.656
  399    H    SER  53           H        SER  53  -8.359   4.419   6.747
  400    HA   SER  53           HA       SER  53 -10.797   4.787   5.594
  401   1HB   SER  53          2HB       SER  53 -10.114   4.496   3.370
  402   2HB   SER  53          1HB       SER  53  -8.991   3.202   3.785
  403    HG   SER  53           HG       SER  53 -11.821   3.087   3.728
  404    H    GLY  54           H        GLY  54  -9.244   1.640   5.178
  405   1HA   GLY  54          2HA       GLY  54  -9.104  -0.012   6.942
  406   2HA   GLY  54          1HA       GLY  54 -10.501   0.747   7.691
  407    H    PHE  55           H        PHE  55 -12.384   0.889   5.867
  408    HA   PHE  55           HA       PHE  55 -14.111  -0.385   5.093
  409   1HB   PHE  55          2HB       PHE  55 -13.368  -1.831   3.070
  410   2HB   PHE  55          1HB       PHE  55 -13.198  -0.084   2.984
  411    HD1  PHE  55           1HD      PHE  55 -11.151   0.864   2.458
  412    HD2  PHE  55           2HD      PHE  55 -11.298  -3.185   3.758
  413    HE1  PHE  55           1HE      PHE  55  -8.771   0.603   1.895
  414    HE2  PHE  55           2HE      PHE  55  -8.915  -3.453   3.201
  415    HZ   PHE  55           HZ       PHE  55  -7.648  -1.556   2.270
  416    H    HIS  56           H        HIS  56 -14.596  -2.818   4.206
  417    HA   HIS  56           HA       HIS  56 -13.945  -4.508   6.508
  418   1HB   HIS  56          2HB       HIS  56 -16.328  -4.057   4.983
  419   2HB   HIS  56          1HB       HIS  56 -15.889  -5.758   4.857
  420    HD1  HIS  56           1HD      HIS  56 -18.119  -3.945   6.687
  421    HD2  HIS  56           2HD      HIS  56 -15.023  -6.461   7.850
  422    HE1  HIS  56           1HE      HIS  56 -18.690  -4.677   9.024
  423    HE2  HIS  56           2HE      HIS  56 -16.868  -6.298   9.656
  424    HA   PRO  57           HA       PRO  57 -12.754  -7.418   2.970
  425   1HB   PRO  57          2HB       PRO  57 -13.583  -7.063   0.470
  426   2HB   PRO  57          1HB       PRO  57 -14.724  -7.571   1.720
  427   1HG   PRO  57          2HG       PRO  57 -14.303  -4.862   0.527
  428   2HG   PRO  57          1HG       PRO  57 -15.820  -5.678   0.949
  429   1HD   PRO  57          2HD       PRO  57 -14.502  -3.791   2.522
  430   2HD   PRO  57          1HD       PRO  57 -15.738  -4.927   3.090
  431    H    SER  58           H        SER  58 -11.893  -7.021   0.246
  432    HA   SER  58           HA       SER  58 -10.345  -5.955  -1.077
  433   1HB   SER  58          2HB       SER  58  -9.504  -4.098   1.120
  434   2HB   SER  58          1HB       SER  58  -9.510  -3.834  -0.622
  435    HG   SER  58           HG       SER  58 -11.194  -2.717   0.552
  436    H    ASP  59           H        ASP  59  -8.521  -6.944  -1.491
  437    HA   ASP  59           HA       ASP  59  -6.837  -7.816   0.760
  438   1HB   ASP  59          2HB       ASP  59  -7.843  -9.680  -0.506
  439   2HB   ASP  59          1HB       ASP  59  -7.111  -9.064  -1.985
  440    H    ILE  60           H        ILE  60  -5.451  -6.109   0.895
  441    HA   ILE  60           HA       ILE  60  -3.685  -5.708  -1.416
  442    HB   ILE  60           HB       ILE  60  -3.526  -3.283  -0.762
  443   1HG1  ILE  60          2HG1      ILE  60  -4.574  -3.658   1.511
  444   2HG1  ILE  60          1HG1      ILE  60  -5.199  -2.283   0.609
  445   1HG2  ILE  60          1HG2      ILE  60  -4.948  -4.319  -2.643
  446   2HG2  ILE  60          2HG2      ILE  60  -5.256  -2.648  -2.174
  447   3HG2  ILE  60          3HG2      ILE  60  -6.323  -3.934  -1.611
  448   1HD1  ILE  60          1HD1      ILE  60  -6.557  -4.670   1.562
  449   2HD1  ILE  60          2HD1      ILE  60  -6.899  -4.303  -0.127
  450   3HD1  ILE  60          3HD1      ILE  60  -7.206  -3.093   1.117
  451    H    GLU  61           H        GLU  61  -1.534  -5.451  -0.954
  452    HA   GLU  61           HA       GLU  61  -0.643  -4.974   1.748
  453   1HB   GLU  61          2HB       GLU  61   0.614  -7.063   1.964
  454   2HB   GLU  61          1HB       GLU  61  -1.112  -7.372   1.834
  455   1HG   GLU  61          2HG       GLU  61  -0.903  -8.115  -0.401
  456   2HG   GLU  61          1HG       GLU  61   0.757  -7.532  -0.511
  457    H    VAL  62           H        VAL  62   1.282  -3.988   1.775
  458    HA   VAL  62           HA       VAL  62   2.780  -3.873  -0.758
  459    HB   VAL  62           HB       VAL  62   2.831  -1.888   1.521
  460   1HG1  VAL  62          1HG1      VAL  62   4.710  -2.334  -0.468
  461   2HG1  VAL  62          2HG1      VAL  62   4.541  -0.875   0.510
  462   3HG1  VAL  62          3HG1      VAL  62   3.762  -0.974  -1.070
  463   1HG2  VAL  62          1HG2      VAL  62   1.150  -2.110  -0.902
  464   2HG2  VAL  62          2HG2      VAL  62   1.774  -0.506  -0.511
  465   3HG2  VAL  62          3HG2      VAL  62   0.794  -1.383   0.665
  466    H    ASP  63           H        ASP  63   4.657  -4.908  -0.803
  467    HA   ASP  63           HA       ASP  63   6.129  -5.250   1.726
  468   1HB   ASP  63          2HB       ASP  63   6.889  -7.452   0.892
  469   2HB   ASP  63          1HB       ASP  63   5.141  -7.382   1.098
  470    H    LEU  64           H        LEU  64   8.158  -4.552   1.720
  471    HA   LEU  64           HA       LEU  64   9.496  -4.152  -0.872
  472   1HB   LEU  64          2HB       LEU  64  10.031  -2.375   1.481
  473   2HB   LEU  64          1HB       LEU  64  10.345  -2.077  -0.217
  474    HG   LEU  64           HG       LEU  64   7.707  -1.945   1.227
  475   1HD1  LEU  64          1HD1      LEU  64   8.724   0.145  -0.612
  476   2HD1  LEU  64          2HD1      LEU  64   9.512  -0.023   0.957
  477   3HD1  LEU  64          3HD1      LEU  64   7.779   0.295   0.867
  478   1HD2  LEU  64          1HD2      LEU  64   7.320  -1.203  -1.443
  479   2HD2  LEU  64          2HD2      LEU  64   6.665  -2.616  -0.617
  480   3HD2  LEU  64          3HD2      LEU  64   8.187  -2.738  -1.498
  481    H    LEU  65           H        LEU  65  11.059  -5.608  -0.994
  482    HA   LEU  65           HA       LEU  65  12.896  -6.853  -0.504
  483   1HB   LEU  65          2HB       LEU  65  13.458  -4.401   0.479
  484   2HB   LEU  65          1HB       LEU  65  13.557  -5.346   1.953
  485    HG   LEU  65           HG       LEU  65  15.187  -5.726  -0.557
  486   1HD1  LEU  65          1HD1      LEU  65  16.895  -4.722   0.510
  487   2HD1  LEU  65          2HD1      LEU  65  16.438  -5.374   2.084
  488   3HD1  LEU  65          3HD1      LEU  65  15.601  -3.962   1.437
  489   1HD2  LEU  65          1HD2      LEU  65  16.360  -7.451   0.951
  490   2HD2  LEU  65          2HD2      LEU  65  14.850  -7.914   0.164
  491   3HD2  LEU  65          3HD2      LEU  65  14.853  -7.456   1.867
  492    H    LYS  66           H        LYS  66  12.941  -8.815   0.368
  493    HA   LYS  66           HA       LYS  66  12.576 -10.572   1.766
  494   1HB   LYS  66          2HB       LYS  66  13.689  -8.775   3.363
  495   2HB   LYS  66          1HB       LYS  66  12.092  -8.774   4.099
  496   1HG   LYS  66          2HG       LYS  66  12.245 -11.053   4.678
  497   2HG   LYS  66          1HG       LYS  66  13.656 -11.296   3.645
  498   1HD   LYS  66          2HD       LYS  66  14.666 -11.144   5.698
  499   2HD   LYS  66          1HD       LYS  66  14.703  -9.451   5.201
  500   1HE   LYS  66          2HE       LYS  66  12.623  -9.065   6.468
  501   2HE   LYS  66          1HE       LYS  66  12.661 -10.744   7.006
  502   1HZ   LYS  66          1HZ       LYS  66  15.092  -9.936   7.724
  503   2HZ   LYS  66          2HZ       LYS  66  13.745  -9.845   8.742
  504   3HZ   LYS  66          3HZ       LYS  66  14.249  -8.478   7.884
  505   1H    SER  67          1HT       SER  67  12.405  10.206  10.484
  506   2H    SER  67          2HT       SER  67  13.754  11.118  11.028
  507   3H    SER  67          3HT       SER  67  12.671  10.423  12.164
  508    HA   SER  67           HA       SER  67  14.848   9.285  11.817
  509   1HB   SER  67          2HB       SER  67  12.208   7.839  11.472
  510   2HB   SER  67          1HB       SER  67  13.717   7.063  11.953
  511    HG   SER  67           HG       SER  67  12.048   7.984  13.592
  512    H    ASN  68           H        ASN  68  12.460   7.980   9.518
  513    HA   ASN  68           HA       ASN  68  13.935   8.453   7.184
  514   1HB   ASN  68          2HB       ASN  68  14.785   6.129   8.755
  515   2HB   ASN  68          1HB       ASN  68  14.394   5.742   7.082
  516   1HD2  ASN  68          1HD2      ASN  68  15.225   7.763   5.634
  517   2HD2  ASN  68          2HD2      ASN  68  16.916   8.055   5.835
  518    H    PHE  69           H        PHE  69  11.713   6.319   8.886
  519    HA   PHE  69           HA       PHE  69  10.152   6.091   6.399
  520   1HB   PHE  69          2HB       PHE  69   9.890   3.872   6.694
  521   2HB   PHE  69          1HB       PHE  69  11.266   4.000   7.780
  522    HD1  PHE  69           1HD      PHE  69   8.032   2.788   7.458
  523    HD2  PHE  69           2HD      PHE  69  10.585   4.705  10.264
  524    HE1  PHE  69           1HE      PHE  69   6.642   1.935   9.295
  525    HE2  PHE  69           2HE      PHE  69   9.196   3.860  12.111
  526    HZ   PHE  69           HZ       PHE  69   7.220   2.472  11.627
  527    H    LEU  70           H        LEU  70   7.769   5.587   6.903
  528    HA   LEU  70           HA       LEU  70   6.784   6.765   9.361
  529   1HB   LEU  70          2HB       LEU  70   7.118   8.733   7.977
  530   2HB   LEU  70          1HB       LEU  70   6.220   7.996   6.664
  531    HG   LEU  70           HG       LEU  70   4.226   7.953   8.274
  532   1HD1  LEU  70          1HD1      LEU  70   6.235   9.437   9.852
  533   2HD1  LEU  70          2HD1      LEU  70   4.889   8.427  10.382
  534   3HD1  LEU  70          3HD1      LEU  70   4.594  10.082   9.846
  535   1HD2  LEU  70          1HD2      LEU  70   4.328   9.446   6.377
  536   2HD2  LEU  70          2HD2      LEU  70   5.348  10.568   7.277
  537   3HD2  LEU  70          3HD2      LEU  70   3.677  10.305   7.772
  538    H    ASN  71           H        ASN  71   5.426   5.207   9.979
  539    HA   ASN  71           HA       ASN  71   3.713   3.930   7.967
  540   1HB   ASN  71          2HB       ASN  71   3.230   2.310   9.894
  541   2HB   ASN  71          1HB       ASN  71   4.838   2.257   9.188
  542   1HD2  ASN  71          1HD2      ASN  71   4.724   1.145  11.520
  543   2HD2  ASN  71          2HD2      ASN  71   5.358   2.146  12.777
  544    H    CYS  72           H        CYS  72   2.618   6.160   8.091
  545    HA   CYS  72           HA       CYS  72   0.990   6.685  10.389
  546   1HB   CYS  72          2HB       CYS  72   1.756   8.502   8.922
  547   2HB   CYS  72          1HB       CYS  72   0.823   7.827   7.593
  548    HG   CYS  72           HG       CYS  72  -0.856   9.439   8.412
  549    H    TYR  73           H        TYR  73  -0.459   5.157  10.876
  550    HA   TYR  73           HA       TYR  73  -2.224   4.168   8.744
  551   1HB   TYR  73          2HB       TYR  73  -2.811   2.493  10.719
  552   2HB   TYR  73          1HB       TYR  73  -1.411   2.241   9.686
  553    HD1  TYR  73           1HD      TYR  73   0.690   1.970  10.640
  554    HD2  TYR  73           2HD      TYR  73  -2.396   3.804  12.923
  555    HE1  TYR  73           1HE      TYR  73   2.154   1.958  12.615
  556    HE2  TYR  73           2HE      TYR  73  -0.939   3.799  14.905
  557    HH   TYR  73           HH       TYR  73   2.403   3.121  14.729
  558    H    VAL  74           H        VAL  74  -4.306   4.715   8.718
  559    HA   VAL  74           HA       VAL  74  -5.529   5.762  11.177
  560    HB   VAL  74           HB       VAL  74  -6.042   6.998   8.479
  561   1HG1  VAL  74          1HG1      VAL  74  -6.641   8.880  10.303
  562   2HG1  VAL  74          2HG1      VAL  74  -6.997   7.425  11.235
  563   3HG1  VAL  74          3HG1      VAL  74  -7.808   7.706   9.695
  564   1HG2  VAL  74          1HG2      VAL  74  -4.268   8.147  10.624
  565   2HG2  VAL  74          2HG2      VAL  74  -4.546   8.771   8.998
  566   3HG2  VAL  74          3HG2      VAL  74  -3.654   7.267   9.224
  567    H    SER  75           H        SER  75  -6.321   3.508  11.155
  568    HA   SER  75           HA       SER  75  -8.994   3.322  10.484
  569   1HB   SER  75          2HB       SER  75  -9.188   2.271   8.455
  570   2HB   SER  75          1HB       SER  75  -7.709   3.172   8.130
  571    HG   SER  75           HG       SER  75  -7.483   0.977   7.569
  572    H    GLY  76           H        GLY  76  -9.897   1.597  11.530
  573   1HA   GLY  76          2HA       GLY  76  -8.480   0.158  13.414
  574   2HA   GLY  76          1HA       GLY  76 -10.028  -0.354  12.752
  575    H    PHE  77           H        PHE  77 -10.066  -1.760  10.959
  576    HA   PHE  77           HA       PHE  77  -8.127  -2.721   9.383
  577   1HB   PHE  77          2HB       PHE  77  -7.695  -3.710  12.125
  578   2HB   PHE  77          1HB       PHE  77  -7.692  -4.965  10.888
  579    HD1  PHE  77           1HD      PHE  77  -6.511  -3.436   8.626
  580    HD2  PHE  77           2HD      PHE  77  -5.441  -3.598  12.735
  581    HE1  PHE  77           1HE      PHE  77  -4.197  -2.825   8.041
  582    HE2  PHE  77           2HE      PHE  77  -3.127  -2.999  12.156
  583    HZ   PHE  77           HZ       PHE  77  -2.503  -2.610   9.810
  584    H    HIS  78           H        HIS  78 -10.252  -4.371  11.740
  585    HA   HIS  78           HA       HIS  78 -11.997  -5.810  11.442
  586   1HB   HIS  78          2HB       HIS  78 -12.183  -4.049   9.017
  587   2HB   HIS  78          1HB       HIS  78 -13.279  -5.413   9.197
  588    HD1  HIS  78           1HD      HIS  78 -15.350  -4.965  10.494
  589    HD2  HIS  78           2HD      HIS  78 -12.365  -2.189  11.307
  590    HE1  HIS  78           1HE      HIS  78 -16.411  -3.258  12.006
  591    HE2  HIS  78           2HE      HIS  78 -14.563  -1.636  12.553
  592    HA   PRO  79           HA       PRO  79 -10.718  -9.436   9.294
  593   1HB   PRO  79          2HB       PRO  79 -13.035 -10.319   8.073
  594   2HB   PRO  79          1HB       PRO  79 -12.619 -10.599   9.766
  595   1HG   PRO  79          2HG       PRO  79 -14.405  -8.522   8.570
  596   2HG   PRO  79          1HG       PRO  79 -14.622  -9.469  10.054
  597   1HD   PRO  79          2HD       PRO  79 -13.813  -6.916  10.132
  598   2HD   PRO  79          1HD       PRO  79 -13.179  -8.121  11.272
  599    H    SER  80           H        SER  80  -9.530  -7.864   7.845
  600    HA   SER  80           HA       SER  80 -10.475  -8.193   5.075
  601   1HB   SER  80          2HB       SER  80  -9.888  -6.008   4.496
  602   2HB   SER  80          1HB       SER  80 -10.560  -5.796   6.112
  603    HG   SER  80           HG       SER  80  -8.682  -4.755   6.260
  604    H    ASP  81           H        ASP  81  -8.177  -7.125   3.832
  605    HA   ASP  81           HA       ASP  81  -6.042  -8.901   4.803
  606   1HB   ASP  81          2HB       ASP  81  -7.494  -9.047   2.285
  607   2HB   ASP  81          1HB       ASP  81  -5.757  -8.904   2.036
  608    H    ILE  82           H        ILE  82  -6.101  -6.205   5.388
  609    HA   ILE  82           HA       ILE  82  -4.248  -4.965   3.486
  610    HB   ILE  82           HB       ILE  82  -4.601  -2.876   4.754
  611   1HG1  ILE  82          2HG1      ILE  82  -6.679  -4.463   6.276
  612   2HG1  ILE  82          1HG1      ILE  82  -5.154  -3.897   6.940
  613   1HG2  ILE  82          1HG2      ILE  82  -6.818  -4.351   3.446
  614   2HG2  ILE  82          2HG2      ILE  82  -5.975  -2.885   2.944
  615   3HG2  ILE  82          3HG2      ILE  82  -7.185  -2.812   4.223
  616   1HD1  ILE  82          1HD1      ILE  82  -7.544  -2.571   7.049
  617   2HD1  ILE  82          2HD1      ILE  82  -6.715  -1.775   5.712
  618   3HD1  ILE  82          3HD1      ILE  82  -5.954  -1.850   7.300
  619    H    GLU  83           H        GLU  83  -2.143  -5.149   3.859
  620    HA   GLU  83           HA       GLU  83  -1.143  -4.888   6.582
  621   1HB   GLU  83          2HB       GLU  83   0.424  -6.923   5.986
  622   2HB   GLU  83          1HB       GLU  83  -1.158  -7.176   6.707
  623   1HG   GLU  83          2HG       GLU  83  -1.234  -7.091   3.800
  624   2HG   GLU  83          1HG       GLU  83  -0.204  -8.374   4.431
  625    H    VAL  84           H        VAL  84   1.225  -4.673   6.671
  626    HA   VAL  84           HA       VAL  84   2.479  -3.845   4.158
  627    HB   VAL  84           HB       VAL  84   2.452  -2.094   6.623
  628   1HG1  VAL  84          1HG1      VAL  84   4.524  -1.815   5.502
  629   2HG1  VAL  84          2HG1      VAL  84   3.514  -0.444   5.042
  630   3HG1  VAL  84          3HG1      VAL  84   3.743  -1.786   3.922
  631   1HG2  VAL  84          1HG2      VAL  84   0.431  -1.492   5.848
  632   2HG2  VAL  84          2HG2      VAL  84   0.714  -2.211   4.263
  633   3HG2  VAL  84          3HG2      VAL  84   1.349  -0.607   4.631
  634    H    ASP  85           H        ASP  85   4.536  -4.507   4.018
  635    HA   ASP  85           HA       ASP  85   6.021  -5.078   6.487
  636   1HB   ASP  85          2HB       ASP  85   5.531  -6.957   4.188
  637   2HB   ASP  85          1HB       ASP  85   6.948  -7.130   5.220
  638    H    LEU  86           H        LEU  86   7.662  -3.682   6.408
  639    HA   LEU  86           HA       LEU  86   9.135  -3.419   3.867
  640   1HB   LEU  86          2HB       LEU  86   9.821  -1.153   4.772
  641   2HB   LEU  86          1HB       LEU  86   8.158  -1.317   4.240
  642    HG   LEU  86           HG       LEU  86   8.819  -1.699   7.134
  643   1HD1  LEU  86          1HD1      LEU  86   9.090   0.780   5.607
  644   2HD1  LEU  86          2HD1      LEU  86   9.684   0.363   7.214
  645   3HD1  LEU  86          3HD1      LEU  86   8.019   0.905   7.002
  646   1HD2  LEU  86          1HD2      LEU  86   6.612  -2.104   7.003
  647   2HD2  LEU  86          2HD2      LEU  86   6.445  -1.271   5.458
  648   3HD2  LEU  86          3HD2      LEU  86   6.474  -0.347   6.960
  649    H    LEU  87           H        LEU  87  10.721  -4.920   4.230
  650    HA   LEU  87           HA       LEU  87  12.658  -5.796   5.031
  651   1HB   LEU  87          2HB       LEU  87  12.834  -3.009   6.153
  652   2HB   LEU  87          1HB       LEU  87  14.106  -4.191   6.396
  653    HG   LEU  87           HG       LEU  87  13.951  -4.357   3.744
  654   1HD1  LEU  87          1HD1      LEU  87  12.059  -2.579   3.920
  655   2HD1  LEU  87          2HD1      LEU  87  13.271  -2.450   2.645
  656   3HD1  LEU  87          3HD1      LEU  87  13.397  -1.444   4.089
  657   1HD2  LEU  87          1HD2      LEU  87  15.372  -1.957   4.783
  658   2HD2  LEU  87          2HD2      LEU  87  15.940  -3.225   3.696
  659   3HD2  LEU  87          3HD2      LEU  87  15.807  -3.542   5.426
  660    H    LYS  88           H        LYS  88  12.068  -3.746   7.858
  661    HA   LYS  88           HA       LYS  88  11.900  -4.260  10.071
  662   1HB   LYS  88          2HB       LYS  88   9.743  -5.409   8.684
  663   2HB   LYS  88          1HB       LYS  88  10.262  -6.626   9.841
  664   1HG   LYS  88          2HG       LYS  88   9.743  -5.318  11.659
  665   2HG   LYS  88          1HG       LYS  88   9.882  -3.813  10.749
  666   1HD   LYS  88          2HD       LYS  88   7.787  -4.060   9.774
  667   2HD   LYS  88          1HD       LYS  88   7.745  -5.799  10.077
  668   1HE   LYS  88          2HE       LYS  88   6.228  -4.423  11.530
  669   2HE   LYS  88          1HE       LYS  88   7.351  -5.470  12.396
  670   1HZ   LYS  88          1HZ       LYS  88   7.081  -3.077  13.195
  671   2HZ   LYS  88          2HZ       LYS  88   8.016  -2.645  11.853
  672   3HZ   LYS  88          3HZ       LYS  88   8.655  -3.674  13.031
  Start of MODEL    7
    1   1H    SER   1          1HT       SER   1  16.157   3.909  -8.368
    2   2H    SER   1          2HT       SER   1  14.510   3.821  -7.894
    3   3H    SER   1          3HT       SER   1  15.741   3.957  -6.706
    4    HA   SER   1           HA       SER   1  16.243   6.117  -7.307
    5   1HB   SER   1          2HB       SER   1  15.547   5.279  -9.835
    6   2HB   SER   1          1HB       SER   1  14.232   6.386  -9.437
    7    HG   SER   1           HG       SER   1  16.022   7.858  -8.779
    8    H    ASN   2           H        ASN   2  14.236   7.969  -7.891
    9    HA   ASN   2           HA       ASN   2  12.782   8.011  -5.491
   10   1HB   ASN   2          2HB       ASN   2  13.389   9.906  -7.248
   11   2HB   ASN   2          1HB       ASN   2  11.777   9.534  -7.854
   12   1HD2  ASN   2          1HD2      ASN   2  13.369   9.992  -4.713
   13   2HD2  ASN   2          2HD2      ASN   2  12.144  11.017  -4.052
   14    H    PHE   3           H        PHE   3  10.758   7.381  -4.938
   15    HA   PHE   3           HA       PHE   3   8.934   6.418  -7.002
   16   1HB   PHE   3          2HB       PHE   3  10.274   4.450  -6.347
   17   2HB   PHE   3          1HB       PHE   3   9.800   4.694  -4.670
   18    HD1  PHE   3           1HD      PHE   3   7.451   4.343  -3.991
   19    HD2  PHE   3           2HD      PHE   3   8.832   3.395  -7.902
   20    HE1  PHE   3           1HE      PHE   3   5.461   2.942  -4.350
   21    HE2  PHE   3           2HE      PHE   3   6.842   1.993  -8.269
   22    HZ   PHE   3           HZ       PHE   3   5.155   1.766  -6.491
   23    H    LEU   4           H        LEU   4   6.900   7.002  -6.572
   24    HA   LEU   4           HA       LEU   4   6.021   7.307  -3.818
   25   1HB   LEU   4          2HB       LEU   4   4.951   9.580  -4.663
   26   2HB   LEU   4          1HB       LEU   4   6.533   9.512  -3.917
   27    HG   LEU   4           HG       LEU   4   6.403  10.968  -5.935
   28   1HD1  LEU   4          1HD1      LEU   4   8.557  10.551  -6.469
   29   2HD1  LEU   4          2HD1      LEU   4   8.284   8.824  -6.701
   30   3HD1  LEU   4          3HD1      LEU   4   8.445   9.481  -5.072
   31   1HD2  LEU   4          1HD2      LEU   4   4.939   9.889  -7.396
   32   2HD2  LEU   4          2HD2      LEU   4   5.774   8.345  -7.245
   33   3HD2  LEU   4          3HD2      LEU   4   6.523   9.666  -8.137
   34    H    ASN   5           H        ASN   5   4.708   5.504  -4.353
   35    HA   ASN   5           HA       ASN   5   2.812   5.601  -6.485
   36   1HB   ASN   5          2HB       ASN   5   3.759   3.519  -5.300
   37   2HB   ASN   5          1HB       ASN   5   2.573   3.853  -4.041
   38   1HD2  ASN   5          1HD2      ASN   5   2.970   3.151  -7.460
   39   2HD2  ASN   5          2HD2      ASN   5   1.405   2.455  -7.688
   40    H    CYS   6           H        CYS   6   1.083   6.884  -6.528
   41    HA   CYS   6           HA       CYS   6  -0.186   7.595  -3.966
   42   1HB   CYS   6          2HB       CYS   6   0.892   9.331  -5.723
   43   2HB   CYS   6          1HB       CYS   6  -0.746   9.245  -6.360
   44    HG   CYS   6           HG       CYS   6  -0.112  10.187  -3.462
   45    H    TYR   7           H        TYR   7  -1.980   6.487  -3.631
   46    HA   TYR   7           HA       TYR   7  -3.790   6.008  -5.906
   47   1HB   TYR   7          2HB       TYR   7  -3.325   3.831  -5.349
   48   2HB   TYR   7          1HB       TYR   7  -2.911   4.232  -3.687
   49    HD1  TYR   7           1HD      TYR   7  -5.424   2.893  -5.860
   50    HD2  TYR   7           2HD      TYR   7  -4.830   4.758  -2.085
   51    HE1  TYR   7           1HE      TYR   7  -7.623   2.074  -5.114
   52    HE2  TYR   7           2HE      TYR   7  -7.022   3.948  -1.333
   53    HH   TYR   7           HH       TYR   7  -9.061   3.143  -2.141
   54    H    VAL   8           H        VAL   8  -5.763   6.881  -5.760
   55    HA   VAL   8           HA       VAL   8  -6.706   7.754  -3.110
   56    HB   VAL   8           HB       VAL   8  -7.149   9.294  -5.668
   57   1HG1  VAL   8          1HG1      VAL   8  -8.857   9.518  -3.871
   58   2HG1  VAL   8          2HG1      VAL   8  -8.024  11.023  -4.255
   59   3HG1  VAL   8          3HG1      VAL   8  -7.590  10.121  -2.803
   60   1HG2  VAL   8          1HG2      VAL   8  -5.581  10.962  -4.547
   61   2HG2  VAL   8          2HG2      VAL   8  -4.847   9.524  -5.256
   62   3HG2  VAL   8          3HG2      VAL   8  -5.082   9.625  -3.512
   63    H    SER   9           H        SER   9  -7.902   5.744  -3.110
   64    HA   SER   9           HA       SER   9  -9.674   4.369  -3.570
   65   1HB   SER   9          2HB       SER   9 -11.172   5.605  -2.425
   66   2HB   SER   9          1HB       SER   9 -10.626   7.109  -3.162
   67    HG   SER   9           HG       SER   9 -12.835   6.412  -3.667
   68    H    GLY  10           H        GLY  10  -9.247   3.318  -5.490
   69   1HA   GLY  10          2HA       GLY  10 -10.809   3.102  -7.545
   70   2HA   GLY  10          1HA       GLY  10 -10.103   4.653  -7.968
   71    H    PHE  11           H        PHE  11 -10.041   1.790  -9.084
   72    HA   PHE  11           HA       PHE  11  -7.535   1.944 -10.300
   73   1HB   PHE  11          2HB       PHE  11  -6.161   0.434  -9.200
   74   2HB   PHE  11          1HB       PHE  11  -6.969   1.222  -7.853
   75    HD1  PHE  11           1HD      PHE  11  -6.352  -1.877  -9.560
   76    HD2  PHE  11           2HD      PHE  11  -8.872   0.044  -6.722
   77    HE1  PHE  11           1HE      PHE  11  -7.085  -4.074  -8.727
   78    HE2  PHE  11           2HE      PHE  11  -9.608  -2.150  -5.885
   79    HZ   PHE  11           HZ       PHE  11  -8.713  -4.212  -6.888
   80    H    HIS  12           H        HIS  12  -6.996  -0.158 -11.493
   81    HA   HIS  12           HA       HIS  12  -9.214  -0.927 -13.016
   82   1HB   HIS  12          2HB       HIS  12  -6.883  -2.783 -12.866
   83   2HB   HIS  12          1HB       HIS  12  -7.761  -2.198 -14.271
   84    HD1  HIS  12           1HD      HIS  12  -4.908  -1.361 -12.023
   85    HD2  HIS  12           2HD      HIS  12  -6.832   0.217 -15.351
   86    HE1  HIS  12           1HE      HIS  12  -3.387   0.447 -12.883
   87    HE2  HIS  12           2HE      HIS  12  -4.525   1.318 -14.956
   88    HA   PRO  13           HA       PRO  13 -10.886  -4.416 -10.878
   89   1HB   PRO  13          2HB       PRO  13 -11.385  -6.263 -12.757
   90   2HB   PRO  13          1HB       PRO  13 -12.222  -4.706 -12.742
   91   1HG   PRO  13          2HG       PRO  13  -9.956  -5.626 -14.449
   92   2HG   PRO  13          1HG       PRO  13 -11.343  -4.611 -14.876
   93   1HD   PRO  13          2HD       PRO  13  -8.799  -3.680 -14.291
   94   2HD   PRO  13          1HD       PRO  13 -10.279  -2.705 -14.228
   95    H    SER  14           H        SER  14 -10.739  -6.867 -10.510
   96    HA   SER  14           HA       SER  14  -9.533  -8.689  -9.868
