*HEADER    DNA BINDING PROTEIN                     19-NOV-07   2JXH              
*TITLE     SOLUTION STRUCTURE OF DNA BINDING DOMAIN OF PROLINE                   
*TITLE    2 UTILIZATION A (PUTA) FOR PSUEDOMONAS PUTIDA                          
*COMPND    MOL_ID: 1;                                                            
*COMPND   2 MOLECULE: PROLINE DEHYDROGENASE;                                     
*COMPND   3 CHAIN: A, B;                                                         
*COMPND   4 FRAGMENT: RESIDUES 1-45                                              
*SOURCE    MOL_ID: 1;                                                            
*SOURCE   2 ORGANISM_SCIENTIFIC: PSEUDOMONAS PUTIDA                              
*KEYWDS    PUTA, PROLINE, UTILIZATION, DNA, BINDING, DNA BINDING                 
*KEYWDS   2 PROTEIN                                                              
*EXPDTA    NMR, 30 STRUCTURES                                                    
*AUTHOR    S.HALOUSKA, Y.ZHOU, D.BECKER, R.POWERS                                
*REVDAT   1   21-OCT-08 2JXH    0                                                


assign (resid 1 and name c)    (resid 2 and name n)
       (resid 2 and name ca)   (resid 2 and name c)
       (resid 3 and name n)  51.9 20.0

assign (resid 2 and name c)    (resid 3 and name n)
       (resid 3 and name ca)   (resid 3 and name c)
       (resid 4 and name n)  61.7 69.6

assign (resid 3 and name c)    (resid 4 and name n)
       (resid 4 and name ca)   (resid 4 and name c)
       (resid 5 and name n)  61.4 71.1

assign (resid 4 and name c)    (resid 5 and name n)
       (resid 5 and name ca)   (resid 5 and name c)
       (resid 6 and name n)  62.1 69.5

assign (resid 5 and name c)    (resid 6 and name n)
       (resid 6 and name ca)   (resid 6 and name c)
       (resid 7 and name n)  54.2 43.9

assign (resid 6 and name c)    (resid 7 and name n)
       (resid 7 and name ca)   (resid 7 and name c)
       (resid 8 and name n)  45.5 $noexpectation

assign (resid 7 and name c)    (resid 8 and name n)
       (resid 8 and name ca)   (resid 8 and name c)
       (resid 9 and name n)  60.8 33.7

assign (resid 8 and name c)    (resid 9 and name n)
       (resid 9 and name ca)   (resid 9 and name c)
       (resid 10 and name n)  56.1 32.6

assign (resid 9 and name c)    (resid 10 and name n)
       (resid 10 and name ca)   (resid 10 and name c)
       (resid 11 and name n)  52.8 45.8

assign (resid 10 and name c)    (resid 11 and name n)
       (resid 11 and name ca)   (resid 11 and name c)
       (resid 12 and name n)  52.7 42.0

!assign (resid 11 and name c)    (resid 12 and name n)
!       (resid 12 and name ca)   (resid 12 and name c)
!       (resid 13 and name n)  59.2 38.1

assign (resid 12 and name c)    (resid 13 and name n)
       (resid 13 and name ca)   (resid 13 and name c)
       (resid 14 and name n)  66.0 30.9

!assign (resid 13 and name c)    (resid 14 and name n)
!       (resid 14 and name ca)   (resid 14 and name c)
!       (resid 15 and name n)  67.4 67.2

assign (resid 14 and name c)    (resid 15 and name n)
       (resid 15 and name ca)   (resid 15 and name c)
       (resid 16 and name n)  60.8 29.8

assign (resid 15 and name c)    (resid 16 and name n)
       (resid 16 and name ca)   (resid 16 and name c)
       (resid 17 and name n)  59.2 29.1

assign (resid 16 and name c)    (resid 17 and name n)
       (resid 17 and name ca)   (resid 17 and name c)
       (resid 18 and name n)  59.4 31.8

assign (resid 17 and name c)    (resid 18 and name n)
       (resid 18 and name ca)   (resid 18 and name c)
       (resid 19 and name n)  58.5 42.7

assign (resid 18 and name c)    (resid 19 and name n)
       (resid 19 and name ca)   (resid 19 and name c)
       (resid 20 and name n)  60.1 32.3

assign (resid 19 and name c)    (resid 20 and name n)
       (resid 20 and name ca)   (resid 20 and name c)
       (resid 21 and name n)  54.9 18.1

assign (resid 20 and name c)    (resid 21 and name n)
       (resid 21 and name ca)   (resid 21 and name c)
       (resid 22 and name n)  54.8 18.6

assign (resid 21 and name c)    (resid 22 and name n)
       (resid 22 and name ca)   (resid 22 and name c)
       (resid 23 and name n)  55.4 18.3

assign (resid 22 and name c)    (resid 23 and name n)
       (resid 23 and name ca)   (resid 23 and name c)
       (resid 24 and name n)  58.8 28.3

assign (resid 23 and name c)    (resid 24 and name n)
       (resid 24 and name ca)   (resid 24 and name c)
       (resid 25 and name n)  61.6 63.1

assign (resid 24 and name c)    (resid 25 and name n)
       (resid 25 and name ca)   (resid 25 and name c)
       (resid 26 and name n)  60.7 38.5

assign (resid 25 and name c)    (resid 26 and name n)
       (resid 26 and name ca)   (resid 26 and name c)
       (resid 27 and name n)  55.2 39.4

assign (resid 26 and name c)    (resid 27 and name n)
       (resid 27 and name ca)   (resid 27 and name c)
       (resid 28 and name n)  52.3 34.5

assign (resid 27 and name c)    (resid 28 and name n)
       (resid 28 and name ca)   (resid 28 and name c)
       (resid 29 and name n)  59.6 69.5

assign (resid 28 and name c)    (resid 29 and name n)
       (resid 29 and name ca)   (resid 29 and name c)
       (resid 30 and name n)  66.0 31.6

assign (resid 29 and name c)    (resid 30 and name n)
       (resid 30 and name ca)   (resid 30 and name c)
       (resid 31 and name n)  60.8 30.1

assign (resid 30 and name c)    (resid 31 and name n)
       (resid 31 and name ca)   (resid 31 and name c)
       (resid 32 and name n)  61.4 30.0

assign (resid 31 and name c)    (resid 32 and name n)
       (resid 32 and name ca)   (resid 32 and name c)
       (resid 33 and name n)  59.5 42.7

assign (resid 32 and name c)    (resid 33 and name n)
       (resid 33 and name ca)   (resid 33 and name c)
       (resid 34 and name n)  66.2 37.6

assign (resid 33 and name c)    (resid 34 and name n)
       (resid 34 and name ca)   (resid 34 and name c)
       (resid 35 and name n)  60.5 31.0

assign (resid 34 and name c)    (resid 35 and name n)
       (resid 35 and name ca)   (resid 35 and name c)
       (resid 36 and name n)  57.7 27.5

assign (resid 35 and name c)    (resid 36 and name n)
       (resid 36 and name ca)   (resid 36 and name c)
       (resid 37 and name n)  54.8 17.1

assign (resid 36 and name c)    (resid 37 and name n)
       (resid 37 and name ca)   (resid 37 and name c)
       (resid 38 and name n)  66.3 37.7

assign (resid 37 and name c)    (resid 38 and name n)
       (resid 38 and name ca)   (resid 38 and name c)
       (resid 39 and name n)  60.9 37.6

assign (resid 38 and name c)    (resid 39 and name n)
       (resid 39 and name ca)   (resid 39 and name c)
       (resid 40 and name n)  56.3 39.0

assign (resid 39 and name c)    (resid 40 and name n)
       (resid 40 and name ca)   (resid 40 and name c)
       (resid 41 and name n)  61.1 39.6

assign (resid 40 and name c)    (resid 41 and name n)
       (resid 41 and name ca)   (resid 41 and name c)
       (resid 42 and name n)  57.8 41.3

assign (resid 41 and name c)    (resid 42 and name n)
       (resid 42 and name ca)   (resid 42 and name c)
       (resid 43 and name n)  59.3 29.6

assign (resid 42 and name c)    (resid 43 and name n)
       (resid 43 and name ca)   (resid 43 and name c)
       (resid 44 and name n)  58.5 32.0

assign (resid 43 and name c)    (resid 44 and name n)
       (resid 44 and name ca)   (resid 44 and name c)
       (resid 45 and name n)  57.2 42.2

assign (resid 46 and name c)    (resid 47 and name n)
       (resid 47 and name ca)   (resid 47 and name c)
       (resid 48 and name n)  51.9 20.0

assign (resid 47 and name c)    (resid 48 and name n)
       (resid 48 and name ca)   (resid 48 and name c)
       (resid 49 and name n)  61.7 69.6

assign (resid 48 and name c)    (resid 49 and name n)
       (resid 49 and name ca)   (resid 49 and name c)
       (resid 50 and name n)  61.4 71.1

assign (resid 49 and name c)    (resid 50 and name n)
       (resid 50 and name ca)   (resid 50 and name c)
       (resid 51 and name n)  62.1 69.5

assign (resid 50 and name c)    (resid 51 and name n)
       (resid 51 and name ca)   (resid 51 and name c)
       (resid 52 and name n)  54.2 43.9

assign (resid 51 and name c)    (resid 52 and name n)
       (resid 52 and name ca)   (resid 52 and name c)
       (resid 53 and name n)  45.5 $noexpectation

assign (resid 52 and name c)    (resid 53 and name n)
       (resid 53 and name ca)   (resid 53 and name c)
       (resid 54 and name n)  60.8 33.7

assign (resid 53 and name c)    (resid 54 and name n)
       (resid 54 and name ca)   (resid 54 and name c)
       (resid 55 and name n)  56.1 32.6

assign (resid 54 and name c)    (resid 55 and name n)
       (resid 55 and name ca)   (resid 55 and name c)
       (resid 56 and name n)  52.8 45.8

assign (resid 55 and name c)    (resid 56 and name n)
       (resid 56 and name ca)   (resid 56 and name c)
       (resid 57 and name n)  52.7 42.0

!assign (resid 56 and name c)    (resid 57 and name n)
!       (resid 57 and name ca)   (resid 57 and name c)
!       (resid 58 and name n)  59.2 38.1

assign (resid 57 and name c)    (resid 58 and name n)
       (resid 58 and name ca)   (resid 58 and name c)
       (resid 59 and name n)  66.0 30.9