   97   1HB   SER  14          2HB       SER  14  -7.329  -7.891 -11.759
   98   2HB   SER  14          1HB       SER  14  -7.854  -9.509 -11.293
   99    HG   SER  14           HG       SER  14  -8.591  -8.161 -13.408
  100    H    ASP  15           H        ASP  15  -6.733  -9.033  -9.612
  101    HA   ASP  15           HA       ASP  15  -6.185  -7.074  -7.489
  102   1HB   ASP  15          2HB       ASP  15  -4.671  -8.800  -6.554
  103   2HB   ASP  15          1HB       ASP  15  -6.335  -9.361  -6.684
  104    H    ILE  16           H        ILE  16  -4.713  -5.577  -7.923
  105    HA   ILE  16           HA       ILE  16  -2.943  -5.824 -10.183
  106    HB   ILE  16           HB       ILE  16  -2.892  -3.652  -8.093
  107   1HG1  ILE  16          2HG1      ILE  16  -5.176  -3.856  -8.915
  108   2HG1  ILE  16          1HG1      ILE  16  -4.432  -2.400  -9.565
  109   1HG2  ILE  16          1HG2      ILE  16  -1.999  -3.783 -10.966
  110   2HG2  ILE  16          2HG2      ILE  16  -0.984  -3.610  -9.535
  111   3HG2  ILE  16          3HG2      ILE  16  -2.063  -2.301 -10.014
  112   1HD1  ILE  16          1HD1      ILE  16  -5.805  -3.687 -11.190
  113   2HD1  ILE  16          2HD1      ILE  16  -4.627  -4.995 -11.069
  114   3HD1  ILE  16          3HD1      ILE  16  -4.137  -3.420 -11.695
  115    H    GLU  17           H        GLU  17  -0.608  -5.499 -10.031
  116    HA   GLU  17           HA       GLU  17   0.611  -6.176  -7.473
  117   1HB   GLU  17          2HB       GLU  17   1.952  -7.995  -8.496
  118   2HB   GLU  17          1HB       GLU  17   0.233  -8.357  -8.435
  119   1HG   GLU  17          2HG       GLU  17   1.574  -7.249 -10.881
  120   2HG   GLU  17          1HG       GLU  17   1.440  -8.977 -10.558
  121    H    VAL  18           H        VAL  18   0.935  -3.757  -8.267
  122    HA   VAL  18           HA       VAL  18   2.926  -3.263 -10.222
  123    HB   VAL  18           HB       VAL  18   2.112  -1.549  -7.867
  124   1HG1  VAL  18          1HG1      VAL  18   4.008  -0.462  -8.450
  125   2HG1  VAL  18          2HG1      VAL  18   2.969   0.202  -9.712
  126   3HG1  VAL  18          3HG1      VAL  18   4.036  -1.155 -10.071
  127   1HG2  VAL  18          1HG2      VAL  18   0.337  -2.192  -9.567
  128   2HG2  VAL  18          2HG2      VAL  18   1.252  -1.231 -10.728
  129   3HG2  VAL  18          3HG2      VAL  18   0.578  -0.469  -9.287
  130    H    ASP  19           H        ASP  19   5.012  -3.777 -10.116
  131    HA   ASP  19           HA       ASP  19   6.359  -3.621  -7.514
  132   1HB   ASP  19          2HB       ASP  19   7.674  -5.685  -8.216
  133   2HB   ASP  19          1HB       ASP  19   6.001  -5.950  -7.734
  134    H    LEU  20           H        LEU  20   8.724  -3.527  -7.687
  135    HA   LEU  20           HA       LEU  20   9.834  -2.761 -10.250
  136   1HB   LEU  20          2HB       LEU  20   9.365  -0.816  -8.023
  137   2HB   LEU  20          1HB       LEU  20  10.756  -0.617  -9.072
  138    HG   LEU  20           HG       LEU  20   7.900  -0.731 -10.039
  139   1HD1  LEU  20          1HD1      LEU  20   7.787   1.549 -10.017
  140   2HD1  LEU  20          2HD1      LEU  20   9.537   1.749 -10.101
  141   3HD1  LEU  20          3HD1      LEU  20   8.775   1.280  -8.581
  142   1HD2  LEU  20          1HD2      LEU  20   9.926   0.513 -11.724
  143   2HD2  LEU  20          2HD2      LEU  20   8.689  -0.677 -12.127
  144   3HD2  LEU  20          3HD2      LEU  20  10.223  -1.200 -11.433
  145    H    LEU  21           H        LEU  21  11.786  -3.621 -10.381
  146    HA   LEU  21           HA       LEU  21  13.820  -4.479  -9.838
  147   1HB   LEU  21          2HB       LEU  21  13.496  -2.738  -7.394
  148   2HB   LEU  21          1HB       LEU  21  14.975  -3.564  -7.838
  149    HG   LEU  21           HG       LEU  21  15.180  -1.277  -8.497
  150   1HD1  LEU  21          1HD1      LEU  21  15.648  -3.338 -10.158
  151   2HD1  LEU  21          2HD1      LEU  21  16.036  -1.662 -10.547
  152   3HD1  LEU  21          3HD1      LEU  21  14.546  -2.386 -11.153
  153   1HD2  LEU  21          1HD2      LEU  21  12.747  -1.534 -10.236
  154   2HD2  LEU  21          2HD2      LEU  21  13.618  -0.075  -9.764
  155   3HD2  LEU  21          3HD2      LEU  21  12.650  -0.949  -8.576
  156    H    LYS  22           H        LYS  22  15.005  -5.577  -7.787
  157    HA   LYS  22           HA       LYS  22  13.624  -7.917  -7.252
  158   1HB   LYS  22          2HB       LYS  22  16.025  -6.599  -6.082
  159   2HB   LYS  22          1HB       LYS  22  15.323  -7.949  -5.201
  160   1HG   LYS  22          2HG       LYS  22  16.935  -8.948  -6.528
  161   2HG   LYS  22          1HG       LYS  22  15.446  -9.204  -7.440
  162   1HD   LYS  22          2HD       LYS  22  17.225  -8.485  -8.927
  163   2HD   LYS  22          1HD       LYS  22  15.978  -7.240  -8.824
  164   1HE   LYS  22          2HE       LYS  22  18.385  -6.447  -8.720
  165   2HE   LYS  22          1HE       LYS  22  17.308  -5.872  -7.448
  166   1HZ   LYS  22          1HZ       LYS  22  19.575  -6.690  -6.739
  167   2HZ   LYS  22          2HZ       LYS  22  19.030  -8.252  -7.092
  168   3HZ   LYS  22          3HZ       LYS  22  18.253  -7.335  -5.902
  169   1H    SER  23          1HT       SER  23  13.998   4.455   2.846
  170   2H    SER  23          2HT       SER  23  13.129   3.816   1.511
  171   3H    SER  23          3HT       SER  23  12.698   5.343   2.167
  172    HA   SER  23           HA       SER  23  14.991   6.079   1.594
  173   1HB   SER  23          2HB       SER  23  15.688   3.631   1.265
  174   2HB   SER  23          1HB       SER  23  14.859   3.723  -0.289
  175    HG   SER  23           HG       SER  23  17.300   4.618   0.379
  176    H    ASN  24           H        ASN  24  13.777   7.787   0.889
  177    HA   ASN  24           HA       ASN  24  12.426   9.062  -0.447
  178   1HB   ASN  24          2HB       ASN  24  13.151   9.052  -2.836
  179   2HB   ASN  24          1HB       ASN  24  14.483   9.171  -1.691
  180   1HD2  ASN  24          1HD2      ASN  24  12.720   6.965  -3.781
  181   2HD2  ASN  24          2HD2      ASN  24  14.022   5.856  -4.018
  182    H    PHE  25           H        PHE  25  10.966   6.936   0.378
  183    HA   PHE  25           HA       PHE  25   9.435   6.199  -2.030
  184   1HB   PHE  25          2HB       PHE  25  10.470   4.212  -1.092
  185   2HB   PHE  25          1HB       PHE  25   9.839   4.598   0.505
  186    HD1  PHE  25           1HD      PHE  25   7.406   4.438   0.938
  187    HD2  PHE  25           2HD      PHE  25   9.139   3.107  -2.713
  188    HE1  PHE  25           1HE      PHE  25   5.379   3.131   0.457
  189    HE2  PHE  25           2HE      PHE  25   7.115   1.796  -3.200
  190    HZ   PHE  25           HZ       PHE  25   5.232   1.808  -1.614
  191    H    LEU  26           H        LEU  26   7.230   6.419  -1.969
  192    HA   LEU  26           HA       LEU  26   5.938   7.231   0.509
  193   1HB   LEU  26          2HB       LEU  26   6.192   8.976  -1.921
  194   2HB   LEU  26          1HB       LEU  26   4.840   9.152  -0.820
  195    HG   LEU  26           HG       LEU  26   6.880   9.262   0.944
  196   1HD1  LEU  26          1HD1      LEU  26   8.786   9.290  -0.275
  197   2HD1  LEU  26          2HD1      LEU  26   8.405  11.008  -0.376
  198   3HD1  LEU  26          3HD1      LEU  26   7.992   9.934  -1.711
  199   1HD2  LEU  26          1HD2      LEU  26   5.377  10.960   1.147
  200   2HD2  LEU  26          2HD2      LEU  26   5.358  11.302  -0.582
  201   3HD2  LEU  26          3HD2      LEU  26   6.709  11.851   0.409
  202    H    ASN  27           H        ASN  27   4.213   5.973   0.662
  203    HA   ASN  27           HA       ASN  27   2.675   5.398  -1.783
  204   1HB   ASN  27          2HB       ASN  27   3.858   3.387  -1.015
  205   2HB   ASN  27          1HB       ASN  27   3.118   3.553   0.575
  206   1HD2  ASN  27          1HD2      ASN  27   1.755   1.920   0.766
  207   2HD2  ASN  27          2HD2      ASN  27   0.545   1.475  -0.384
  208    H    CYS  28           H        CYS  28   1.213   7.067  -1.445
  209    HA   CYS  28           HA       CYS  28  -0.184   7.311   1.068
  210   1HB   CYS  28          2HB       CYS  28  -0.566   8.692  -1.595
  211   2HB   CYS  28          1HB       CYS  28  -1.485   9.073  -0.142
  212    HG   CYS  28           HG       CYS  28   1.160   9.537   0.782
  213    H    TYR  29           H        TYR  29  -1.816   6.043   1.622
  214    HA   TYR  29           HA       TYR  29  -3.464   4.857  -0.510
  215   1HB   TYR  29          2HB       TYR  29  -2.373   3.111   0.699
  216   2HB   TYR  29          1HB       TYR  29  -2.760   3.847   2.249
  217    HD1  TYR  29           1HD      TYR  29  -3.693   1.700   3.024
  218    HD2  TYR  29           2HD      TYR  29  -5.326   3.736  -0.330
  219    HE1  TYR  29           1HE      TYR  29  -5.721   0.316   3.178
  220    HE2  TYR  29           2HE      TYR  29  -7.358   2.358  -0.188
  221    HH   TYR  29           HH       TYR  29  -8.165   0.549   2.471
  222    H    VAL  30           H        VAL  30  -5.208   6.112  -0.759
  223    HA   VAL  30           HA       VAL  30  -6.598   7.091   1.637
  224    HB   VAL  30           HB       VAL  30  -7.125   7.936  -1.210
  225   1HG1  VAL  30          1HG1      VAL  30  -7.841   9.125   1.465
  226   2HG1  VAL  30          2HG1      VAL  30  -8.943   8.422   0.280
  227   3HG1  VAL  30          3HG1      VAL  30  -8.097   9.926  -0.085
  228   1HG2  VAL  30          1HG2      VAL  30  -5.027   8.782  -1.092
  229   2HG2  VAL  30          2HG2      VAL  30  -5.001   8.765   0.672
  230   3HG2  VAL  30          3HG2      VAL  30  -5.844  10.055  -0.185
  231    H    SER  31           H        SER  31  -8.019   5.590   2.313
  232    HA   SER  31           HA       SER  31  -9.234   3.627   0.759
  233   1HB   SER  31          2HB       SER  31  -9.946   4.862   3.407
  234   2HB   SER  31          1HB       SER  31 -10.964   3.618   2.683
  235    HG   SER  31           HG       SER  31  -9.437   2.154   2.998
  236    H    GLY  32           H        GLY  32 -11.833   3.509   0.897
  237   1HA   GLY  32          2HA       GLY  32 -13.865   4.768   0.520
  238   2HA   GLY  32          1HA       GLY  32 -12.892   6.008  -0.257
  239    H    PHE  33           H        PHE  33 -13.100   2.473  -0.671
  240    HA   PHE  33           HA       PHE  33 -14.353   2.678  -3.225
  241   1HB   PHE  33          2HB       PHE  33 -12.582   2.117  -4.672
  242   2HB   PHE  33          1HB       PHE  33 -11.925   3.381  -3.643
  243    HD1  PHE  33           1HD      PHE  33 -11.466   1.560  -1.198
  244    HD2  PHE  33           2HD      PHE  33 -10.519   1.163  -5.328
  245    HE1  PHE  33           1HE      PHE  33  -9.572   0.102  -0.622
  246    HE2  PHE  33           2HE      PHE  33  -8.628  -0.302  -4.754
  247    HZ   PHE  33           HZ       PHE  33  -8.151  -0.833  -2.400
  248    H    HIS  34           H        HIS  34 -14.619   0.562  -4.274
  249    HA   HIS  34           HA       HIS  34 -14.024  -1.763  -2.629
  250   1HB   HIS  34          2HB       HIS  34 -16.436  -2.503  -2.755
  251   2HB   HIS  34          1HB       HIS  34 -16.122  -1.147  -1.675
  252    HD1  HIS  34           1HD      HIS  34 -16.980  -1.388  -5.385
  253    HD2  HIS  34           2HD      HIS  34 -18.120   0.635  -1.939
  254    HE1  HIS  34           1HE      HIS  34 -18.819   0.174  -6.098
  255    HE2  HIS  34           2HE      HIS  34 -19.559   1.314  -3.978
  256    HA   PRO  35           HA       PRO  35 -14.220  -2.496  -7.266
  257   1HB   PRO  35          2HB       PRO  35 -11.369  -2.368  -7.534
  258   2HB   PRO  35          1HB       PRO  35 -12.574  -1.274  -8.213
  259   1HG   PRO  35          2HG       PRO  35 -10.761  -0.567  -6.269
  260   2HG   PRO  35          1HG       PRO  35 -12.307   0.252  -6.541
  261   1HD   PRO  35          2HD       PRO  35 -11.595  -1.831  -4.506
  262   2HD   PRO  35          1HD       PRO  35 -12.572  -0.359  -4.319
  263    H    SER  36           H        SER  36 -11.084  -3.484  -5.908
  264    HA   SER  36           HA       SER  36 -11.929  -6.212  -5.567
  265   1HB   SER  36          2HB       SER  36 -11.610  -6.169  -7.989
  266   2HB   SER  36          1HB       SER  36  -9.982  -5.522  -7.782
  267    HG   SER  36           HG       SER  36 -10.886  -8.035  -6.816
  268    H    ASP  37           H        ASP  37  -8.714  -6.348  -6.415
  269    HA   ASP  37           HA       ASP  37  -7.825  -5.676  -3.690
  270   1HB   ASP  37          2HB       ASP  37  -6.737  -8.003  -5.272
  271   2HB   ASP  37          1HB       ASP  37  -6.508  -7.649  -3.562
  272    H    ILE  38           H        ILE  38  -5.443  -5.390  -3.530
  273    HA   ILE  38           HA       ILE  38  -4.121  -4.617  -6.013
  274    HB   ILE  38           HB       ILE  38  -4.244  -2.690  -3.698
  275   1HG1  ILE  38          2HG1      ILE  38  -5.768  -2.552  -6.309
  276   2HG1  ILE  38          1HG1      ILE  38  -6.478  -2.965  -4.751
  277   1HG2  ILE  38          1HG2      ILE  38  -3.298  -1.113  -5.309
  278   2HG2  ILE  38          2HG2      ILE  38  -3.275  -2.381  -6.537
  279   3HG2  ILE  38          3HG2      ILE  38  -2.260  -2.524  -5.101
  280   1HD1  ILE  38          1HD1      ILE  38  -6.255  -0.442  -5.875
  281   2HD1  ILE  38          2HD1      ILE  38  -5.027  -0.478  -4.609
  282   3HD1  ILE  38          3HD1      ILE  38  -6.710  -0.829  -4.216
  283    H    GLU  39           H        GLU  39  -1.961  -4.977  -5.977
  284    HA   GLU  39           HA       GLU  39  -0.710  -5.548  -3.375
  285   1HB   GLU  39          2HB       GLU  39  -1.356  -7.597  -4.828
  286   2HB   GLU  39          1HB       GLU  39   0.001  -7.115  -5.837
  287   1HG   GLU  39          2HG       GLU  39   1.293  -7.115  -3.559
  288   2HG   GLU  39          1HG       GLU  39  -0.016  -8.188  -3.065
  289    H    VAL  40           H        VAL  40   1.445  -5.003  -3.158
  290    HA   VAL  40           HA       VAL  40   2.812  -3.780  -5.433
  291    HB   VAL  40           HB       VAL  40   2.526  -2.350  -2.786
  292   1HG1  VAL  40          1HG1      VAL  40   3.503  -0.450  -4.174
  293   2HG1  VAL  40          2HG1      VAL  40   3.954  -1.691  -5.343
  294   3HG1  VAL  40          3HG1      VAL  40   4.601  -1.748  -3.702
  295   1HG2  VAL  40          1HG2      VAL  40   1.322  -0.662  -4.356
  296   2HG2  VAL  40          2HG2      VAL  40   0.437  -2.051  -3.725
  297   3HG2  VAL  40          3HG2      VAL  40   1.060  -2.077  -5.375
  298    H    ASP  41           H        ASP  41   5.015  -3.989  -5.375
  299    HA   ASP  41           HA       ASP  41   6.443  -4.640  -2.978
  300   1HB   ASP  41          2HB       ASP  41   5.389  -6.829  -3.542
  301   2HB   ASP  41          1HB       ASP  41   6.222  -6.792  -5.093
  302    H    LEU  42           H        LEU  42   8.288  -3.568  -3.216
  303    HA   LEU  42           HA       LEU  42   9.896  -3.899  -5.581
  304   1HB   LEU  42          2HB       LEU  42   9.956  -1.632  -6.295
  305   2HB   LEU  42          1HB       LEU  42   8.273  -2.110  -6.208
  306    HG   LEU  42           HG       LEU  42   9.777  -0.288  -4.340
  307   1HD1  LEU  42          1HD1      LEU  42   8.373   1.388  -5.090
  308   2HD1  LEU  42          2HD1      LEU  42   7.152   0.253  -5.663
  309   3HD1  LEU  42          3HD1      LEU  42   8.660   0.453  -6.558
  310   1HD2  LEU  42          1HD2      LEU  42   8.509  -1.617  -2.858
  311   2HD2  LEU  42          2HD2      LEU  42   7.120  -1.639  -3.944
  312   3HD2  LEU  42          3HD2      LEU  42   7.567  -0.148  -3.115
  313    H    LEU  43           H        LEU  43  11.692  -1.919  -5.345
  314    HA   LEU  43           HA       LEU  43  13.579  -1.313  -4.236
  315   1HB   LEU  43          2HB       LEU  43  11.402  -0.999  -2.285
  316   2HB   LEU  43          1HB       LEU  43  13.003  -1.121  -1.580
  317    HG   LEU  43           HG       LEU  43  12.462   1.200  -1.886
  318   1HD1  LEU  43          1HD1      LEU  43  14.788   0.317  -2.419
  319   2HD1  LEU  43          2HD1      LEU  43  14.379   1.920  -3.028
  320   3HD1  LEU  43          3HD1      LEU  43  14.358   0.532  -4.116
  321   1HD2  LEU  43          1HD2      LEU  43  10.841   1.386  -3.498
  322   2HD2  LEU  43          2HD2      LEU  43  11.668   0.297  -4.612
  323   3HD2  LEU  43          3HD2      LEU  43  12.257   1.945  -4.389
  324    H    LYS  44           H        LYS  44  15.204  -1.998  -2.618
  325    HA   LYS  44           HA       LYS  44  14.897  -4.491  -1.265
  326   1HB   LYS  44          2HB       LYS  44  16.707  -5.648  -2.627
  327   2HB   LYS  44          1HB       LYS  44  15.121  -5.530  -3.375
  328   1HG   LYS  44          2HG       LYS  44  16.625  -5.004  -5.078
  329   2HG   LYS  44          1HG       LYS  44  16.003  -3.444  -4.539
  330   1HD   LYS  44          2HD       LYS  44  18.360  -4.269  -3.050
  331   2HD   LYS  44          1HD       LYS  44  18.667  -4.158  -4.784
  332   1HE   LYS  44          2HE       LYS  44  17.385  -1.987  -3.132
  333   2HE   LYS  44          1HE       LYS  44  19.097  -2.044  -3.550
  334   1HZ   LYS  44          1HZ       LYS  44  16.810  -1.352  -5.196
  335   2HZ   LYS  44          2HZ       LYS  44  17.984  -2.305  -5.955
  336   3HZ   LYS  44          3HZ       LYS  44  18.411  -0.813  -5.283
  337   1H    SER  45          1HT       SER  45  14.077  11.998   1.679
  338   2H    SER  45          2HT       SER  45  14.667  11.535   3.223
  339   3H    SER  45          3HT       SER  45  12.983  11.488   2.896
  340    HA   SER  45           HA       SER  45  13.409   9.826   1.185
  341   1HB   SER  45          2HB       SER  45  15.650   8.698   1.332
  342   2HB   SER  45          1HB       SER  45  15.722  10.348   0.714
  343    HG   SER  45           HG       SER  45  16.183   9.629   3.420
  344    H    ASN  46           H        ASN  46  11.967   8.563   2.211
  345    HA   ASN  46           HA       ASN  46  12.804   6.623   4.062
  346   1HB   ASN  46          2HB       ASN  46  11.580   7.329   6.063
  347   2HB   ASN  46          1HB       ASN  46  12.820   8.504   5.644
  348   1HD2  ASN  46          1HD2      ASN  46  12.111  10.407   4.434
  349   2HD2  ASN  46          2HD2      ASN  46  10.536  11.048   4.748
  350    H    PHE  47           H        PHE  47  10.790   5.512   5.094
  351    HA   PHE  47           HA       PHE  47   8.934   5.045   2.917
  352   1HB   PHE  47          2HB       PHE  47   9.842   3.102   4.019
  353   2HB   PHE  47          1HB       PHE  47   9.319   3.692   5.592
  354    HD1  PHE  47           1HD      PHE  47   7.875   2.837   2.258
  355    HD2  PHE  47           2HD      PHE  47   7.402   2.809   6.487
  356    HE1  PHE  47           1HE      PHE  47   5.760   1.605   2.010
  357    HE2  PHE  47           2HE      PHE  47   5.288   1.574   6.247
  358    HZ   PHE  47           HZ       PHE  47   4.464   0.970   4.006
  359    H    LEU  48           H        LEU  48   7.285   6.428   2.741
  360    HA   LEU  48           HA       LEU  48   5.831   7.164   5.198
  361   1HB   LEU  48          2HB       LEU  48   7.004   9.027   3.962
  362   2HB   LEU  48          1HB       LEU  48   5.896   8.746   2.632
  363    HG   LEU  48           HG       LEU  48   3.999   9.322   4.064
  364   1HD1  LEU  48          1HD1      LEU  48   4.382   8.838   6.239
  365   2HD1  LEU  48          2HD1      LEU  48   4.874  10.531   6.284
  366   3HD1  LEU  48          3HD1      LEU  48   6.092   9.263   6.149
  367   1HD2  LEU  48          1HD2      LEU  48   6.237  11.183   3.562
  368   2HD2  LEU  48          2HD2      LEU  48   4.977  11.745   4.660
  369   3HD2  LEU  48          3HD2      LEU  48   4.560  11.249   3.020
  370    H    ASN  49           H        ASN  49   4.532   5.269   5.003
  371    HA   ASN  49           HA       ASN  49   2.744   5.164   2.686
  372   1HB   ASN  49          2HB       ASN  49   3.744   3.051   3.206
  373   2HB   ASN  49          1HB       ASN  49   3.308   3.191   4.906
  374   1HD2  ASN  49          1HD2      ASN  49   1.303   3.899   2.097
  375   2HD2  ASN  49          2HD2      ASN  49   0.126   2.673   2.402
  376    H    CYS  50           H        CYS  50   1.121   6.584   2.945
  377    HA   CYS  50           HA       CYS  50  -0.084   7.063   5.524
  378   1HB   CYS  50          2HB       CYS  50   0.226   8.632   3.351
  379   2HB   CYS  50          1HB       CYS  50  -1.413   8.057   3.068
  380    HG   CYS  50           HG       CYS  50  -0.544   9.990   5.283
  381    H    TYR  51           H        TYR  51  -1.536   5.722   6.367
  382    HA   TYR  51           HA       TYR  51  -3.357   4.304   4.532
  383   1HB   TYR  51          2HB       TYR  51  -1.767   2.841   5.775
  384   2HB   TYR  51          1HB       TYR  51  -2.465   3.418   7.283
  385    HD1  TYR  51           1HD      TYR  51  -2.596   0.900   4.831
  386    HD2  TYR  51           2HD      TYR  51  -5.072   3.109   7.494
  387    HE1  TYR  51           1HE      TYR  51  -4.295  -0.874   4.715
  388    HE2  TYR  51           2HE      TYR  51  -6.777   1.341   7.385
  389    HH   TYR  51           HH       TYR  51  -7.466  -0.475   6.041
  390    H    VAL  52           H        VAL  52  -5.176   5.500   4.520
  391    HA   VAL  52           HA       VAL  52  -6.328   6.261   7.123
  392    HB   VAL  52           HB       VAL  52  -7.603   7.993   5.956
  393   1HG1  VAL  52          1HG1      VAL  52  -4.694   8.257   5.234
  394   2HG1  VAL  52          2HG1      VAL  52  -5.301   8.406   6.883
  395   3HG1  VAL  52          3HG1      VAL  52  -5.832   9.541   5.642
  396   1HG2  VAL  52          1HG2      VAL  52  -6.499   6.649   3.588
  397   2HG2  VAL  52          2HG2      VAL  52  -6.474   8.412   3.530
  398   3HG2  VAL  52          3HG2      VAL  52  -7.997   7.559   3.785
  399    H    SER  53           H        SER  53  -7.891   4.957   7.736
  400    HA   SER  53           HA       SER  53  -9.137   2.994   6.268
  401   1HB   SER  53          2HB       SER  53 -10.568   2.682   8.095
  402   2HB   SER  53          1HB       SER  53  -9.150   3.441   8.818
  403    HG   SER  53           HG       SER  53 -10.349   5.477   8.498
  404    H    GLY  54           H        GLY  54 -11.699   2.942   6.150
  405   1HA   GLY  54          2HA       GLY  54 -13.495   4.755   5.630
  406   2HA   GLY  54          1HA       GLY  54 -12.404   5.110   4.297
  407    H    PHE  55           H        PHE  55 -11.669   2.289   3.969
  408    HA   PHE  55           HA       PHE  55 -13.981   1.497   2.381
  409   1HB   PHE  55          2HB       PHE  55 -12.516   0.123   1.137
  410   2HB   PHE  55          1HB       PHE  55 -11.604   1.590   1.465
  411    HD1  PHE  55           1HD      PHE  55 -10.449  -1.060   0.642
  412    HD2  PHE  55           2HD      PHE  55 -11.153   0.627   4.485
  413    HE1  PHE  55           1HE      PHE  55  -8.619  -2.415   1.571
  414    HE2  PHE  55           2HE      PHE  55  -9.326  -0.722   5.417
  415    HZ   PHE  55           HZ       PHE  55  -8.054  -2.246   3.961
  416    H    HIS  56           H        HIS  56 -13.490  -1.258   2.228
  417    HA   HIS  56           HA       HIS  56 -13.394  -2.504   4.769
  418   1HB   HIS  56          2HB       HIS  56 -15.842  -1.297   4.260
  419   2HB   HIS  56          1HB       HIS  56 -16.109  -2.979   3.817
  420    HD1  HIS  56           1HD      HIS  56 -17.550  -3.614   5.789
  421    HD2  HIS  56           2HD      HIS  56 -13.913  -1.949   6.911
  422    HE1  HIS  56           1HE      HIS  56 -17.388  -3.967   8.272
  423    HE2  HIS  56           2HE      HIS  56 -15.247  -2.827   8.946
  424    HA   PRO  57           HA       PRO  57 -14.294  -5.719   1.426
  425   1HB   PRO  57          2HB       PRO  57 -15.776  -5.173  -0.713
  426   2HB   PRO  57          1HB       PRO  57 -16.518  -5.299   0.887
  427   1HG   PRO  57          2HG       PRO  57 -15.932  -2.888  -0.740
  428   2HG   PRO  57          1HG       PRO  57 -17.237  -3.170   0.422
  429   1HD   PRO  57          2HD       PRO  57 -14.776  -1.803   0.870
  430   2HD   PRO  57          1HD       PRO  57 -16.024  -2.197   2.066
  431    H    SER  58           H        SER  58 -11.917  -4.713   1.244
  432    HA   SER  58           HA       SER  58 -11.197  -4.987  -1.527
  433   1HB   SER  58          2HB       SER  58 -11.670  -2.396  -0.673
  434   2HB   SER  58          1HB       SER  58  -9.921  -2.559  -0.514
  435    HG   SER  58           HG       SER  58  -9.742  -2.912  -2.647
  436    H    ASP  59           H        ASP  59  -8.884  -5.163  -1.850
  437    HA   ASP  59           HA       ASP  59  -7.486  -5.951   0.622
  438   1HB   ASP  59          2HB       ASP  59  -7.778  -7.256  -1.987
  439   2HB   ASP  59          1HB       ASP  59  -6.113  -7.189  -1.419
  440    H    ILE  60           H        ILE  60  -5.454  -5.185   1.013
  441    HA   ILE  60           HA       ILE  60  -4.156  -3.555  -1.051
  442    HB   ILE  60           HB       ILE  60  -4.274  -2.540   1.768
  443   1HG1  ILE  60          2HG1      ILE  60  -6.608  -2.810   0.928
  444   2HG1  ILE  60          1HG1      ILE  60  -6.160  -1.133   1.216
  445   1HG2  ILE  60          1HG2      ILE  60  -3.329  -1.577  -0.853
  446   2HG2  ILE  60          2HG2      ILE  60  -2.705  -1.264   0.767
  447   3HG2  ILE  60          3HG2      ILE  60  -4.114  -0.380   0.179
  448   1HD1  ILE  60          1HD1      ILE  60  -6.703  -0.614  -0.860
  449   2HD1  ILE  60          2HD1      ILE  60  -7.208  -2.281  -1.127
  450   3HD1  ILE  60          3HD1      ILE  60  -5.552  -1.794  -1.485
  451    H    GLU  61           H        GLU  61  -2.354  -4.739  -1.335
  452    HA   GLU  61           HA       GLU  61  -0.770  -5.406   1.061
  453   1HB   GLU  61          2HB       GLU  61  -1.752  -7.194  -0.746
  454   2HB   GLU  61          1HB       GLU  61  -0.164  -6.866  -1.427
  455   1HG   GLU  61          2HG       GLU  61  -0.678  -7.752   1.403
  456   2HG   GLU  61          1HG       GLU  61  -0.194  -8.810   0.079
  457    H    VAL  62           H        VAL  62   1.199  -4.526   1.217
  458    HA   VAL  62           HA       VAL  62   2.464  -3.471  -1.216
  459    HB   VAL  62           HB       VAL  62   2.436  -1.978   1.407
  460   1HG1  VAL  62          1HG1      VAL  62   4.286  -1.161   0.365
  461   2HG1  VAL  62          2HG1      VAL  62   3.071  -0.139  -0.405
  462   3HG1  VAL  62          3HG1      VAL  62   3.692  -1.560  -1.247
  463   1HG2  VAL  62          1HG2      VAL  62   0.333  -1.418   0.880
  464   2HG2  VAL  62          2HG2      VAL  62   0.478  -2.057  -0.757
  465   3HG2  VAL  62          3HG2      VAL  62   1.055  -0.432  -0.392
  466    H    ASP  63           H        ASP  63   4.700  -3.504  -1.258
  467    HA   ASP  63           HA       ASP  63   6.091  -4.597   1.073
  468   1HB   ASP  63          2HB       ASP  63   5.780  -5.896  -1.578
  469   2HB   ASP  63          1HB       ASP  63   7.377  -5.974  -0.842
  470    H    LEU  64           H        LEU  64   8.296  -4.115   1.183
  471    HA   LEU  64           HA       LEU  64   9.519  -2.534  -0.921
  472   1HB   LEU  64          2HB       LEU  64   8.491  -1.394   1.587
  473   2HB   LEU  64          1HB       LEU  64  10.149  -0.960   1.219
  474    HG   LEU  64           HG       LEU  64   9.018  -0.438  -1.166
  475   1HD1  LEU  64          1HD1      LEU  64   6.796  -1.002   0.321
  476   2HD1  LEU  64          2HD1      LEU  64   6.824  -0.011  -1.138
  477   3HD1  LEU  64          3HD1      LEU  64   6.896   0.754   0.449
  478   1HD2  LEU  64          1HD2      LEU  64   8.582   1.798   0.623
  479   2HD2  LEU  64          2HD2      LEU  64   9.752   1.607  -0.683
  480   3HD2  LEU  64          3HD2      LEU  64  10.125   1.001   0.930
  481    H    LEU  65           H        LEU  65  10.699  -4.615  -0.815
  482    HA   LEU  65           HA       LEU  65  13.246  -4.500  -0.016
  483   1HB   LEU  65          2HB       LEU  65  12.749  -4.148   2.283
  484   2HB   LEU  65          1HB       LEU  65  11.578  -5.448   2.309
  485    HG   LEU  65           HG       LEU  65  13.817  -5.837   3.472
  486   1HD1  LEU  65          1HD1      LEU  65  12.042  -7.543   2.371
  487   2HD1  LEU  65          2HD1      LEU  65  13.459  -8.045   3.294
  488   3HD1  LEU  65          3HD1      LEU  65  13.516  -8.022   1.531
  489   1HD2  LEU  65          1HD2      LEU  65  15.729  -5.814   2.339
  490   2HD2  LEU  65          2HD2      LEU  65  14.837  -5.073   1.011
  491   3HD2  LEU  65          3HD2      LEU  65  15.066  -6.821   1.053
  492    H    LYS  66           H        LYS  66  14.336  -6.273  -0.711
  493    HA   LYS  66           HA       LYS  66  13.103  -8.881  -0.747
  494   1HB   LYS  66          2HB       LYS  66  12.339  -7.521  -2.838
  495   2HB   LYS  66          1HB       LYS  66  13.971  -7.829  -3.417
  496   1HG   LYS  66          2HG       LYS  66  12.500  -9.493  -4.310
  497   2HG   LYS  66          1HG       LYS  66  13.573 -10.253  -3.134
  498   1HD   LYS  66          2HD       LYS  66  11.098  -9.254  -1.955
  499   2HD   LYS  66          1HD       LYS  66  10.829 -10.474  -3.201
  500   1HE   LYS  66          2HE       LYS  66  12.771 -10.823  -0.927
  501   2HE   LYS  66          1HE       LYS  66  11.092 -11.353  -0.856
  502   1HZ   LYS  66          1HZ       LYS  66  11.872 -12.463  -3.147
  503   2HZ   LYS  66          2HZ       LYS  66  11.965 -13.248  -1.651
  504   3HZ   LYS  66          3HZ       LYS  66  13.335 -12.496  -2.296
  505   1H    SER  67          1HT       SER  67  15.381   0.630   6.674
  506   2H    SER  67          2HT       SER  67  15.691   0.821   8.352
  507   3H    SER  67          3HT       SER  67  16.989   0.542   7.263
  508    HA   SER  67           HA       SER  67  17.107   2.763   7.690
  509   1HB   SER  67          2HB       SER  67  16.592   1.810   5.179
  510   2HB   SER  67          1HB       SER  67  15.384   3.089   5.318
  511    HG   SER  67           HG       SER  67  18.106   3.500   5.969
  512    H    ASN  68           H        ASN  68  15.504   4.835   6.730
  513    HA   ASN  68           HA       ASN  68  13.890   5.410   8.922
  514   1HB   ASN  68          2HB       ASN  68  13.677   6.563   6.134
  515   2HB   ASN  68          1HB       ASN  68  13.046   7.295   7.606
  516   1HD2  ASN  68          1HD2      ASN  68  15.098   6.915   9.356
  517   2HD2  ASN  68          2HD2      ASN  68  16.488   7.801   8.835
  518    H    PHE  69           H        PHE  69  11.874   4.903   9.486
  519    HA   PHE  69           HA       PHE  69  10.064   3.815   7.438
  520   1HB   PHE  69          2HB       PHE  69  10.796   1.876   8.580
  521   2HB   PHE  69          1HB       PHE  69  10.724   2.672  10.147
  522    HD1  PHE  69           1HD      PHE  69   8.603   2.973  11.293
  523    HD2  PHE  69           2HD      PHE  69   8.822   0.959   7.551
  524    HE1  PHE  69           1HE      PHE  69   6.345   2.066  11.655
  525    HE2  PHE  69           2HE      PHE  69   6.564   0.050   7.906
  526    HZ   PHE  69           HZ       PHE  69   5.323   0.603   9.959
  527    H    LEU  70           H        LEU  70   7.954   4.426   7.577
  528    HA   LEU  70           HA       LEU  70   6.893   5.693   9.937
  529   1HB   LEU  70          2HB       LEU  70   8.237   7.435   8.544
  530   2HB   LEU  70          1HB       LEU  70   6.866   7.368   7.453
  531    HG   LEU  70           HG       LEU  70   5.372   8.100   9.235
  532   1HD1  LEU  70          1HD1      LEU  70   6.700   9.014  11.322
  533   2HD1  LEU  70          2HD1      LEU  70   7.808   7.712  10.890
  534   3HD1  LEU  70          3HD1      LEU  70   6.121   7.350  11.254
  535   1HD2  LEU  70          1HD2      LEU  70   7.536  10.080   9.511
  536   2HD2  LEU  70          2HD2      LEU  70   5.871  10.282   8.965
  537   3HD2  LEU  70          3HD2      LEU  70   7.091   9.651   7.860
  538    H    ASN  71           H        ASN  71   5.243   4.219   9.921
  539    HA   ASN  71           HA       ASN  71   3.523   4.156   7.534
  540   1HB   ASN  71          2HB       ASN  71   4.471   1.979   8.269
  541   2HB   ASN  71          1HB       ASN  71   3.647   2.170   9.814
  542   1HD2  ASN  71          1HD2      ASN  71   3.365   0.096   7.792
  543   2HD2  ASN  71          2HD2      ASN  71   1.700   0.094   7.334
  544    H    CYS  72           H        CYS  72   1.649   5.180   7.632
  545    HA   CYS  72           HA       CYS  72   0.629   6.046  10.230
  546   1HB   CYS  72          2HB       CYS  72   0.385   7.006   7.442
  547   2HB   CYS  72          1HB       CYS  72  -1.048   7.201   8.444
  548    HG   CYS  72           HG       CYS  72   0.289   9.336   8.789
  549    H    TYR  73           H        TYR  73   0.174   3.581  10.401
  550    HA   TYR  73           HA       TYR  73  -2.106   2.571   9.014
  551   1HB   TYR  73          2HB       TYR  73  -1.990   0.866  11.038
  552   2HB   TYR  73          1HB       TYR  73  -0.820   0.811   9.726
  553    HD1  TYR  73           1HD      TYR  73   1.138   0.009  10.684
  554    HD2  TYR  73           2HD      TYR  73  -0.998   3.112  12.662
  555    HE1  TYR  73           1HE      TYR  73   2.972   0.230  12.306
  556    HE2  TYR  73           2HE      TYR  73   0.830   3.341  14.289
  557    HH   TYR  73           HH       TYR  73   2.677   1.925  15.195
  558    H    VAL  74           H        VAL  74  -3.451   4.506   9.469
  559    HA   VAL  74           HA       VAL  74  -4.635   4.520  12.151
  560    HB   VAL  74           HB       VAL  74  -5.176   6.451   9.894
  561   1HG1  VAL  74          1HG1      VAL  74  -5.718   7.878  12.021
  562   2HG1  VAL  74          2HG1      VAL  74  -5.935   6.298  12.773
  563   3HG1  VAL  74          3HG1      VAL  74  -6.909   6.749  11.374
  564   1HG2  VAL  74          1HG2      VAL  74  -2.820   6.546  10.423
  565   2HG2  VAL  74          2HG2      VAL  74  -3.181   6.658  12.146
  566   3HG2  VAL  74          3HG2      VAL  74  -3.627   7.977  11.064
  567    H    SER  75           H        SER  75  -6.039   2.819  12.196
  568    HA   SER  75           HA       SER  75  -8.573   3.130  11.009
  569   1HB   SER  75          2HB       SER  75  -8.584   1.169   9.510
  570   2HB   SER  75          1HB       SER  75  -7.441   2.397   8.964
  571    HG   SER  75           HG       SER  75  -6.966  -0.149   9.544
  572    H    GLY  76           H        GLY  76  -6.761   0.115  11.512
  573   1HA   GLY  76          2HA       GLY  76  -7.168  -0.527  14.079
  574   2HA   GLY  76          1HA       GLY  76  -8.776  -0.763  13.412
  575    H    PHE  77           H        PHE  77  -7.803  -1.683  10.827
  576    HA   PHE  77           HA       PHE  77  -7.279  -3.624   9.768
  577   1HB   PHE  77          2HB       PHE  77  -5.459  -4.043  12.148
  578   2HB   PHE  77          1HB       PHE  77  -5.400  -4.959  10.646
  579    HD1  PHE  77           1HD      PHE  77  -5.803  -2.732   8.698
  580    HD2  PHE  77           2HD      PHE  77  -3.370  -3.009  12.179
  581    HE1  PHE  77           1HE      PHE  77  -4.257  -1.072   7.745
  582    HE2  PHE  77           2HE      PHE  77  -1.822  -1.348  11.233
  583    HZ   PHE  77           HZ       PHE  77  -2.263  -0.378   9.013
  584    H    HIS  78           H        HIS  78  -9.059  -4.865   9.722
  585    HA   HIS  78           HA       HIS  78  -9.244  -7.157  11.347
  586   1HB   HIS  78          2HB       HIS  78 -10.780  -4.781  12.216
  587   2HB   HIS  78          1HB       HIS  78 -11.674  -6.297  12.169
  588    HD1  HIS  78           1HD      HIS  78  -9.260  -8.113  13.108
  589    HD2  HIS  78           2HD      HIS  78 -10.552  -4.622  14.955
  590    HE1  HIS  78           1HE      HIS  78  -8.483  -8.287  15.494
  591    HE2  HIS  78           2HE      HIS  78  -9.353  -6.205  16.613
  592    HA   PRO  79           HA       PRO  79 -13.172  -7.022   8.566
  593   1HB   PRO  79          2HB       PRO  79 -13.675  -4.703   7.204
  594   2HB   PRO  79          1HB       PRO  79 -14.377  -5.098   8.775
  595   1HG   PRO  79          2HG       PRO  79 -12.068  -3.323   8.124
  596   2HG   PRO  79          1HG       PRO  79 -13.337  -3.116   9.341
  597   1HD   PRO  79          2HD       PRO  79 -10.829  -3.968   9.943
  598   2HD   PRO  79          1HD       PRO  79 -12.263  -4.448  10.870
  599    H    SER  80           H        SER  80 -11.529  -4.451   6.754
  600    HA   SER  80           HA       SER  80 -11.383  -5.891   4.369
  601   1HB   SER  80          2HB       SER  80  -9.700  -4.148   3.691
  602   2HB   SER  80          1HB       SER  80 -11.207  -3.493   4.333
  603    HG   SER  80           HG       SER  80 -10.146  -2.667   5.952
  604    H    ASP  81           H        ASP  81  -9.033  -6.007   3.261
  605    HA   ASP  81           HA       ASP  81  -7.344  -7.620   5.061
  606   1HB   ASP  81          2HB       ASP  81  -8.734  -8.504   2.791
  607   2HB   ASP  81          1HB       ASP  81  -7.054  -8.363   2.276
  608    H    ILE  82           H        ILE  82  -5.582  -6.450   5.457
  609    HA   ILE  82           HA       ILE  82  -4.068  -5.419   3.178
  610    HB   ILE  82           HB       ILE  82  -3.565  -3.317   4.331
  611   1HG1  ILE  82          2HG1      ILE  82  -3.992  -4.179   6.643
  612   2HG1  ILE  82          1HG1      ILE  82  -4.747  -2.624   6.315
  613   1HG2  ILE  82          1HG2      ILE  82  -6.549  -3.510   4.198
  614   2HG2  ILE  82          2HG2      ILE  82  -5.566  -3.697   2.747
  615   3HG2  ILE  82          3HG2      ILE  82  -5.490  -2.200   3.674
  616   1HD1  ILE  82          1HD1      ILE  82  -5.941  -5.121   7.110
  617   2HD1  ILE  82          2HD1      ILE  82  -6.680  -4.497   5.635
  618   3HD1  ILE  82          3HD1      ILE  82  -6.630  -3.497   7.086
  619    H    GLU  83           H        GLU  83  -1.817  -4.893   3.739
  620    HA   GLU  83           HA       GLU  83  -0.694  -5.701   6.218
  621   1HB   GLU  83          2HB       GLU  83  -1.297  -7.920   5.220
  622   2HB   GLU  83          1HB       GLU  83  -0.189  -7.573   3.900
  623   1HG   GLU  83          2HG       GLU  83   1.650  -7.402   5.542
  624   2HG   GLU  83          1HG       GLU  83   0.518  -7.870   6.809
  625    H    VAL  84           H        VAL  84   1.130  -4.584   6.451
  626    HA   VAL  84           HA       VAL  84   2.493  -3.631   4.019
  627    HB   VAL  84           HB       VAL  84   2.626  -2.381   6.762
  628   1HG1  VAL  84          1HG1      VAL  84   4.345  -2.074   4.701
  629   2HG1  VAL  84          2HG1      VAL  84   3.992  -0.817   5.888
  630   3HG1  VAL  84          3HG1      VAL  84   3.167  -0.814   4.329
  631   1HG2  VAL  84          1HG2      VAL  84   1.196  -0.589   5.527
  632   2HG2  VAL  84          2HG2      VAL  84   0.411  -2.009   6.217
  633   3HG2  VAL  84          3HG2      VAL  84   0.740  -1.938   4.486
  634    H    ASP  85           H        ASP  85   4.510  -4.277   3.650
  635    HA   ASP  85           HA       ASP  85   6.184  -5.146   5.891
  636   1HB   ASP  85          2HB       ASP  85   5.134  -7.176   4.948
  637   2HB   ASP  85          1HB       ASP  85   5.784  -6.765   3.364
  638    H    LEU  86           H        LEU  86   7.642  -3.522   5.739
  639    HA   LEU  86           HA       LEU  86   8.845  -2.966   3.119
  640   1HB   LEU  86          2HB       LEU  86   9.312  -1.367   5.618
  641   2HB   LEU  86          1HB       LEU  86   9.532  -0.872   3.952
  642    HG   LEU  86           HG       LEU  86   7.628   0.277   4.726
  643   1HD1  LEU  86          1HD1      LEU  86   7.118  -0.374   2.568
  644   2HD1  LEU  86          2HD1      LEU  86   5.713  -0.925   3.480
  645   3HD1  LEU  86          3HD1      LEU  86   6.963  -2.075   3.007
  646   1HD2  LEU  86          1HD2      LEU  86   6.178  -2.190   5.547
  647   2HD2  LEU  86          2HD2      LEU  86   5.979  -0.527   6.097
  648   3HD2  LEU  86          3HD2      LEU  86   7.357  -1.478   6.649
  649    H    LEU  87           H        LEU  87  11.257  -1.933   3.845
  650    HA   LEU  87           HA       LEU  87  12.819  -4.261   4.233
  651   1HB   LEU  87          2HB       LEU  87  14.726  -2.554   4.443
  652   2HB   LEU  87          1HB       LEU  87  13.874  -2.671   2.920
  653    HG   LEU  87           HG       LEU  87  14.487  -0.342   3.920
  654   1HD1  LEU  87          1HD1      LEU  87  11.710  -0.177   3.075
  655   2HD1  LEU  87          2HD1      LEU  87  12.695  -1.212   2.041
  656   3HD1  LEU  87          3HD1      LEU  87  13.171   0.462   2.323
  657   1HD2  LEU  87          1HD2      LEU  87  13.567  -0.431   6.078
  658   2HD2  LEU  87          2HD2      LEU  87  12.032  -1.069   5.494
  659   3HD2  LEU  87          3HD2      LEU  87  12.478   0.599   5.152
  660    H    LYS  88           H        LYS  88  11.600  -4.765   6.320
  661    HA   LYS  88           HA       LYS  88  11.688  -5.127   8.563
  662   1HB   LYS  88          2HB       LYS  88  14.442  -3.908   8.290
  663   2HB   LYS  88          1HB       LYS  88  13.850  -4.757   9.710
  664   1HG   LYS  88          2HG       LYS  88  14.014  -6.027   6.992
  665   2HG   LYS  88          1HG       LYS  88  15.326  -6.085   8.172
  666   1HD   LYS  88          2HD       LYS  88  12.520  -7.040   8.724
  667   2HD   LYS  88          1HD       LYS  88  13.826  -8.091   8.174
  668   1HE   LYS  88          2HE       LYS  88  14.096  -8.402  10.401
  669   2HE   LYS  88          1HE       LYS  88  15.057  -6.933  10.245
  670   1HZ   LYS  88          1HZ       LYS  88  12.239  -6.479  10.683
  671   2HZ   LYS  88          2HZ       LYS  88  13.578  -5.752  11.413
  672   3HZ   LYS  88          3HZ       LYS  88  13.023  -7.250  11.968
  Start of MODEL    8
    1   1H    SER   1          1HT       SER   1  15.632   8.601  -4.492
    2   2H    SER   1          2HT       SER   1  15.575  10.226  -5.043
    3   3H    SER   1          3HT       SER   1  16.553   9.073  -5.857
    4    HA   SER   1           HA       SER   1  14.729   9.293  -7.190
    5   1HB   SER   1          2HB       SER   1  13.613   7.103  -6.962
    6   2HB   SER   1          1HB       SER   1  15.352   6.966  -6.698
    7    HG   SER   1           HG       SER   1  13.256   6.861  -4.818
    8    H    ASN   2           H        ASN   2  13.753   9.021  -3.802
    9    HA   ASN   2           HA       ASN   2  11.945   9.793  -2.662
   10   1HB   ASN   2          2HB       ASN   2  12.707  11.909  -3.909
   11   2HB   ASN   2          1HB       ASN   2  11.357  11.603  -4.996
   12   1HD2  ASN   2          1HD2      ASN   2  12.306  12.499  -1.781
   13   2HD2  ASN   2          2HD2      ASN   2  10.759  13.068  -1.263
   14    H    PHE   3           H        PHE   3  11.380   7.461  -3.689
   15    HA   PHE   3           HA       PHE   3   9.328   7.263  -5.585
   16   1HB   PHE   3          2HB       PHE   3  10.615   5.319  -4.887
   17   2HB   PHE   3          1HB       PHE   3   9.982   5.451  -3.250
   18    HD1  PHE   3           1HD      PHE   3   7.881   4.541  -2.671
   19    HD2  PHE   3           2HD      PHE   3   9.101   4.670  -6.746
   20    HE1  PHE   3           1HE      PHE   3   6.008   3.063  -3.273
   21    HE2  PHE   3           2HE      PHE   3   7.229   3.193  -7.357
   22    HZ   PHE   3           HZ       PHE   3   5.680   2.389  -5.620
   23    H    LEU   4           H        LEU   4   7.373   8.138  -5.493
   24    HA   LEU   4           HA       LEU   4   5.970   8.172  -2.902
   25   1HB   LEU   4          2HB       LEU   4   4.890  10.258  -3.564
   26   2HB   LEU   4          1HB       LEU   4   6.634  10.433  -3.506
   27    HG   LEU   4           HG       LEU   4   6.159   9.771  -6.150
   28   1HD1  LEU   4          1HD1      LEU   4   3.685  10.335  -5.331
   29   2HD1  LEU   4          2HD1      LEU   4   4.271  10.738  -6.945
   30   3HD1  LEU   4          3HD1      LEU   4   4.239  11.972  -5.684
   31   1HD2  LEU   4          1HD2      LEU   4   6.508  12.294  -6.471
   32   2HD2  LEU   4          2HD2      LEU   4   7.768  11.383  -5.639
   33   3HD2  LEU   4          3HD2      LEU   4   6.628  12.362  -4.713
   34    H    ASN   5           H        ASN   5   4.680   6.414  -3.171
   35    HA   ASN   5           HA       ASN   5   3.260   5.974  -5.654
   36   1HB   ASN   5          2HB       ASN   5   4.200   4.255  -3.807
   37   2HB   ASN   5          1HB       ASN   5   2.543   4.421  -3.228
   38   1HD2  ASN   5          1HD2      ASN   5   4.067   4.253  -6.432
   39   2HD2  ASN   5          2HD2      ASN   5   3.066   2.977  -7.027
   40    H    CYS   6           H        CYS   6   1.838   7.672  -5.897
   41    HA   CYS   6           HA       CYS   6  -0.028   8.295  -3.756
   42   1HB   CYS   6          2HB       CYS   6   0.660   9.523  -6.395
   43   2HB   CYS   6          1HB       CYS   6  -0.901   9.889  -5.667
   44    HG   CYS   6           HG       CYS   6   0.437  10.865  -3.597
   45    H    TYR   7           H        TYR   7  -1.560   6.773  -3.519
   46    HA   TYR   7           HA       TYR   7  -2.974   5.840  -5.924
   47   1HB   TYR   7          2HB       TYR   7  -1.924   4.086  -4.512
   48   2HB   TYR   7          1HB       TYR   7  -2.930   4.603  -3.164
   49    HD1  TYR   7           1HD      TYR   7  -2.649   2.332  -5.823
   50    HD2  TYR   7           2HD      TYR   7  -5.530   4.610  -3.675
   51    HE1  TYR   7           1HE      TYR   7  -4.414   0.790  -6.567
   52    HE2  TYR   7           2HE      TYR   7  -7.303   3.074  -4.414
   53    HH   TYR   7           HH       TYR   7  -6.618   0.080  -5.949
   54    H    VAL   8           H        VAL   8  -4.868   6.766  -6.300
   55    HA   VAL   8           HA       VAL   8  -6.465   7.679  -3.998
   56    HB   VAL   8           HB       VAL   8  -5.614   9.597  -5.236
   57   1HG1  VAL   8          1HG1      VAL   8  -6.120   7.962  -7.498
   58   2HG1  VAL   8          2HG1      VAL   8  -5.332   9.538  -7.432
   59   3HG1  VAL   8          3HG1      VAL   8  -7.077   9.434  -7.662
   60   1HG2  VAL   8          1HG2      VAL   8  -7.966   9.524  -4.268
   61   2HG2  VAL   8          2HG2      VAL   8  -8.526   9.323  -5.927
   62   3HG2  VAL   8          3HG2      VAL   8  -7.638  10.775  -5.466
   63    H    SER   9           H        SER   9  -7.634   5.711  -3.915
   64    HA   SER   9           HA       SER   9  -9.209   4.163  -4.527
   65   1HB   SER   9          2HB       SER   9 -11.298   5.111  -5.246
   66   2HB   SER   9          1HB       SER   9 -10.527   6.284  -4.181
   67    HG   SER   9           HG       SER   9 -11.013   7.527  -5.847
   68    H    GLY  10           H        GLY  10 -10.855   3.837  -6.704
   69   1HA   GLY  10          2HA       GLY  10 -10.908   3.412  -9.001
   70   2HA   GLY  10          1HA       GLY  10  -9.247   3.969  -9.121
   71    H    PHE  11           H        PHE  11 -10.233   1.689 -10.414
   72    HA   PHE  11           HA       PHE  11  -8.259  -0.184  -9.890
   73   1HB   PHE  11          2HB       PHE  11 -10.151  -0.374  -7.909
   74   2HB   PHE  11          1HB       PHE  11 -10.703  -1.587  -9.061
   75    HD1  PHE  11           1HD      PHE  11  -8.533  -2.947 -10.080
   76    HD2  PHE  11           2HD      PHE  11  -8.883  -1.219  -6.207
   77    HE1  PHE  11           1HE      PHE  11  -6.846  -4.524  -9.231
   78    HE2  PHE  11           2HE      PHE  11  -7.196  -2.792  -5.349
   79    HZ   PHE  11           HZ       PHE  11  -6.173  -4.446  -6.861
   80    H    HIS  12           H        HIS  12  -7.997  -0.866 -11.909
   81    HA   HIS  12           HA       HIS  12 -10.312  -1.151 -13.654
   82   1HB   HIS  12          2HB       HIS  12  -7.685  -1.804 -14.796
   83   2HB   HIS  12          1HB       HIS  12  -8.934  -0.717 -15.387
   84    HD1  HIS  12           1HD      HIS  12  -9.010   1.651 -13.889
   85    HD2  HIS  12           2HD      HIS  12  -5.456  -0.495 -14.032
   86    HE1  HIS  12           1HE      HIS  12  -7.214   3.284 -13.237
   87    HE2  HIS  12           2HE      HIS  12  -5.062   1.987 -13.423
   88    HA   PRO  13           HA       PRO  13  -8.652  -5.585 -13.872
   89   1HB   PRO  13          2HB       PRO  13  -6.412  -6.328 -12.603
   90   2HB   PRO  13          1HB       PRO  13  -6.366  -5.460 -14.141
   91   1HG   PRO  13          2HG       PRO  13  -5.878  -4.447 -11.382
   92   2HG   PRO  13          1HG       PRO  13  -5.093  -3.993 -12.902
   93   1HD   PRO  13          2HD       PRO  13  -7.138  -2.579 -11.625
   94   2HD   PRO  13          1HD       PRO  13  -6.622  -2.367 -13.308
   95    H    SER  14           H        SER  14  -6.971  -5.910 -10.857
   96    HA   SER  14           HA       SER  14  -9.106  -5.959  -9.057
   97   1HB   SER  14          2HB       SER  14  -9.794  -8.198  -8.948
   98   2HB   SER  14          1HB       SER  14  -9.704  -7.892 -10.682
   99    HG   SER  14           HG       SER  14  -8.431  -9.743  -9.293
  100    H    ASP  15           H        ASP  15  -6.242  -7.908  -9.911
  101    HA   ASP  15           HA       ASP  15  -5.273  -7.514  -7.157
  102   1HB   ASP  15          2HB       ASP  15  -3.927  -9.588  -7.536
  103   2HB   ASP  15          1HB       ASP  15  -5.668  -9.852  -7.572
  104    H    ILE  16           H        ILE  16  -4.259  -5.533  -7.649
  105    HA   ILE  16           HA       ILE  16  -1.601  -5.838  -8.734
  106    HB   ILE  16           HB       ILE  16  -1.724  -4.093 -10.390
  107   1HG1  ILE  16          2HG1      ILE  16  -4.246  -3.404 -10.962
  108   2HG1  ILE  16          1HG1      ILE  16  -4.436  -3.681  -9.234
  109   1HG2  ILE  16          1HG2      ILE  16  -2.333  -6.413 -11.042
  110   2HG2  ILE  16          2HG2      ILE  16  -3.031  -5.172 -12.081
  111   3HG2  ILE  16          3HG2      ILE  16  -4.030  -5.970 -10.866
  112   1HD1  ILE  16          1HD1      ILE  16  -3.308  -1.825  -8.691
  113   2HD1  ILE  16          2HD1      ILE  16  -3.696  -1.335 -10.341
  114   3HD1  ILE  16          3HD1      ILE  16  -2.121  -2.043  -9.978
  115    H    GLU  17           H        GLU  17  -0.799  -3.254  -8.912
  116    HA   GLU  17           HA       GLU  17  -1.565  -1.267  -7.297
  117   1HB   GLU  17          2HB       GLU  17  -1.799  -2.619  -5.350
  118   2HB   GLU  17          1HB       GLU  17  -0.237  -3.381  -5.603
  119   1HG   GLU  17          2HG       GLU  17  -0.171  -1.796  -3.765
  120   2HG   GLU  17          1HG       GLU  17   0.881  -1.285  -5.083
  121    H    VAL  18           H        VAL  18   1.479  -2.914  -6.555
  122    HA   VAL  18           HA       VAL  18   2.903  -1.108  -8.371
  123    HB   VAL  18           HB       VAL  18   3.681  -1.467  -5.470
  124   1HG1  VAL  18          1HG1      VAL  18   5.691  -1.114  -6.527
  125   2HG1  VAL  18          2HG1      VAL  18   5.191   0.546  -6.201
  126   3HG1  VAL  18          3HG1      VAL  18   4.970  -0.141  -7.810
  127   1HG2  VAL  18          1HG2      VAL  18   1.884   0.406  -6.750
  128   2HG2  VAL  18          2HG2      VAL  18   3.238   1.233  -5.981
  129   3HG2  VAL  18          3HG2      VAL  18   2.214   0.154  -5.036
  130    H    ASP  19           H        ASP  19   4.719  -1.971  -9.274
  131    HA   ASP  19           HA       ASP  19   5.931  -4.365  -8.191
  132   1HB   ASP  19          2HB       ASP  19   3.958  -5.148  -9.563
  133   2HB   ASP  19          1HB       ASP  19   4.762  -4.471 -10.975
  134    H    LEU  20           H        LEU  20   7.717  -2.905  -8.065
  135    HA   LEU  20           HA       LEU  20   8.818  -1.863 -10.538
  136   1HB   LEU  20          2HB       LEU  20   9.277  -1.463  -7.659
  137   2HB   LEU  20          1HB       LEU  20  10.725  -1.392  -8.646
  138    HG   LEU  20           HG       LEU  20   9.756   0.829  -8.282
  139   1HD1  LEU  20          1HD1      LEU  20   9.305   1.227 -10.887
  140   2HD1  LEU  20          2HD1      LEU  20  10.058  -0.367 -10.966
  141   3HD1  LEU  20          3HD1      LEU  20  10.916   0.978 -10.215
  142   1HD2  LEU  20          1HD2      LEU  20   7.620   1.453  -8.987
  143   2HD2  LEU  20          2HD2      LEU  20   7.374  -0.113  -8.214
  144   3HD2  LEU  20          3HD2      LEU  20   7.420   0.005  -9.974
  145    H    LEU  21           H        LEU  21   9.300  -3.763 -11.660
  146    HA   LEU  21           HA       LEU  21  10.356  -5.759 -12.134
  147   1HB   LEU  21          2HB       LEU  21  12.722  -5.408 -12.500
  148   2HB   LEU  21          1HB       LEU  21  11.803  -3.999 -12.990
  149    HG   LEU  21           HG       LEU  21  12.628  -3.626 -10.282
  150   1HD1  LEU  21          1HD1      LEU  21  15.160  -3.481 -11.117
  151   2HD1  LEU  21          2HD1      LEU  21  14.634  -4.882 -12.049
  152   3HD1  LEU  21          3HD1      LEU  21  14.502  -4.893 -10.290
  153   1HD2  LEU  21          1HD2      LEU  21  13.367  -2.321 -12.893
  154   2HD2  LEU  21          2HD2      LEU  21  13.835  -1.701 -11.310
  155   3HD2  LEU  21          3HD2      LEU  21  12.129  -1.806 -11.748
  156    H    LYS  22           H        LYS  22   9.844  -7.299 -10.639
  157    HA   LYS  22           HA       LYS  22  11.364  -7.444  -8.158
  158   1HB   LYS  22          2HB       LYS  22   9.868  -9.518  -7.815
  159   2HB   LYS  22          1HB       LYS  22   9.117  -7.930  -7.755
  160   1HG   LYS  22          2HG       LYS  22   7.789  -9.580  -9.002
  161   2HG   LYS  22          1HG       LYS  22   8.259  -8.196  -9.989
  162   1HD   LYS  22          2HD       LYS  22   9.767  -9.429 -11.234
  163   2HD   LYS  22          1HD       LYS  22   9.973 -10.643  -9.969
  164   1HE   LYS  22          2HE       LYS  22   8.521 -11.929 -11.054
  165   2HE   LYS  22          1HE       LYS  22   7.267 -10.746 -10.681