!assign (resid 58 and name c)    (resid 59 and name n)
!       (resid 59 and name ca)   (resid 59 and name c)
!       (resid 60 and name n)  67.4 67.2

assign (resid 59 and name c)    (resid 60 and name n)
       (resid 60 and name ca)   (resid 60 and name c)
       (resid 61 and name n)  60.8 29.8

assign (resid 60 and name c)    (resid 61 and name n)
       (resid 61 and name ca)   (resid 61 and name c)
       (resid 62 and name n)  59.2 29.1

assign (resid 61 and name c)    (resid 62 and name n)
       (resid 62 and name ca)   (resid 62 and name c)
       (resid 63 and name n)  59.4 31.8

assign (resid 62 and name c)    (resid 63 and name n)
       (resid 63 and name ca)   (resid 63 and name c)
       (resid 64 and name n)  58.5 42.7

assign (resid 63 and name c)    (resid 64 and name n)
       (resid 64 and name ca)   (resid 64 and name c)
       (resid 65 and name n)  60.1 32.3

assign (resid 64 and name c)    (resid 65 and name n)
       (resid 65 and name ca)   (resid 65 and name c)
       (resid 66 and name n)  54.9 18.1

assign (resid 65 and name c)    (resid 66 and name n)
       (resid 66 and name ca)   (resid 66 and name c)
       (resid 67 and name n)  54.8 18.6

assign (resid 66 and name c)    (resid 67 and name n)
       (resid 67 and name ca)   (resid 67 and name c)
       (resid 68 and name n)  55.4 18.3

assign (resid 67 and name c)    (resid 68 and name n)
       (resid 68 and name ca)   (resid 68 and name c)
       (resid 69 and name n)  58.8 28.3

assign (resid 68 and name c)    (resid 69 and name n)
       (resid 69 and name ca)   (resid 69 and name c)
       (resid 70 and name n)  61.6 63.1

assign (resid 69 and name c)    (resid 70 and name n)
       (resid 70 and name ca)   (resid 70 and name c)
       (resid 71 and name n)  60.7 38.5

assign (resid 70 and name c)    (resid 71 and name n)
       (resid 71 and name ca)   (resid 71 and name c)
       (resid 72 and name n)  55.2 39.4

assign (resid 71 and name c)    (resid 72 and name n)
       (resid 72 and name ca)   (resid 72 and name c)
       (resid 73 and name n)  52.3 34.5

assign (resid 72 and name c)    (resid 73 and name n)
       (resid 73 and name ca)   (resid 73 and name c)
       (resid 74 and name n)  59.6 69.5

assign (resid 73 and name c)    (resid 74 and name n)
       (resid 74 and name ca)   (resid 74 and name c)
       (resid 75 and name n)  66.0 31.6

assign (resid 74 and name c)    (resid 75 and name n)
       (resid 75 and name ca)   (resid 75 and name c)
       (resid 76 and name n)  60.8 30.1

assign (resid 75 and name c)    (resid 76 and name n)
       (resid 76 and name ca)   (resid 76 and name c)
       (resid 77 and name n)  61.4 30.0

assign (resid 76 and name c)    (resid 77 and name n)
       (resid 77 and name ca)   (resid 77 and name c)
       (resid 78 and name n)  59.5 42.7

assign (resid 77 and name c)    (resid 78 and name n)
       (resid 78 and name ca)   (resid 78 and name c)
       (resid 79 and name n)  66.2 37.6

assign (resid 78 and name c)    (resid 79 and name n)
       (resid 79 and name ca)   (resid 79 and name c)
       (resid 80 and name n)  60.5 31.0

assign (resid 79 and name c)    (resid 80 and name n)
       (resid 80 and name ca)   (resid 80 and name c)
       (resid 81 and name n)  57.7 27.5

assign (resid 80 and name c)    (resid 81 and name n)
       (resid 81 and name ca)   (resid 81 and name c)
       (resid 82 and name n)  54.8 17.1

assign (resid 81 and name c)    (resid 82 and name n)
       (resid 82 and name ca)   (resid 82 and name c)
       (resid 83 and name n)  66.3 37.7

assign (resid 82 and name c)    (resid 83 and name n)
       (resid 83 and name ca)   (resid 83 and name c)
       (resid 84 and name n)  60.9 37.6

assign (resid 83 and name c)    (resid 84 and name n)
       (resid 84 and name ca)   (resid 84 and name c)
       (resid 85 and name n)  56.3 39.0

assign (resid 84 and name c)    (resid 85 and name n)
       (resid 85 and name ca)   (resid 85 and name c)
       (resid 86 and name n)  61.1 39.6

assign (resid 85 and name c)    (resid 86 and name n)
       (resid 86 and name ca)   (resid 86 and name c)
       (resid 87 and name n)  57.8 41.3

assign (resid 86 and name c)    (resid 87 and name n)
       (resid 87 and name ca)   (resid 87 and name c)
       (resid 88 and name n)  59.3 29.6

assign (resid 87 and name c)    (resid 88 and name n)
       (resid 88 and name ca)   (resid 88 and name c)
       (resid 89 and name n)  58.5 32.0

assign (resid 88 and name c)    (resid 89 and name n)
       (resid 89 and name ca)   (resid 89 and name c)
       (resid 90 and name n)  57.2 42.2

assign ( resid 12 and name o )  ( resid 16 and name hn ) 1.8 0.3 0.5
 assign ( resid 12 and name o )  ( resid 16 and name n ) 2.8 0.4 0.5
 assign ( resid 13 and name o )  ( resid 17 and name hn ) 1.8 0.3 0.5
 assign ( resid 13 and name o )  ( resid 17 and name n ) 2.8 0.4 0.5
 assign ( resid 14 and name o )  ( resid 18 and name hn ) 1.8 0.3 0.5
 assign ( resid 14 and name o )  ( resid 18 and name n ) 2.8 0.4 0.5
 assign ( resid 15 and name o )  ( resid 19 and name hn ) 1.8 0.3 0.5
 assign ( resid 15 and name o )  ( resid 19 and name n ) 2.8 0.4 0.5
 assign ( resid 16 and name o )  ( resid 20 and name hn ) 1.8 0.3 0.5
 assign ( resid 16 and name o )  ( resid 20 and name n ) 2.8 0.4 0.5
 assign ( resid 17 and name o )  ( resid 21 and name hn ) 1.8 0.3 0.5
 assign ( resid 17 and name o )  ( resid 21 and name n ) 2.8 0.4 0.5
 assign ( resid 19 and name o )  ( resid 23 and name hn ) 1.8 0.3 0.5
 assign ( resid 19 and name o )  ( resid 23 and name n ) 2.8 0.4 0.5
 assign ( resid 20 and name o )  ( resid 24 and name hn ) 1.8 0.3 0.5
 assign ( resid 20 and name o )  ( resid 24 and name n ) 2.8 0.4 0.5
 assign ( resid 21 and name o )  ( resid 25 and name hn ) 1.8 0.3 0.5
 assign ( resid 21 and name o )  ( resid 25 and name n ) 2.8 0.4 0.5
 assign ( resid 22 and name o )  ( resid 26 and name hn ) 1.8 0.3 0.5
 assign ( resid 22 and name o )  ( resid 26 and name n ) 2.8 0.4 0.5
 assign ( resid 22 and name o )  ( resid 27 and name hn ) 1.8 0.3 0.5
 assign ( resid 22 and name o )  ( resid 27 and name n ) 2.8 0.4 0.5
 assign ( resid 30 and name o )  ( resid 34 and name hn ) 1.8 0.3 0.5
 assign ( resid 30 and name o )  ( resid 34 and name n ) 2.8 0.4 0.5
 assign ( resid 75 and name o )  ( resid 79 and name hn ) 1.8 0.3 0.5
 assign ( resid 75 and name o )  ( resid 79 and name n ) 2.8 0.4 0.5
 assign ( resid 31 and name o )  ( resid 35 and name hn ) 1.8 0.3 0.5
 assign ( resid 31 and name o )  ( resid 35 and name n ) 2.8 0.4 0.5
 assign ( resid 32 and name o )  ( resid 36 and name hn ) 1.8 0.3 0.5
 assign ( resid 32 and name o )  ( resid 36 and name n ) 2.8 0.4 0.5
 assign ( resid 33 and name o )  ( resid 37 and name hn ) 1.8 0.3 0.5
 assign ( resid 33 and name o )  ( resid 37 and name n ) 2.8 0.4 0.5
 assign ( resid 34 and name o )  ( resid 38 and name hn ) 1.8 0.3 0.5
 assign ( resid 34 and name o )  ( resid 38 and name n ) 2.8 0.4 0.5
 assign ( resid 35 and name o )  ( resid 39 and name hn ) 1.8 0.3 0.5
 assign ( resid 35 and name o )  ( resid 39 and name n ) 1.8 0.4 0.5
 assign ( resid 37 and name o )  ( resid 41 and name hn ) 1.8 0.3 0.5
 assign ( resid 37 and name o )  ( resid 41 and name n ) 2.8 0.4 0.5
 assign ( resid 38 and name o )  ( resid 42 and name hn ) 1.8 0.3 0.5
 assign ( resid 38 and name o )  ( resid 42 and name n ) 2.8 0.4 0.5
 assign ( resid 39 and name o )  ( resid 43 and name hn ) 1.8 0.3 0.5
 assign ( resid 39 and name o )  ( resid 43 and name n ) 2.8 0.4 0.5
 assign ( resid 41 and name o )  ( resid 45 and name hn ) 1.8 0.3 0.5
 assign ( resid 41 and name o )  ( resid 45 and name n ) 2.8 0.4 0.5
 assign ( resid 57 and name o )  ( resid 61 and name hn ) 1.8 0.3 0.5
 assign ( resid 57 and name o )  ( resid 61 and name n ) 2.8 0.4 0.5
 assign ( resid 58 and name o )  ( resid 62 and name hn ) 1.8 0.3 0.5
 assign ( resid 58 and name o )  ( resid 62 and name n ) 2.8 0.4 0.5
 assign ( resid 59 and name o )  ( resid 63 and name hn ) 1.8 0.3 0.5
 assign ( resid 59 and name o )  ( resid 63 and name n ) 2.8 0.4 0.5
 assign ( resid 60 and name o )  ( resid 64 and name hn ) 1.8 0.3 0.5
 assign ( resid 60 and name o )  ( resid 64 and name n ) 2.8 0.4 0.5
 assign ( resid 61 and name o )  ( resid 65 and name hn ) 1.8 0.3 0.5
 assign ( resid 61 and name o )  ( resid 65 and name n ) 2.8 0.4 0.5
 assign ( resid 62 and name o )  ( resid 66 and name hn ) 1.8 0.3 0.5
 assign ( resid 62 and name o )  ( resid 66 and name n ) 2.8 0.4 0.5
 assign ( resid 64 and name o )  ( resid 68 and name hn ) 1.8 0.3 0.5
 assign ( resid 64 and name o )  ( resid 68 and name n ) 2.8 0.4 0.5
 assign ( resid 65 and name o )  ( resid 69 and name hn ) 1.8 0.3 0.5
 assign ( resid 65 and name o )  ( resid 69 and name n ) 2.8 0.4 0.5
 assign ( resid 66 and name o )  ( resid 70 and name hn ) 1.8 0.3 0.5
 assign ( resid 66 and name o )  ( resid 70 and name n ) 2.8 0.4 0.5
 assign ( resid 67 and name o )  ( resid 71 and name hn ) 1.8 0.3 0.5
 assign ( resid 67 and name o )  ( resid 71 and name n ) 2.8 0.4 0.5
 assign ( resid 67 and name o )  ( resid 72 and name hn ) 1.8 0.3 0.5
 assign ( resid 67 and name o )  ( resid 72 and name n ) 2.8 0.4 0.5
 assign ( resid 76 and name o )  ( resid 80 and name hn ) 1.8 0.3 0.5
 assign ( resid 76 and name o )  ( resid 80 and name n ) 2.8 0.4 0.5
 assign ( resid 77 and name o )  ( resid 81 and name hn ) 1.8 0.3 0.5
 assign ( resid 77 and name o )  ( resid 81 and name n ) 2.8 0.4 0.5
 assign ( resid 78 and name o )  ( resid 82 and name hn ) 1.8 0.3 0.5
 assign ( resid 78 and name o )  ( resid 82 and name n ) 2.8 0.4 0.5
 assign ( resid 79 and name o )  ( resid 83 and name hn ) 1.8 0.3 0.5
 assign ( resid 79 and name o )  ( resid 83 and name n ) 2.8 0.4 0.5
 assign ( resid 80 and name o )  ( resid 84 and name hn ) 1.8 0.3 0.5
 assign ( resid 80 and name o )  ( resid 84 and name n ) 1.8 0.4 0.5
 assign ( resid 82 and name o )  ( resid 86 and name hn ) 1.8 0.3 0.5
 assign ( resid 82 and name o )  ( resid 86 and name n ) 2.8 0.4 0.5
 assign ( resid 83 and name o )  ( resid 87 and name hn ) 1.8 0.3 0.5
 assign ( resid 83 and name o )  ( resid 87 and name n ) 2.8 0.4 0.5
 assign ( resid 84 and name o )  ( resid 88 and name hn ) 1.8 0.3 0.5
 assign ( resid 84 and name o )  ( resid 88 and name n ) 2.8 0.4 0.5
 assign ( resid 86 and name o )  ( resid 90 and name hn ) 1.8 0.3 0.5
 assign ( resid 86 and name o )  ( resid 90 and name n ) 2.8 0.4 0.5
 assign ( resid 10 and name o )  ( resid 49 and name hn ) 1.8 0.3 0.5
 assign ( resid 10 and name o )  ( resid 49 and name n ) 2.8 0.4 0.5
 assign ( resid 8 and name o )  ( resid 51 and name hn ) 1.8 0.3 0.5
 assign ( resid 8 and name o )  ( resid 51 and name n ) 2.8 0.4 0.5
 assign ( resid 6 and name o )  ( resid 53 and name hn ) 1.8 0.3 0.5
 assign ( resid 6 and name o )  ( resid 53 and name n ) 2.8 0.4 0.5
 assign ( resid 4 and name o )  ( resid 55 and name hn ) 1.8 0.3 0.5
 assign ( resid 4 and name o )  ( resid 55 and name n ) 2.8 0.4 0.5
 assign ( resid 55 and name o )  ( resid 4 and name hn ) 1.8 0.3 0.5
 assign ( resid 55 and name o )  ( resid 4 and name n ) 2.8 0.4 0.5
 assign ( resid 53 and name o )  ( resid 6 and name hn ) 1.8 0.3 0.5
 assign ( resid 53 and name o )  ( resid 6 and name n ) 2.8 0.4 0.5
 assign ( resid 51 and name o )  ( resid 8 and name hn ) 1.8 0.3 0.5
 assign ( resid 51 and name o )  ( resid 8 and name n ) 2.8 0.4 0.5
 assign ( resid 49 and name o )  ( resid 10 and name hn ) 1.8 0.3 0.5
 assign ( resid 49 and name o )  ( resid 10 and name n ) 2.8 0.4 0.5


! RES_COUNT is 100
assign (resid 5 and name c)    (resid 6 and name n)
       (resid 6 and name ca)    (resid 6 and name c)  8.75 0.5 
assign (resid 50 and name c)    (resid 51 and name n)
       (resid 51 and name ca)    (resid 51 and name c)  8.75 0.5 
assign (resid 7 and name c)    (resid 8 and name n)
       (resid 8 and name ca)    (resid 8 and name c)  8.61 0.5 
assign (resid 52 and name c)    (resid 53 and name n)
       (resid 53 and name ca)    (resid 53 and name c)  8.61 0.5 
assign (resid 9 and name c)    (resid 10 and name n)
       (resid 10 and name ca)    (resid 10 and name c)  9.55 0.5 
assign (resid 54 and name c)    (resid 55 and name n)
       (resid 55 and name ca)    (resid 55 and name c)  9.55 0.5 
assign (resid 10 and name c)    (resid 11 and name n)
       (resid 11 and name ca)    (resid 11 and name c)  7.25 0.5 
assign (resid 55 and name c)    (resid 56 and name n)
       (resid 56 and name ca)    (resid 56 and name c)  7.25 0.5 
assign (resid 13 and name c)    (resid 14 and name n)
       (resid 14 and name ca)    (resid 14 and name c)  5.48 0.5 
assign (resid 58 and name c)    (resid 59 and name n)
       (resid 59 and name ca)    (resid 59 and name c)  5.48 0.5 
assign (resid 15 and name c)    (resid 16 and name n)
       (resid 16 and name ca)    (resid 16 and name c)  4.48 0.5 
assign (resid 60 and name c)    (resid 61 and name n)
       (resid 61 and name ca)    (resid 61 and name c)  4.48 0.5 
assign (resid 16 and name c)    (resid 17 and name n)
       (resid 17 and name ca)    (resid 17 and name c)  4.58 0.5 
assign (resid 61 and name c)    (resid 62 and name n)
       (resid 62 and name ca)    (resid 62 and name c)  4.58 0.5 
assign (resid 19 and name c)    (resid 20 and name n)
       (resid 20 and name ca)    (resid 20 and name c)  4.50 0.5 
assign (resid 64 and name c)    (resid 65 and name n)
       (resid 65 and name ca)    (resid 65 and name c)  4.50 0.5 
assign (resid 20 and name c)    (resid 21 and name n)
       (resid 21 and name ca)    (resid 21 and name c)  4.25 0.5 
assign (resid 65 and name c)    (resid 66 and name n)
       (resid 66 and name ca)    (resid 66 and name c)  4.25 0.5 
assign (resid 21 and name c)    (resid 22 and name n)
       (resid 22 and name ca)    (resid 22 and name c)  3.66 0.5 
assign (resid 66 and name c)    (resid 67 and name n)
       (resid 67 and name ca)    (resid 67 and name c)  3.66 0.5 
assign (resid 22 and name c)    (resid 23 and name n)
       (resid 23 and name ca)    (resid 23 and name c)  4.58 0.5 
assign (resid 67 and name c)    (resid 68 and name n)
       (resid 68 and name ca)    (resid 68 and name c)  4.58 0.5 
assign (resid 23 and name c)    (resid 24 and name n)
       (resid 24 and name ca)    (resid 24 and name c)  4.05 0.5 
assign (resid 68 and name c)    (resid 69 and name n)
       (resid 69 and name ca)    (resid 69 and name c)  4.05 0.5 
assign (resid 24 and name c)    (resid 25 and name n)
       (resid 25 and name ca)    (resid 25 and name c)  9.31 0.5 
assign (resid 69 and name c)    (resid 70 and name n)
       (resid 70 and name ca)    (resid 70 and name c)  9.31 0.5 
assign (resid 25 and name c)    (resid 26 and name n)
       (resid 26 and name ca)    (resid 26 and name c)  6.63 0.5 
assign (resid 70 and name c)    (resid 71 and name n)
       (resid 71 and name ca)    (resid 71 and name c)  6.63 0.5 
!assign (resid 26 and name c)    (resid 27 and name n)
!       (resid 27 and name ca)    (resid 27 and name c)  8.67 0.5 
!assign (resid 71 and name c)    (resid 72 and name n)
!       (resid 72 and name ca)    (resid 72 and name c)  8.67 0.5 
assign (resid 27 and name c)    (resid 28 and name n)
       (resid 28 and name ca)    (resid 28 and name c)  6.43 0.5 
assign (resid 72 and name c)    (resid 73 and name n)
       (resid 73 and name ca)    (resid 73 and name c)  6.43 0.5 
assign (resid 31 and name c)    (resid 32 and name n)
       (resid 32 and name ca)    (resid 32 and name c)  3.51 0.5 
assign (resid 76 and name c)    (resid 77 and name n)
       (resid 77 and name ca)    (resid 77 and name c)  3.51 0.5 
assign (resid 33 and name c)    (resid 34 and name n)
       (resid 34 and name ca)    (resid 34 and name c)  4.32 0.5 
assign (resid 78 and name c)    (resid 79 and name n)
       (resid 79 and name ca)    (resid 79 and name c)  4.32 0.5 
assign (resid 34 and name c)    (resid 35 and name n)
       (resid 35 and name ca)    (resid 35 and name c)  4.31 0.5 
assign (resid 79 and name c)    (resid 80 and name n)
       (resid 80 and name ca)    (resid 80 and name c)  4.31 0.5 
assign (resid 37 and name c)    (resid 38 and name n)
       (resid 38 and name ca)    (resid 38 and name c)  5.06 0.5 
assign (resid 82 and name c)    (resid 83 and name n)
       (resid 83 and name ca)    (resid 83 and name c)  5.06 0.5 
assign (resid 38 and name c)    (resid 39 and name n)
       (resid 39 and name ca)    (resid 39 and name c)  3.68 0.5 
assign (resid 83 and name c)    (resid 84 and name n)
       (resid 84 and name ca)    (resid 84 and name c)  3.68 0.5 
assign (resid 39 and name c)    (resid 40 and name n)
       (resid 40 and name ca)    (resid 40 and name c)  4.11 0.5 
assign (resid 84 and name c)    (resid 85 and name n)
       (resid 85 and name ca)    (resid 85 and name c)  4.11 0.5 
assign (resid 41 and name c)    (resid 42 and name n)
       (resid 42 and name ca)    (resid 42 and name c)  3.86 0.5 
assign (resid 86 and name c)    (resid 87 and name n)
       (resid 87 and name ca)    (resid 87 and name c)  3.86 0.5 
assign (resid 42 and name c)    (resid 43 and name n)
       (resid 43 and name ca)    (resid 43 and name c)  5.18 0.5 
assign (resid 87 and name c)    (resid 88 and name n)
       (resid 88 and name ca)    (resid 88 and name c)  5.18 0.5 
assign (resid 43 and name c)    (resid 44 and name n)
       (resid 44 and name ca)    (resid 44 and name c)  5.05 0.5 
assign (resid 88 and name c)    (resid 89 and name n)
       (resid 89 and name ca)    (resid 89 and name c)  5.05 0.5 
assign (resid 44 and name c)    (resid 45 and name n)
       (resid 45 and name ca)    (resid 45 and name c)  5.36 0.5 
assign (resid 89 and name c)    (resid 90 and name n)
       (resid 90 and name ca)    (resid 90 and name c)  5.36 0.5 
! intra_sel.awk Range:   6 - 9999
 assign ( resid 6 and name HD# )  ( resid 55 and name HG ) 4.0 3.2 2.0
 assign ( resid 18 and name HB# )  ( resid 10 and name HD1# ) 5.0 4.5 3.5
 assign ( resid 18 and name HG )  ( resid 10 and name HD1# ) 4.0 3.7 2.5
 assign ( resid 18 and name HG )  ( resid 32 and name HG ) 5.0 2.0 1.0
 assign ( resid 18 and name HD2# )  ( resid 33 and name HG1# ) 4.0 5.2 4.0
 assign ( resid 18 and name HD2# )  ( resid 32 and name HD2# ) 4.0 5.2 4.0
 assign ( resid 18 and name HB# )  ( resid 29 and name HA ) 4.0 3.2 2.0
 assign ( resid 18 and name HD1# )  ( resid 10 and name HD# ) 4.0 4.7 3.5
 assign ( resid 19 and name HA )  ( resid 29 and name HD# ) 4.0 3.2 2.0
 assign ( resid 19 and name HA )  ( resid 29 and name HB# ) 4.0 3.2 2.0
 assign ( resid 21 and name HN )  ( resid 32 and name HD2# ) 4.0 3.7 2.5
 assign ( resid 22 and name HN )  ( resid 29 and name HA ) 4.0 2.2 1.0
 assign ( resid 22 and name HN )  ( resid 32 and name HB# ) 4.0 3.2 2.0
 assign ( resid 22 and name HN )  ( resid 32 and name HD2# ) 3.0 2.7 1.8
 assign ( resid 22 and name HA )  ( resid 32 and name HD2# ) 4.0 3.7 2.5
 assign ( resid 22 and name HB# )  ( resid 32 and name HD2# ) 4.0 4.7 3.5
 assign ( resid 22 and name HB# )  ( resid 32 and name HG# ) 4.0 4.2 3.0
 assign ( resid 22 and name HB# )  ( resid 29 and name HA ) 4.0 3.2 2.0
 assign ( resid 22 and name HB# )  ( resid 28 and name HA ) 4.0 3.2 2.0
 assign ( resid 22 and name HB# )  ( resid 29 and name HD# ) 4.0 4.2 3.0
 assign ( resid 22 and name HA )  ( resid 32 and name HB# ) 4.0 3.2 2.0
 assign ( resid 29 and name HA )  ( resid 22 and name HB# ) 4.0 3.2 2.0
 assign ( resid 29 and name HD# )  ( resid 19 and name HA ) 4.0 3.2 2.0
 assign ( resid 29 and name HA )  ( resid 22 and name HB# ) 3.0 2.2 1.3
 assign ( resid 29 and name HA )  ( resid 18 and name HD2# ) 4.0 3.7 2.5
 assign ( resid 29 and name HD# )  ( resid 22 and name HB# ) 4.0 4.2 3.0
 assign ( resid 29 and name HD# )  ( resid 19 and name HG# ) 4.0 4.2 3.0
 assign ( resid 32 and name HN )  ( resid 22 and name HB# ) 4.0 3.2 2.0
 assign ( resid 32 and name HB# )  ( resid 18 and name HD2# ) 4.0 4.7 3.5
 assign ( resid 32 and name HB1 ) ( resid 22 and name HB# ) 4.0 2.2 1.0
 assign ( resid 32 and name HB2 ) ( resid 22 and name HB# ) 4.0 2.2 1.0
 assign ( resid 32 and name HB# )  ( resid 22 and name HA ) 4.0 3.2 2.0
 assign ( resid 32 and name HG )  ( resid 18 and name HD2# ) 4.0 3.7 2.5
 assign ( resid 32 and name HD2# )  ( resid 18 and name HD2# ) 3.0 4.2 3.3
 assign ( resid 32 and name HD2# )  ( resid 22 and name HB# ) 4.0 4.7 3.5
 assign ( resid 32 and name HD2# )  ( resid 21 and name HB# ) 3.0 3.7 2.8
 assign ( resid 32 and name HD2# )  ( resid 18 and name HA ) 4.0 3.7 2.5
 assign ( resid 32 and name HD2# )  ( resid 22 and name HA ) 3.0 2.7 1.8
 assign ( resid 32 and name HD2# )  ( resid 22 and name HN ) 4.0 3.7 2.5
 assign ( resid 51 and name HD# )  ( resid 10 and name HG ) 4.0 3.2 2.0
 assign ( resid 63 and name HB# )  ( resid 55 and name HD1# ) 5.0 4.5 3.5
 assign ( resid 63 and name HG )  ( resid 55 and name HD1# ) 4.0 3.7 2.5
 assign ( resid 63 and name HG )  ( resid 77 and name HG ) 5.0 2.0 1.0
 assign ( resid 63 and name HD2# )  ( resid 78 and name HG1# ) 4.0 5.2 4.0
 assign ( resid 63 and name HD2# )  ( resid 77 and name HD2# ) 4.0 5.2 4.0