  166   1HZ   LYS  22          1HZ       LYS  22   8.392  -9.602 -12.793
  167   2HZ   LYS  22          2HZ       LYS  22   7.101 -10.689 -12.911
  168   3HZ   LYS  22          3HZ       LYS  22   8.683 -11.225 -13.173
  169   1H    SER  23          1HT       SER  23  14.651   3.539  -0.958
  170   2H    SER  23          2HT       SER  23  15.667   4.399   0.124
  171   3H    SER  23          3HT       SER  23  16.354   3.396  -1.088
  172    HA   SER  23           HA       SER  23  16.459   5.776  -1.564
  173   1HB   SER  23          2HB       SER  23  14.872   3.953  -3.389
  174   2HB   SER  23          1HB       SER  23  15.623   5.462  -3.905
  175    HG   SER  23           HG       SER  23  17.536   4.546  -3.844
  176    H    ASN  24           H        ASN  24  14.551   6.041   0.365
  177    HA   ASN  24           HA       ASN  24  12.764   7.304   0.977
  178   1HB   ASN  24          2HB       ASN  24  13.403   8.446  -1.726
  179   2HB   ASN  24          1HB       ASN  24  11.995   9.013  -0.832
  180   1HD2  ASN  24          1HD2      ASN  24  14.396  10.453  -1.589
  181   2HD2  ASN  24          2HD2      ASN  24  15.099  11.031  -0.122
  182    H    PHE  25           H        PHE  25  11.327   5.582   1.171
  183    HA   PHE  25           HA       PHE  25   9.578   5.070  -1.136
  184   1HB   PHE  25          2HB       PHE  25  10.618   3.060  -0.267
  185   2HB   PHE  25          1HB       PHE  25  10.079   3.442   1.364
  186    HD1  PHE  25           1HD      PHE  25   7.757   3.150   2.007
  187    HD2  PHE  25           2HD      PHE  25   9.111   2.141  -1.899
  188    HE1  PHE  25           1HE      PHE  25   5.693   1.864   1.630
  189    HE2  PHE  25           2HE      PHE  25   7.049   0.853  -2.285
  190    HZ   PHE  25           HZ       PHE  25   5.336   0.713  -0.520
  191    H    LEU  26           H        LEU  26   7.693   6.090  -1.133
  192    HA   LEU  26           HA       LEU  26   6.332   6.528   1.436
  193   1HB   LEU  26          2HB       LEU  26   6.236   8.542  -0.793
  194   2HB   LEU  26          1HB       LEU  26   5.725   8.738   0.873
  195    HG   LEU  26           HG       LEU  26   8.407   8.180   1.143
  196   1HD1  LEU  26          1HD1      LEU  26   7.914   9.429  -1.489
  197   2HD1  LEU  26          2HD1      LEU  26   9.245   8.410  -0.945
  198   3HD1  LEU  26          3HD1      LEU  26   9.209  10.118  -0.511
  199   1HD2  LEU  26          1HD2      LEU  26   8.625  10.533   1.717
  200   2HD2  LEU  26          2HD2      LEU  26   7.112   9.878   2.344
  201   3HD2  LEU  26          3HD2      LEU  26   7.103  10.888   0.897
  202    H    ASN  27           H        ASN  27   4.846   4.919   1.164
  203    HA   ASN  27           HA       ASN  27   3.199   4.960  -1.264
  204   1HB   ASN  27          2HB       ASN  27   4.350   2.834  -0.087
  205   2HB   ASN  27          1HB       ASN  27   2.814   2.837   0.773
  206   1HD2  ASN  27          1HD2      ASN  27   0.922   3.339  -0.862
  207   2HD2  ASN  27          2HD2      ASN  27   0.910   2.310  -2.249
  208    H    CYS  28           H        CYS  28   1.482   6.243  -1.098
  209    HA   CYS  28           HA       CYS  28  -0.102   6.132   1.381
  210   1HB   CYS  28          2HB       CYS  28  -0.686   8.501   1.050
  211   2HB   CYS  28          1HB       CYS  28   1.048   8.284   1.263
  212    HG   CYS  28           HG       CYS  28  -0.128   8.705  -1.584
  213    H    TYR  29           H        TYR  29  -2.184   5.582   1.114
  214    HA   TYR  29           HA       TYR  29  -3.389   5.969  -1.534
  215   1HB   TYR  29          2HB       TYR  29  -4.229   3.774  -1.665
  216   2HB   TYR  29          1HB       TYR  29  -2.560   3.582  -1.146
  217    HD1  TYR  29           1HD      TYR  29  -2.095   2.234   0.688
  218    HD2  TYR  29           2HD      TYR  29  -6.018   3.820   0.245
  219    HE1  TYR  29           1HE      TYR  29  -2.851   0.893   2.606
  220    HE2  TYR  29           2HE      TYR  29  -6.780   2.486   2.165
  221    HH   TYR  29           HH       TYR  29  -5.827   1.404   4.153
  222    H    VAL  30           H        VAL  30  -5.711   5.999  -1.564
  223    HA   VAL  30           HA       VAL  30  -6.937   6.539   1.055
  224    HB   VAL  30           HB       VAL  30  -8.194   8.393   0.167
  225   1HG1  VAL  30          1HG1      VAL  30  -5.664   8.557   0.877
  226   2HG1  VAL  30          2HG1      VAL  30  -6.528   9.960   0.246
  227   3HG1  VAL  30          3HG1      VAL  30  -5.456   9.036  -0.808
  228   1HG2  VAL  30          1HG2      VAL  30  -7.044   9.025  -2.288
  229   2HG2  VAL  30          2HG2      VAL  30  -8.677   8.420  -2.008
  230   3HG2  VAL  30          3HG2      VAL  30  -7.373   7.294  -2.377
  231    H    SER  31           H        SER  31  -8.867   5.622   1.397
  232    HA   SER  31           HA       SER  31  -9.802   3.470   0.028
  233   1HB   SER  31          2HB       SER  31 -10.772   3.750   2.117
  234   2HB   SER  31          1HB       SER  31 -11.160   5.443   1.825
  235    HG   SER  31           HG       SER  31 -13.033   4.832   1.120
  236    H    GLY  32           H        GLY  32 -11.952   3.209  -1.100
  237   1HA   GLY  32          2HA       GLY  32 -13.477   4.920  -2.435
  238   2HA   GLY  32          1HA       GLY  32 -11.993   5.042  -3.368
  239    H    PHE  33           H        PHE  33 -11.226   2.287  -3.152
  240    HA   PHE  33           HA       PHE  33 -13.053   1.207  -5.142
  241   1HB   PHE  33          2HB       PHE  33 -11.304  -0.524  -5.471
  242   2HB   PHE  33          1HB       PHE  33 -10.700   1.115  -5.685
  243    HD1  PHE  33           1HD      PHE  33  -8.708   1.676  -4.692
  244    HD2  PHE  33           2HD      PHE  33 -11.021  -1.482  -3.023
  245    HE1  PHE  33           1HE      PHE  33  -6.911   1.216  -3.075
  246    HE2  PHE  33           2HE      PHE  33  -9.230  -1.945  -1.404
  247    HZ   PHE  33           HZ       PHE  33  -7.169  -0.596  -1.432
  248    H    HIS  34           H        HIS  34 -13.609  -1.128  -5.056
  249    HA   HIS  34           HA       HIS  34 -14.673  -1.754  -2.430
  250   1HB   HIS  34          2HB       HIS  34 -15.324  -2.421  -5.194
  251   2HB   HIS  34          1HB       HIS  34 -15.404  -3.821  -4.129
  252    HD1  HIS  34           1HD      HIS  34 -17.634  -4.142  -3.128
  253    HD2  HIS  34           2HD      HIS  34 -16.870  -0.135  -3.921
  254    HE1  HIS  34           1HE      HIS  34 -19.721  -2.913  -2.452
  255    HE2  HIS  34           2HE      HIS  34 -19.272  -0.504  -3.036
  256    HA   PRO  35           HA       PRO  35 -12.227  -5.099  -0.925
  257   1HB   PRO  35          2HB       PRO  35 -14.212  -7.032  -2.065
  258   2HB   PRO  35          1HB       PRO  35 -13.458  -7.010  -0.465
  259   1HG   PRO  35          2HG       PRO  35 -15.953  -6.137  -0.807
  260   2HG   PRO  35          1HG       PRO  35 -14.844  -5.327   0.314
  261   1HD   PRO  35          2HD       PRO  35 -15.830  -4.441  -2.336
  262   2HD   PRO  35          1HD       PRO  35 -15.284  -3.475  -0.952
  263    H    SER  36           H        SER  36 -10.509  -4.790  -2.383
  264    HA   SER  36           HA       SER  36 -10.421  -6.743  -4.587
  265   1HB   SER  36          2HB       SER  36 -10.365  -4.003  -4.897
  266   2HB   SER  36          1HB       SER  36  -8.653  -4.423  -4.900
  267    HG   SER  36           HG       SER  36  -9.329  -6.100  -6.485
  268    H    ASP  37           H        ASP  37  -7.755  -6.403  -5.283
  269    HA   ASP  37           HA       ASP  37  -6.330  -7.175  -2.824
  270   1HB   ASP  37          2HB       ASP  37  -6.974  -8.928  -4.798
  271   2HB   ASP  37          1HB       ASP  37  -5.394  -8.381  -5.352
  272    H    ILE  38           H        ILE  38  -5.005  -5.523  -2.414
  273    HA   ILE  38           HA       ILE  38  -3.505  -4.337  -4.649
  274    HB   ILE  38           HB       ILE  38  -2.956  -2.602  -2.714
  275   1HG1  ILE  38          2HG1      ILE  38  -4.450  -4.076  -1.162
  276   2HG1  ILE  38          1HG1      ILE  38  -4.584  -2.325  -1.075
  277   1HG2  ILE  38          1HG2      ILE  38  -3.958  -2.085  -4.874
  278   2HG2  ILE  38          2HG2      ILE  38  -4.746  -1.192  -3.574
  279   3HG2  ILE  38          3HG2      ILE  38  -5.533  -2.606  -4.276
  280   1HD1  ILE  38          1HD1      ILE  38  -6.770  -3.324  -1.015
  281   2HD1  ILE  38          2HD1      ILE  38  -6.452  -4.195  -2.514
  282   3HD1  ILE  38          3HD1      ILE  38  -6.571  -2.436  -2.525
  283    H    GLU  39           H        GLU  39  -1.489  -5.054  -4.863
  284    HA   GLU  39           HA       GLU  39   0.017  -5.697  -2.408
  285   1HB   GLU  39          2HB       GLU  39   1.115  -7.540  -3.628
  286   2HB   GLU  39          1HB       GLU  39  -0.617  -7.783  -3.459
  287   1HG   GLU  39          2HG       GLU  39  -0.894  -6.913  -5.773
  288   2HG   GLU  39          1HG       GLU  39   0.862  -6.890  -5.919
  289    H    VAL  40           H        VAL  40   1.699  -4.404  -2.180
  290    HA   VAL  40           HA       VAL  40   2.859  -3.086  -4.514
  291    HB   VAL  40           HB       VAL  40   3.505  -2.641  -1.597
  292   1HG1  VAL  40          1HG1      VAL  40   4.951  -1.047  -2.228
  293   2HG1  VAL  40          2HG1      VAL  40   3.913  -0.485  -3.539
  294   3HG1  VAL  40          3HG1      VAL  40   4.953  -1.889  -3.778
  295   1HG2  VAL  40          1HG2      VAL  40   1.103  -2.185  -2.308
  296   2HG2  VAL  40          2HG2      VAL  40   1.763  -0.886  -3.303
  297   3HG2  VAL  40          3HG2      VAL  40   1.979  -0.854  -1.554
  298    H    ASP  41           H        ASP  41   4.645  -3.825  -5.446
  299    HA   ASP  41           HA       ASP  41   6.538  -5.398  -3.829
  300   1HB   ASP  41          2HB       ASP  41   5.859  -5.945  -6.725
  301   2HB   ASP  41          1HB       ASP  41   6.924  -6.893  -5.691
  302    H    LEU  42           H        LEU  42   7.977  -3.726  -3.539
  303    HA   LEU  42           HA       LEU  42   9.099  -2.493  -5.964
  304   1HB   LEU  42          2HB       LEU  42   8.166  -1.242  -3.780
  305   2HB   LEU  42          1HB       LEU  42   9.828  -1.480  -3.274
  306    HG   LEU  42           HG       LEU  42   9.604  -0.388  -5.978
  307   1HD1  LEU  42          1HD1      LEU  42   8.974   1.881  -5.190
  308   2HD1  LEU  42          2HD1      LEU  42   8.500   1.170  -3.647
  309   3HD1  LEU  42          3HD1      LEU  42   7.652   0.714  -5.125
  310   1HD2  LEU  42          1HD2      LEU  42  11.533   0.629  -5.407
  311   2HD2  LEU  42          2HD2      LEU  42  11.531  -0.553  -4.099
  312   3HD2  LEU  42          3HD2      LEU  42  10.946   1.084  -3.808
  313    H    LEU  43           H        LEU  43  10.807  -3.602  -6.682
  314    HA   LEU  43           HA       LEU  43  12.739  -4.617  -4.703
  315   1HB   LEU  43          2HB       LEU  43  11.773  -5.667  -7.310
  316   2HB   LEU  43          1HB       LEU  43  13.449  -5.965  -6.890
  317    HG   LEU  43           HG       LEU  43  11.954  -7.833  -6.275
  318   1HD1  LEU  43          1HD1      LEU  43  12.802  -6.802  -3.646
  319   2HD1  LEU  43          2HD1      LEU  43  14.046  -6.869  -4.895
  320   3HD1  LEU  43          3HD1      LEU  43  13.171  -8.332  -4.443
  321   1HD2  LEU  43          1HD2      LEU  43  10.119  -7.625  -4.978
  322   2HD2  LEU  43          2HD2      LEU  43  10.154  -5.963  -5.567
  323   3HD2  LEU  43          3HD2      LEU  43  10.831  -6.353  -3.986
  324    H    LYS  44           H        LYS  44  12.711  -1.907  -5.612
  325    HA   LYS  44           HA       LYS  44  15.431  -1.569  -6.241
  326   1HB   LYS  44          2HB       LYS  44  13.600  -1.788  -8.511
  327   2HB   LYS  44          1HB       LYS  44  14.530  -0.297  -8.520
  328   1HG   LYS  44          2HG       LYS  44  16.374  -2.298  -7.910
  329   2HG   LYS  44          1HG       LYS  44  15.350  -2.975  -9.175
  330   1HD   LYS  44          2HD       LYS  44  16.516  -1.811 -10.670
  331   2HD   LYS  44          1HD       LYS  44  15.885  -0.329  -9.950
  332   1HE   LYS  44          2HE       LYS  44  17.770  -0.413  -8.314
  333   2HE   LYS  44          1HE       LYS  44  18.428  -1.775  -9.218
  334   1HZ   LYS  44          1HZ       LYS  44  18.422   1.048  -9.870
  335   2HZ   LYS  44          2HZ       LYS  44  18.074   0.017 -11.165
  336   3HZ   LYS  44          3HZ       LYS  44  19.520  -0.164 -10.307
  337   1H    SER  45          1HT       SER  45  17.136   6.379   3.013
  338   2H    SER  45          2HT       SER  45  18.136   5.087   3.538
  339   3H    SER  45          3HT       SER  45  17.441   6.158   4.684
  340    HA   SER  45           HA       SER  45  15.878   4.445   2.879
  341   1HB   SER  45          2HB       SER  45  15.784   2.807   4.573
  342   2HB   SER  45          1HB       SER  45  17.481   3.286   4.547
  343    HG   SER  45           HG       SER  45  16.838   4.808   6.274
  344    H    ASN  46           H        ASN  46  13.665   4.425   3.379
  345    HA   ASN  46           HA       ASN  46  12.538   5.825   5.568
  346   1HB   ASN  46          2HB       ASN  46  13.366   7.748   4.186
  347   2HB   ASN  46          1HB       ASN  46  12.275   7.230   2.905
  348   1HD2  ASN  46          1HD2      ASN  46  11.112   9.139   2.974
  349   2HD2  ASN  46          2HD2      ASN  46  10.032   9.517   4.268
  350    H    PHE  47           H        PHE  47  10.749   4.716   5.948
  351    HA   PHE  47           HA       PHE  47   9.222   3.674   3.651
  352   1HB   PHE  47          2HB       PHE  47  10.086   1.825   4.899
  353   2HB   PHE  47          1HB       PHE  47   9.602   2.548   6.428
  354    HD1  PHE  47           1HD      PHE  47   8.058   1.466   3.206
  355    HD2  PHE  47           2HD      PHE  47   7.726   1.723   7.436
  356    HE1  PHE  47           1HE      PHE  47   5.921   0.248   3.108
  357    HE2  PHE  47           2HE      PHE  47   5.593   0.503   7.350
  358    HZ   PHE  47           HZ       PHE  47   4.688  -0.237   5.184
  359    H    LEU  48           H        LEU  48   7.469   4.856   3.303
  360    HA   LEU  48           HA       LEU  48   5.960   5.847   5.630
  361   1HB   LEU  48          2HB       LEU  48   7.135   7.332   3.583
  362   2HB   LEU  48          1HB       LEU  48   5.431   7.288   3.170
  363    HG   LEU  48           HG       LEU  48   5.290   7.931   5.806
  364   1HD1  LEU  48          1HD1      LEU  48   7.886   8.983   4.736
  365   2HD1  LEU  48          2HD1      LEU  48   7.562   8.188   6.276
  366   3HD1  LEU  48          3HD1      LEU  48   6.992   9.832   5.996
  367   1HD2  LEU  48          1HD2      LEU  48   5.727  10.142   3.861
  368   2HD2  LEU  48          2HD2      LEU  48   4.464   9.937   5.075
  369   3HD2  LEU  48          3HD2      LEU  48   4.405   9.010   3.576
  370    H    ASN  49           H        ASN  49   4.497   4.169   5.767
  371    HA   ASN  49           HA       ASN  49   2.820   3.691   3.391
  372   1HB   ASN  49          2HB       ASN  49   3.896   1.662   4.156
  373   2HB   ASN  49          1HB       ASN  49   3.330   1.934   5.801
  374   1HD2  ASN  49          1HD2      ASN  49   1.778   0.589   6.311
  375   2HD2  ASN  49          2HD2      ASN  49   0.503   0.053   5.275
  376    H    CYS  50           H        CYS  50   1.618   5.626   3.858
  377    HA   CYS  50           HA       CYS  50  -0.131   5.427   6.214
  378   1HB   CYS  50          2HB       CYS  50  -0.521   7.817   5.956
  379   2HB   CYS  50          1HB       CYS  50   1.207   7.490   6.031
  380    HG   CYS  50           HG       CYS  50   0.674   9.206   4.111
  381    H    TYR  51           H        TYR  51  -2.370   5.895   5.997
  382    HA   TYR  51           HA       TYR  51  -3.498   5.973   3.325
  383   1HB   TYR  51          2HB       TYR  51  -5.118   4.071   4.082
  384   2HB   TYR  51          1HB       TYR  51  -3.543   3.658   3.417
  385    HD1  TYR  51           1HD      TYR  51  -2.736   1.759   4.437
  386    HD2  TYR  51           2HD      TYR  51  -4.683   4.685   6.833
  387    HE1  TYR  51           1HE      TYR  51  -2.241   0.433   6.448
  388    HE2  TYR  51           2HE      TYR  51  -4.190   3.369   8.851
  389    HH   TYR  51           HH       TYR  51  -3.661   1.112   9.493
  390    H    VAL  52           H        VAL  52  -5.837   6.371   3.354
  391    HA   VAL  52           HA       VAL  52  -6.703   7.668   5.855
  392    HB   VAL  52           HB       VAL  52  -7.370   8.669   3.088
  393   1HG1  VAL  52          1HG1      VAL  52  -8.689   9.121   5.404
  394   2HG1  VAL  52          2HG1      VAL  52  -8.613  10.271   4.068
  395   3HG1  VAL  52          3HG1      VAL  52  -7.513  10.434   5.437
  396   1HG2  VAL  52          1HG2      VAL  52  -5.223   9.570   5.003
  397   2HG2  VAL  52          2HG2      VAL  52  -5.787  10.531   3.636
  398   3HG2  VAL  52          3HG2      VAL  52  -5.015   8.970   3.357
  399    H    SER  53           H        SER  53  -8.547   6.942   6.647
  400    HA   SER  53           HA       SER  53 -10.589   5.963   6.841
  401   1HB   SER  53          2HB       SER  53 -10.923   7.606   4.765
  402   2HB   SER  53          1HB       SER  53 -11.136   6.076   3.915
  403    HG   SER  53           HG       SER  53 -13.014   5.864   4.825
  404    H    GLY  54           H        GLY  54 -12.030   4.187   5.438
  405   1HA   GLY  54          2HA       GLY  54 -10.109   2.019   4.849
  406   2HA   GLY  54          1HA       GLY  54 -11.576   1.757   5.781
  407    H    PHE  55           H        PHE  55 -11.229   0.132   3.713
  408    HA   PHE  55           HA       PHE  55 -13.308   1.007   1.856
  409   1HB   PHE  55          2HB       PHE  55 -11.862  -0.121  -0.002
  410   2HB   PHE  55          1HB       PHE  55 -11.524   1.540   0.470
  411    HD1  PHE  55           1HD      PHE  55  -9.262   1.592  -0.234
  412    HD2  PHE  55           2HD      PHE  55 -10.580  -1.407   2.484
  413    HE1  PHE  55           1HE      PHE  55  -6.924   0.989   0.231
  414    HE2  PHE  55           2HE      PHE  55  -8.245  -2.014   2.956
  415    HZ   PHE  55           HZ       PHE  55  -6.413  -0.812   1.828
  416    H    HIS  56           H        HIS  56 -14.101  -0.630   3.666
  417    HA   HIS  56           HA       HIS  56 -15.007  -2.676   4.106
  418   1HB   HIS  56          2HB       HIS  56 -14.471  -3.667   1.347
  419   2HB   HIS  56          1HB       HIS  56 -15.933  -3.788   2.316
  420    HD1  HIS  56           1HD      HIS  56 -17.593  -1.797   2.218
  421    HD2  HIS  56           2HD      HIS  56 -14.291  -1.400  -0.273
  422    HE1  HIS  56           1HE      HIS  56 -18.151   0.096   0.658
  423    HE2  HIS  56           2HE      HIS  56 -16.107   0.367  -0.791
  424    HA   PRO  57           HA       PRO  57 -11.809  -5.560   5.039
  425   1HB   PRO  57          2HB       PRO  57 -12.944  -8.010   4.598
  426   2HB   PRO  57          1HB       PRO  57 -13.296  -7.005   6.008
  427   1HG   PRO  57          2HG       PRO  57 -14.857  -7.330   3.475
  428   2HG   PRO  57          1HG       PRO  57 -15.440  -7.250   5.148
  429   1HD   PRO  57          2HD       PRO  57 -15.573  -5.134   3.494
  430   2HD   PRO  57          1HD       PRO  57 -15.267  -4.944   5.232
  431    H    SER  58           H        SER  58 -10.625  -4.774   3.105
  432    HA   SER  58           HA       SER  58 -10.628  -6.627   0.843
  433   1HB   SER  58          2HB       SER  58 -10.595  -3.998   0.711
  434   2HB   SER  58          1HB       SER  58  -8.864  -4.209   0.973
  435    HG   SER  58           HG       SER  58  -8.700  -4.787  -1.030
  436    H    ASP  59           H        ASP  59  -8.038  -6.394  -0.043
  437    HA   ASP  59           HA       ASP  59  -6.420  -7.511   2.147
  438   1HB   ASP  59          2HB       ASP  59  -6.731  -8.594  -0.656
  439   2HB   ASP  59          1HB       ASP  59  -5.457  -9.103   0.448
  440    H    ILE  60           H        ILE  60  -4.455  -6.629   2.345
  441    HA   ILE  60           HA       ILE  60  -3.346  -5.168   0.042
  442    HB   ILE  60           HB       ILE  60  -2.898  -4.229   2.855
  443   1HG1  ILE  60          2HG1      ILE  60  -5.077  -3.215   1.019
  444   2HG1  ILE  60          1HG1      ILE  60  -5.363  -4.298   2.377
  445   1HG2  ILE  60          1HG2      ILE  60  -1.419  -3.057   1.620
  446   2HG2  ILE  60          2HG2      ILE  60  -2.826  -2.045   1.295
  447   3HG2  ILE  60          3HG2      ILE  60  -2.331  -3.271   0.127
  448   1HD1  ILE  60          1HD1      ILE  60  -5.852  -2.255   3.291
  449   2HD1  ILE  60          2HD1      ILE  60  -4.595  -1.423   2.376
  450   3HD1  ILE  60          3HD1      ILE  60  -4.159  -2.443   3.747
  451    H    GLU  61           H        GLU  61  -1.450  -5.961  -0.556
  452    HA   GLU  61           HA       GLU  61   0.209  -7.326   1.457
  453   1HB   GLU  61          2HB       GLU  61  -0.714  -8.561  -0.645
  454   2HB   GLU  61          1HB       GLU  61   0.554  -7.694  -1.502
  455   1HG   GLU  61          2HG       GLU  61   1.860  -8.764   0.680
  456   2HG   GLU  61          1HG       GLU  61   0.720 -10.024   0.213
  457    H    VAL  62           H        VAL  62   1.013  -5.192   2.070
  458    HA   VAL  62           HA       VAL  62   2.555  -3.681   0.170
  459    HB   VAL  62           HB       VAL  62   2.555  -3.396   3.176
  460   1HG1  VAL  62          1HG1      VAL  62   3.399  -1.605   0.913
  461   2HG1  VAL  62          2HG1      VAL  62   4.368  -2.190   2.266
  462   3HG1  VAL  62          3HG1      VAL  62   3.093  -1.002   2.541
  463   1HG2  VAL  62          1HG2      VAL  62   0.664  -2.329   1.100
  464   2HG2  VAL  62          2HG2      VAL  62   0.900  -1.519   2.649
  465   3HG2  VAL  62          3HG2      VAL  62   0.293  -3.175   2.603
  466    H    ASP  63           H        ASP  63   4.605  -4.005  -0.372
  467    HA   ASP  63           HA       ASP  63   6.486  -5.104   1.547
  468   1HB   ASP  63          2HB       ASP  63   5.340  -6.990   0.150
  469   2HB   ASP  63          1HB       ASP  63   6.383  -6.420  -1.148
  470    H    LEU  64           H        LEU  64   8.252  -3.900   1.450
  471    HA   LEU  64           HA       LEU  64   9.174  -2.936  -1.159
  472   1HB   LEU  64          2HB       LEU  64   9.841  -0.847   0.517
  473   2HB   LEU  64          1HB       LEU  64   8.568  -0.847  -0.685
  474    HG   LEU  64           HG       LEU  64   7.853   0.006   1.528
  475   1HD1  LEU  64          1HD1      LEU  64   6.235  -2.425   1.288
  476   2HD1  LEU  64          2HD1      LEU  64   6.472  -1.540  -0.220
  477   3HD1  LEU  64          3HD1      LEU  64   5.767  -0.728   1.178
  478   1HD2  LEU  64          1HD2      LEU  64   7.575  -2.596   2.774
  479   2HD2  LEU  64          2HD2      LEU  64   8.192  -1.084   3.437
  480   3HD2  LEU  64          3HD2      LEU  64   9.264  -2.149   2.528
  481    H    LEU  65           H        LEU  65  11.360  -2.839  -1.414
  482    HA   LEU  65           HA       LEU  65  12.935  -4.176   0.632
  483   1HB   LEU  65          2HB       LEU  65  12.925  -4.488  -2.015
  484   2HB   LEU  65          1HB       LEU  65  14.147  -3.236  -1.912
  485    HG   LEU  65           HG       LEU  65  14.431  -5.627  -0.157
  486   1HD1  LEU  65          1HD1      LEU  65  14.526  -5.640  -3.108
  487   2HD1  LEU  65          2HD1      LEU  65  14.202  -6.951  -1.973
  488   3HD1  LEU  65          3HD1      LEU  65  15.861  -6.432  -2.272
  489   1HD2  LEU  65          1HD2      LEU  65  16.563  -4.231  -1.723
  490   2HD2  LEU  65          2HD2      LEU  65  16.685  -5.096  -0.191
  491   3HD2  LEU  65          3HD2      LEU  65  15.918  -3.509  -0.248
  492    H    LYS  66           H        LYS  66  13.559  -1.365  -1.476
  493    HA   LYS  66           HA       LYS  66  14.682   0.034   0.853
  494   1HB   LYS  66          2HB       LYS  66  16.010  -0.667  -1.690
  495   2HB   LYS  66          1HB       LYS  66  16.243   0.991  -1.152
  496   1HG   LYS  66          2HG       LYS  66  16.643  -1.153   0.852
  497   2HG   LYS  66          1HG       LYS  66  17.851  -0.992  -0.426
  498   1HD   LYS  66          2HD       LYS  66  18.200   1.337   0.158
  499   2HD   LYS  66          1HD       LYS  66  16.929   1.244   1.380
  500   1HE   LYS  66          2HE       LYS  66  18.828   0.979   2.661
  501   2HE   LYS  66          1HE       LYS  66  18.378  -0.695   2.341
  502   1HZ   LYS  66          1HZ       LYS  66  20.638   0.849   1.320
  503   2HZ   LYS  66          2HZ       LYS  66  19.953  -0.298   0.283
  504   3HZ   LYS  66          3HZ       LYS  66  20.562  -0.776   1.787
  505   1H    SER  67          1HT       SER  67  16.343   4.308  10.209
  506   2H    SER  67          2HT       SER  67  16.457   3.891   8.548
  507   3H    SER  67          3HT       SER  67  17.068   2.825   9.745
  508    HA   SER  67           HA       SER  67  15.033   1.994   8.947
  509   1HB   SER  67          2HB       SER  67  13.729   2.507  11.273
  510   2HB   SER  67          1HB       SER  67  15.075   1.375  11.141
  511    HG   SER  67           HG       SER  67  16.442   2.902  11.946
  512    H    ASN  68           H        ASN  68  14.040   4.835  10.843
  513    HA   ASN  68           HA       ASN  68  12.368   6.349  10.549
  514   1HB   ASN  68          2HB       ASN  68  13.974   6.839   8.582
  515   2HB   ASN  68          1HB       ASN  68  12.749   6.068   7.580
  516   1HD2  ASN  68          1HD2      ASN  68  13.704   8.838   7.643
  517   2HD2  ASN  68          2HD2      ASN  68  12.301   9.811   7.907
  518    H    PHE  69           H        PHE  69  10.571   5.275  11.245
  519    HA   PHE  69           HA       PHE  69   9.019   3.819   9.207
  520   1HB   PHE  69          2HB       PHE  69   9.626   2.366  11.046
  521   2HB   PHE  69          1HB       PHE  69   9.022   3.532  12.218
  522    HD1  PHE  69           1HD      PHE  69   7.365   2.553   9.065
  523    HD2  PHE  69           2HD      PHE  69   7.398   2.228  13.304
  524    HE1  PHE  69           1HE      PHE  69   5.158   1.469   8.995
  525    HE2  PHE  69           2HE      PHE  69   5.188   1.150  13.244
  526    HZ   PHE  69           HZ       PHE  69   4.065   0.767  11.086
  527    H    LEU  70           H        LEU  70   7.116   4.621   8.599
  528    HA   LEU  70           HA       LEU  70   5.527   6.255  10.376
  529   1HB   LEU  70          2HB       LEU  70   7.351   7.549   8.744
  530   2HB   LEU  70          1HB       LEU  70   5.853   7.656   7.841
  531    HG   LEU  70           HG       LEU  70   4.759   8.739   9.736
  532   1HD1  LEU  70          1HD1      LEU  70   6.349   9.524  11.601
  533   2HD1  LEU  70          2HD1      LEU  70   7.381   8.193  11.075
  534   3HD1  LEU  70          3HD1      LEU  70   5.745   7.868  11.651
  535   1HD2  LEU  70          1HD2      LEU  70   6.187  10.821   9.791