 assign ( resid 63 and name HB# )  ( resid 74 and name HA ) 4.0 3.2 2.0
 assign ( resid 63 and name HD1# )  ( resid 55 and name HD# ) 4.0 4.7 3.5
 assign ( resid 64 and name HA )  ( resid 74 and name HD# ) 4.0 3.2 2.0
 assign ( resid 64 and name HA )  ( resid 74 and name HB# ) 4.0 3.2 2.0
 assign ( resid 66 and name HN )  ( resid 77 and name HD2# ) 4.0 3.7 2.5
 assign ( resid 67 and name HN )  ( resid 74 and name HA ) 4.0 2.2 1.0
 assign ( resid 67 and name HN )  ( resid 77 and name HB# ) 4.0 3.2 2.0
 assign ( resid 67 and name HN )  ( resid 77 and name HD2# ) 3.0 2.7 1.8
 assign ( resid 67 and name HA )  ( resid 77 and name HD2# ) 4.0 3.7 2.5
 assign ( resid 67 and name HB# )  ( resid 77 and name HD2# ) 4.0 4.7 3.5
 assign ( resid 67 and name HB# )  ( resid 77 and name HG# ) 4.0 4.2 3.0
 assign ( resid 67 and name HB# )  ( resid 74 and name HA ) 4.0 3.2 2.0
 assign ( resid 67 and name HB# )  ( resid 73 and name HA ) 4.0 3.2 2.0
 assign ( resid 67 and name HB# )  ( resid 74 and name HD# ) 4.0 4.2 3.0
 assign ( resid 67 and name HA )  ( resid 77 and name HB# ) 4.0 3.2 2.0
 assign ( resid 74 and name HA )  ( resid 67 and name HB# ) 4.0 3.2 2.0
 assign ( resid 74 and name HD# )  ( resid 64 and name HA ) 4.0 3.2 2.0
 assign ( resid 74 and name HA )  ( resid 67 and name HB# ) 3.0 2.2 1.3
 assign ( resid 74 and name HA )  ( resid 63 and name HD2# ) 4.0 3.7 2.5
 assign ( resid 74 and name HD# )  ( resid 67 and name HB# ) 4.0 4.2 3.0
 assign ( resid 74 and name HD# )  ( resid 64 and name HG# ) 4.0 4.2 3.0
 assign ( resid 77 and name HB# )  ( resid 63 and name HD2# ) 4.0 4.7 3.5
 assign ( resid 77 and name HB1 ) ( resid 67 and name HB# ) 4.0 2.2 1.0
 assign ( resid 77 and name HB2 ) ( resid 67 and name HB# ) 4.0 2.2 1.0
 assign ( resid 77 and name HB# )  ( resid 67 and name HA ) 4.0 3.2 2.0
 assign ( resid 77 and name HG )  ( resid 63 and name HD2# ) 4.0 3.7 2.5
 assign ( resid 77 and name HD2# )  ( resid 63 and name HD2# ) 3.0 4.2 3.3
 assign ( resid 77 and name HD2# )  ( resid 67 and name HB# ) 4.0 4.7 3.5
 assign ( resid 77 and name HD2# )  ( resid 66 and name HB# ) 3.0 3.7 2.8
 assign ( resid 77 and name HD2# )  ( resid 63 and name HA ) 4.0 3.7 2.5
 assign ( resid 77 and name HD2# )  ( resid 67 and name HA ) 3.0 2.7 1.8
 assign ( resid 77 and name HD2# )  ( resid 67 and name HN ) 4.0 3.7 2.5
 assign ( resid 2 and name HN )  ( resid 56 and name HA ) 4.0 2.2 1.0
 assign ( resid 47 and name HN )  ( resid 11 and name HA ) 4.0 2.2 1.0
 assign ( resid 2 and name HN ) ( resid 56 and name HB# ) 4.0 3.2 2.0
 assign ( resid 47 and name HN )  ( resid 11 and name HB# ) 4.0 3.2 2.0
 assign ( resid 2 and name HB# )  ( resid 56 and name HB# ) 4.0 4.7 3.5
 assign ( resid 47 and name HB# )  ( resid 11 and name HB# ) 4.0 4.7 3.5  
 assign ( resid 4 and name HN )  ( resid 56 and name HA ) 3.0 1.2 0.3
 assign ( resid 49 and name HN )  ( resid 11 and name HA ) 3.0 1.2 0.3
 assign ( resid 11 and name HB# )  ( resid 49 and name HN ) 4.0 3.2 2.0
 assign ( resid 56 and name HB# )  ( resid 4 and name HN ) 4.0 3.2 2.0
 assign ( resid 5 and name HA )  ( resid 54 and name HA ) 4.0 2.2 1.0
 assign ( resid 50 and name HA )  ( resid 9 and name HA ) 4.0 2.2 1.0
 assign ( resid 5 and name HG2# )  ( resid 53 and name HN ) 4.0 3.7 2.5
 assign ( resid 50 and name HG2# )  ( resid 8 and name HN ) 4.0 3.7 2.5
 assign ( resid 5 and name HG2# )  ( resid 54 and name HG# ) 4.0 4.7 3.5
 assign ( resid 50 and name HG2# )  ( resid 9 and name HG# ) 4.0 4.7 3.5
 assign ( resid 5 and name HG2# )  ( resid 52 and name HA# ) 3.0 4.7 3.5
 assign ( resid 50 and name HG2# )  ( resid 7 and name HA# ) 3.0 4.7 3.5
 assign ( resid 6 and name HD1# )  ( resid 53 and name HB ) 5.0 3.7 2.5
 assign ( resid 51 and name HD1# )  ( resid 8 and name HB ) 5.0 3.7 2.5
 assign ( resid 6 and name HN )  ( resid 53 and name HB ) 4.0 2.2 1.0 
 assign ( resid 51 and name HN )  ( resid 8 and name HB ) 4.0 2.2 1.0
 assign ( resid 6 and name HN )  ( resid 53 and name HG# ) 4.0 3.2 2.0
 assign ( resid 51 and name HN )  ( resid 8 and name HG# ) 4.0 3.2 2.0
 assign ( resid 7 and name HN )  ( resid 50 and name HG2# ) 5.0 3.7 2.5
 assign ( resid 52 and name HN )  ( resid 5 and name HG2# ) 5.0 3.7 2.5
 assign ( resid 8 and name HN )  ( resid 52 and name HA2 ) 4.0 2.2 1.0
 assign ( resid 53 and name HN )  ( resid 7 and name HA2 ) 4.0 2.2 1.0
 assign ( resid 8 and name HN )  ( resid 51 and name HN ) 3.0 1.2 0.3
 assign ( resid 53 and name HN )  ( resid 6 and name HN ) 3.0 1.2 0.3
 assign ( resid 8 and name HN )  ( resid 51 and name HB# ) 4.0 3.2 2.0
 assign ( resid 53 and name HN )  ( resid 6 and name HB# ) 4.0 3.2 2.0
 assign ( resid 8 and name HN )  ( resid 50 and name HG2# ) 4.0 3.7 2.5
 assign ( resid 53 and name HN )  ( resid 5 and name HG2# ) 4.0 3.7 2.5
 assign ( resid 10 and name HN )  ( resid 50 and name HA ) 4.0 2.2 1.0
 assign ( resid 55 and name HN )  ( resid 5 and name HA ) 4.0 2.2 1.0
 assign ( resid 10 and name HD# )  ( resid 82 and name HD# ) 4.0 4.2 3.0
 assign ( resid 55 and name HD# )  ( resid 37 and name HD# ) 4.0 4.2 3.0
 assign ( resid 14 and name HG2# )  ( resid 83 and name HE# ) 4.0 5.7 4.5
 assign ( resid 59 and name HG2# )  ( resid 38 and name HE# ) 4.0 5.7 4.5
 assign ( resid 18 and name HD1# )  ( resid 86 and name HB# ) 4.0 4.7 3.5
 assign ( resid 63 and name HD1# )  ( resid 41 and name HB# ) 4.0 4.7 3.5
 assign ( resid 18 and name HD1# )  ( resid 86 and name HD# ) 3.0 3.7 2.8
 assign ( resid 63 and name HD1# )  ( resid 41 and name HD# ) 3.0 3.7 2.8
 assign ( resid 18 and name HD2# )  ( resid 86 and name HG ) 4.0 3.7 2.5
 assign ( resid 63 and name HD2# )  ( resid 41 and name HG ) 4.0 3.7 2.5
 assign ( resid 18 and name HG )  ( resid 86 and name HG ) 4.0 2.2 1.0
 assign ( resid 63 and name HG )  ( resid 41 and name HG ) 4.0 2.2 1.0
 assign ( resid 18 and name HD1# )  ( resid 83 and name HD# ) 4.0 5.7 4.5
 assign ( resid 63 and name HD1# )  ( resid 38 and name HD# ) 4.0 5.7 4.5
 assign ( resid 18 and name HD# )  ( resid 82 and name HB ) 4.0 3.2 2.0
 assign ( resid 63 and name HD# )  ( resid 37 and name HB ) 4.0 3.2 2.0
 assign ( resid 21 and name HA )  ( resid 89 and name HD1# ) 4.0 3.7 2.5
 assign ( resid 66 and name HA )  ( resid 44 and name HD1# ) 4.0 3.7 2.5
 assign ( resid 21 and name HA )  ( resid 89 and name HD2# ) 4.0 3.7 2.5
 assign ( resid 66 and name HA )  ( resid 44 and name HD2# ) 4.0 3.7 2.5
 assign ( resid 21 and name HB# )  ( resid 86 and name HD# ) 3.0 3.2 2.3
 assign ( resid 66 and name HB# )  ( resid 41 and name HD# ) 3.0 3.2 2.3
 assign ( resid 32 and name HD# )  ( resid 85 and name HE# ) 4.0 5.2 4.0
 assign ( resid 77 and name HD# )  ( resid 40 and name HE# ) 4.0 5.2 4.0
 assign ( resid 33 and name HG1# )  ( resid 82 and name HD1# ) 3.0 4.2 3.3
 assign ( resid 78 and name HG1# )  ( resid 37 and name HD1# ) 3.0 4.2 3.3
 assign ( resid 33 and name HA )  ( resid 82 and name HD1# ) 3.0 2.7 1.8
 assign ( resid 78 and name HA )  ( resid 37 and name HD1# ) 3.0 2.7 1.8
 assign ( resid 33 and name HA )  ( resid 82 and name HG1# ) 4.0 3.7 2.5
 assign ( resid 78 and name HA )  ( resid 37 and name HG1# ) 4.0 3.7 2.5
 assign ( resid 33 and name HD# )  ( resid 53 and name HG# ) 4.0 4.2 3.0
 assign ( resid 78 and name HD# )  ( resid 8 and name HG# ) 4.0 4.2 3.0
 assign ( resid 34 and name HB# )  ( resid 53 and name HG1# ) 4.0 4.7 3.5
 assign ( resid 79 and name HB# )  ( resid 8 and name HG1# ) 4.0 4.7 3.5
 assign ( resid 36 and name HA )  ( resid 85 and name HD# ) 4.0 4.2 3.0
 assign ( resid 81 and name HA )  ( resid 40 and name HD# ) 4.0 4.2 3.0
 assign ( resid 36 and name HA )  ( resid 85 and name HE# ) 4.0 4.2 3.0
 assign ( resid 81 and name HA )  ( resid 40 and name HE# ) 4.0 4.2 3.0
 assign ( resid 36 and name HB# )  ( resid 82 and name HD1# ) 3.0 3.7 2.8
 assign ( resid 81 and name HB# )  ( resid 37 and name HD1# ) 3.0 3.7 2.8
 assign ( resid 36 and name HB# )  ( resid 82 and name HG1# ) 3.0 3.7 2.8
 assign ( resid 81 and name HB# )  ( resid 37 and name HG1# ) 3.0 3.7 2.8
 assign ( resid 36 and name HB# )  ( resid 82 and name HB# ) 4.0 4.2 3.0
 assign ( resid 81 and name HB# )  ( resid 37 and name HB# ) 4.0 4.2 3.0
 assign ( resid 36 and name HB# )  ( resid 82 and name HA ) 4.0 3.2 2.0
 assign ( resid 81 and name HB# )  ( resid 37 and name HA ) 4.0 3.2 2.0
 assign ( resid 36 and name HB# )  ( resid 85 and name HB# ) 3.0 3.2 2.3
 assign ( resid 81 and name HB# )  ( resid 40 and name HB# ) 3.0 3.2 2.3
 assign ( resid 36 and name HB# )  ( resid 85 and name HD# ) 4.0 5.2 4.0
 assign ( resid 81 and name HB# )  ( resid 40 and name HD# ) 4.0 5.2 4.0
 assign ( resid 37 and name HD# )  ( resid 77 and name HD# ) 4.0 4.2 3.0
 assign ( resid 82 and name HD# )  ( resid 32 and name HD# ) 4.0 4.2 3.0
 assign ( resid 37 and name HD# )  ( resid 63 and name HD# ) 4.0 4.2 3.0
 assign ( resid 82 and name HD# )  ( resid 18 and name HD# ) 4.0 4.2 3.0
 assign ( resid 40 and name HE# )  ( resid 77 and name HD# ) 4.0 5.2 4.0
 assign ( resid 85 and name HE# )  ( resid 32 and name HD# ) 4.0 5.2 4.0
 assign ( resid 18 and name HD1# )  ( resid 33 and name HG1# ) 4.0 5.2 4.0
 assign ( resid 63 and name HD1# )  ( resid 78 and name HG1# ) 4.0 5.2 4.0
 assign ( resid 18 and name HD2# )  ( resid 51 and name HD1# ) 4.0 5.2 4.0
 assign ( resid 63 and name HD2# )  ( resid 6 and name HD1# ) 4.0 5.2 4.0
 assign ( resid 32 and name HD1# )  ( resid 21 and name HB# ) 4.0 4.7 3.5
 assign ( resid 77 and name HD1# )  ( resid 66 and name HB# ) 4.0 4.7 3.5
! intra_sel.awk RES_COUNT is 176
!!A2
assign (resid 1 and name c )    (resid 2 and name n )
       (resid 2 and name ca )   (resid 2 and name c ) 1.0  -89.14 30.0 2