  536   2HD2  LEU  70          2HD2      LEU  70   5.739  10.235   8.189
  537   3HD2  LEU  70          3HD2      LEU  70   7.360   9.936   8.815
  538    H    ASN  71           H        ASN  71   3.999   4.585  10.092
  539    HA   ASN  71           HA       ASN  71   2.700   4.618   7.453
  540   1HB   ASN  71          2HB       ASN  71   2.315   2.297   7.507
  541   2HB   ASN  71          1HB       ASN  71   3.974   2.475   8.059
  542   1HD2  ASN  71          1HD2      ASN  71   2.297   0.247   8.520
  543   2HD2  ASN  71          2HD2      ASN  71   2.057   0.110  10.225
  544    H    CYS  72           H        CYS  72   0.552   2.894   8.288
  545    HA   CYS  72           HA       CYS  72  -1.571   3.077   9.078
  546   1HB   CYS  72          2HB       CYS  72  -0.572   2.548  11.209
  547   2HB   CYS  72          1HB       CYS  72  -0.061   4.215  11.439
  548    HG   CYS  72           HG       CYS  72  -2.139   4.253  12.787
  549    H    TYR  73           H        TYR  73  -0.416   5.967  10.725
  550    HA   TYR  73           HA       TYR  73  -0.889   8.159  10.490
  551   1HB   TYR  73          2HB       TYR  73  -0.777   7.104   7.798
  552   2HB   TYR  73          1HB       TYR  73  -1.870   8.480   7.903
  553    HD1  TYR  73           1HD      TYR  73   1.609   7.380   8.216
  554    HD2  TYR  73           2HD      TYR  73  -1.089  10.656   8.497
  555    HE1  TYR  73           1HE      TYR  73   3.512   8.939   8.192
  556    HE2  TYR  73           2HE      TYR  73   0.805  12.226   8.472
  557    HH   TYR  73           HH       TYR  73   3.738  11.583   9.189
  558    H    VAL  74           H        VAL  74  -3.355   7.499   8.075
  559    HA   VAL  74           HA       VAL  74  -5.354   8.277  10.082
  560    HB   VAL  74           HB       VAL  74  -5.552   8.548   7.080
  561   1HG1  VAL  74          1HG1      VAL  74  -7.244  10.019   9.053
  562   2HG1  VAL  74          2HG1      VAL  74  -7.648   8.357   8.622
  563   3HG1  VAL  74          3HG1      VAL  74  -7.583   9.599   7.373
  564   1HG2  VAL  74          1HG2      VAL  74  -3.887  10.006   8.623
  565   2HG2  VAL  74          2HG2      VAL  74  -5.366  10.955   8.764
  566   3HG2  VAL  74          3HG2      VAL  74  -4.679  10.624   7.174
  567    H    SER  75           H        SER  75  -5.064   5.841  10.533
  568    HA   SER  75           HA       SER  75  -6.096   3.896   8.802
  569   1HB   SER  75          2HB       SER  75  -4.752   3.395  10.822
  570   2HB   SER  75          1HB       SER  75  -6.115   3.879  11.830
  571    HG   SER  75           HG       SER  75  -5.648   1.510  10.722
  572    H    GLY  76           H        GLY  76  -8.041   2.539  10.263
  573   1HA   GLY  76          2HA       GLY  76 -10.265   2.968  11.188
  574   2HA   GLY  76          1HA       GLY  76 -10.334   4.399  10.168
  575    H    PHE  77           H        PHE  77  -9.624   0.934   9.703
  576    HA   PHE  77           HA       PHE  77 -11.637   0.906   7.558
  577   1HB   PHE  77          2HB       PHE  77 -10.067  -0.759   6.399
  578   2HB   PHE  77          1HB       PHE  77  -9.611   0.941   6.354
  579    HD1  PHE  77           1HD      PHE  77  -7.758   1.770   7.710
  580    HD2  PHE  77           2HD      PHE  77  -8.766  -2.364   7.608
  581    HE1  PHE  77           1HE      PHE  77  -5.570   1.216   8.690
  582    HE2  PHE  77           2HE      PHE  77  -6.580  -2.926   8.589
  583    HZ   PHE  77           HZ       PHE  77  -4.978  -1.134   9.131
  584    H    HIS  78           H        HIS  78 -12.352  -1.303   6.985
  585    HA   HIS  78           HA       HIS  78 -13.003  -2.773   9.364
  586   1HB   HIS  78          2HB       HIS  78 -13.897  -2.677   6.583
  587   2HB   HIS  78          1HB       HIS  78 -13.829  -4.319   7.214
  588    HD1  HIS  78           1HD      HIS  78 -14.695  -3.513  10.164
  589    HD2  HIS  78           2HD      HIS  78 -16.651  -2.460   6.652
  590    HE1  HIS  78           1HE      HIS  78 -17.073  -3.045  10.834
  591    HE2  HIS  78           2HE      HIS  78 -18.218  -2.330   8.706
  592    HA   PRO  79           HA       PRO  79 -10.117  -6.097   9.474
  593   1HB   PRO  79          2HB       PRO  79 -11.644  -8.336   8.772
  594   2HB   PRO  79          1HB       PRO  79 -11.434  -7.693  10.402
  595   1HG   PRO  79          2HG       PRO  79 -13.675  -7.292   8.477
  596   2HG   PRO  79          1HG       PRO  79 -13.722  -7.450  10.243
  597   1HD   PRO  79          2HD       PRO  79 -14.010  -5.073   9.058
  598   2HD   PRO  79          1HD       PRO  79 -13.110  -5.233  10.579
  599    H    SER  80           H        SER  80  -8.957  -5.323   7.639
  600    HA   SER  80           HA       SER  80  -9.470  -6.812   5.149
  601   1HB   SER  80          2HB       SER  80  -7.701  -4.391   5.240
  602   2HB   SER  80          1HB       SER  80  -8.678  -5.011   3.909
  603    HG   SER  80           HG       SER  80  -9.543  -3.100   4.895
  604    H    ASP  81           H        ASP  81  -8.106  -8.418   4.742
  605    HA   ASP  81           HA       ASP  81  -5.898  -9.093   6.275
  606   1HB   ASP  81          2HB       ASP  81  -6.241  -9.800   3.356
  607   2HB   ASP  81          1HB       ASP  81  -5.363 -10.712   4.581
  608    H    ILE  82           H        ILE  82  -4.421  -7.489   6.627
  609    HA   ILE  82           HA       ILE  82  -3.047  -6.395   4.262
  610    HB   ILE  82           HB       ILE  82  -2.236  -4.604   5.819
  611   1HG1  ILE  82          2HG1      ILE  82  -4.322  -5.794   7.660
  612   2HG1  ILE  82          1HG1      ILE  82  -2.582  -5.824   7.930
  613   1HG2  ILE  82          1HG2      ILE  82  -4.147  -3.284   5.554
  614   2HG2  ILE  82          2HG2      ILE  82  -5.233  -4.661   5.742
  615   3HG2  ILE  82          3HG2      ILE  82  -4.271  -4.492   4.275
  616   1HD1  ILE  82          1HD1      ILE  82  -4.130  -3.270   7.650
  617   2HD1  ILE  82          2HD1      ILE  82  -2.499  -3.500   8.283
  618   3HD1  ILE  82          3HD1      ILE  82  -3.892  -4.084   9.196
  619    H    GLU  83           H        GLU  83  -1.034  -7.014   3.892
  620    HA   GLU  83           HA       GLU  83   0.486  -8.261   6.084
  621   1HB   GLU  83          2HB       GLU  83  -0.206  -9.591   3.938
  622   2HB   GLU  83          1HB       GLU  83   1.120  -8.713   3.189
  623   1HG   GLU  83          2HG       GLU  83   2.708  -9.680   4.649
  624   2HG   GLU  83          1HG       GLU  83   1.450 -10.334   5.696
  625    H    VAL  84           H        VAL  84   1.863  -6.798   6.877
  626    HA   VAL  84           HA       VAL  84   3.104  -4.853   5.088
  627    HB   VAL  84           HB       VAL  84   3.387  -5.042   8.086
  628   1HG1  VAL  84          1HG1      VAL  84   3.571  -2.415   6.894
  629   2HG1  VAL  84          2HG1      VAL  84   4.759  -3.521   6.204
  630   3HG1  VAL  84          3HG1      VAL  84   4.708  -3.258   7.947
  631   1HG2  VAL  84          1HG2      VAL  84   1.404  -4.060   8.393
  632   2HG2  VAL  84          2HG2      VAL  84   1.034  -4.544   6.738
  633   3HG2  VAL  84          3HG2      VAL  84   1.664  -2.929   7.065
  634    H    ASP  85           H        ASP  85   5.155  -4.942   4.438
  635    HA   ASP  85           HA       ASP  85   7.024  -6.721   5.841
  636   1HB   ASP  85          2HB       ASP  85   6.861  -6.567   2.828
  637   2HB   ASP  85          1HB       ASP  85   7.827  -7.675   3.798
  638    H    LEU  86           H        LEU  86   8.106  -4.997   6.750
  639    HA   LEU  86           HA       LEU  86   9.108  -2.870   5.047
  640   1HB   LEU  86          2HB       LEU  86   9.764  -3.248   7.955
  641   2HB   LEU  86          1HB       LEU  86   9.770  -1.765   7.024
  642    HG   LEU  86           HG       LEU  86   7.866  -1.486   8.276
  643   1HD1  LEU  86          1HD1      LEU  86   5.968  -1.702   6.872
  644   2HD1  LEU  86          2HD1      LEU  86   6.684  -3.051   5.994
  645   3HD1  LEU  86          3HD1      LEU  86   7.352  -1.430   5.814
  646   1HD2  LEU  86          1HD2      LEU  86   8.138  -4.072   8.946
  647   2HD2  LEU  86          2HD2      LEU  86   6.690  -4.167   7.943
  648   3HD2  LEU  86          3HD2      LEU  86   6.720  -3.103   9.349
  649    H    LEU  87           H        LEU  87  10.464  -4.241   3.733
  650    HA   LEU  87           HA       LEU  87  12.476  -5.082   3.091
  651   1HB   LEU  87          2HB       LEU  87  13.367  -2.998   3.918
  652   2HB   LEU  87          1HB       LEU  87  13.371  -3.604   5.563
  653    HG   LEU  87           HG       LEU  87  15.144  -5.161   5.050
  654   1HD1  LEU  87          1HD1      LEU  87  14.678  -5.866   2.856
  655   2HD1  LEU  87          2HD1      LEU  87  16.218  -5.012   2.756
  656   3HD1  LEU  87          3HD1      LEU  87  14.734  -4.220   2.226
  657   1HD2  LEU  87          1HD2      LEU  87  16.069  -3.145   5.706
  658   2HD2  LEU  87          2HD2      LEU  87  15.530  -2.305   4.253
  659   3HD2  LEU  87          3HD2      LEU  87  16.874  -3.445   4.166
  660    H    LYS  88           H        LYS  88  12.646  -7.218   3.161
  661    HA   LYS  88           HA       LYS  88  13.461  -8.487   5.667
  662   1HB   LYS  88          2HB       LYS  88  11.074  -9.276   4.004
  663   2HB   LYS  88          1HB       LYS  88  11.863 -10.400   5.103
  664   1HG   LYS  88          2HG       LYS  88  11.311  -7.927   6.451
  665   2HG   LYS  88          1HG       LYS  88   9.845  -8.555   5.694
  666   1HD   LYS  88          2HD       LYS  88   9.880 -10.504   6.945
  667   2HD   LYS  88          1HD       LYS  88  11.610 -10.384   7.271
  668   1HE   LYS  88          2HE       LYS  88   9.827  -8.251   8.325
  669   2HE   LYS  88          1HE       LYS  88   9.796  -9.825   9.118
  670   1HZ   LYS  88          1HZ       LYS  88  11.461  -8.840  10.277
  671   2HZ   LYS  88          2HZ       LYS  88  11.944  -7.847   8.996
  672   3HZ   LYS  88          3HZ       LYS  88  12.390  -9.480   9.014
  Start of MODEL    9
    1   1H    SER   1          1HT       SER   1  16.712   5.304  -3.104
    2   2H    SER   1          2HT       SER   1  17.644   6.295  -4.152
    3   3H    SER   1          3HT       SER   1  17.732   4.585  -4.280
    4    HA   SER   1           HA       SER   1  16.412   5.603  -6.016
    5   1HB   SER   1          2HB       SER   1  14.555   4.028  -4.272
    6   2HB   SER   1          1HB       SER   1  14.897   3.849  -5.992
    7    HG   SER   1           HG       SER   1  15.797   2.191  -4.575
    8    H    ASN   2           H        ASN   2  13.658   5.695  -5.947
    9    HA   ASN   2           HA       ASN   2  12.542   7.408  -4.024
   10   1HB   ASN   2          2HB       ASN   2  12.388   9.472  -5.516
   11   2HB   ASN   2          1HB       ASN   2  13.948   9.165  -4.759
   12   1HD2  ASN   2          1HD2      ASN   2  12.511  10.061  -7.542
   13   2HD2  ASN   2          2HD2      ASN   2  13.728   9.591  -8.675
   14    H    PHE   3           H        PHE   3  10.892   5.871  -4.343
   15    HA   PHE   3           HA       PHE   3   9.437   6.098  -6.896
   16   1HB   PHE   3          2HB       PHE   3  10.047   3.837  -6.538
   17   2HB   PHE   3          1HB       PHE   3   9.601   3.899  -4.841
   18    HD1  PHE   3           1HD      PHE   3   7.119   4.161  -4.289
   19    HD2  PHE   3           2HD      PHE   3   8.558   3.046  -8.131
   20    HE1  PHE   3           1HE      PHE   3   4.925   3.193  -4.818
   21    HE2  PHE   3           2HE      PHE   3   6.360   2.081  -8.676
   22    HZ   PHE   3           HZ       PHE   3   4.540   2.153  -7.017
   23    H    LEU   4           H        LEU   4   7.059   6.057  -6.769
   24    HA   LEU   4           HA       LEU   4   5.927   6.952  -4.233
   25   1HB   LEU   4          2HB       LEU   4   6.742   8.932  -5.640
   26   2HB   LEU   4          1HB       LEU   4   5.430   8.542  -6.735
   27    HG   LEU   4           HG       LEU   4   3.861   8.798  -4.760
   28   1HD1  LEU   4          1HD1      LEU   4   6.167  10.266  -3.510
   29   2HD1  LEU   4          2HD1      LEU   4   5.744   8.608  -3.082
   30   3HD1  LEU   4          3HD1      LEU   4   4.588   9.911  -2.813
   31   1HD2  LEU   4          1HD2      LEU   4   3.576  11.055  -5.176
   32   2HD2  LEU   4          2HD2      LEU   4   4.463  10.519  -6.604
   33   3HD2  LEU   4          3HD2      LEU   4   5.309  11.357  -5.303
   34    H    ASN   5           H        ASN   5   3.775   6.510  -3.979
   35    HA   ASN   5           HA       ASN   5   2.109   5.718  -6.185
   36   1HB   ASN   5          2HB       ASN   5   3.316   3.632  -5.878
   37   2HB   ASN   5          1HB       ASN   5   2.978   3.653  -4.150
   38   1HD2  ASN   5          1HD2      ASN   5   0.866   3.241  -3.434
   39   2HD2  ASN   5          2HD2      ASN   5  -0.280   2.421  -4.434
   40    H    CYS   6           H        CYS   6   0.262   6.696  -5.705
   41    HA   CYS   6           HA       CYS   6  -0.703   6.582  -2.925
   42   1HB   CYS   6          2HB       CYS   6   0.105   8.838  -3.405
   43   2HB   CYS   6          1HB       CYS   6  -0.915   8.917  -4.837
   44    HG   CYS   6           HG       CYS   6  -2.418   8.559  -2.184
   45    H    TYR   7           H        TYR   7  -2.903   6.350  -2.614
   46    HA   TYR   7           HA       TYR   7  -4.497   5.772  -5.025
   47   1HB   TYR   7          2HB       TYR   7  -3.717   3.895  -3.191
   48   2HB   TYR   7          1HB       TYR   7  -5.289   4.371  -2.559
   49    HD1  TYR   7           1HD      TYR   7  -3.537   2.490  -5.078
   50    HD2  TYR   7           2HD      TYR   7  -7.308   4.178  -4.059
   51    HE1  TYR   7           1HE      TYR   7  -4.631   1.021  -6.719
   52    HE2  TYR   7           2HE      TYR   7  -8.413   2.713  -5.697
   53    HH   TYR   7           HH       TYR   7  -6.656   0.191  -7.398
   54    H    VAL   8           H        VAL   8  -6.484   6.697  -5.132
   55    HA   VAL   8           HA       VAL   8  -7.652   7.856  -2.718
   56    HB   VAL   8           HB       VAL   8  -7.298   9.514  -5.215
   57   1HG1  VAL   8          1HG1      VAL   8  -8.267  10.189  -2.439
   58   2HG1  VAL   8          2HG1      VAL   8  -9.239  10.123  -3.909
   59   3HG1  VAL   8          3HG1      VAL   8  -7.995  11.359  -3.730
   60   1HG2  VAL   8          1HG2      VAL   8  -5.129   9.052  -4.117
   61   2HG2  VAL   8          2HG2      VAL   8  -5.771   9.733  -2.622
   62   3HG2  VAL   8          3HG2      VAL   8  -5.585  10.754  -4.049
   63    H    SER   9           H        SER   9  -9.757   7.442  -2.634
   64    HA   SER   9           HA       SER   9 -11.900   6.973  -3.237
   65   1HB   SER   9          2HB       SER   9 -11.363   8.993  -4.818
   66   2HB   SER   9          1HB       SER   9 -11.352   7.761  -6.081
   67    HG   SER   9           HG       SER   9 -13.491   8.052  -4.250
   68    H    GLY  10           H        GLY  10 -12.921   5.977  -5.700
   69   1HA   GLY  10          2HA       GLY  10 -12.363   3.239  -5.422
   70   2HA   GLY  10          1HA       GLY  10 -13.233   3.970  -6.761
   71    H    PHE  11           H        PHE  11 -12.380   3.077  -8.537
   72    HA   PHE  11           HA       PHE  11  -9.824   3.811  -9.439
   73   1HB   PHE  11          2HB       PHE  11  -8.587   1.774  -9.327
   74   2HB   PHE  11          1HB       PHE  11  -9.186   2.093  -7.707
   75    HD1  PHE  11           1HD      PHE  11 -12.104   1.124  -8.732
   76    HD2  PHE  11           2HD      PHE  11  -8.191  -0.547  -8.598
   77    HE1  PHE  11           1HE      PHE  11 -13.074  -1.132  -8.654
   78    HE2  PHE  11           2HE      PHE  11  -9.157  -2.808  -8.524
   79    HZ   PHE  11           HZ       PHE  11 -11.602  -3.102  -8.552
   80    H    HIS  12           H        HIS  12  -9.247   1.729 -11.193
   81    HA   HIS  12           HA       HIS  12 -11.693   1.606 -12.826
   82   1HB   HIS  12          2HB       HIS  12  -9.110   2.714 -13.453
   83   2HB   HIS  12          1HB       HIS  12  -9.479   1.393 -14.556
   84    HD1  HIS  12           1HD      HIS  12 -10.286   2.455 -16.638
   85    HD2  HIS  12           2HD      HIS  12 -11.908   4.245 -13.257
   86    HE1  HIS  12           1HE      HIS  12 -11.923   4.160 -17.499
   87    HE2  HIS  12           2HE      HIS  12 -12.957   5.166 -15.434
   88    HA   PRO  13           HA       PRO  13  -9.313  -2.438 -14.058
   89   1HB   PRO  13          2HB       PRO  13  -7.060  -2.954 -12.532
   90   2HB   PRO  13          1HB       PRO  13  -7.044  -2.273 -14.161
   91   1HG   PRO  13          2HG       PRO  13  -6.842  -0.885 -11.521
   92   2HG   PRO  13          1HG       PRO  13  -5.965  -0.563 -13.029
   93   1HD   PRO  13          2HD       PRO  13  -8.010   0.977 -12.261
   94   2HD   PRO  13          1HD       PRO  13  -7.753   0.580 -13.971
   95    H    SER  14           H        SER  14  -8.363  -4.433 -12.474
   96    HA   SER  14           HA       SER  14 -10.037  -4.371 -10.056
   97   1HB   SER  14          2HB       SER  14 -10.386  -6.918 -10.668
   98   2HB   SER  14          1HB       SER  14 -11.417  -5.674 -11.377
   99    HG   SER  14           HG       SER  14  -9.717  -7.376 -12.593
  100    H    ASP  15           H        ASP  15  -7.772  -6.577 -11.713
  101    HA   ASP  15           HA       ASP  15  -6.511  -7.135  -9.130
  102   1HB   ASP  15          2HB       ASP  15  -7.290  -8.966 -10.772
  103   2HB   ASP  15          1HB       ASP  15  -5.874  -8.526 -11.724
  104    H    ILE  16           H        ILE  16  -5.157  -5.425  -8.760
  105    HA   ILE  16           HA       ILE  16  -3.270  -4.650 -10.858
  106    HB   ILE  16           HB       ILE  16  -3.580  -3.386  -8.139
  107   1HG1  ILE  16          2HG1      ILE  16  -4.862  -2.474 -10.720
  108   2HG1  ILE  16          1HG1      ILE  16  -5.714  -3.394  -9.484
  109   1HG2  ILE  16          1HG2      ILE  16  -2.328  -2.465 -10.719
  110   2HG2  ILE  16          2HG2      ILE  16  -1.509  -2.824  -9.200
  111   3HG2  ILE  16          3HG2      ILE  16  -2.583  -1.431  -9.314
  112   1HD1  ILE  16          1HD1      ILE  16  -4.356  -0.996  -8.497
  113   2HD1  ILE  16          2HD1      ILE  16  -5.977  -1.606  -8.169
  114   3HD1  ILE  16          3HD1      ILE  16  -5.661  -0.695  -9.645
  115    H    GLU  17           H        GLU  17  -1.041  -4.703 -10.583
  116    HA   GLU  17           HA       GLU  17   0.072  -5.890  -8.177
  117   1HB   GLU  17          2HB       GLU  17  -0.515  -7.841  -9.541
  118   2HB   GLU  17          1HB       GLU  17   0.399  -7.183 -10.891
  119   1HG   GLU  17          2HG       GLU  17   2.258  -7.200  -8.890
  120   2HG   GLU  17          1HG       GLU  17   1.309  -8.642  -8.535
  121    H    VAL  18           H        VAL  18   1.811  -4.744  -7.668
  122    HA   VAL  18           HA       VAL  18   3.255  -3.347  -9.819
  123    HB   VAL  18           HB       VAL  18   3.388  -2.721  -6.871
  124   1HG1  VAL  18          1HG1      VAL  18   5.175  -1.601  -7.676
  125   2HG1  VAL  18          2HG1      VAL  18   3.948  -0.425  -8.151
  126   3HG1  VAL  18          3HG1      VAL  18   4.560  -1.588  -9.328
  127   1HG2  VAL  18          1HG2      VAL  18   1.228  -2.108  -7.144
  128   2HG2  VAL  18          2HG2      VAL  18   1.368  -2.002  -8.899
  129   3HG2  VAL  18          3HG2      VAL  18   1.955  -0.683  -7.887
  130    H    ASP  19           H        ASP  19   5.305  -3.853 -10.257
  131    HA   ASP  19           HA       ASP  19   6.956  -5.164  -8.242
  132   1HB   ASP  19          2HB       ASP  19   5.813  -6.970  -9.553
  133   2HB   ASP  19          1HB       ASP  19   6.605  -6.354 -11.000
  134    H    LEU  20           H        LEU  20   8.210  -3.292  -8.219
  135    HA   LEU  20           HA       LEU  20   9.649  -2.685 -10.715
  136   1HB   LEU  20          2HB       LEU  20   8.235  -0.967  -9.164
  137   2HB   LEU  20          1HB       LEU  20   9.832  -0.788  -8.464
  138    HG   LEU  20           HG       LEU  20   9.695  -0.636 -11.415
  139   1HD1  LEU  20          1HD1      LEU  20   7.754   0.635 -11.050
  140   2HD1  LEU  20          2HD1      LEU  20   9.057   1.813 -11.197
  141   3HD1  LEU  20          3HD1      LEU  20   8.422   1.396  -9.606
  142   1HD2  LEU  20          1HD2      LEU  20  11.685  -0.280  -9.757
  143   2HD2  LEU  20          2HD2      LEU  20  10.993   1.335  -9.592
  144   3HD2  LEU  20          3HD2      LEU  20  11.509   0.754 -11.175
  145    H    LEU  21           H        LEU  21  11.756  -3.105 -10.825
  146    HA   LEU  21           HA       LEU  21  13.293  -3.354  -8.338
  147   1HB   LEU  21          2HB       LEU  21  12.686  -5.453 -10.264
  148   2HB   LEU  21          1HB       LEU  21  14.411  -5.252 -10.023
  149    HG   LEU  21           HG       LEU  21  13.801  -5.360  -7.484
  150   1HD1  LEU  21          1HD1      LEU  21  11.878  -6.880  -7.087
  151   2HD1  LEU  21          2HD1      LEU  21  11.414  -6.666  -8.775
  152   3HD1  LEU  21          3HD1      LEU  21  11.414  -5.285  -7.679
  153   1HD2  LEU  21          1HD2      LEU  21  13.783  -7.754  -9.316
  154   2HD2  LEU  21          2HD2      LEU  21  14.004  -7.827  -7.568
  155   3HD2  LEU  21          3HD2      LEU  21  15.191  -6.994  -8.573
  156    H    LYS  22           H        LYS  22  15.740  -3.967  -9.312
  157    HA   LYS  22           HA       LYS  22  17.606  -3.049 -10.231
  158   1HB   LYS  22          2HB       LYS  22  15.557  -2.558 -12.361
  159   2HB   LYS  22          1HB       LYS  22  17.170  -1.879 -12.532
  160   1HG   LYS  22          2HG       LYS  22  17.091  -3.957 -13.702
  161   2HG   LYS  22          1HG       LYS  22  18.103  -4.163 -12.271
  162   1HD   LYS  22          2HD       LYS  22  16.653  -6.080 -12.514
  163   2HD   LYS  22          1HD       LYS  22  16.170  -5.155 -11.090
  164   1HE   LYS  22          2HE       LYS  22  14.241  -5.899 -12.425
  165   2HE   LYS  22          1HE       LYS  22  14.350  -4.143 -12.321
  166   1HZ   LYS  22          1HZ       LYS  22  15.337  -5.742 -14.621
  167   2HZ   LYS  22          2HZ       LYS  22  15.244  -4.056 -14.522
  168   3HZ   LYS  22          3HZ       LYS  22  13.827  -4.977 -14.571
  169   1H    SER  23          1HT       SER  23  13.552  -0.826   2.469
  170   2H    SER  23          2HT       SER  23  14.679   0.460   2.328
  171   3H    SER  23          3HT       SER  23  14.224  -0.441   0.940
  172    HA   SER  23           HA       SER  23  12.119   0.438   0.901
  173   1HB   SER  23          2HB       SER  23  12.758   1.523   3.657
  174   2HB   SER  23          1HB       SER  23  11.270   1.842   2.767
  175    HG   SER  23           HG       SER  23  12.085  -0.437   4.105
  176    H    ASN  24           H        ASN  24  11.645   2.430  -0.036
  177    HA   ASN  24           HA       ASN  24  13.087   4.803   0.368
  178   1HB   ASN  24          2HB       ASN  24  14.678   3.040  -0.938
  179   2HB   ASN  24          1HB       ASN  24  13.876   3.808  -2.305
  180   1HD2  ASN  24          1HD2      ASN  24  13.763   6.282  -2.051
  181   2HD2  ASN  24          2HD2      ASN  24  15.242   7.044  -1.585
  182    H    PHE  25           H        PHE  25  10.482   4.563   0.254
  183    HA   PHE  25           HA       PHE  25   9.739   6.230  -1.899
  184   1HB   PHE  25          2HB       PHE  25   8.658   4.870  -3.371
  185   2HB   PHE  25          1HB       PHE  25   9.864   3.734  -2.803
  186    HD1  PHE  25           1HD      PHE  25   6.385   4.844  -2.018
  187    HD2  PHE  25           2HD      PHE  25   9.179   1.641  -2.184
  188    HE1  PHE  25           1HE      PHE  25   4.599   3.266  -1.434
  189    HE2  PHE  25           2HE      PHE  25   7.392   0.056  -1.600
  190    HZ   PHE  25           HZ       PHE  25   5.102   0.864  -1.218
  191    H    LEU  26           H        LEU  26   7.480   6.866  -1.851
  192    HA   LEU  26           HA       LEU  26   6.391   6.593   0.868
  193   1HB   LEU  26          2HB       LEU  26   5.611   8.727  -1.094
  194   2HB   LEU  26          1HB       LEU  26   5.438   8.734   0.650
  195    HG   LEU  26           HG       LEU  26   7.173  10.251   0.200
  196   1HD1  LEU  26          1HD1      LEU  26   8.457   9.442   1.811
  197   2HD1  LEU  26          2HD1      LEU  26   9.189   8.297   0.688
  198   3HD1  LEU  26          3HD1      LEU  26   7.733   7.851   1.577
  199   1HD2  LEU  26          1HD2      LEU  26   8.848   8.366  -1.356
  200   2HD2  LEU  26          2HD2      LEU  26   8.710  10.120  -1.467
  201   3HD2  LEU  26          3HD2      LEU  26   7.463   9.091  -2.170
  202    H    ASN  27           H        ASN  27   4.665   5.371   1.108
  203    HA   ASN  27           HA       ASN  27   2.968   4.768  -1.202
  204   1HB   ASN  27          2HB       ASN  27   3.973   2.957   0.334
  205   2HB   ASN  27          1HB       ASN  27   2.778   3.478   1.516
  206   1HD2  ASN  27          1HD2      ASN  27   3.345   1.760  -1.402
  207   2HD2  ASN  27          2HD2      ASN  27   1.741   1.156  -1.616
  208    H    CYS  28           H        CYS  28   0.635   4.835  -0.975
  209    HA   CYS  28           HA       CYS  28  -0.571   6.118   1.281
  210   1HB   CYS  28          2HB       CYS  28   0.489   8.055   0.119
  211   2HB   CYS  28          1HB       CYS  28  -0.491   7.694  -1.298
  212    HG   CYS  28           HG       CYS  28  -2.574   8.123   0.488
  213    H    TYR  29           H        TYR  29  -2.874   6.209   1.149
  214    HA   TYR  29           HA       TYR  29  -4.365   5.514  -1.120
  215   1HB   TYR  29          2HB       TYR  29  -4.100   3.296  -1.249
  216   2HB   TYR  29          1HB       TYR  29  -3.113   3.289   0.205
  217    HD1  TYR  29           1HD      TYR  29  -3.943   2.397   2.219
  218    HD2  TYR  29           2HD      TYR  29  -6.617   3.115  -1.011
  219    HE1  TYR  29           1HE      TYR  29  -5.708   1.180   3.417
  220    HE2  TYR  29           2HE      TYR  29  -8.391   1.897   0.180
  221    HH   TYR  29           HH       TYR  29  -7.825  -0.086   2.795
  222    H    VAL  30           H        VAL  30  -6.344   6.270  -0.762
  223    HA   VAL  30           HA       VAL  30  -7.400   6.211   1.987
  224    HB   VAL  30           HB       VAL  30  -8.482   8.400   1.563
  225   1HG1  VAL  30          1HG1      VAL  30  -5.611   8.959   1.123
  226   2HG1  VAL  30          2HG1      VAL  30  -6.024   7.936   2.498
  227   3HG1  VAL  30          3HG1      VAL  30  -6.707   9.557   2.368
  228   1HG2  VAL  30          1HG2      VAL  30  -6.834   8.308  -0.956
  229   2HG2  VAL  30          2HG2      VAL  30  -7.537   9.787  -0.304
  230   3HG2  VAL  30          3HG2      VAL  30  -8.585   8.463  -0.815
  231    H    SER  31           H        SER  31  -9.361   5.360   2.181
  232    HA   SER  31           HA       SER  31 -11.470   4.636   1.705
  233   1HB   SER  31          2HB       SER  31 -11.169   6.846  -0.000