assign (resid 2 and name n )    (resid 2 and name ca )
       (resid 2 and name c )   (resid 3 and name n ) 1.0  -7.62 67.8 2

!!A2
assign (resid 46 and name c )    (resid 47 and name n )
       (resid 47 and name ca )   (resid 47 and name c ) 1.0  -89.14 30.0 2

assign (resid 47 and name n )    (resid 47 and name ca )
       (resid 47 and name c )   (resid 48 and name n ) 1.0  -7.62 67.8 2

!!T3
assign (resid 2 and name c )    (resid 3 and name n )
       (resid 3 and name ca )   (resid 3 and name c ) 1.0  -100.01 30.9 2

assign (resid 3 and name n )    (resid 3 and name ca )
       (resid 3 and name c )   (resid 4 and name n ) 1.0  137.78 50.0 2

!!T3
assign (resid 47 and name c )    (resid 48 and name n )
       (resid 48 and name ca )   (resid 48 and name c ) 1.0  -100.01 30.9 2

assign (resid 48 and name n )    (resid 48 and name ca )
       (resid 48 and name c )   (resid 49 and name n ) 1.0  137.78 50.0 2

!!T4
assign (resid 3 and name c )    (resid 4 and name n )
       (resid 4 and name ca )   (resid 4 and name c ) 1.0  -120.72 33.5 2

assign (resid 4 and name n )    (resid 4 and name ca )
       (resid 4 and name c )   (resid 5 and name n ) 1.0  131.71 50.0 2

!!T4
assign (resid 48 and name c )    (resid 49 and name n )
       (resid 49 and name ca )   (resid 49 and name c ) 1.0  -120.72 33.5 2

assign (resid 49 and name n )    (resid 49 and name ca )
       (resid 49 and name c )   (resid 50 and name n ) 1.0  131.71 50.0 2

!!T5
assign (resid 4 and name c )    (resid 5 and name n )
       (resid 5 and name ca )   (resid 5 and name c ) 1.0  -95.40 30.0 2

assign (resid 5 and name n )    (resid 5 and name ca )
       (resid 5 and name c )   (resid 6 and name n ) 1.0  129.54 50.0 2

!!T5
assign (resid 49 and name c )    (resid 50 and name n )
       (resid 50 and name ca )   (resid 50 and name c ) 1.0  -95.40 30.0 2

assign (resid 50 and name n )    (resid 50 and name ca )
       (resid 50 and name c )   (resid 51 and name n ) 1.0  129.54 50.0 2

!!L6
assign (resid 5 and name c )    (resid 6 and name n )
       (resid 6 and name ca )   (resid 6 and name c ) 1.0  -97.00 31.3 2

assign (resid 6 and name n )    (resid 6 and name ca )
       (resid 6 and name c )   (resid 7 and name n ) 1.0  130.14 50.0 2

!!L6
assign (resid 50 and name c )    (resid 51 and name n )
       (resid 51 and name ca )   (resid 51 and name c ) 1.0  -97.00 31.3 2

assign (resid 51 and name n )    (resid 51 and name ca )
       (resid 51 and name c )   (resid 52 and name n ) 1.0  130.14 50.0 2

!!G7
assign (resid 6 and name c )    (resid 7 and name n )
       (resid 7 and name ca )   (resid 7 and name c ) 1.0  -100.90 47.9 2

assign (resid 7 and name n )    (resid 7 and name ca )
       (resid 7 and name c )   (resid 8 and name n ) 1.0  137.37 50.0 2

!!G7
assign (resid 51 and name c )    (resid 52 and name n )
       (resid 52 and name ca )   (resid 52 and name c ) 1.0  -100.90 47.9 2

assign (resid 52 and name n )    (resid 52 and name ca )
       (resid 52 and name c )   (resid 53 and name n ) 1.0  137.37 50.0 2

!!V8
assign (resid 7 and name c )    (resid 8 and name n )
       (resid 8 and name ca )   (resid 8 and name c ) 1.0  -117.54 30.0 2

assign (resid 8 and name n )    (resid 8 and name ca )
       (resid 8 and name c )   (resid 9 and name n ) 1.0  126.43 50.0 2

!!V8
assign (resid 52 and name c )    (resid 53 and name n )
       (resid 53 and name ca )   (resid 53 and name c ) 1.0  -117.54 30.0 2

assign (resid 53 and name n )    (resid 53 and name ca )
       (resid 53 and name c )   (resid 54 and name n ) 1.0  126.43 50.0 2

!!K9
assign (resid 8 and name c )    (resid 9 and name n )
       (resid 9 and name ca )   (resid 9 and name c ) 1.0  -97.86 30.0 2

assign (resid 9 and name n )    (resid 9 and name ca )
       (resid 9 and name c )   (resid 10 and name n ) 1.0  126.15 50.0 2

!!K9
assign (resid 53 and name c )    (resid 54 and name n )
       (resid 54 and name ca )   (resid 54 and name c ) 1.0  -97.86 30.0 2

assign (resid 54 and name n )    (resid 54 and name ca )
       (resid 54 and name c )   (resid 55 and name n ) 1.0  126.15 50.0 2

!!L10
assign (resid 9 and name c )    (resid 10 and name n )
       (resid 10 and name ca )   (resid 10 and name c ) 1.0  -116.78 30.0 2

assign (resid 10 and name n )    (resid 10 and name ca )
       (resid 10 and name c )   (resid 11 and name n ) 1.0  144.46 50.0 2

!!L10
assign (resid 54 and name c )    (resid 55 and name n )
       (resid 55 and name ca )   (resid 55 and name c ) 1.0  -116.78 30.0 2

assign (resid 55 and name n )    (resid 55 and name ca )
       (resid 55 and name c )   (resid 56 and name n ) 1.0  144.46 50.0 2

!!D11
assign (resid 10 and name c )    (resid 11 and name n )
       (resid 11 and name ca )   (resid 11 and name c ) 1.0  -76.65 30.0 2

assign (resid 11 and name n )    (resid 11 and name ca )
       (resid 11 and name c )   (resid 12 and name n ) 1.0  165.58 50.0 2

!!D11
assign (resid 55 and name c )    (resid 56 and name n )
       (resid 56 and name ca )   (resid 56 and name c ) 1.0  -76.65 30.0 2

assign (resid 56 and name n )    (resid 56 and name ca )
       (resid 56 and name c )   (resid 57 and name n ) 1.0  165.58 50.0 2

!!D12
assign (resid 11 and name c )    (resid 12 and name n )
       (resid 12 and name ca )   (resid 12 and name c ) 1.0  -56.41 30.0 2

assign (resid 12 and name n )    (resid 12 and name ca )
       (resid 12 and name c )   (resid 13 and name n ) 1.0  -42.96 50.0 2

!!D12
assign (resid 56 and name c )    (resid 57 and name n )
       (resid 57 and name ca )   (resid 57 and name c ) 1.0  -56.41 30.0 2

assign (resid 57 and name n )    (resid 57 and name ca )
       (resid 57 and name c )   (resid 58 and name n ) 1.0  -42.96 50.0 2

!!P13
assign (resid 12 and name c )    (resid 13 and name n )
       (resid 13 and name ca )   (resid 13 and name c ) 1.0  -62.07 30.0 2

assign (resid 13 and name n )    (resid 13 and name ca )
       (resid 13 and name c )   (resid 14 and name n ) 1.0  -35.38 50.0 2

!!P13
assign (resid 57 and name c )    (resid 58 and name n )
       (resid 58 and name ca )   (resid 58 and name c ) 1.0  -62.07 30.0 2

assign (resid 58 and name n )    (resid 58 and name ca )
       (resid 58 and name c )   (resid 59 and name n ) 1.0  -35.38 50.0 2

!!T14
assign (resid 13 and name c )    (resid 14 and name n )
       (resid 14 and name ca )   (resid 14 and name c ) 1.0  -69.91 30.0 2

assign (resid 14 and name n )    (resid 14 and name ca )
       (resid 14 and name c )   (resid 15 and name n ) 1.0  -36.34 50.0 2