  234   2HB   SER  31          1HB       SER  31 -11.794   5.552  -1.022
  235    HG   SER  31           HG       SER  31 -13.011   6.934   1.017
  236    H    GLY  32           H        GLY  32 -12.413   2.837   0.718
  237   1HA   GLY  32          2HA       GLY  32 -10.558   1.025  -0.500
  238   2HA   GLY  32          1HA       GLY  32 -12.253   0.709  -0.164
  239    H    PHE  33           H        PHE  33 -12.636  -0.283  -2.148
  240    HA   PHE  33           HA       PHE  33 -13.505   1.365  -4.231
  241   1HB   PHE  33          2HB       PHE  33 -11.833   0.780  -5.980
  242   2HB   PHE  33          1HB       PHE  33 -11.191   1.818  -4.716
  243    HD1  PHE  33           1HD      PHE  33  -9.103   0.882  -6.043
  244    HD2  PHE  33           2HD      PHE  33 -11.481  -1.398  -3.345
  245    HE1  PHE  33           1HE      PHE  33  -7.233  -0.678  -5.712
  246    HE2  PHE  33           2HE      PHE  33  -9.615  -2.958  -3.012
  247    HZ   PHE  33           HZ       PHE  33  -7.486  -2.600  -4.196
  248    H    HIS  34           H        HIS  34 -14.444  -0.897  -2.793
  249    HA   HIS  34           HA       HIS  34 -15.585  -2.838  -3.132
  250   1HB   HIS  34          2HB       HIS  34 -15.717  -1.379  -5.602
  251   2HB   HIS  34          1HB       HIS  34 -15.624  -3.099  -5.956
  252    HD1  HIS  34           1HD      HIS  34 -17.304  -3.506  -3.051
  253    HD2  HIS  34           2HD      HIS  34 -18.418  -1.595  -6.569
  254    HE1  HIS  34           1HE      HIS  34 -19.815  -3.475  -3.031
  255    HE2  HIS  34           2HE      HIS  34 -20.468  -2.390  -5.209
  256    HA   PRO  35           HA       PRO  35 -13.211  -6.501  -3.871
  257   1HB   PRO  35          2HB       PRO  35 -14.521  -6.879  -6.539
  258   2HB   PRO  35          1HB       PRO  35 -14.206  -8.065  -5.265
  259   1HG   PRO  35          2HG       PRO  35 -16.637  -7.027  -5.575
  260   2HG   PRO  35          1HG       PRO  35 -15.975  -7.328  -3.958
  261   1HD   PRO  35          2HD       PRO  35 -16.381  -4.762  -5.387
  262   2HD   PRO  35          1HD       PRO  35 -16.374  -5.097  -3.646
  263    H    SER  36           H        SER  36 -11.121  -6.456  -4.357
  264    HA   SER  36           HA       SER  36 -10.049  -6.313  -6.926
  265   1HB   SER  36          2HB       SER  36 -10.539  -4.036  -7.159
  266   2HB   SER  36          1HB       SER  36 -10.200  -3.690  -5.465
  267    HG   SER  36           HG       SER  36  -8.221  -4.516  -7.318
  268    H    ASP  37           H        ASP  37  -7.809  -6.645  -6.944
  269    HA   ASP  37           HA       ASP  37  -6.596  -6.996  -4.280
  270   1HB   ASP  37          2HB       ASP  37  -6.662  -8.782  -6.660
  271   2HB   ASP  37          1HB       ASP  37  -5.180  -8.754  -5.711
  272    H    ILE  38           H        ILE  38  -4.630  -6.145  -3.924
  273    HA   ILE  38           HA       ILE  38  -3.089  -5.133  -6.208
  274    HB   ILE  38           HB       ILE  38  -3.553  -3.526  -3.694
  275   1HG1  ILE  38          2HG1      ILE  38  -4.716  -3.168  -6.466
  276   2HG1  ILE  38          1HG1      ILE  38  -5.607  -3.636  -5.022
  277   1HG2  ILE  38          1HG2      ILE  38  -1.652  -2.558  -4.365
  278   2HG2  ILE  38          2HG2      ILE  38  -2.630  -1.832  -5.639
  279   3HG2  ILE  38          3HG2      ILE  38  -1.723  -3.309  -5.958
  280   1HD1  ILE  38          1HD1      ILE  38  -5.314  -1.088  -5.991
  281   2HD1  ILE  38          2HD1      ILE  38  -4.138  -1.156  -4.678
  282   3HD1  ILE  38          3HD1      ILE  38  -5.833  -1.526  -4.363
  283    H    GLU  39           H        GLU  39  -1.231  -6.203  -6.122
  284    HA   GLU  39           HA       GLU  39  -0.038  -6.765  -3.494
  285   1HB   GLU  39          2HB       GLU  39  -0.582  -8.578  -5.348
  286   2HB   GLU  39          1HB       GLU  39   0.961  -8.046  -5.999
  287   1HG   GLU  39          2HG       GLU  39   2.049  -9.294  -4.539
  288   2HG   GLU  39          1HG       GLU  39   1.245  -8.483  -3.196
  289    H    VAL  40           H        VAL  40   0.829  -4.627  -3.314
  290    HA   VAL  40           HA       VAL  40   2.633  -3.593  -5.272
  291    HB   VAL  40           HB       VAL  40   2.369  -2.767  -2.377
  292   1HG1  VAL  40          1HG1      VAL  40   3.101  -0.770  -4.388
  293   2HG1  VAL  40          2HG1      VAL  40   4.299  -2.048  -4.178
  294   3HG1  VAL  40          3HG1      VAL  40   3.788  -1.082  -2.794
  295   1HG2  VAL  40          1HG2      VAL  40   0.393  -2.662  -4.290
  296   2HG2  VAL  40          2HG2      VAL  40   1.122  -1.060  -4.384
  297   3HG2  VAL  40          3HG2      VAL  40   0.489  -1.652  -2.848
  298    H    ASP  41           H        ASP  41   4.638  -4.214  -5.620
  299    HA   ASP  41           HA       ASP  41   6.267  -5.144  -3.367
  300   1HB   ASP  41          2HB       ASP  41   6.272  -6.510  -6.062
  301   2HB   ASP  41          1HB       ASP  41   7.118  -7.017  -4.603
  302    H    LEU  42           H        LEU  42   7.848  -3.692  -3.231
  303    HA   LEU  42           HA       LEU  42   9.264  -2.967  -5.698
  304   1HB   LEU  42          2HB       LEU  42   8.529  -1.054  -3.483
  305   2HB   LEU  42          1HB       LEU  42   9.499  -0.664  -4.892
  306    HG   LEU  42           HG       LEU  42   6.584  -1.451  -4.903
  307   1HD1  LEU  42          1HD1      LEU  42   7.605   1.148  -5.909
  308   2HD1  LEU  42          2HD1      LEU  42   7.470   0.922  -4.166
  309   3HD1  LEU  42          3HD1      LEU  42   6.047   0.744  -5.192
  310   1HD2  LEU  42          1HD2      LEU  42   6.971  -2.119  -6.993
  311   2HD2  LEU  42          2HD2      LEU  42   8.602  -1.449  -6.995
  312   3HD2  LEU  42          3HD2      LEU  42   7.223  -0.416  -7.378
  313    H    LEU  43           H        LEU  43  11.454  -2.722  -5.544
  314    HA   LEU  43           HA       LEU  43  13.564  -2.881  -4.700
  315   1HB   LEU  43          2HB       LEU  43  12.451  -2.819  -1.910
  316   2HB   LEU  43          1HB       LEU  43  14.025  -2.291  -2.470
  317    HG   LEU  43           HG       LEU  43  11.588  -0.874  -3.459
  318   1HD1  LEU  43          1HD1      LEU  43  12.711  -0.776  -0.701
  319   2HD1  LEU  43          2HD1      LEU  43  11.036  -0.672  -1.241
  320   3HD1  LEU  43          3HD1      LEU  43  12.115   0.708  -1.444
  321   1HD2  LEU  43          1HD2      LEU  43  14.497  -0.322  -3.135
  322   2HD2  LEU  43          2HD2      LEU  43  13.361   1.026  -3.116
  323   3HD2  LEU  43          3HD2      LEU  43  13.443  -0.039  -4.520
  324    H    LYS  44           H        LYS  44  14.863  -4.608  -4.352
  325    HA   LYS  44           HA       LYS  44  14.077  -6.826  -2.713
  326   1HB   LYS  44          2HB       LYS  44  13.932  -7.017  -5.709
  327   2HB   LYS  44          1HB       LYS  44  14.280  -8.436  -4.730
  328   1HG   LYS  44          2HG       LYS  44  12.111  -7.591  -3.444
  329   2HG   LYS  44          1HG       LYS  44  11.767  -6.903  -5.033
  330   1HD   LYS  44          2HD       LYS  44  11.544  -8.950  -6.022
  331   2HD   LYS  44          1HD       LYS  44  12.676  -9.729  -4.914
  332   1HE   LYS  44          2HE       LYS  44  11.064 -10.251  -3.431
  333   2HE   LYS  44          1HE       LYS  44  10.214  -8.724  -3.667
  334   1HZ   LYS  44          1HZ       LYS  44   8.900 -10.610  -4.422
  335   2HZ   LYS  44          2HZ       LYS  44  10.117 -11.050  -5.512
  336   3HZ   LYS  44          3HZ       LYS  44   9.286  -9.591  -5.717
  337   1H    SER  45          1HT       SER  45  17.114   5.789   4.299
  338   2H    SER  45          2HT       SER  45  17.977   4.374   3.851
  339   3H    SER  45          3HT       SER  45  17.204   4.464   5.382
  340    HA   SER  45           HA       SER  45  15.997   4.259   2.716
  341   1HB   SER  45          2HB       SER  45  14.789   2.429   4.257
  342   2HB   SER  45          1HB       SER  45  16.321   2.106   3.446
  343    HG   SER  45           HG       SER  45  16.537   1.538   5.591
  344    H    ASN  46           H        ASN  46  14.537   5.857   2.491
  345    HA   ASN  46           HA       ASN  46  12.930   6.685   4.783
  346   1HB   ASN  46          2HB       ASN  46  12.129   8.484   3.279
  347   2HB   ASN  46          1HB       ASN  46  13.882   8.467   3.437
  348   1HD2  ASN  46          1HD2      ASN  46  15.138   8.010   1.683
  349   2HD2  ASN  46          2HD2      ASN  46  14.510   7.853   0.081
  350    H    PHE  47           H        PHE  47  10.942   5.965   5.125
  351    HA   PHE  47           HA       PHE  47   9.405   4.905   2.856
  352   1HB   PHE  47          2HB       PHE  47  10.161   2.932   3.932
  353   2HB   PHE  47          1HB       PHE  47   9.873   3.602   5.534
  354    HD1  PHE  47           1HD      PHE  47   7.903   3.121   6.651
  355    HD2  PHE  47           2HD      PHE  47   8.091   2.568   2.437
  356    HE1  PHE  47           1HE      PHE  47   5.676   2.075   6.694
  357    HE2  PHE  47           2HE      PHE  47   5.866   1.521   2.471
  358    HZ   PHE  47           HZ       PHE  47   4.656   1.273   4.601
  359    H    LEU  48           H        LEU  48   7.315   5.498   2.781
  360    HA   LEU  48           HA       LEU  48   6.172   6.816   5.152
  361   1HB   LEU  48          2HB       LEU  48   6.995   8.413   3.345
  362   2HB   LEU  48          1HB       LEU  48   5.706   7.782   2.340
  363    HG   LEU  48           HG       LEU  48   4.040   8.568   3.952
  364   1HD1  LEU  48          1HD1      LEU  48   4.840   8.623   6.065
  365   2HD1  LEU  48          2HD1      LEU  48   5.171  10.303   5.643
  366   3HD1  LEU  48          3HD1      LEU  48   6.460   9.102   5.558
  367   1HD2  LEU  48          1HD2      LEU  48   4.982  10.024   2.097
  368   2HD2  LEU  48          2HD2      LEU  48   5.922  10.830   3.352
  369   3HD2  LEU  48          3HD2      LEU  48   4.161  10.856   3.418
  370    H    ASN  49           H        ASN  49   4.224   6.089   5.707
  371    HA   ASN  49           HA       ASN  49   2.599   4.705   3.680
  372   1HB   ASN  49          2HB       ASN  49   3.913   3.308   5.565
  373   2HB   ASN  49          1HB       ASN  49   2.459   3.710   6.475
  374   1HD2  ASN  49          1HD2      ASN  49   0.896   2.288   6.343
  375   2HD2  ASN  49          2HD2      ASN  49   0.611   1.199   5.031
  376    H    CYS  50           H        CYS  50   1.150   6.374   3.424
  377    HA   CYS  50           HA       CYS  50  -0.338   7.169   5.838
  378   1HB   CYS  50          2HB       CYS  50  -0.920   9.242   4.446
  379   2HB   CYS  50          1HB       CYS  50   0.716   9.125   5.084
  380    HG   CYS  50           HG       CYS  50   1.621   8.772   2.756
  381    H    TYR  51           H        TYR  51  -2.112   5.944   5.867
  382    HA   TYR  51           HA       TYR  51  -3.905   6.112   3.556
  383   1HB   TYR  51          2HB       TYR  51  -4.513   3.790   3.690
  384   2HB   TYR  51          1HB       TYR  51  -2.760   3.880   3.553
  385    HD1  TYR  51           1HD      TYR  51  -5.338   2.248   5.189
  386    HD2  TYR  51           2HD      TYR  51  -1.571   4.056   5.968
  387    HE1  TYR  51           1HE      TYR  51  -5.111   0.882   7.222
  388    HE2  TYR  51           2HE      TYR  51  -1.329   2.695   7.997
  389    HH   TYR  51           HH       TYR  51  -2.183   1.011   9.211
  390    H    VAL  52           H        VAL  52  -6.161   5.905   4.101
  391    HA   VAL  52           HA       VAL  52  -7.067   5.587   6.762
  392    HB   VAL  52           HB       VAL  52  -6.093   7.595   7.417
  393   1HG1  VAL  52          1HG1      VAL  52  -6.528   9.696   5.860
  394   2HG1  VAL  52          2HG1      VAL  52  -6.600   8.441   4.624
  395   3HG1  VAL  52          3HG1      VAL  52  -5.155   8.615   5.622
  396   1HG2  VAL  52          1HG2      VAL  52  -8.475   7.628   7.985
  397   2HG2  VAL  52          2HG2      VAL  52  -8.831   8.441   6.463
  398   3HG2  VAL  52          3HG2      VAL  52  -7.866   9.255   7.693
  399    H    SER  53           H        SER  53  -9.337   6.170   7.054
  400    HA   SER  53           HA       SER  53 -11.442   6.877   6.261
  401   1HB   SER  53          2HB       SER  53 -10.334   7.696   4.107
  402   2HB   SER  53          1HB       SER  53 -10.661   6.087   3.462
  403    HG   SER  53           HG       SER  53 -12.338   7.591   2.996
  404    H    GLY  54           H        GLY  54 -11.889   5.028   7.571
  405   1HA   GLY  54          2HA       GLY  54 -13.005   3.063   7.945
  406   2HA   GLY  54          1HA       GLY  54 -13.484   3.125   6.260
  407    H    PHE  55           H        PHE  55 -11.521   2.549   4.741
  408    HA   PHE  55           HA       PHE  55  -9.934   1.051   4.056
  409   1HB   PHE  55          2HB       PHE  55  -8.974   1.382   6.430
  410   2HB   PHE  55          1HB       PHE  55  -9.790  -0.127   6.824
  411    HD1  PHE  55           1HD      PHE  55  -6.730   1.117   6.128
  412    HD2  PHE  55           2HD      PHE  55  -9.347  -1.935   4.732
  413    HE1  PHE  55           1HE      PHE  55  -4.802  -0.139   5.254
  414    HE2  PHE  55           2HE      PHE  55  -7.427  -3.190   3.857
  415    HZ   PHE  55           HZ       PHE  55  -5.150  -2.292   4.119
  416    H    HIS  56           H        HIS  56 -11.816   0.235   2.934
  417    HA   HIS  56           HA       HIS  56 -12.394  -2.513   3.747
  418   1HB   HIS  56          2HB       HIS  56 -14.809  -2.091   2.948
  419   2HB   HIS  56          1HB       HIS  56 -14.354  -1.512   4.546
  420    HD1  HIS  56           1HD      HIS  56 -16.207   0.295   4.488
  421    HD2  HIS  56           2HD      HIS  56 -13.376   0.657   1.468
  422    HE1  HIS  56           1HE      HIS  56 -16.570   2.578   3.497
  423    HE2  HIS  56           2HE      HIS  56 -14.780   2.811   1.738
  424    HA   PRO  57           HA       PRO  57 -11.732  -1.614  -0.914
  425   1HB   PRO  57          2HB       PRO  57  -9.125  -2.390  -1.162
  426   2HB   PRO  57          1HB       PRO  57  -9.631  -0.717  -0.914
  427   1HG   PRO  57          2HG       PRO  57  -8.533  -2.676   1.045
  428   2HG   PRO  57          1HG       PRO  57  -8.262  -0.931   0.927
  429   1HD   PRO  57          2HD       PRO  57  -9.952  -2.085   2.737
  430   2HD   PRO  57          1HD       PRO  57 -10.141  -0.433   2.120
  431    H    SER  58           H        SER  58  -9.425  -4.057   0.214
  432    HA   SER  58           HA       SER  58 -10.996  -6.321   0.131
  433   1HB   SER  58          2HB       SER  58 -10.321  -5.289  -2.538
  434   2HB   SER  58          1HB       SER  58  -9.907  -6.987  -2.298
  435    HG   SER  58           HG       SER  58 -12.443  -5.771  -1.929
  436    H    ASP  59           H        ASP  59  -8.054  -5.905  -1.809
  437    HA   ASP  59           HA       ASP  59  -6.508  -7.181   0.336
  438   1HB   ASP  59          2HB       ASP  59  -7.152  -8.920  -1.300
  439   2HB   ASP  59          1HB       ASP  59  -6.386  -7.983  -2.579
  440    H    ILE  60           H        ILE  60  -4.520  -6.346   0.655
  441    HA   ILE  60           HA       ILE  60  -3.204  -4.807  -1.425
  442    HB   ILE  60           HB       ILE  60  -3.677  -3.453   1.221
  443   1HG1  ILE  60          2HG1      ILE  60  -5.246  -3.090  -1.343
  444   2HG1  ILE  60          1HG1      ILE  60  -5.863  -3.784   0.152
  445   1HG2  ILE  60          1HG2      ILE  60  -2.909  -1.484   0.085
  446   2HG2  ILE  60          2HG2      ILE  60  -2.875  -2.335  -1.460
  447   3HG2  ILE  60          3HG2      ILE  60  -1.742  -2.778  -0.183
  448   1HD1  ILE  60          1HD1      ILE  60  -6.194  -1.222  -0.558
  449   2HD1  ILE  60          2HD1      ILE  60  -4.705  -1.090   0.377
  450   3HD1  ILE  60          3HD1      ILE  60  -6.153  -1.776   1.116
  451    H    GLU  61           H        GLU  61  -1.313  -5.850  -1.411
  452    HA   GLU  61           HA       GLU  61  -0.029  -6.408   1.176
  453   1HB   GLU  61          2HB       GLU  61  -0.394  -8.372  -0.251
  454   2HB   GLU  61          1HB       GLU  61   0.508  -7.604  -1.550
  455   1HG   GLU  61          2HG       GLU  61   2.530  -7.937  -0.537
  456   2HG   GLU  61          1HG       GLU  61   1.836  -7.969   1.084
  457    H    VAL  62           H        VAL  62   1.176  -4.671   1.697
  458    HA   VAL  62           HA       VAL  62   2.725  -3.302  -0.359
  459    HB   VAL  62           HB       VAL  62   2.562  -2.666   2.590
  460   1HG1  VAL  62          1HG1      VAL  62   4.387  -1.781   0.794
  461   2HG1  VAL  62          2HG1      VAL  62   3.850  -0.862   2.198
  462   3HG1  VAL  62          3HG1      VAL  62   3.128  -0.560   0.619
  463   1HG2  VAL  62          1HG2      VAL  62   0.926  -1.632   0.279
  464   2HG2  VAL  62          2HG2      VAL  62   0.981  -0.874   1.871
  465   3HG2  VAL  62          3HG2      VAL  62   0.347  -2.511   1.693
  466    H    ASP  63           H        ASP  63   4.783  -3.750  -0.758
  467    HA   ASP  63           HA       ASP  63   6.385  -5.028   1.354
  468   1HB   ASP  63          2HB       ASP  63   6.039  -5.828  -1.513
  469   2HB   ASP  63          1HB       ASP  63   7.564  -6.159  -0.696
  470    H    LEU  64           H        LEU  64   8.272  -4.086   1.767
  471    HA   LEU  64           HA       LEU  64   9.536  -2.411  -0.276
  472   1HB   LEU  64          2HB       LEU  64   8.397  -1.515   2.288
  473   2HB   LEU  64          1HB       LEU  64  10.024  -0.947   1.970
  474    HG   LEU  64           HG       LEU  64   8.663  -0.475  -0.409
  475   1HD1  LEU  64          1HD1      LEU  64   6.847  -0.283   1.918
  476   2HD1  LEU  64          2HD1      LEU  64   6.487  -0.580   0.217
  477   3HD1  LEU  64          3HD1      LEU  64   6.820   1.060   0.775
  478   1HD2  LEU  64          1HD2      LEU  64  10.178   1.128   0.186
  479   2HD2  LEU  64          2HD2      LEU  64   9.655   1.157   1.869
  480   3HD2  LEU  64          3HD2      LEU  64   8.680   1.945   0.629
  481    H    LEU  65           H        LEU  65  11.273  -3.742  -0.551
  482    HA   LEU  65           HA       LEU  65  12.717  -4.664   1.817
  483   1HB   LEU  65          2HB       LEU  65  12.891  -5.355  -1.102
  484   2HB   LEU  65          1HB       LEU  65  14.123  -5.865   0.036
  485    HG   LEU  65           HG       LEU  65  11.313  -6.509   0.736
  486   1HD1  LEU  65          1HD1      LEU  65  11.494  -8.594  -0.664
  487   2HD1  LEU  65          2HD1      LEU  65  12.807  -7.800  -1.531
  488   3HD1  LEU  65          3HD1      LEU  65  11.188  -7.101  -1.551
  489   1HD2  LEU  65          1HD2      LEU  65  13.038  -7.169   2.248
  490   2HD2  LEU  65          2HD2      LEU  65  13.970  -7.910   0.947
  491   3HD2  LEU  65          3HD2      LEU  65  12.436  -8.621   1.450
  492    H    LYS  66           H        LYS  66  14.377  -3.963  -1.196
  493    HA   LYS  66           HA       LYS  66  15.381  -1.434  -0.681
  494   1HB   LYS  66          2HB       LYS  66  16.427  -3.316   1.143
  495   2HB   LYS  66          1HB       LYS  66  17.718  -2.974   0.001
  496   1HG   LYS  66          2HG       LYS  66  16.780  -0.472   0.549
  497   2HG   LYS  66          1HG       LYS  66  16.560  -1.296   2.093
  498   1HD   LYS  66          2HD       LYS  66  18.714  -0.614   2.370
  499   2HD   LYS  66          1HD       LYS  66  19.023  -2.142   1.543
  500   1HE   LYS  66          2HE       LYS  66  19.811  -1.124  -0.296
  501   2HE   LYS  66          1HE       LYS  66  18.566   0.124  -0.255
  502   1HZ   LYS  66          1HZ       LYS  66  20.626   0.259   1.801
  503   2HZ   LYS  66          2HZ       LYS  66  19.864   1.506   0.949
  504   3HZ   LYS  66          3HZ       LYS  66  21.112   0.625   0.223
  505   1H    SER  67          1HT       SER  67  17.620   6.405   7.694
  506   2H    SER  67          2HT       SER  67  16.604   7.757   7.982
  507   3H    SER  67          3HT       SER  67  16.316   6.735   6.634
  508    HA   SER  67           HA       SER  67  15.576   5.014   7.921
  509   1HB   SER  67          2HB       SER  67  17.331   5.000   9.572
  510   2HB   SER  67          1HB       SER  67  16.803   6.552  10.221
  511    HG   SER  67           HG       SER  67  16.122   4.610  11.402
  512    H    ASN  68           H        ASN  68  14.544   7.604   6.975
  513    HA   ASN  68           HA       ASN  68  12.729   8.628   8.918
  514   1HB   ASN  68          2HB       ASN  68  13.278   9.073   6.045
  515   2HB   ASN  68          1HB       ASN  68  11.635   9.425   6.569
  516   1HD2  ASN  68          1HD2      ASN  68  11.732  10.568   8.870
  517   2HD2  ASN  68          2HD2      ASN  68  12.745  11.968   8.894
  518    H    PHE  69           H        PHE  69  11.239   7.308   9.754
  519    HA   PHE  69           HA       PHE  69   9.588   5.735   7.886
  520   1HB   PHE  69          2HB       PHE  69  10.880   4.259   9.319
  521   2HB   PHE  69          1HB       PHE  69  10.329   5.118  10.753
  522    HD1  PHE  69           1HD      PHE  69   8.041   4.860  11.555
  523    HD2  PHE  69           2HD      PHE  69   9.477   2.669   8.202
  524    HE1  PHE  69           1HE      PHE  69   6.123   3.329  11.739
  525    HE2  PHE  69           2HE      PHE  69   7.561   1.135   8.379
  526    HZ   PHE  69           HZ       PHE  69   5.881   1.464  10.149
  527    H    LEU  70           H        LEU  70   7.525   6.307   7.762
  528    HA   LEU  70           HA       LEU  70   6.185   7.440  10.093
  529   1HB   LEU  70          2HB       LEU  70   6.881   8.908   7.657
  530   2HB   LEU  70          1HB       LEU  70   5.182   9.013   8.073
  531    HG   LEU  70           HG       LEU  70   7.432   9.708   9.961
  532   1HD1  LEU  70          1HD1      LEU  70   7.098  11.156   7.848
  533   2HD1  LEU  70          2HD1      LEU  70   7.182  11.947   9.422
  534   3HD1  LEU  70          3HD1      LEU  70   5.620  11.691   8.646
  535   1HD2  LEU  70          1HD2      LEU  70   4.459  10.189  10.121
  536   2HD2  LEU  70          2HD2      LEU  70   5.661  10.737  11.289
  537   3HD2  LEU  70          3HD2      LEU  70   5.369   9.011  11.067
  538    H    ASN  71           H        ASN  71   4.866   5.666  10.271
  539    HA   ASN  71           HA       ASN  71   3.260   4.916   7.935
  540   1HB   ASN  71          2HB       ASN  71   4.577   3.275   9.568
  541   2HB   ASN  71          1HB       ASN  71   3.086   3.401  10.497
  542   1HD2  ASN  71          1HD2      ASN  71   4.610   1.550   8.347
  543   2HD2  ASN  71          2HD2      ASN  71   3.265   0.863   7.506
  544    H    CYS  72           H        CYS  72   1.955   6.844   8.093
  545    HA   CYS  72           HA       CYS  72   0.342   7.341  10.401
  546   1HB   CYS  72          2HB       CYS  72   0.606   8.476   7.673
  547   2HB   CYS  72          1HB       CYS  72  -0.954   8.691   8.459
  548    HG   CYS  72           HG       CYS  72   0.417   9.881  10.439
  549    H    TYR  73           H        TYR  73  -1.165   5.928  11.010
  550    HA   TYR  73           HA       TYR  73  -2.878   4.737   8.927
  551   1HB   TYR  73          2HB       TYR  73  -3.253   2.985  10.872
  552   2HB   TYR  73          1HB       TYR  73  -1.871   2.859   9.794
  553    HD1  TYR  73           1HD      TYR  73   0.308   2.860  10.648
  554    HD2  TYR  73           2HD      TYR  73  -2.904   4.139  13.127
  555    HE1  TYR  73           1HE      TYR  73   1.828   2.913  12.581
  556    HE2  TYR  73           2HE      TYR  73  -1.392   4.199  15.064
  557    HH   TYR  73           HH       TYR  73   1.148   2.737  15.462
  558    H    VAL  74           H        VAL  74  -4.899   5.471   8.945
  559    HA   VAL  74           HA       VAL  74  -6.126   6.083  11.551
  560    HB   VAL  74           HB       VAL  74  -6.718   7.772   9.139
  561   1HG1  VAL  74          1HG1      VAL  74  -7.823   9.185  10.602
  562   2HG1  VAL  74          2HG1      VAL  74  -6.950   8.575  12.008
  563   3HG1  VAL  74          3HG1      VAL  74  -8.200   7.589  11.249
  564   1HG2  VAL  74          1HG2      VAL  74  -4.637   8.291  11.257
  565   2HG2  VAL  74          2HG2      VAL  74  -5.203   9.479  10.084
  566   3HG2  VAL  74          3HG2      VAL  74  -4.348   8.037   9.535
  567    H    SER  75           H        SER  75  -7.179   4.085  11.451
  568    HA   SER  75           HA       SER  75  -9.759   4.025  10.543
  569   1HB   SER  75          2HB       SER  75  -9.379   3.945   8.277
  570   2HB   SER  75          1HB       SER  75  -7.812   3.158   8.458
  571    HG   SER  75           HG       SER  75  -8.841   1.218   8.793
  572    H    GLY  76           H        GLY  76  -6.953   1.826  10.530
  573   1HA   GLY  76          2HA       GLY  76  -7.217   0.434  12.774
  574   2HA   GLY  76          1HA       GLY  76  -8.544  -0.238  11.839
  575    H    PHE  77           H        PHE  77  -7.533  -2.300  11.906
  576    HA   PHE  77           HA       PHE  77  -5.995  -2.910   9.647
  577   1HB   PHE  77          2HB       PHE  77  -4.415  -1.906  11.725
  578   2HB   PHE  77          1HB       PHE  77  -4.186  -3.651  11.788
  579    HD1  PHE  77           1HD      PHE  77  -2.869  -0.762  10.495
  580    HD2  PHE  77           2HD      PHE  77  -3.964  -4.692   9.282
  581    HE1  PHE  77           1HE      PHE  77  -1.294  -0.616   8.608
  582    HE2  PHE  77           2HE      PHE  77  -2.391  -4.551   7.397
  583    HZ   PHE  77           HZ       PHE  77  -1.058  -2.511   7.057
  584    H    HIS  78           H        HIS  78  -7.624  -4.467   9.498
  585    HA   HIS  78           HA       HIS  78  -7.017  -7.017  10.374
  586   1HB   HIS  78          2HB       HIS  78  -7.555  -6.435  12.620
  587   2HB   HIS  78          1HB       HIS  78  -9.034  -5.619  12.134
  588    HD1  HIS  78           1HD      HIS  78 -10.510  -7.079  13.648
  589    HD2  HIS  78           2HD      HIS  78  -8.325  -9.239  10.850
  590    HE1  HIS  78           1HE      HIS  78 -11.477  -9.399  13.686
  591    HE2  HIS  78           2HE      HIS  78 -10.194 -10.667  11.927
  592    HA   PRO  79           HA       PRO  79 -11.484  -7.100   8.543
  593   1HB   PRO  79          2HB       PRO  79 -12.685  -4.728   7.997
  594   2HB   PRO  79          1HB       PRO  79 -12.850  -5.550   9.553
  595   1HG   PRO  79          2HG       PRO  79 -11.036  -3.292   8.787
  596   2HG   PRO  79          1HG       PRO  79 -12.021  -3.487  10.250
  597   1HD   PRO  79          2HD       PRO  79  -9.375  -4.007  10.222
  598   2HD   PRO  79          1HD       PRO  79 -10.510  -4.930  11.228
  599    H    SER  80           H        SER  80  -9.323  -7.333   7.109
  600    HA   SER  80           HA       SER  80 -10.045  -6.725   4.490
  601   1HB   SER  80          2HB       SER  80  -8.336  -4.681   5.821
  602   2HB   SER  80          1HB       SER  80  -7.931  -5.122   4.162
  603    HG   SER  80           HG       SER  80 -10.381  -4.085   5.138