!!T14
assign (resid 58 and name c )    (resid 59 and name n )
       (resid 59 and name ca )   (resid 59 and name c ) 1.0  -69.91 30.0 2

assign (resid 59 and name n )    (resid 59 and name ca )
       (resid 59 and name c )   (resid 60 and name n ) 1.0  -36.34 50.0 2

!!R15
assign (resid 14 and name c )    (resid 15 and name n )
       (resid 15 and name ca )   (resid 15 and name c ) 1.0  -66.21 30.0 2

assign (resid 15 and name n )    (resid 15 and name ca )
       (resid 15 and name c )   (resid 16 and name n ) 1.0  -40.99 50.0 2

!!R15
assign (resid 59 and name c )    (resid 60 and name n )
       (resid 60 and name ca )   (resid 60 and name c ) 1.0  -66.21 30.0 2

assign (resid 60 and name n )    (resid 60 and name ca )
       (resid 60 and name c )   (resid 61 and name n ) 1.0  -40.99 50.0 2

!!E16
assign (resid 15 and name c )    (resid 16 and name n )
       (resid 16 and name ca )   (resid 16 and name c ) 1.0  -65.80 30.0 2

assign (resid 16 and name n )    (resid 16 and name ca )
       (resid 16 and name c )   (resid 17 and name n ) 1.0  -39.87 50.0 2

!!E16
assign (resid 60 and name c )    (resid 61 and name n )
       (resid 61 and name ca )   (resid 61 and name c ) 1.0  -65.80 30.0 2

assign (resid 61 and name n )    (resid 61 and name ca )
       (resid 61 and name c )   (resid 62 and name n ) 1.0  -39.87 50.0 2

!!R17
assign (resid 16 and name c )    (resid 17 and name n )
       (resid 17 and name ca )   (resid 17 and name c ) 1.0  -66.91 30.0 2

assign (resid 17 and name n )    (resid 17 and name ca )
       (resid 17 and name c )   (resid 18 and name n ) 1.0  -40.39 50.0 2

!!R17
assign (resid 61 and name c )    (resid 62 and name n )
       (resid 62 and name ca )   (resid 62 and name c ) 1.0  -66.91 30.0 2

assign (resid 62 and name n )    (resid 62 and name ca )
       (resid 62 and name c )   (resid 63 and name n ) 1.0  -40.39 50.0 2

!!L18
assign (resid 17 and name c )    (resid 18 and name n )
       (resid 18 and name ca )   (resid 18 and name c ) 1.0  -65.45 30.0 2

assign (resid 18 and name n )    (resid 18 and name ca )
       (resid 18 and name c )   (resid 19 and name n ) 1.0  -40.22 50.0 2

!!L18
assign (resid 62 and name c )    (resid 63 and name n )
       (resid 63 and name ca )   (resid 63 and name c ) 1.0  -65.45 30.0 2

assign (resid 63 and name n )    (resid 63 and name ca )
       (resid 63 and name c )   (resid 64 and name n ) 1.0  -40.22 50.0 2

!!K19
assign (resid 18 and name c )    (resid 19 and name n )
       (resid 19 and name ca )   (resid 19 and name c ) 1.0  -62.43 30.0 2

assign (resid 19 and name n )    (resid 19 and name ca )
       (resid 19 and name c )   (resid 20 and name n ) 1.0  -42.46 50.0 2

!!K19
assign (resid 63 and name c )    (resid 64 and name n )
       (resid 64 and name ca )   (resid 64 and name c ) 1.0  -62.43 30.0 2

assign (resid 64 and name n )    (resid 64 and name ca )
       (resid 64 and name c )   (resid 65 and name n ) 1.0  -42.46 50.0 2

!!A20
assign (resid 19 and name c )    (resid 20 and name n )
       (resid 20 and name ca )   (resid 20 and name c ) 1.0  -64.19 30.0 2

assign (resid 20 and name n )    (resid 20 and name ca )
       (resid 20 and name c )   (resid 21 and name n ) 1.0  -41.41 50.0 2

!!A20
assign (resid 64 and name c )    (resid 65 and name n )
       (resid 65 and name ca )   (resid 65 and name c ) 1.0  -64.19 30.0 2

assign (resid 65 and name n )    (resid 65 and name ca )
       (resid 65 and name c )   (resid 66 and name n ) 1.0  -41.41 50.0 2

!!A21
assign (resid 20 and name c )    (resid 21 and name n )
       (resid 21 and name ca )   (resid 21 and name c ) 1.0  -68.15 30.0 2

assign (resid 21 and name n )    (resid 21 and name ca )
       (resid 21 and name c )   (resid 22 and name n ) 1.0  -42.15 50.0 2

!!A21
assign (resid 65 and name c )    (resid 66 and name n )
       (resid 66 and name ca )   (resid 66 and name c ) 1.0  -68.15 30.0 2

assign (resid 66 and name n )    (resid 66 and name ca )
       (resid 66 and name c )   (resid 67 and name n ) 1.0  -42.15 50.0 2

!!A22
assign (resid 21 and name c )    (resid 22 and name n )
       (resid 22 and name ca )   (resid 22 and name c ) 1.0  -63.96 30.0 2

assign (resid 22 and name n )    (resid 22 and name ca )
       (resid 22 and name c )   (resid 23 and name n ) 1.0  -39.72 50.0 2

!!A22
assign (resid 66 and name c )    (resid 67 and name n )
       (resid 67 and name ca )   (resid 67 and name c ) 1.0  -63.96 30.0 2

assign (resid 67 and name n )    (resid 67 and name ca )
       (resid 67 and name c )   (resid 68 and name n ) 1.0  -39.72 50.0 2

!!Q23
assign (resid 22 and name c )    (resid 23 and name n )
       (resid 23 and name ca )   (resid 23 and name c ) 1.0  -63.20 30.0 2

assign (resid 23 and name n )    (resid 23 and name ca )
       (resid 23 and name c )   (resid 24 and name n ) 1.0  -40.35 50.0 2

!!Q23
assign (resid 67 and name c )    (resid 68 and name n )
       (resid 68 and name ca )   (resid 68 and name c ) 1.0  -63.20 30.0 2

assign (resid 68 and name n )    (resid 68 and name ca )
       (resid 68 and name c )   (resid 69 and name n ) 1.0  -40.35 50.0 2

!!S24
assign (resid 23 and name c )    (resid 24 and name n )
       (resid 24 and name ca )   (resid 24 and name c ) 1.0  -65.35 30.0 2

assign (resid 24 and name n )    (resid 24 and name ca )
       (resid 24 and name c )   (resid 25 and name n ) 1.0  -35.67 50.0 2

!!S24
assign (resid 68 and name c )    (resid 69 and name n )
       (resid 69 and name ca )   (resid 69 and name c ) 1.0  -65.35 30.0 2

assign (resid 69 and name n )    (resid 69 and name ca )
       (resid 69 and name c )   (resid 70 and name n ) 1.0  -35.67 50.0 2

!!I25
assign (resid 24 and name c )    (resid 25 and name n )
       (resid 25 and name ca )   (resid 25 and name c ) 1.0  -104.01 30.0 2

assign (resid 25 and name n )    (resid 25 and name ca )
       (resid 25 and name c )   (resid 26 and name n ) 1.0  -0.49 60.2 2

!!I25
assign (resid 69 and name c )    (resid 70 and name n )
       (resid 70 and name ca )   (resid 70 and name c ) 1.0  -104.01 30.0 2

assign (resid 70 and name n )    (resid 70 and name ca )
       (resid 70 and name c )   (resid 71 and name n ) 1.0  -0.49 60.2 2

!!R27
assign (resid 26 and name c )    (resid 27 and name n )
       (resid 27 and name ca )   (resid 27 and name c ) 1.0  -129.01 30.0 2

assign (resid 27 and name n )    (resid 27 and name ca )
       (resid 27 and name c )   (resid 28 and name n ) 1.0  154.36 50.0 2

!!R27
assign (resid 71 and name c )    (resid 72 and name n )
       (resid 72 and name ca )   (resid 72 and name c ) 1.0  -129.01 30.0 2

assign (resid 72 and name n )    (resid 72 and name ca )
       (resid 72 and name c )   (resid 73 and name n ) 1.0  154.36 50.0 2

!!T28
assign (resid 27 and name c )    (resid 28 and name n )
       (resid 28 and name ca )   (resid 28 and name c ) 1.0  -92.03 33.1 2

assign (resid 28 and name n )    (resid 28 and name ca )
       (resid 28 and name c )   (resid 29 and name n ) 1.0  149.26 61.6 2

!!T28
assign (resid 72 and name c )    (resid 73 and name n )
       (resid 73 and name ca )   (resid 73 and name c ) 1.0  -92.03 33.1 2

assign (resid 73 and name n )    (resid 73 and name ca )
       (resid 73 and name c )   (resid 74 and name n ) 1.0  149.26 61.6 2

!!P29
assign (resid 28 and name c )    (resid 29 and name n )
       (resid 29 and name ca )   (resid 29 and name c ) 1.0  -58.57 30.0 2

assign (resid 29 and name n )    (resid 29 and name ca )
       (resid 29 and name c )   (resid 30 and name n ) 1.0  -38.17 50.0 2

!!P29
assign (resid 73 and name c )    (resid 74 and name n )
       (resid 74 and name ca )   (resid 74 and name c ) 1.0  -58.57 30.0 2

assign (resid 74 and name n )    (resid 74 and name ca )
       (resid 74 and name c )   (resid 75 and name n ) 1.0  -38.17 50.0 2

!!H30
assign (resid 29 and name c )    (resid 30 and name n )
       (resid 30 and name ca )   (resid 30 and name c ) 1.0  -66.26 30.0 2

assign (resid 30 and name n )    (resid 30 and name ca )
       (resid 30 and name c )   (resid 31 and name n ) 1.0  -39.37 50.0 2

!!H30
assign (resid 74 and name c )    (resid 75 and name n )
       (resid 75 and name ca )   (resid 75 and name c ) 1.0  -66.26 30.0 2

assign (resid 75 and name n )    (resid 75 and name ca )
       (resid 75 and name c )   (resid 76 and name n ) 1.0  -39.37 50.0 2

!!W31
assign (resid 30 and name c )    (resid 31 and name n )
       (resid 31 and name ca )   (resid 31 and name c ) 1.0  -62.60 30.0 2

assign (resid 31 and name n )    (resid 31 and name ca )
       (resid 31 and name c )   (resid 32 and name n ) 1.0  -44.17 50.0 2

!!W31
assign (resid 75 and name c )    (resid 76 and name n )
       (resid 76 and name ca )   (resid 76 and name c ) 1.0  -62.60 30.0 2

assign (resid 76 and name n )    (resid 76 and name ca )
       (resid 76 and name c )   (resid 77 and name n ) 1.0  -44.17 50.0 2

!!L32
assign (resid 31 and name c )    (resid 32 and name n )
       (resid 32 and name ca )   (resid 32 and name c ) 1.0  -60.88 30.0 2

assign (resid 32 and name n )    (resid 32 and name ca )
       (resid 32 and name c )   (resid 33 and name n ) 1.0  -39.18 50.0 2

!!L32
assign (resid 76 and name c )    (resid 77 and name n )
       (resid 77 and name ca )   (resid 77 and name c ) 1.0  -60.88 30.0 2

assign (resid 77 and name n )    (resid 77 and name ca )
       (resid 77 and name c )   (resid 78 and name n ) 1.0  -39.18 50.0 2

!!I33
assign (resid 32 and name c )    (resid 33 and name n )
       (resid 33 and name ca )   (resid 33 and name c ) 1.0  -66.05 30.0 2

assign (resid 33 and name n )    (resid 33 and name ca )
       (resid 33 and name c )   (resid 34 and name n ) 1.0  -44.80 50.0 2