  604    H    ASP  81           H        ASP  81  -8.410  -7.361   2.911
  605    HA   ASP  81           HA       ASP  81  -6.630  -9.387   4.041
  606   1HB   ASP  81          2HB       ASP  81  -7.313  -8.962   1.128
  607   2HB   ASP  81          1HB       ASP  81  -6.604 -10.396   1.868
  608    H    ILE  82           H        ILE  82  -5.433  -7.231   4.688
  609    HA   ILE  82           HA       ILE  82  -3.442  -6.694   2.584
  610    HB   ILE  82           HB       ILE  82  -3.142  -4.470   3.355
  611   1HG1  ILE  82          2HG1      ILE  82  -3.392  -4.988   5.796
  612   2HG1  ILE  82          1HG1      ILE  82  -4.205  -3.513   5.294
  613   1HG2  ILE  82          1HG2      ILE  82  -6.111  -4.635   3.499
  614   2HG2  ILE  82          2HG2      ILE  82  -5.293  -5.190   2.040
  615   3HG2  ILE  82          3HG2      ILE  82  -5.082  -3.529   2.591
  616   1HD1  ILE  82          1HD1      ILE  82  -6.167  -5.412   5.035
  617   2HD1  ILE  82          2HD1      ILE  82  -5.961  -4.308   6.394
  618   3HD1  ILE  82          3HD1      ILE  82  -5.285  -5.935   6.470
  619    H    GLU  83           H        GLU  83  -1.407  -5.609   3.773
  620    HA   GLU  83           HA       GLU  83  -0.700  -6.504   6.337
  621   1HB   GLU  83          2HB       GLU  83  -0.448  -8.478   4.223
  622   2HB   GLU  83          1HB       GLU  83   1.105  -8.143   4.979
  623   1HG   GLU  83          2HG       GLU  83   0.442  -8.947   7.022
  624   2HG   GLU  83          1HG       GLU  83  -1.267  -8.656   6.702
  625    H    VAL  84           H        VAL  84   1.310  -5.754   6.978
  626    HA   VAL  84           HA       VAL  84   2.740  -4.142   4.967
  627    HB   VAL  84           HB       VAL  84   2.581  -3.705   7.955
  628   1HG1  VAL  84          1HG1      VAL  84   4.021  -2.195   5.782
  629   2HG1  VAL  84          2HG1      VAL  84   4.713  -2.958   7.214
  630   3HG1  VAL  84          3HG1      VAL  84   3.698  -1.526   7.382
  631   1HG2  VAL  84          1HG2      VAL  84   1.606  -1.590   6.208
  632   2HG2  VAL  84          2HG2      VAL  84   0.858  -2.323   7.626
  633   3HG2  VAL  84          3HG2      VAL  84   0.693  -3.091   6.047
  634    H    ASP  85           H        ASP  85   4.638  -4.940   4.394
  635    HA   ASP  85           HA       ASP  85   6.350  -6.158   6.436
  636   1HB   ASP  85          2HB       ASP  85   5.609  -7.390   3.780
  637   2HB   ASP  85          1HB       ASP  85   7.033  -7.883   4.692
  638    H    LEU  86           H        LEU  86   8.102  -4.911   6.487
  639    HA   LEU  86           HA       LEU  86   9.776  -4.570   4.237
  640   1HB   LEU  86          2HB       LEU  86   9.594  -2.175   3.911
  641   2HB   LEU  86          1HB       LEU  86   8.057  -2.957   3.590
  642    HG   LEU  86           HG       LEU  86   8.723  -1.536   6.168
  643   1HD1  LEU  86          1HD1      LEU  86   7.882   0.395   5.360
  644   2HD1  LEU  86          2HD1      LEU  86   6.762  -0.418   4.266
  645   3HD1  LEU  86          3HD1      LEU  86   8.465  -0.263   3.831
  646   1HD2  LEU  86          1HD2      LEU  86   7.008  -2.934   6.750
  647   2HD2  LEU  86          2HD2      LEU  86   6.345  -2.982   5.116
  648   3HD2  LEU  86          3HD2      LEU  86   6.090  -1.562   6.130
  649    H    LEU  87           H        LEU  87  11.497  -2.789   4.746
  650    HA   LEU  87           HA       LEU  87  13.254  -2.212   6.075
  651   1HB   LEU  87          2HB       LEU  87  10.865  -1.762   7.795
  652   2HB   LEU  87          1HB       LEU  87  12.448  -1.659   8.540
  653    HG   LEU  87           HG       LEU  87  12.373  -0.123   6.089
  654   1HD1  LEU  87          1HD1      LEU  87   9.992   0.088   6.574
  655   2HD1  LEU  87          2HD1      LEU  87  10.831   1.618   6.833
  656   3HD1  LEU  87          3HD1      LEU  87  10.366   0.622   8.213
  657   1HD2  LEU  87          1HD2      LEU  87  13.463   1.470   7.375
  658   2HD2  LEU  87          2HD2      LEU  87  13.920  -0.042   8.159
  659   3HD2  LEU  87          3HD2      LEU  87  12.658   0.969   8.861
  660    H    LYS  88           H        LYS  88  14.326  -4.198   6.029
  661    HA   LYS  88           HA       LYS  88  14.932  -5.363   8.483
  662   1HB   LYS  88          2HB       LYS  88  12.576  -6.480   7.196
  663   2HB   LYS  88          1HB       LYS  88  13.824  -7.696   7.432
  664   1HG   LYS  88          2HG       LYS  88  13.607  -7.681   9.675
  665   2HG   LYS  88          1HG       LYS  88  13.271  -5.950   9.741
  666   1HD   LYS  88          2HD       LYS  88  11.000  -6.316   9.019
  667   2HD   LYS  88          1HD       LYS  88  11.320  -8.033   8.766
  668   1HE   LYS  88          2HE       LYS  88  11.198  -8.520  10.973
  669   2HE   LYS  88          1HE       LYS  88  11.909  -6.981  11.459
  670   1HZ   LYS  88          1HZ       LYS  88   9.554  -7.231  12.100
  671   2HZ   LYS  88          2HZ       LYS  88   9.130  -7.296  10.464
  672   3HZ   LYS  88          3HZ       LYS  88   9.825  -5.892  11.103
  Start of MODEL   10
    1   1H    SER   1          1HT       SER   1  15.321   4.795  -5.928
    2   2H    SER   1          2HT       SER   1  14.827   5.391  -4.396
    3   3H    SER   1          3HT       SER   1  16.362   4.642  -4.573
    4    HA   SER   1           HA       SER   1  16.832   6.861  -4.505
    5   1HB   SER   1          2HB       SER   1  16.570   6.547  -7.469
    6   2HB   SER   1          1HB       SER   1  17.947   7.105  -6.518
    7    HG   SER   1           HG       SER   1  18.062   4.853  -5.758
    8    H    ASN   2           H        ASN   2  13.943   6.192  -6.365
    9    HA   ASN   2           HA       ASN   2  12.631   8.537  -5.568
   10   1HB   ASN   2          2HB       ASN   2  14.383   8.885  -7.817
   11   2HB   ASN   2          1HB       ASN   2  12.717   9.092  -8.346
   12   1HD2  ASN   2          1HD2      ASN   2  13.069  11.288  -8.707
   13   2HD2  ASN   2          2HD2      ASN   2  13.171  12.419  -7.406
   14    H    PHE   3           H        PHE   3  11.091   6.880  -5.183
   15    HA   PHE   3           HA       PHE   3   9.623   6.087  -7.608
   16   1HB   PHE   3          2HB       PHE   3  10.531   4.045  -6.959
   17   2HB   PHE   3          1HB       PHE   3  10.434   4.430  -5.245
   18    HD1  PHE   3           1HD      PHE   3   8.240   3.787  -8.190
   19    HD2  PHE   3           2HD      PHE   3   8.762   3.492  -3.978
   20    HE1  PHE   3           1HE      PHE   3   6.146   2.503  -8.024
   21    HE2  PHE   3           2HE      PHE   3   6.674   2.204  -3.813
   22    HZ   PHE   3           HZ       PHE   3   5.365   1.707  -5.828
   23    H    LEU   4           H        LEU   4   7.814   7.221  -7.624
   24    HA   LEU   4           HA       LEU   4   6.410   7.701  -5.085
   25   1HB   LEU   4          2HB       LEU   4   5.146   9.368  -6.739
   26   2HB   LEU   4          1HB       LEU   4   6.604   9.814  -5.877
   27    HG   LEU   4           HG       LEU   4   7.918   9.189  -7.921
   28   1HD1  LEU   4          1HD1      LEU   4   6.484   7.708  -9.065
   29   2HD1  LEU   4          2HD1      LEU   4   6.563   9.164 -10.055
   30   3HD1  LEU   4          3HD1      LEU   4   5.150   8.861  -9.045
   31   1HD2  LEU   4          1HD2      LEU   4   5.926  11.407  -7.840
   32   2HD2  LEU   4          2HD2      LEU   4   6.926  11.190  -9.277
   33   3HD2  LEU   4          3HD2      LEU   4   7.684  11.465  -7.709
   34    H    ASN   5           H        ASN   5   4.719   6.446  -4.717
   35    HA   ASN   5           HA       ASN   5   3.052   5.624  -6.994
   36   1HB   ASN   5          2HB       ASN   5   2.727   3.423  -5.984
   37   2HB   ASN   5          1HB       ASN   5   4.433   3.718  -6.293
   38   1HD2  ASN   5          1HD2      ASN   5   5.590   4.751  -4.364
   39   2HD2  ASN   5          2HD2      ASN   5   5.252   4.051  -2.823
   40    H    CYS   6           H        CYS   6   2.008   7.664  -6.123
   41    HA   CYS   6           HA       CYS   6   0.449   7.278  -3.697
   42   1HB   CYS   6          2HB       CYS   6   1.487   9.469  -4.103
   43   2HB   CYS   6          1HB       CYS   6   0.581   9.624  -5.605
   44    HG   CYS   6           HG       CYS   6  -0.403  10.552  -3.015
   45    H    TYR   7           H        TYR   7  -1.452   6.291  -3.772
   46    HA   TYR   7           HA       TYR   7  -3.056   6.534  -6.228
   47   1HB   TYR   7          2HB       TYR   7  -3.028   4.309  -6.387
   48   2HB   TYR   7          1HB       TYR   7  -2.075   4.196  -4.917
   49    HD1  TYR   7           1HD      TYR   7  -5.640   4.737  -5.925
   50    HD2  TYR   7           2HD      TYR   7  -2.920   2.904  -3.216
   51    HE1  TYR   7           1HE      TYR   7  -7.519   3.615  -4.806
   52    HE2  TYR   7           2HE      TYR   7  -4.792   1.778  -2.089
   53    HH   TYR   7           HH       TYR   7  -7.057   1.106  -2.513
   54    H    VAL   8           H        VAL   8  -5.083   7.241  -6.050
   55    HA   VAL   8           HA       VAL   8  -6.393   7.258  -3.436
   56    HB   VAL   8           HB       VAL   8  -6.932   9.579  -3.496
   57   1HG1  VAL   8          1HG1      VAL   8  -4.870  10.496  -2.998
   58   2HG1  VAL   8          2HG1      VAL   8  -4.057   9.647  -4.311
   59   3HG1  VAL   8          3HG1      VAL   8  -4.541   8.769  -2.860
   60   1HG2  VAL   8          1HG2      VAL   8  -5.921  11.019  -5.368
   61   2HG2  VAL   8          2HG2      VAL   8  -7.362  10.075  -5.743
   62   3HG2  VAL   8          3HG2      VAL   8  -5.775   9.508  -6.265
   63    H    SER   9           H        SER   9  -8.707   7.940  -3.611
   64    HA   SER   9           HA       SER   9 -10.779   7.915  -4.575
   65   1HB   SER   9          2HB       SER   9 -11.050   8.451  -6.787
   66   2HB   SER   9          1HB       SER   9  -9.357   8.908  -6.605
   67    HG   SER   9           HG       SER   9  -8.742   7.072  -7.625
   68    H    GLY  10           H        GLY  10 -11.848   6.346  -6.576
   69   1HA   GLY  10          2HA       GLY  10 -11.766   3.763  -5.304
   70   2HA   GLY  10          1HA       GLY  10 -12.801   4.237  -6.641
   71    H    PHE  11           H        PHE  11 -12.274   2.041  -7.385
   72    HA   PHE  11           HA       PHE  11  -9.797   2.067  -8.973
   73   1HB   PHE  11          2HB       PHE  11 -10.258   0.378  -6.819
   74   2HB   PHE  11          1HB       PHE  11 -10.675  -0.613  -8.211
   75    HD1  PHE  11           1HD      PHE  11  -8.063   2.018  -7.955
   76    HD2  PHE  11           2HD      PHE  11  -8.926  -2.133  -8.330
   77    HE1  PHE  11           1HE      PHE  11  -5.677   1.559  -8.340
   78    HE2  PHE  11           2HE      PHE  11  -6.540  -2.598  -8.715
   79    HZ   PHE  11           HZ       PHE  11  -4.913  -0.750  -8.719
   80    H    HIS  12           H        HIS  12 -10.340  -0.503 -10.155
   81    HA   HIS  12           HA       HIS  12 -12.904  -0.671 -11.283
   82   1HB   HIS  12          2HB       HIS  12 -11.498   1.452 -12.360
   83   2HB   HIS  12          1HB       HIS  12 -11.220   0.159 -13.523
   84    HD1  HIS  12           1HD      HIS  12 -14.248  -0.983 -12.717
   85    HD2  HIS  12           2HD      HIS  12 -13.141   2.669 -14.364
   86    HE1  HIS  12           1HE      HIS  12 -16.299  -0.128 -13.893
   87    HE2  HIS  12           2HE      HIS  12 -15.582   2.043 -14.952
   88    HA   PRO  13           HA       PRO  13  -9.894  -3.497 -13.825
   89   1HB   PRO  13          2HB       PRO  13  -7.248  -3.355 -13.136
   90   2HB   PRO  13          1HB       PRO  13  -7.967  -2.440 -14.466
   91   1HG   PRO  13          2HG       PRO  13  -7.354  -1.558 -11.672
   92   2HG   PRO  13          1HG       PRO  13  -7.095  -0.695 -13.200
   93   1HD   PRO  13          2HD       PRO  13  -9.176  -0.136 -11.603
   94   2HD   PRO  13          1HD       PRO  13  -9.315  -0.069 -13.370
   95    H    SER  14           H        SER  14  -9.406  -2.743 -10.459
   96    HA   SER  14           HA       SER  14  -9.436  -4.045  -8.594
   97   1HB   SER  14          2HB       SER  14  -9.928  -6.442 -10.362
   98   2HB   SER  14          1HB       SER  14 -10.363  -6.236  -8.666
   99    HG   SER  14           HG       SER  14 -11.818  -5.668 -10.799
  100    H    ASP  15           H        ASP  15  -8.029  -6.149 -11.118
  101    HA   ASP  15           HA       ASP  15  -5.916  -6.982  -9.364
  102   1HB   ASP  15          2HB       ASP  15  -6.468  -7.486 -12.290
  103   2HB   ASP  15          1HB       ASP  15  -5.075  -8.154 -11.446
  104    H    ILE  16           H        ILE  16  -3.980  -6.082  -9.098
  105    HA   ILE  16           HA       ILE  16  -2.679  -4.624 -11.214
  106    HB   ILE  16           HB       ILE  16  -4.190  -2.913 -10.245
  107   1HG1  ILE  16          2HG1      ILE  16  -1.878  -2.444 -11.234
  108   2HG1  ILE  16          1HG1      ILE  16  -2.588  -1.181 -10.236
  109   1HG2  ILE  16          1HG2      ILE  16  -4.382  -3.582  -7.985
  110   2HG2  ILE  16          2HG2      ILE  16  -3.576  -2.012  -7.980
  111   3HG2  ILE  16          3HG2      ILE  16  -2.639  -3.485  -7.734
  112   1HD1  ILE  16          1HD1      ILE  16  -0.737  -1.155  -9.035
  113   2HD1  ILE  16          2HD1      ILE  16  -0.088  -2.517  -9.947
  114   3HD1  ILE  16          3HD1      ILE  16  -1.071  -2.806  -8.513
  115    H    GLU  17           H        GLU  17  -0.497  -4.595 -10.983
  116    HA   GLU  17           HA       GLU  17   0.655  -5.311  -8.388
  117   1HB   GLU  17          2HB       GLU  17   2.137  -6.969  -9.462
  118   2HB   GLU  17          1HB       GLU  17   0.441  -7.420  -9.570
  119   1HG   GLU  17          2HG       GLU  17   0.345  -7.058 -11.836
  120   2HG   GLU  17          1HG       GLU  17   1.696  -5.928 -11.821
  121    H    VAL  18           H        VAL  18   2.578  -4.351  -7.951
  122    HA   VAL  18           HA       VAL  18   3.733  -2.664 -10.077
  123    HB   VAL  18           HB       VAL  18   3.897  -2.162  -7.103
  124   1HG1  VAL  18          1HG1      VAL  18   4.618   0.095  -7.839
  125   2HG1  VAL  18          2HG1      VAL  18   4.641  -0.493  -9.501
  126   3HG1  VAL  18          3HG1      VAL  18   5.736  -1.185  -8.306
  127   1HG2  VAL  18          1HG2      VAL  18   1.623  -1.861  -7.611
  128   2HG2  VAL  18          2HG2      VAL  18   1.981  -1.123  -9.173
  129   3HG2  VAL  18          3HG2      VAL  18   2.321  -0.242  -7.683
  130    H    ASP  19           H        ASP  19   5.747  -3.111 -10.677
  131    HA   ASP  19           HA       ASP  19   7.393  -4.783  -8.894
  132   1HB   ASP  19          2HB       ASP  19   7.593  -4.568 -11.904
  133   2HB   ASP  19          1HB       ASP  19   8.472  -5.686 -10.865
  134    H    LEU  20           H        LEU  20   9.331  -4.057  -8.259
  135    HA   LEU  20           HA       LEU  20  10.922  -2.229  -9.722
  136   1HB   LEU  20          2HB       LEU  20   8.909  -1.090  -8.018
  137   2HB   LEU  20          1HB       LEU  20  10.496  -0.696  -7.386
  138    HG   LEU  20           HG       LEU  20   9.454  -0.073 -10.148
  139   1HD1  LEU  20          1HD1      LEU  20  10.151   2.281  -9.161
  140   2HD1  LEU  20          2HD1      LEU  20   9.806   1.466  -7.636
  141   3HD1  LEU  20          3HD1      LEU  20   8.557   1.586  -8.874
  142   1HD2  LEU  20          1HD2      LEU  20  11.743   1.293 -10.007
  143   2HD2  LEU  20          2HD2      LEU  20  11.642  -0.333 -10.680
  144   3HD2  LEU  20          3HD2      LEU  20  12.190  -0.098  -9.020
  145    H    LEU  21           H        LEU  21  11.208  -4.742  -8.399
  146    HA   LEU  21           HA       LEU  21  12.951  -4.120  -6.124
  147   1HB   LEU  21          2HB       LEU  21  11.300  -5.818  -5.681
  148   2HB   LEU  21          1HB       LEU  21  11.774  -6.718  -7.108
  149    HG   LEU  21           HG       LEU  21  13.985  -6.310  -5.242
  150   1HD1  LEU  21          1HD1      LEU  21  13.251  -7.453  -3.397
  151   2HD1  LEU  21          2HD1      LEU  21  11.947  -8.252  -4.274
  152   3HD1  LEU  21          3HD1      LEU  21  11.795  -6.555  -3.822
  153   1HD2  LEU  21          1HD2      LEU  21  14.498  -8.515  -5.798
  154   2HD2  LEU  21          2HD2      LEU  21  13.761  -7.872  -7.265
  155   3HD2  LEU  21          3HD2      LEU  21  12.824  -8.907  -6.187
  156    H    LYS  22           H        LYS  22  12.996  -6.359  -8.908
  157    HA   LYS  22           HA       LYS  22  14.685  -7.078 -10.251
  158   1HB   LYS  22          2HB       LYS  22  15.922  -4.432  -9.467
  159   2HB   LYS  22          1HB       LYS  22  16.484  -5.460 -10.778
  160   1HG   LYS  22          2HG       LYS  22  13.756  -5.071 -11.250
  161   2HG   LYS  22          1HG       LYS  22  14.388  -3.497 -10.764
  162   1HD   LYS  22          2HD       LYS  22  15.631  -3.277 -12.634
  163   2HD   LYS  22          1HD       LYS  22  16.062  -4.988 -12.672
  164   1HE   LYS  22          2HE       LYS  22  13.384  -3.857 -13.477
  165   2HE   LYS  22          1HE       LYS  22  14.674  -4.293 -14.597
  166   1HZ   LYS  22          1HZ       LYS  22  13.564  -6.234 -14.633
  167   2HZ   LYS  22          2HZ       LYS  22  12.849  -6.000 -13.117
  168   3HZ   LYS  22          3HZ       LYS  22  14.443  -6.552 -13.222
  169   1H    SER  23          1HT       SER  23  12.471  11.976  -1.795
  170   2H    SER  23          2HT       SER  23  13.196  10.545  -2.407
  171   3H    SER  23          3HT       SER  23  13.137  10.824  -0.714
  172    HA   SER  23           HA       SER  23  10.768  10.704  -0.751
  173   1HB   SER  23          2HB       SER  23   9.541  10.437  -2.712
  174   2HB   SER  23          1HB       SER  23  10.852  11.477  -3.264
  175    HG   SER  23           HG       SER  23  10.200   9.287  -4.366
  176    H    ASN  24           H        ASN  24  12.731   8.630  -2.882
  177    HA   ASN  24           HA       ASN  24  13.301   6.439  -2.779
  178   1HB   ASN  24          2HB       ASN  24  14.117   6.971  -0.538
  179   2HB   ASN  24          1HB       ASN  24  12.511   6.701   0.126
  180   1HD2  ASN  24          1HD2      ASN  24  15.349   5.392   0.189
  181   2HD2  ASN  24          2HD2      ASN  24  14.977   3.707   0.123
  182    H    PHE  25           H        PHE  25  10.847   5.958  -0.279
  183    HA   PHE  25           HA       PHE  25   9.162   4.633  -2.303
  184   1HB   PHE  25          2HB       PHE  25  10.292   2.911  -1.050
  185   2HB   PHE  25          1HB       PHE  25   9.872   3.679   0.476
  186    HD1  PHE  25           1HD      PHE  25   7.622   3.151  -2.415
  187    HD2  PHE  25           2HD      PHE  25   8.690   1.958   1.522
  188    HE1  PHE  25           1HE      PHE  25   5.586   1.769  -2.285
  189    HE2  PHE  25           2HE      PHE  25   6.660   0.577   1.661
  190    HZ   PHE  25           HZ       PHE  25   5.106   0.480  -0.246
  191    H    LEU  26           H        LEU  26   7.454   5.964  -2.510
  192    HA   LEU  26           HA       LEU  26   6.159   6.914  -0.034
  193   1HB   LEU  26          2HB       LEU  26   6.551   8.186  -2.702
  194   2HB   LEU  26          1HB       LEU  26   5.122   8.598  -1.776
  195    HG   LEU  26           HG       LEU  26   6.681   9.203   0.131
  196   1HD1  LEU  26          1HD1      LEU  26   8.993   9.864  -0.724
  197   2HD1  LEU  26          2HD1      LEU  26   8.674   8.764  -2.066
  198   3HD1  LEU  26          3HD1      LEU  26   8.698   8.153  -0.411
  199   1HD2  LEU  26          1HD2      LEU  26   7.371  11.368  -1.011
  200   2HD2  LEU  26          2HD2      LEU  26   5.652  10.972  -1.023
  201   3HD2  LEU  26          3HD2      LEU  26   6.628  10.707  -2.468
  202    H    ASN  27           H        ASN  27   4.803   5.125   0.228
  203    HA   ASN  27           HA       ASN  27   2.941   4.514  -1.945
  204   1HB   ASN  27          2HB       ASN  27   4.217   2.746  -0.515
  205   2HB   ASN  27          1HB       ASN  27   2.974   3.074   0.687
  206   1HD2  ASN  27          1HD2      ASN  27   3.795   1.037  -1.689
  207   2HD2  ASN  27          2HD2      ASN  27   2.233   0.499  -2.192
  208    H    CYS  28           H        CYS  28   1.182   5.740  -2.016
  209    HA   CYS  28           HA       CYS  28  -0.069   6.551   0.525
  210   1HB   CYS  28          2HB       CYS  28  -0.603   7.872  -2.123
  211   2HB   CYS  28          1HB       CYS  28  -0.868   8.510  -0.504
  212    HG   CYS  28           HG       CYS  28   2.074   8.110  -1.000
  213    H    TYR  29           H        TYR  29  -2.233   6.225   0.859
  214    HA   TYR  29           HA       TYR  29  -3.867   5.082  -1.254
  215   1HB   TYR  29          2HB       TYR  29  -2.934   3.065  -0.404
  216   2HB   TYR  29          1HB       TYR  29  -3.111   3.598   1.262
  217    HD1  TYR  29           1HD      TYR  29  -4.128   1.333   1.632
  218    HD2  TYR  29           2HD      TYR  29  -5.965   4.240  -0.877
  219    HE1  TYR  29           1HE      TYR  29  -6.260   0.120   1.789
  220    HE2  TYR  29           2HE      TYR  29  -8.099   3.035  -0.716
  221    HH   TYR  29           HH       TYR  29  -8.899   0.990   1.494
  222    H    VAL  30           H        VAL  30  -5.415   6.605  -1.189
  223    HA   VAL  30           HA       VAL  30  -6.797   6.982   1.387
  224    HB   VAL  30           HB       VAL  30  -7.241   9.302   0.871
  225   1HG1  VAL  30          1HG1      VAL  30  -5.255  10.049   1.629
  226   2HG1  VAL  30          2HG1      VAL  30  -4.345   9.270   0.336
  227   3HG1  VAL  30          3HG1      VAL  30  -4.879   8.330   1.729
  228   1HG2  VAL  30          1HG2      VAL  30  -5.630  10.084  -1.179
  229   2HG2  VAL  30          2HG2      VAL  30  -7.364   9.792  -1.317
  230   3HG2  VAL  30          3HG2      VAL  30  -6.219   8.529  -1.766
  231    H    SER  31           H        SER  31  -8.962   6.832   1.372
  232    HA   SER  31           HA       SER  31 -11.110   6.627   0.627
  233   1HB   SER  31          2HB       SER  31 -10.328   7.033  -2.236
  234   2HB   SER  31          1HB       SER  31 -11.785   7.553  -1.388
  235    HG   SER  31           HG       SER  31  -9.624   8.971  -1.875
  236    H    GLY  32           H        GLY  32 -11.016   4.435   1.181
  237   1HA   GLY  32          2HA       GLY  32  -9.943   2.378  -0.378
  238   2HA   GLY  32          1HA       GLY  32 -11.237   2.184   0.795
  239    H    PHE  33           H        PHE  33 -11.691   0.506  -0.986
  240    HA   PHE  33           HA       PHE  33 -13.951   1.453  -2.460
  241   1HB   PHE  33          2HB       PHE  33 -13.004   0.548  -4.678
  242   2HB   PHE  33          1HB       PHE  33 -12.477   2.138  -4.145
  243    HD1  PHE  33           1HD      PHE  33 -10.375   2.400  -5.061
  244    HD2  PHE  33           2HD      PHE  33 -11.307  -1.226  -3.037
  245    HE1  PHE  33           1HE      PHE  33  -8.032   1.685  -5.265
  246    HE2  PHE  33           2HE      PHE  33  -8.967  -1.943  -3.233
  247    HZ   PHE  33           HZ       PHE  33  -7.324  -0.488  -4.350
  248    H    HIS  34           H        HIS  34 -14.470  -0.545  -4.164
  249    HA   HIS  34           HA       HIS  34 -15.277  -2.661  -2.521
  250   1HB   HIS  34          2HB       HIS  34 -14.894  -2.879  -5.507
  251   2HB   HIS  34          1HB       HIS  34 -16.067  -3.722  -4.500
  252    HD1  HIS  34           1HD      HIS  34 -18.121  -2.316  -3.658
  253    HD2  HIS  34           2HD      HIS  34 -15.668  -0.379  -6.396
  254    HE1  HIS  34           1HE      HIS  34 -19.443  -0.334  -4.458
  255    HE2  HIS  34           2HE      HIS  34 -17.882   0.900  -6.003
  256    HA   PRO  35           HA       PRO  35 -12.047  -5.601  -2.037
  257   1HB   PRO  35          2HB       PRO  35 -13.615  -7.474  -3.760
  258   2HB   PRO  35          1HB       PRO  35 -12.878  -7.753  -2.177
  259   1HG   PRO  35          2HG       PRO  35 -15.498  -7.360  -2.390
  260   2HG   PRO  35          1HG       PRO  35 -14.582  -6.657  -1.043
  261   1HD   PRO  35          2HD       PRO  35 -15.696  -5.339  -3.470
  262   2HD   PRO  35          1HD       PRO  35 -15.492  -4.697  -1.828
  263    H    SER  36           H        SER  36 -10.230  -5.075  -3.102
  264    HA   SER  36           HA       SER  36  -9.992  -5.925  -5.905
  265   1HB   SER  36          2HB       SER  36  -9.256  -3.254  -4.725
  266   2HB   SER  36          1HB       SER  36  -8.435  -3.868  -6.160
  267    HG   SER  36           HG       SER  36 -10.667  -4.157  -7.006
  268    H    ASP  37           H        ASP  37  -7.750  -6.279  -6.590
  269    HA   ASP  37           HA       ASP  37  -6.110  -7.216  -4.336
  270   1HB   ASP  37          2HB       ASP  37  -6.978  -8.807  -6.203
  271   2HB   ASP  37          1HB       ASP  37  -5.702  -8.087  -7.181
  272    H    ILE  38           H        ILE  38  -4.674  -5.687  -3.823
  273    HA   ILE  38           HA       ILE  38  -3.109  -4.475  -6.009
  274    HB   ILE  38           HB       ILE  38  -3.173  -3.081  -3.396
  275   1HG1  ILE  38          2HG1      ILE  38  -5.557  -3.704  -3.745
  276   2HG1  ILE  38          1HG1      ILE  38  -5.285  -1.966  -3.819
  277   1HG2  ILE  38          1HG2      ILE  38  -3.660  -1.605  -5.873
  278   2HG2  ILE  38          2HG2      ILE  38  -2.166  -2.542  -5.870
  279   3HG2  ILE  38          3HG2      ILE  38  -2.459  -1.345  -4.609
  280   1HD1  ILE  38          1HD1      ILE  38  -6.177  -3.839  -5.903
  281   2HD1  ILE  38          2HD1      ILE  38  -5.066  -2.570  -6.418
  282   3HD1  ILE  38          3HD1      ILE  38  -6.589  -2.145  -5.638
  283    H    GLU  39           H        GLU  39  -1.064  -5.161  -6.040
  284    HA   GLU  39           HA       GLU  39   0.252  -5.718  -3.470
  285   1HB   GLU  39          2HB       GLU  39   1.211  -7.729  -4.241
  286   2HB   GLU  39          1HB       GLU  39  -0.478  -7.815  -4.714
  287   1HG   GLU  39          2HG       GLU  39   0.299  -8.390  -6.716
  288   2HG   GLU  39          1HG       GLU  39   0.672  -6.678  -6.913
  289    H    VAL  40           H        VAL  40   2.335  -5.052  -3.269
  290    HA   VAL  40           HA       VAL  40   3.657  -3.941  -5.649
  291    HB   VAL  40           HB       VAL  40   3.513  -2.544  -2.971
  292   1HG1  VAL  40          1HG1      VAL  40   5.056  -2.031  -5.475
  293   2HG1  VAL  40          2HG1      VAL  40   5.567  -1.902  -3.792
  294   3HG1  VAL  40          3HG1      VAL  40   4.519  -0.669  -4.492
  295   1HG2  VAL  40          1HG2      VAL  40   2.196  -0.849  -4.122
  296   2HG2  VAL  40          2HG2      VAL  40   1.400  -2.421  -4.205
  297   3HG2  VAL  40          3HG2      VAL  40   2.261  -1.791  -5.611
  298    H    ASP  41           H        ASP  41   5.573  -4.868  -5.891
  299    HA   ASP  41           HA       ASP  41   7.068  -5.659  -3.478
  300   1HB   ASP  41          2HB       ASP  41   7.987  -7.551  -4.757
  301   2HB   ASP  41          1HB       ASP  41   6.231  -7.643  -4.646
  302    H    LEU  42           H        LEU  42   8.600  -4.140  -3.279
  303    HA   LEU  42           HA       LEU  42  10.347  -3.670  -5.597
  304   1HB   LEU  42          2HB       LEU  42   9.993  -1.387  -3.764
  305   2HB   LEU  42          1HB       LEU  42  10.187  -1.413  -5.506
  306    HG   LEU  42           HG       LEU  42   7.622  -2.032  -4.035
  307   1HD1  LEU  42          1HD1      LEU  42   7.902   0.312  -5.815
  308   2HD1  LEU  42          2HD1      LEU  42   8.669   0.408  -4.230
  309   3HD1  LEU  42          3HD1      LEU  42   6.936   0.100  -4.354
  310   1HD2  LEU  42          1HD2      LEU  42   7.271  -1.387  -6.786
  311   2HD2  LEU  42          2HD2      LEU  42   6.866  -2.880  -5.940
  312   3HD2  LEU  42          3HD2      LEU  42   8.463  -2.679  -6.660
  313    H    LEU  43           H        LEU  43  12.367  -2.356  -4.760
  314    HA   LEU  43           HA       LEU  43  13.212  -3.394  -2.149
  315   1HB   LEU  43          2HB       LEU  43  14.066  -4.957  -3.791
  316   2HB   LEU  43          1HB       LEU  43  14.747  -3.644  -4.733
  317    HG   LEU  43           HG       LEU  43  15.946  -3.293  -2.278
  318   1HD1  LEU  43          1HD1      LEU  43  15.297  -6.163  -2.678
  319   2HD1  LEU  43          2HD1      LEU  43  15.451  -5.233  -1.188
  320   3HD1  LEU  43          3HD1      LEU  43  16.895  -5.747  -2.058
  321   1HD2  LEU  43          1HD2      LEU  43  16.867  -4.767  -4.737
  322   2HD2  LEU  43          2HD2      LEU  43  17.935  -4.326  -3.405
  323   3HD2  LEU  43          3HD2      LEU  43  17.120  -3.069  -4.335
  324    H    LYS  44           H        LYS  44  14.092  -1.293  -4.879
  325    HA   LYS  44           HA       LYS  44  15.828   0.344  -3.304
  326   1HB   LYS  44          2HB       LYS  44  14.585   1.109  -5.940
  327   2HB   LYS  44          1HB       LYS  44  16.107   1.666  -5.258
  328   1HG   LYS  44          2HG       LYS  44  16.661  -0.931  -5.390
  329   2HG   LYS  44          1HG       LYS  44  15.470  -0.843  -6.689
  330   1HD   LYS  44          2HD       LYS  44  17.572   1.245  -6.642
  331   2HD   LYS  44          1HD       LYS  44  18.075  -0.390  -7.078
  332   1HE   LYS  44          2HE       LYS  44  15.967   1.299  -8.411
  333   2HE   LYS  44          1HE       LYS  44  17.510   0.781  -9.088
  334   1HZ   LYS  44          1HZ       LYS  44  16.456  -1.571  -8.516
  335   2HZ   LYS  44          2HZ       LYS  44  16.195  -0.795  -9.995
  336   3HZ   LYS  44          3HZ       LYS  44  15.025  -0.705  -8.777
  337   1H    SER  45          1HT       SER  45  14.706   4.958   6.394
  338   2H    SER  45          2HT       SER  45  15.182   3.310   6.340
  339   3H    SER  45          3HT       SER  45  13.580   3.757   5.916
  340    HA   SER  45           HA       SER  45  15.930   4.762   4.481
  341   1HB   SER  45          2HB       SER  45  15.400   2.922   2.832
  342   2HB   SER  45          1HB       SER  45  16.090   2.368   4.358
  343    HG   SER  45           HG       SER  45  13.301   2.473   3.885
  344    H    ASN  46           H        ASN  46  13.699   6.265   5.200
  345    HA   ASN  46           HA       ASN  46  12.085   7.608   4.333
  346   1HB   ASN  46          2HB       ASN  46  13.521   6.785   1.815
  347   2HB   ASN  46          1HB       ASN  46  12.171   7.916   1.794
  348   1HD2  ASN  46          1HD2      ASN  46  14.339   8.922   0.810
  349   2HD2  ASN  46          2HD2      ASN  46  15.151   9.980   1.908
  350    H    PHE  47           H        PHE  47  10.829   5.611   5.191
  351    HA   PHE  47           HA       PHE  47   9.286   4.372   3.016
  352   1HB   PHE  47          2HB       PHE  47  10.219   2.713   4.456
  353   2HB   PHE  47          1HB       PHE  47   9.726   3.589   5.899
  354    HD1  PHE  47           1HD      PHE  47   7.651   2.904   2.911
  355    HD2  PHE  47           2HD      PHE  47   8.439   1.968   6.983
  356    HE1  PHE  47           1HE      PHE  47   5.582   1.573   3.000
  357    HE2  PHE  47           2HE      PHE  47   6.374   0.639   7.085
  358    HZ   PHE  47           HZ       PHE  47   4.941   0.437   5.091
  359    H    LEU  48           H        LEU  48   7.353   5.205   2.585
  360    HA   LEU  48           HA       LEU  48   5.867   6.505   4.771
  361   1HB   LEU  48          2HB       LEU  48   6.752   8.205   3.281
  362   2HB   LEU  48          1HB       LEU  48   6.070   7.382   1.891
  363    HG   LEU  48           HG       LEU  48   3.815   7.878   2.655
  364   1HD1  LEU  48          1HD1      LEU  48   3.736   7.898   4.933
  365   2HD1  LEU  48          2HD1      LEU  48   3.793   9.633   4.624
  366   3HD1  LEU  48          3HD1      LEU  48   5.259   8.773   5.090
  367   1HD2  LEU  48          1HD2      LEU  48   5.123   9.539   1.305
  368   2HD2  LEU  48          2HD2      LEU  48   5.469  10.390   2.810
  369   3HD2  LEU  48          3HD2      LEU  48   3.804  10.223   2.253
  370    H    ASN  49           H        ASN  49   4.215   5.228   5.241
  371    HA   ASN  49           HA       ASN  49   2.565   4.206   3.029
  372   1HB   ASN  49          2HB       ASN  49   2.117   2.173   4.346
  373   2HB   ASN  49          1HB       ASN  49   3.832   2.338   3.988
  374   1HD2  ASN  49          1HD2      ASN  49   5.092   3.512   5.728
  375   2HD2  ASN  49          2HD2      ASN  49   4.730   3.081   7.361
  376    H    CYS  50           H        CYS  50   0.865   5.578   3.130
  377    HA   CYS  50           HA       CYS  50  -0.413   5.940   5.768
  378   1HB   CYS  50          2HB       CYS  50  -1.359   8.054   4.801
  379   2HB   CYS  50          1HB       CYS  50   0.389   8.058   4.994
  380    HG   CYS  50           HG       CYS  50   0.610   7.763   2.412
  381    H    TYR  51           H        TYR  51  -2.500   5.398   6.026
  382    HA   TYR  51           HA       TYR  51  -4.127   4.869   3.651
  383   1HB   TYR  51          2HB       TYR  51  -4.890   2.740   4.453
  384   2HB   TYR  51          1HB       TYR  51  -3.132   2.714   4.436
  385    HD1  TYR  51           1HD      TYR  51  -1.899   2.325   6.426
  386    HD2  TYR  51           2HD      TYR  51  -6.096   2.992   6.637
  387    HE1  TYR  51           1HE      TYR  51  -1.890   1.599   8.775
  388    HE2  TYR  51           2HE      TYR  51  -6.098   2.271   8.988
  389    HH   TYR  51           HH       TYR  51  -4.215   2.227  10.904
  390    H    VAL  52           H        VAL  52  -6.046   5.789   3.775
  391    HA   VAL  52           HA       VAL  52  -7.223   6.304   6.419
  392    HB   VAL  52           HB       VAL  52  -7.727   8.534   5.973
  393   1HG1  VAL  52          1HG1      VAL  52  -5.254   8.730   4.408
  394   2HG1  VAL  52          2HG1      VAL  52  -5.124   7.774   5.883
  395   3HG1  VAL  52          3HG1      VAL  52  -5.676   9.447   5.964
  396   1HG2  VAL  52          1HG2      VAL  52  -7.277   9.508   3.618
  397   2HG2  VAL  52          2HG2      VAL  52  -8.745   8.569   3.886
  398   3HG2  VAL  52          3HG2      VAL  52  -7.360   7.828   3.086
  399    H    SER  53           H        SER  53  -9.217   5.495   6.577
  400    HA   SER  53           HA       SER  53 -11.366   5.887   4.964
  401   1HB   SER  53          2HB       SER  53  -9.575   3.853   3.806
  402   2HB   SER  53          1HB       SER  53 -11.264   3.360   3.924
  403    HG   SER  53           HG       SER  53 -10.469   5.839   2.816
  404    H    GLY  54           H        GLY  54 -10.374   2.572   5.695
  405   1HA   GLY  54          2HA       GLY  54 -11.419   2.405   8.297
  406   2HA   GLY  54          1HA       GLY  54 -12.691   1.975   7.162
  407    H    PHE  55           H        PHE  55 -11.012   0.748   5.213
  408    HA   PHE  55           HA       PHE  55 -10.093  -1.256   4.670
  409   1HB   PHE  55          2HB       PHE  55  -8.865  -0.584   7.244
  410   2HB   PHE  55          1HB       PHE  55  -8.897  -2.314   6.914
  411    HD1  PHE  55           1HD      PHE  55  -7.975   0.926   5.334
  412    HD2  PHE  55           2HD      PHE  55  -7.240  -3.255   5.620
  413    HE1  PHE  55           1HE      PHE  55  -6.020   1.174   3.861
  414    HE2  PHE  55           2HE      PHE  55  -5.282  -3.017   4.148
  415    HZ   PHE  55           HZ       PHE  55  -4.672  -0.800   3.264
  416    H    HIS  56           H        HIS  56 -11.094  -3.124   4.365
  417    HA   HIS  56           HA       HIS  56 -11.981  -4.899   6.300
  418   1HB   HIS  56          2HB       HIS  56 -13.656  -2.918   6.601
  419   2HB   HIS  56          1HB       HIS  56 -14.395  -3.549   5.135
  420    HD1  HIS  56           1HD      HIS  56 -14.757  -3.778   8.630
  421    HD2  HIS  56           2HD      HIS  56 -14.862  -6.550   5.536
  422    HE1  HIS  56           1HE      HIS  56 -15.998  -5.764   9.548
  423    HE2  HIS  56           2HE      HIS  56 -15.986  -7.457   7.680
  424    HA   PRO  57           HA       PRO  57 -13.532  -6.285   2.056
  425   1HB   PRO  57          2HB       PRO  57 -14.023  -4.515   0.094
  426   2HB   PRO  57          1HB       PRO  57 -15.157  -4.788   1.419
  427   1HG   PRO  57          2HG       PRO  57 -13.392  -2.484   0.902
  428   2HG   PRO  57          1HG       PRO  57 -14.886  -2.567   1.847
  429   1HD   PRO  57          2HD       PRO  57 -12.176  -2.622   2.797
  430   2HD   PRO  57          1HD       PRO  57 -13.670  -2.698   3.746
  431    H    SER  58           H        SER  58 -11.602  -3.440   1.061
  432    HA   SER  58           HA       SER  58 -10.289  -4.583  -1.074
  433   1HB   SER  58          2HB       SER  58 -10.227  -2.177  -0.545
  434   2HB   SER  58          1HB       SER  58  -9.182  -2.512   0.835
  435    HG   SER  58           HG       SER  58  -8.166  -1.864  -1.248
  436    H    ASP  59           H        ASP  59  -8.074  -5.272  -1.323
  437    HA   ASP  59           HA       ASP  59  -6.836  -6.429   1.061
  438   1HB   ASP  59          2HB       ASP  59  -7.747  -7.934  -1.375
  439   2HB   ASP  59          1HB       ASP  59  -6.367  -8.505  -0.443
  440    H    ILE  60           H        ILE  60  -5.036  -5.177   1.030
  441    HA   ILE  60           HA       ILE  60  -3.476  -5.146  -1.471
  442    HB   ILE  60           HB       ILE  60  -3.360  -3.137   0.773
  443   1HG1  ILE  60          2HG1      ILE  60  -4.418  -2.554  -1.967
  444   2HG1  ILE  60          1HG1      ILE  60  -5.474  -3.291  -0.765
  445   1HG2  ILE  60          1HG2      ILE  60  -1.373  -2.666  -0.133
  446   2HG2  ILE  60          2HG2      ILE  60  -2.287  -1.981  -1.477
  447   3HG2  ILE  60          3HG2      ILE  60  -1.699  -3.640  -1.566
  448   1HD1  ILE  60          1HD1      ILE  60  -3.988  -0.707  -0.370
  449   2HD1  ILE  60          2HD1      ILE  60  -5.198  -1.417   0.698
  450   3HD1  ILE  60          3HD1      ILE  60  -5.665  -0.834  -0.899
  451    H    GLU  61           H        GLU  61  -1.295  -5.598  -1.410
  452    HA   GLU  61           HA       GLU  61  -0.146  -6.389   1.170
  453   1HB   GLU  61          2HB       GLU  61   0.888  -8.377   0.005
  454   2HB   GLU  61          1HB       GLU  61  -0.848  -8.474   0.272
  455   1HG   GLU  61          2HG       GLU  61  -1.125  -7.638  -2.097
  456   2HG   GLU  61          1HG       GLU  61   0.603  -7.924  -2.297
  457    H    VAL  62           H        VAL  62   1.024  -4.406   1.032
  458    HA   VAL  62           HA       VAL  62   2.889  -4.048  -1.162
  459    HB   VAL  62           HB       VAL  62   2.561  -2.435   1.375
  460   1HG1  VAL  62          1HG1      VAL  62   4.499  -1.501   0.799
  461   2HG1  VAL  62          2HG1      VAL  62   3.675  -0.840  -0.613
  462   3HG1  VAL  62          3HG1      VAL  62   4.539  -2.373  -0.733
  463   1HG2  VAL  62          1HG2      VAL  62   1.739  -1.325  -1.229
  464   2HG2  VAL  62          2HG2      VAL  62   0.994  -1.165   0.362
  465   3HG2  VAL  62          3HG2      VAL  62   0.729  -2.624  -0.594
  466    H    ASP  63           H        ASP  63   4.823  -4.994  -1.185
  467    HA   ASP  63           HA       ASP  63   6.071  -5.678   1.393
  468   1HB   ASP  63          2HB       ASP  63   7.143  -7.578   0.275
  469   2HB   ASP  63          1HB       ASP  63   5.388  -7.680   0.159
  470    H    LEU  64           H        LEU  64   7.939  -4.725   1.829
  471    HA   LEU  64           HA       LEU  64   9.486  -3.584  -0.405
  472   1HB   LEU  64          2HB       LEU  64   9.494  -2.578   2.433
  473   2HB   LEU  64          1HB       LEU  64  10.210  -1.814   1.030
  474    HG   LEU  64           HG       LEU  64   8.267  -0.582   1.579
  475   1HD1  LEU  64          1HD1      LEU  64   8.086  -2.302  -0.836
  476   2HD1  LEU  64          2HD1      LEU  64   8.269  -0.554  -0.700
  477   3HD1  LEU  64          3HD1      LEU  64   6.697  -1.300  -0.417
  478   1HD2  LEU  64          1HD2      LEU  64   7.290  -2.628   2.849
  479   2HD2  LEU  64          2HD2      LEU  64   6.473  -2.952   1.319
  480   3HD2  LEU  64          3HD2      LEU  64   6.205  -1.423   2.156
  481    H    LEU  65           H        LEU  65  11.559  -4.183  -0.613
  482    HA   LEU  65           HA       LEU  65  13.524  -5.275  -0.270
  483   1HB   LEU  65          2HB       LEU  65  12.864  -4.726   2.623
  484   2HB   LEU  65          1HB       LEU  65  14.418  -5.293   2.044
  485    HG   LEU  65           HG       LEU  65  14.568  -2.935   2.456
  486   1HD1  LEU  65          1HD1      LEU  65  15.595  -3.982   0.358
  487   2HD1  LEU  65          2HD1      LEU  65  15.479  -2.224   0.430
  488   3HD1  LEU  65          3HD1      LEU  65  14.318  -3.147  -0.524
  489   1HD2  LEU  65          1HD2      LEU  65  12.473  -2.331   0.415
  490   2HD2  LEU  65          2HD2      LEU  65  13.080  -1.330   1.733
  491   3HD2  LEU  65          3HD2      LEU  65  12.002  -2.682   2.077
  492    H    LYS  66           H        LYS  66  14.512  -7.153   1.233
  493    HA   LYS  66           HA       LYS  66  12.793  -9.083   2.315
  494   1HB   LYS  66          2HB       LYS  66  12.470  -9.010  -0.395
  495   2HB   LYS  66          1HB       LYS  66  13.720 -10.235  -0.232
  496   1HG   LYS  66          2HG       LYS  66  11.189 -10.330   1.373
  497   2HG   LYS  66          1HG       LYS  66  11.301 -11.015  -0.250
  498   1HD   LYS  66          2HD       LYS  66  11.853 -12.862   0.970
  499   2HD   LYS  66          1HD       LYS  66  13.459 -12.155   0.783
  500   1HE   LYS  66          2HE       LYS  66  13.293 -12.702   3.061
  501   2HE   LYS  66          1HE       LYS  66  13.018 -10.962   2.985
  502   1HZ   LYS  66          1HZ       LYS  66  11.396 -11.877   4.423
  503   2HZ   LYS  66          2HZ       LYS  66  10.986 -13.095   3.324
  504   3HZ   LYS  66          3HZ       LYS  66  10.591 -11.485   2.988
  505   1H    SER  67          1HT       SER  67  10.185   8.496  11.734
  506   2H    SER  67          2HT       SER  67  11.644   9.392  11.627
  507   3H    SER  67          3HT       SER  67  10.956   9.052  13.162
  508    HA   SER  67           HA       SER  67  12.907   7.693  12.462
  509   1HB   SER  67          2HB       SER  67  11.634   5.572  13.270
  510   2HB   SER  67          1HB       SER  67  11.711   6.970  14.343
  511    HG   SER  67           HG       SER  67   9.627   7.542  13.644
  512    H    ASN  68           H        ASN  68  11.866   8.393   9.918
  513    HA   ASN  68           HA       ASN  68  11.643   7.634   7.793
  514   1HB   ASN  68          2HB       ASN  68  13.147   5.975   7.121
  515   2HB   ASN  68          1HB       ASN  68  13.871   6.601   8.596
  516   1HD2  ASN  68          1HD2      ASN  68  14.378   5.211  10.145
  517   2HD2  ASN  68          2HD2      ASN  68  13.879   3.557  10.213
  518    H    PHE  69           H        PHE  69   9.637   6.738   9.948
  519    HA   PHE  69           HA       PHE  69   8.258   4.825   8.211
  520   1HB   PHE  69          2HB       PHE  69   9.217   3.435   9.931
  521   2HB   PHE  69          1HB       PHE  69   8.657   4.524  11.193
  522    HD1  PHE  69           1HD      PHE  69   6.366   4.507  11.928
  523    HD2  PHE  69           2HD      PHE  69   7.674   1.938   8.797
  524    HE1  PHE  69           1HE      PHE  69   4.289   3.205  12.134
  525    HE2  PHE  69           2HE      PHE  69   5.600   0.631   8.998
  526    HZ   PHE  69           HZ       PHE  69   3.903   1.264  10.668
  527    H    LEU  70           H        LEU  70   6.841   6.400   7.517
  528    HA   LEU  70           HA       LEU  70   5.233   7.768   9.551
  529   1HB   LEU  70          2HB       LEU  70   6.073   8.381   6.803
  530   2HB   LEU  70          1HB       LEU  70   4.401   8.780   7.154
  531    HG   LEU  70           HG       LEU  70   5.657   9.855   9.319
  532   1HD1  LEU  70          1HD1      LEU  70   7.794   9.209   7.832
  533   2HD1  LEU  70          2HD1      LEU  70   7.743  10.602   8.910
  534   3HD1  LEU  70          3HD1      LEU  70   7.448  10.811   7.184
  535   1HD2  LEU  70          1HD2      LEU  70   5.556  11.574   6.920
  536   2HD2  LEU  70          2HD2      LEU  70   4.851  11.810   8.519
  537   3HD2  LEU  70          3HD2      LEU  70   4.063  10.742   7.356
  538    H    ASN  71           H        ASN  71   3.795   6.191  10.170
  539    HA   ASN  71           HA       ASN  71   2.174   4.918   8.092
  540   1HB   ASN  71          2HB       ASN  71   3.177   3.449   9.790
  541   2HB   ASN  71          1HB       ASN  71   2.333   4.337  11.054
  542   1HD2  ASN  71          1HD2      ASN  71   1.330   3.107   7.883
  543   2HD2  ASN  71          2HD2      ASN  71   0.001   2.174   8.474
  544    H    CYS  72           H        CYS  72   0.514   6.175   7.496
  545    HA   CYS  72           HA       CYS  72  -0.825   7.903   9.384
  546   1HB   CYS  72          2HB       CYS  72  -0.393   8.377   6.883
  547   2HB   CYS  72          1HB       CYS  72  -1.770   7.323   6.586
  548    HG   CYS  72           HG       CYS  72  -2.273  10.022   6.852
  549    H    TYR  73           H        TYR  73  -1.334   5.928  10.721
  550    HA   TYR  73           HA       TYR  73  -3.371   4.145   9.818
  551   1HB   TYR  73          2HB       TYR  73  -3.520   3.721  12.416
  552   2HB   TYR  73          1HB       TYR  73  -2.147   3.141  11.485
  553    HD1  TYR  73           1HD      TYR  73  -0.447   3.095  13.095
  554    HD2  TYR  73           2HD      TYR  73  -2.778   6.627  12.640
  555    HE1  TYR  73           1HE      TYR  73   1.084   4.293  14.599
  556    HE2  TYR  73           2HE      TYR  73  -1.254   7.833  14.143
  557    HH   TYR  73           HH       TYR  73   0.363   7.416  15.854
  558    H    VAL  74           H        VAL  74  -4.944   5.712   9.047
  559    HA   VAL  74           HA       VAL  74  -6.597   6.755  11.260
  560    HB   VAL  74           HB       VAL  74  -7.442   8.363   9.340
  561   1HG1  VAL  74          1HG1      VAL  74  -4.812   8.972  10.661
  562   2HG1  VAL  74          2HG1      VAL  74  -6.327   8.893  11.558
  563   3HG1  VAL  74          3HG1      VAL  74  -6.127  10.081  10.270
  564   1HG2  VAL  74          1HG2      VAL  74  -6.052   7.431   7.582
  565   2HG2  VAL  74          2HG2      VAL  74  -4.599   7.774   8.520
  566   3HG2  VAL  74          3HG2      VAL  74  -5.587   9.100   7.907
  567    H    SER  75           H        SER  75  -7.757   4.775  11.266
  568    HA   SER  75           HA       SER  75 -10.121   4.778   9.791
  569   1HB   SER  75          2HB       SER  75  -9.514   3.858   7.832
  570   2HB   SER  75          1HB       SER  75  -7.888   3.522   8.427
  571    HG   SER  75           HG       SER  75  -8.611   1.534   8.178
  572    H    GLY  76           H        GLY  76  -7.933   2.117  10.718
  573   1HA   GLY  76          2HA       GLY  76  -9.046   1.565  13.211
  574   2HA   GLY  76          1HA       GLY  76  -9.958   0.637  12.028
  575    H    PHE  77           H        PHE  77  -8.157  -0.237  10.271
  576    HA   PHE  77           HA       PHE  77  -6.578  -1.821   9.883
  577   1HB   PHE  77          2HB       PHE  77  -5.319   0.055  11.421
  578   2HB   PHE  77          1HB       PHE  77  -5.067  -1.401  12.377
  579    HD1  PHE  77           1HD      PHE  77  -2.758  -1.681  12.101
  580    HD2  PHE  77           2HD      PHE  77  -5.245  -1.224   8.676
  581    HE1  PHE  77           1HE      PHE  77  -0.873  -2.307  10.651
  582    HE2  PHE  77           2HE      PHE  77  -3.364  -1.855   7.222
  583    HZ   PHE  77           HZ       PHE  77  -1.174  -2.395   8.209
  584    H    HIS  78           H        HIS  78  -7.829  -3.622  10.091
  585    HA   HIS  78           HA       HIS  78  -7.198  -5.382  12.240
  586   1HB   HIS  78          2HB       HIS  78  -9.414  -3.736  12.700
  587   2HB   HIS  78          1HB       HIS  78 -10.100  -5.282  12.206
  588    HD1  HIS  78           1HD      HIS  78  -6.917  -5.027  14.194
  589    HD2  HIS  78           2HD      HIS  78 -10.913  -6.027  14.749
  590    HE1  HIS  78           1HE      HIS  78  -7.044  -6.037  16.493
  591    HE2  HIS  78           2HE      HIS  78  -9.464  -6.674  16.793
  592    HA   PRO  79           HA       PRO  79  -9.626  -7.667   8.905
  593   1HB   PRO  79          2HB       PRO  79 -11.583  -6.447   7.518
  594   2HB   PRO  79          1HB       PRO  79 -11.814  -6.973   9.187
  595   1HG   PRO  79          2HG       PRO  79 -11.568  -4.257   8.110
  596   2HG   PRO  79          1HG       PRO  79 -12.215  -4.790   9.668
  597   1HD   PRO  79          2HD       PRO  79  -9.573  -3.748   9.045
  598   2HD   PRO  79          1HD       PRO  79 -10.291  -4.088  10.631
  599    H    SER  80           H        SER  80 -10.387  -7.386   6.291
  600    HA   SER  80           HA       SER  80  -9.516  -7.181   4.190
  601   1HB   SER  80          2HB       SER  80 -10.024  -4.943   4.033
  602   2HB   SER  80          1HB       SER  80  -9.083  -4.521   5.462
  603    HG   SER  80           HG       SER  80  -7.216  -4.655   4.237
  604    H    ASP  81           H        ASP  81  -7.338  -6.603   2.965
  605    HA   ASP  81           HA       ASP  81  -5.296  -8.139   4.337
  606   1HB   ASP  81          2HB       ASP  81  -6.050  -8.075   1.733
  607   2HB   ASP  81          1HB       ASP  81  -4.655  -7.000   1.692
  608    H    ILE  82           H        ILE  82  -4.193  -7.080   5.779
  609    HA   ILE  82           HA       ILE  82  -3.538  -4.910   6.729
  610    HB   ILE  82           HB       ILE  82  -1.271  -6.372   5.387
  611   1HG1  ILE  82          2HG1      ILE  82  -2.688  -7.809   6.802
  612   2HG1  ILE  82          1HG1      ILE  82  -1.088  -7.585   7.502
  613   1HG2  ILE  82          1HG2      ILE  82  -1.325  -4.017   7.060
  614   2HG2  ILE  82          2HG2      ILE  82   0.023  -4.757   6.198
  615   3HG2  ILE  82          3HG2      ILE  82  -0.404  -5.320   7.811
  616   1HD1  ILE  82          1HD1      ILE  82  -1.955  -6.770   9.364
  617   2HD1  ILE  82          2HD1      ILE  82  -3.548  -7.199   8.739
  618   3HD1  ILE  82          3HD1      ILE  82  -2.901  -5.580   8.470
  619    H    GLU  83           H        GLU  83  -1.744  -5.302   3.661
  620    HA   GLU  83           HA       GLU  83  -1.659  -3.799   1.872
  621   1HB   GLU  83          2HB       GLU  83  -2.648  -1.738   1.859
  622   2HB   GLU  83          1HB       GLU  83  -3.570  -2.476   3.157
  623   1HG   GLU  83          2HG       GLU  83  -3.053  -0.617   4.284
  624   2HG   GLU  83          1HG       GLU  83  -1.489  -1.387   4.530
  625    H    VAL  84           H        VAL  84  -0.376  -3.264   5.060
  626    HA   VAL  84           HA       VAL  84   2.035  -2.056   3.874
  627    HB   VAL  84           HB       VAL  84   1.096  -1.919   6.742
  628   1HG1  VAL  84          1HG1      VAL  84   3.554  -0.970   5.344
  629   2HG1  VAL  84          2HG1      VAL  84   3.376  -1.705   6.937
  630   3HG1  VAL  84          3HG1      VAL  84   2.902  -0.026   6.684
  631   1HG2  VAL  84          1HG2      VAL  84   0.580  -0.248   4.389
  632   2HG2  VAL  84          2HG2      VAL  84   1.134   0.640   5.810
  633   3HG2  VAL  84          3HG2      VAL  84  -0.306  -0.375   5.910
  634    H    ASP  85           H        ASP  85   3.724  -3.358   3.698
  635    HA   ASP  85           HA       ASP  85   4.461  -5.116   5.874
  636   1HB   ASP  85          2HB       ASP  85   3.308  -6.110   3.343
  637   2HB   ASP  85          1HB       ASP  85   4.799  -6.903   3.845
  638    H    LEU  86           H        LEU  86   6.590  -4.916   6.146
  639    HA   LEU  86           HA       LEU  86   8.276  -4.516   3.779
  640   1HB   LEU  86          2HB       LEU  86   9.627  -3.010   5.575
  641   2HB   LEU  86          1HB       LEU  86   8.532  -2.370   4.369
  642    HG   LEU  86           HG       LEU  86   8.290  -1.456   6.712
  643   1HD1  LEU  86          1HD1      LEU  86   5.766  -2.724   5.696
  644   2HD1  LEU  86          2HD1      LEU  86   6.551  -1.377   4.874
  645   3HD1  LEU  86          3HD1      LEU  86   5.965  -1.184   6.525
  646   1HD2  LEU  86          1HD2      LEU  86   8.204  -4.150   7.400
  647   2HD2  LEU  86          2HD2      LEU  86   6.551  -3.573   7.613
  648   3HD2  LEU  86          3HD2      LEU  86   7.879  -2.771   8.450
  649    H    LEU  87           H        LEU  87  10.695  -4.612   4.516
  650    HA   LEU  87           HA       LEU  87  11.426  -7.131   5.095
  651   1HB   LEU  87          2HB       LEU  87  13.585  -6.266   5.896
  652   2HB   LEU  87          1HB       LEU  87  13.036  -5.470   4.435
  653    HG   LEU  87           HG       LEU  87  12.055  -3.810   6.390
  654   1HD1  LEU  87          1HD1      LEU  87  13.370  -3.699   8.211
  655   2HD1  LEU  87          2HD1      LEU  87  14.829  -4.125   7.316
  656   3HD1  LEU  87          3HD1      LEU  87  13.708  -5.387   7.826
  657   1HD2  LEU  87          1HD2      LEU  87  13.325  -3.330   4.243
  658   2HD2  LEU  87          2HD2      LEU  87  14.798  -3.506   5.198
  659   3HD2  LEU  87          3HD2      LEU  87  13.628  -2.249   5.603
  660    H    LYS  88           H        LYS  88  10.674  -8.407   6.657
  661    HA   LYS  88           HA       LYS  88   9.822  -7.575   9.197
  662   1HB   LYS  88          2HB       LYS  88  10.821 -10.344   8.539
  663   2HB   LYS  88          1HB       LYS  88   9.617  -9.887   9.736
  664   1HG   LYS  88          2HG       LYS  88   8.120 -10.463   8.192
  665   2HG   LYS  88          1HG       LYS  88   8.523  -8.927   7.421
  666   1HD   LYS  88          2HD       LYS  88  10.455 -10.363   6.347
  667   2HD   LYS  88          1HD       LYS  88   9.355 -11.697   6.702
  668   1HE   LYS  88          2HE       LYS  88   8.544 -11.179   4.655
  669   2HE   LYS  88          1HE       LYS  88   7.625  -9.989   5.577
  670   1HZ   LYS  88          1HZ       LYS  88  10.268  -9.175   4.661
  671   2HZ   LYS  88          2HZ       LYS  88   8.833  -8.285   4.754
  672   3HZ   LYS  88          3HZ       LYS  88   9.081  -9.355   3.468