!!I33
assign (resid 77 and name c )    (resid 78 and name n )
       (resid 78 and name ca )   (resid 78 and name c ) 1.0  -66.05 30.0 2

assign (resid 78 and name n )    (resid 78 and name ca )
       (resid 78 and name c )   (resid 79 and name n ) 1.0  -44.80 50.0 2

!!K34
assign (resid 33 and name c )    (resid 34 and name n )
       (resid 34 and name ca )   (resid 34 and name c ) 1.0  -60.92 30.0 2

assign (resid 34 and name n )    (resid 34 and name ca )
       (resid 34 and name c )   (resid 35 and name n ) 1.0  -42.46 50.0 2

!!K34
assign (resid 78 and name c )    (resid 79 and name n )
       (resid 79 and name ca )   (resid 79 and name c ) 1.0  -60.92 30.0 2

assign (resid 79 and name n )    (resid 79 and name ca )
       (resid 79 and name c )   (resid 80 and name n ) 1.0  -42.46 50.0 2

!!Q35
assign (resid 34 and name c )    (resid 35 and name n )
       (resid 35 and name ca )   (resid 35 and name c ) 1.0  -63.98 30.0 2

assign (resid 35 and name n )    (resid 35 and name ca )
       (resid 35 and name c )   (resid 36 and name n ) 1.0  -38.85 50.0 2

!!Q35
assign (resid 79 and name c )    (resid 80 and name n )
       (resid 80 and name ca )   (resid 80 and name c ) 1.0  -63.98 30.0 2

assign (resid 80 and name n )    (resid 80 and name ca )
       (resid 80 and name c )   (resid 81 and name n ) 1.0  -38.85 50.0 2

!!A36
assign (resid 35 and name c )    (resid 36 and name n )
       (resid 36 and name ca )   (resid 36 and name c ) 1.0  -66.57 30.0 2

assign (resid 36 and name n )    (resid 36 and name ca )
       (resid 36 and name c )   (resid 37 and name n ) 1.0  -38.71 50.0 2

!!A36
assign (resid 80 and name c )    (resid 81 and name n )
       (resid 81 and name ca )   (resid 81 and name c ) 1.0  -66.57 30.0 2

assign (resid 81 and name n )    (resid 81 and name ca )
       (resid 81 and name c )   (resid 82 and name n ) 1.0  -38.71 50.0 2

!!I37
assign (resid 36 and name c )    (resid 37 and name n )
       (resid 37 and name ca )   (resid 37 and name c ) 1.0  -64.49 30.0 2

assign (resid 37 and name n )    (resid 37 and name ca )
       (resid 37 and name c )   (resid 38 and name n ) 1.0  -43.33 50.0 2

!!I37
assign (resid 81 and name c )    (resid 82 and name n )
       (resid 82 and name ca )   (resid 82 and name c ) 1.0  -64.49 30.0 2

assign (resid 82 and name n )    (resid 82 and name ca )
       (resid 82 and name c )   (resid 83 and name n ) 1.0  -43.33 50.0 2

!!F38
assign (resid 37 and name c )    (resid 38 and name n )
       (resid 38 and name ca )   (resid 38 and name c ) 1.0  -62.18 30.0 2

assign (resid 38 and name n )    (resid 38 and name ca )
       (resid 38 and name c )   (resid 39 and name n ) 1.0  -38.80 50.0 2

!!F38
assign (resid 82 and name c )    (resid 83 and name n )
       (resid 83 and name ca )   (resid 83 and name c ) 1.0  -62.18 30.0 2

assign (resid 83 and name n )    (resid 83 and name ca )
       (resid 83 and name c )   (resid 84 and name n ) 1.0  -38.80 50.0 2

!!N39
assign (resid 38 and name c )    (resid 39 and name n )
       (resid 39 and name ca )   (resid 39 and name c ) 1.0  -66.13 30.0 2

assign (resid 39 and name n )    (resid 39 and name ca )
       (resid 39 and name c )   (resid 40 and name n ) 1.0  -36.72 50.0 2

!!N39
assign (resid 83 and name c )    (resid 84 and name n )
       (resid 84 and name ca )   (resid 84 and name c ) 1.0  -66.13 30.0 2

assign (resid 84 and name n )    (resid 84 and name ca )
       (resid 84 and name c )   (resid 85 and name n ) 1.0  -36.72 50.0 2

!!Y40
assign (resid 39 and name c )    (resid 40 and name n )
       (resid 40 and name ca )   (resid 40 and name c ) 1.0  -64.40 30.0 2

assign (resid 40 and name n )    (resid 40 and name ca )
       (resid 40 and name c )   (resid 41 and name n ) 1.0  -42.06 50.0 2

!!Y40
assign (resid 84 and name c )    (resid 85 and name n )
       (resid 85 and name ca )   (resid 85 and name c ) 1.0  -64.40 30.0 2

assign (resid 85 and name n )    (resid 85 and name ca )
       (resid 85 and name c )   (resid 86 and name n ) 1.0  -42.06 50.0 2

!!L41
assign (resid 40 and name c )    (resid 41 and name n )
       (resid 41 and name ca )   (resid 41 and name c ) 1.0  -63.70 30.0 2

assign (resid 41 and name n )    (resid 41 and name ca )
       (resid 41 and name c )   (resid 42 and name n ) 1.0  -37.81 50.0 2

!!L41
assign (resid 85 and name c )    (resid 86 and name n )
       (resid 86 and name ca )   (resid 86 and name c ) 1.0  -63.70 30.0 2

assign (resid 86 and name n )    (resid 86 and name ca )
       (resid 86 and name c )   (resid 87 and name n ) 1.0  -37.81 50.0 2

!!E42
assign (resid 41 and name c )    (resid 42 and name n )
       (resid 42 and name ca )   (resid 42 and name c ) 1.0  -63.65 30.0 2

assign (resid 42 and name n )    (resid 42 and name ca )
       (resid 42 and name c )   (resid 43 and name n ) 1.0  -42.03 50.0 2

!!E42
assign (resid 86 and name c )    (resid 87 and name n )
       (resid 87 and name ca )   (resid 87 and name c ) 1.0  -63.65 30.0 2

assign (resid 87 and name n )    (resid 87 and name ca )
       (resid 87 and name c )   (resid 88 and name n ) 1.0  -42.03 50.0 2

!!K43
assign (resid 42 and name c )    (resid 43 and name n )
       (resid 43 and name ca )   (resid 43 and name c ) 1.0  -65.82 30.0 2

assign (resid 43 and name n )    (resid 43 and name ca )
       (resid 43 and name c )   (resid 44 and name n ) 1.0  -38.44 50.0 2

!!K43
assign (resid 87 and name c )    (resid 88 and name n )
       (resid 88 and name ca )   (resid 88 and name c ) 1.0  -65.82 30.0 2

assign (resid 88 and name n )    (resid 88 and name ca )
       (resid 88 and name c )   (resid 89 and name n ) 1.0  -38.44 50.0 2

!!L44
assign (resid 43 and name c )    (resid 44 and name n )
       (resid 44 and name ca )   (resid 44 and name c ) 1.0  -63.36 30.0 2

assign (resid 44 and name n )    (resid 44 and name ca )
       (resid 44 and name c )   (resid 45 and name n ) 1.0  -33.27 50.0 2

!!L44
assign (resid 88 and name c )    (resid 89 and name n )
       (resid 89 and name ca )   (resid 89 and name c ) 1.0  -63.36 30.0 2

assign (resid 89 and name n )    (resid 89 and name ca )
       (resid 89 and name c )   (resid 90 and name n ) 1.0  -33.27 50.0 2

! intra_sel.awk Range:   1 -   1
 assign ( resid 3 and name HA )  ( resid 4 and name HB# ) 4.0 3.2 2.0
 assign ( resid 3 and name HA )  ( resid 4 and name HA ) 4.0 2.2 1.0
 assign ( resid 3 and name HG2# )  ( resid 2 and name HA ) 4.0 3.7 2.5
 assign ( resid 4 and name HN )  ( resid 3 and name HA ) 3.0 1.2 0.3
 assign ( resid 4 and name HA )  ( resid 5 and name HA ) 4.0 2.2 1.0
 assign ( resid 4 and name HB# )  ( resid 5 and name HA ) 4.0 3.2 2.0
 assign ( resid 4 and name HG2# )  ( resid 5 and name HA ) 4.0 3.7 2.5
 assign ( resid 5 and name HN )  ( resid 6 and name HN ) 4.0 2.2 1.0
 assign ( resid 5 and name HN )  ( resid 4 and name HA ) 2.5 0.7 0.2
 assign ( resid 5 and name HN )  ( resid 4 and name HG2# ) 2.5 2.2 1.7
 assign ( resid 5 and name HN )  ( resid 6 and name HD# ) 4.0 3.2 2.0
 assign ( resid 5 and name HN )  ( resid 6 and name HG ) 4.0 2.2 1.0
 assign ( resid 6 and name HN )  ( resid 5 and name HA ) 3.0 1.2 0.3
 assign ( resid 6 and name HN )  ( resid 5 and name HB# ) 4.0 3.2 2.0
 assign ( resid 6 and name HN )  ( resid 5 and name HG2# ) 4.0 3.7 2.5
 assign ( resid 6 and name HD2# )  ( resid 5 and name HB# ) 4.0 4.7 3.5
 assign ( resid 7 and name HN )  ( resid 6 and name HN ) 4.0 2.2 1.0
 assign ( resid 7 and name HN )  ( resid 6 and name HA ) 2.5 0.7 0.2
 assign ( resid 7 and name HN )  ( resid 6 and name HB# ) 2.5 1.7 1.2
 assign ( resid 8 and name HN )  ( resid 7 and name HN ) 4.0 2.2 1.0
 assign ( resid 8 and name HN )  ( resid 7 and name HA# ) 2.5 1.7 1.2
 assign ( resid 8 and name HN )  ( resid 9 and name HG# ) 4.0 3.2 2.0
 assign ( resid 9 and name HN )  ( resid 8 and name HN ) 5.0 2.2 1.0
 assign ( resid 9 and name HN )  ( resid 8 and name HA ) 2.5 0.7 0.2
 assign ( resid 9 and name HN )  ( resid 10 and name HB# ) 4.0 3.2 2.0
 assign ( resid 10 and name HN )  ( resid 9 and name HN ) 4.0 2.2 1.0
 assign ( resid 10 and name HN )  ( resid 9 and name HA ) 2.5 0.7 0.2
 assign ( resid 10 and name HN )  ( resid 11 and name HA ) 4.0 2.2 1.0
 assign ( resid 10 and name HN )  ( resid 9 and name HB# ) 4.0 3.2 2.0
 assign ( resid 10 and name HB# )  ( resid 9 and name HA ) 4.0 3.2 2.0
 assign ( resid 10 and name HB# )  ( resid 11 and name HA ) 4.0 3.2 2.0
 assign ( resid 11 and name HN )  ( resid 10 and name HN ) 4.0 2.2 1.0
 assign ( resid 11 and name HN )  ( resid 10 and name HA ) 4.0 2.2 1.0
 assign ( resid 11 and name HN )  ( resid 10 and name HB2 ) 4.0 2.2 1.0
 assign ( resid 11 and name HN )  ( resid 10 and name HB1 ) 3.0 1.2 0.3
 assign ( resid 11 and name HN )  ( resid 10 and name HD2# ) 2.5 2.2 1.7
 assign ( resid 12 and name HN )  ( resid 11 and name HA ) 2.5 0.7 0.2
 assign ( resid 12 and name HN )  ( resid 13 and name HD# ) 3.0 2.2 1.3
 assign ( resid 12 and name HN )  ( resid 11 and name HB1 ) 3.0 1.2 0.3
 assign ( resid 12 and name HN )  ( resid 11 and name HB2 ) 4.0 2.2 1.0
 assign ( resid 12 and name HB1 )  ( resid 13 and name HD# ) 4.0 2.2 1.0
 assign ( resid 12 and name HB2 )  ( resid 13 and name HD# ) 4.0 2.2 1.0
 assign ( resid 12 and name HA )  ( resid 11 and name HB# ) 4.0 3.2 2.0
 assign ( resid 12 and name HB# )  ( resid 13 and name HA ) 4.0 3.2 2.0
 assign ( resid 12 and name HB# )  ( resid 11 and name HB# ) 4.0 4.2 3.0
 assign ( resid 13 and name HA )  ( resid 14 and name HA ) 4.0 2.2 1.0
 assign ( resid 13 and name HD1 )  ( resid 12 and name HB# ) 2.5 0.7 0.2
 assign ( resid 13 and name HD2 )  ( resid 12 and name HB# ) 2.5 0.7 0.2
 assign ( resid 14 and name HN )  ( resid 13 and name HB# ) 3.0 2.2 1.3
 assign ( resid 14 and name HN )  ( resid 15 and name HB# ) 4.0 3.2 2.0
 assign ( resid 14 and name HA )  ( resid 15 and name HA ) 4.0 2.2 1.0
 assign ( resid 14 and name HB# )  ( resid 15 and name HA ) 4.0 3.2 2.0
 assign ( resid 14 and name HG2# )  ( resid 15 and name HN ) 4.0 3.7 2.5
 assign ( resid 15 and name HN )  ( resid 14 and name HB ) 4.0 2.2 1.0
 assign ( resid 15 and name HN )  ( resid 16 and name HG# ) 4.0 3.2 2.0
 assign ( resid 15 and name HN )  ( resid 14 and name HG2# ) 3.0 2.7 1.8
 assign ( resid 15 and name HA )  ( resid 14 and name HA ) 4.0 2.2 1.0
 assign ( resid 15 and name HA )  ( resid 14 and name HB# ) 4.0 3.2 2.0
 assign ( resid 15 and name HB# )  ( resid 16 and name HB# ) 5.0 4.0 3.0
 assign ( resid 15 and name HB1 )  ( resid 16 and name HA ) 4.0 2.2 1.0
 assign ( resid 15 and name HB# )  ( resid 16 and name HN ) 3.0 2.2 1.3
 assign ( resid 15 and name HB# )  ( resid 14 and name HN ) 4.0 3.2 2.0
 assign ( resid 16 and name HN ) ( resid 15 and name HB1 ) 3.0 1.2 0.3
 assign ( resid 16 and name HN ) ( resid 15 and name HB2 ) 4.0 2.2 1.0
 assign ( resid 16 and name HA )  ( resid 17 and name HA ) 4.0 2.2 1.0
 assign ( resid 16 and name HA )  ( resid 15 and name HB# ) 4.0 3.2 2.0
 assign ( resid 16 and name HB# )  ( resid 17 and name HA ) 4.0 3.2 2.0
 assign ( resid 16 and name HB# )  ( resid 17 and name HN ) 4.0 3.2 2.0
 assign ( resid 16 and name HG# )  ( resid 15 and name HB# ) 4.0 4.2 3.0
 assign ( resid 16 and name HG# )  ( resid 17 and name HA ) 4.0 3.2 2.0
 assign ( resid 16 and name HG# )  ( resid 17 and name HB# ) 4.0 4.2 3.0
 assign ( resid 17 and name HN )  ( resid 16 and name HG# ) 3.0 2.2 1.3
 assign ( resid 17 and name HB# )  ( resid 18 and name HA ) 4.0 3.2 2.0
 assign ( resid 17 and name HB# )  ( resid 16 and name HG# ) 4.0 4.2 3.0
 assign ( resid 17 and name HG# )  ( resid 18 and name HA ) 4.0 3.2 2.0
 assign ( resid 18 and name HN )  ( resid 17 and name HB# ) 3.0 2.2 1.3
 assign ( resid 18 and name HN )  ( resid 17 and name HG# ) 4.0 3.2 2.0
 assign ( resid 18 and name HA )  ( resid 17 and name HG# ) 4.0 3.2 2.0
 assign ( resid 19 and name HN )  ( resid 18 and name HG# ) 4.0 3.2 2.0
 assign ( resid 19 and name HN )  ( resid 18 and name HD# ) 4.0 3.2 2.0
 assign ( resid 19 and name HA )  ( resid 18 and name HB# ) 4.0 3.2 2.0
 assign ( resid 19 and name HA )  ( resid 18 and name HB# ) 4.0 3.2 2.0
 assign ( resid 19 and name HB# )  ( resid 18 and name HB# ) 4.0 4.2 3.0
 assign ( resid 19 and name HB# )  ( resid 20 and name HN ) 3.0 2.2 1.3
 assign ( resid 19 and name HD# )  ( resid 20 and name HA ) 4.0 3.2 2.0
 assign ( resid 20 and name HN )  ( resid 19 and name HB# ) 2.5 1.7 1.2
 assign ( resid 20 and name HB# )  ( resid 21 and name HN ) 3.0 2.2 1.3
 assign ( resid 20 and name HB# )  ( resid 19 and name HB# ) 5.0 4.0 3.0
 assign ( resid 21 and name HN )  ( resid 20 and name HB# ) 4.0 3.2 2.0
 assign ( resid 21 and name HA )  ( resid 20 and name HB# ) 4.0 3.2 2.0
 assign ( resid 21 and name HB# )  ( resid 22 and name HA ) 4.0 3.2 2.0
 assign ( resid 22 and name HN )  ( resid 21 and name HB# ) 4.0 3.2 2.0
 assign ( resid 22 and name HN )  ( resid 23 and name HB# ) 4.0 3.2 2.0
 assign ( resid 22 and name HN )  ( resid 23 and name HG# ) 4.0 3.2 2.0
 assign ( resid 22 and name HA )  ( resid 21 and name HB# ) 4.0 3.2 2.0
 assign ( resid 22 and name HB# )  ( resid 23 and name HN ) 3.0 2.2 1.3
 assign ( resid 23 and name HN )  ( resid 22 and name HB# ) 3.0 2.2 1.3
 assign ( resid 23 and name HB1 )  ( resid 24 and name HA ) 4.0 2.2 1.0
 assign ( resid 23 and name HB2 )  ( resid 24 and name HA ) 4.0 2.2 1.0
 assign ( resid 24 and name HN )  ( resid 25 and name HA ) 5.0 2.0 1.0
 assign ( resid 24 and name HN )  ( resid 23 and name HB# ) 3.0 2.2 1.3
 assign ( resid 24 and name HN )  ( resid 23 and name HG# ) 4.0 3.2 2.0
 assign ( resid 24 and name HN )  ( resid 25 and name HG2# ) 4.0 3.7 2.5
 assign ( resid 24 and name HB# )  ( resid 25 and name HB# ) 4.0 4.2 3.0
 assign ( resid 25 and name HN )  ( resid 26 and name HA ) 4.0 2.2 1.0
 assign ( resid 25 and name HN )  ( resid 24 and name HB# ) 4.0 3.2 2.0
 assign ( resid 25 and name HG2# )  ( resid 26 and name HN ) 4.0 3.7 2.5
 assign ( resid 25 and name HG2# )  ( resid 24 and name HB# ) 4.0 4.5 3.5
 assign ( resid 26 and name HN )  ( resid 25 and name HB# ) 4.0 3.2 2.0
 assign ( resid 26 and name HN )  ( resid 25 and name HG2# ) 3.0 2.7 1.8
 assign ( resid 26 and name HN )  ( resid 25 and name HD# ) 4.0 3.2 2.0
 assign ( resid 26 and name HA )  ( resid 25 and name HA ) 4.0 2.2 1.0
 assign ( resid 27 and name HN )  ( resid 28 and name HA ) 4.0 2.2 1.0
 assign ( resid 27 and name HN )  ( resid 26 and name HB1 ) 4.0 2.2 1.0
 assign ( resid 27 and name HN )  ( resid 26 and name HB2 ) 4.0 2.2 1.0
 assign ( resid 27 and name HA )  ( resid 26 and name HA ) 4.0 2.2 1.0
 assign ( resid 28 and name HN )  ( resid 27 and name HA ) 3.0 1.2 0.3
 assign ( resid 28 and name HN )  ( resid 29 and name HD# ) 4.0 3.2 2.0
 assign ( resid 28 and name HN )  ( resid 27 and name HB# ) 3.0 2.2 1.3
 assign ( resid 29 and name HD# )  ( resid 28 and name HA ) 2.5 1.7 1.3
 assign ( resid 29 and name HD# )  ( resid 28 and name HB# ) 4.0 4.2 3.0
 assign ( resid 29 and name HB# )  ( resid 30 and name HA ) 4.0 3.2 2.0
 assign ( resid 29 and name HD# )  ( resid 28 and name HA ) 2.5 2.2 1.2
 assign ( resid 29 and name HD# )  ( resid 28 and name HG2# ) 4.0 4.7 3.5
 assign ( resid 30 and name HN )  ( resid 29 and name HB# ) 4.0 3.2 2.0
 assign ( resid 30 and name HA )  ( resid 29 and name HA ) 4.0 2.2 1.0
 assign ( resid 31 and name HN )  ( resid 30 and name HB# ) 3.0 2.2 1.3
 assign ( resid 31 and name HN )  ( resid 32 and name HB# ) 4.0 3.2 2.0
 assign ( resid 31 and name HA )  ( resid 30 and name HA ) 4.0 2.2 1.0
 assign ( resid 32 and name HN )  ( resid 31 and name HD1# ) 4.0 2.2 1.0
 assign ( resid 32 and name HN )  ( resid 33 and name HA ) 5.0 2.0 1.0
 assign ( resid 32 and name HG )  ( resid 33 and name HA ) 5.0 2.0 1.0
 assign ( resid 33 and name HN )  ( resid 32 and name HB# ) 3.0 2.2 1.3
 assign ( resid 33 and name HA )  ( resid 32 and name HB# ) 4.0 3.2 2.0
 assign ( resid 33 and name HG1# )  ( resid 32 and name HB# ) 4.0 4.7 3.5
 assign ( resid 34 and name HN )  ( resid 33 and name HD1# ) 4.0 3.7 2.5
 assign ( resid 34 and name HN )  ( resid 33 and name HG2# ) 4.0 3.7 2.5
 assign ( resid 34 and name HN )  ( resid 33 and name HB# ) 3.0 2.2 1.3
 assign ( resid 34 and name HA )  ( resid 33 and name HG2# ) 3.0 2.7 1.8
 assign ( resid 34 and name HA )  ( resid 33 and name HB# ) 4.0 3.2 2.0
 assign ( resid 34 and name HB# )  ( resid 35 and name HG# ) 4.0 4.2 3.0
 assign ( resid 35 and name HN )  ( resid 34 and name HB# ) 4.0 3.2 2.0
 assign ( resid 35 and name HN )  ( resid 34 and name HG# ) 4.0 3.2 2.0
 assign ( resid 35 and name HA )  ( resid 36 and name HA ) 4.0 2.2 1.0
 assign ( resid 35 and name HA )  ( resid 34 and name HB# ) 4.0 3.2 2.0
 assign ( resid 35 and name HB# )  ( resid 36 and name HA ) 4.0 3.2 2.0
 assign ( resid 36 and name HN )  ( resid 37 and name HB# ) 4.0 3.2 2.0
 assign ( resid 36 and name HN )  ( resid 35 and name HG# ) 3.0 2.5 1.3
 assign ( resid 36 and name HA )  ( resid 35 and name HA ) 4.0 2.2 1.0
 assign ( resid 36 and name HB# )  ( resid 37 and name HA ) 4.0 3.2 2.0
 assign ( resid 36 and name HB# )  ( resid 37 and name HG1# ) 4.0 4.7 3.5
 assign ( resid 36 and name HA )  ( resid 35 and name HB# ) 4.0 3.2 2.0
 assign ( resid 37 and name HN )  ( resid 36 and name HB# ) 3.0 2.2 1.3
 assign ( resid 37 and name HA )  ( resid 36 and name HB# ) 4.0 3.2 2.0
 assign ( resid 38 and name HN )  ( resid 37 and name HB# ) 3.0 2.2 1.3
 assign ( resid 38 and name HN )  ( resid 37 and name HG2# ) 3.0 2.7 1.8
 assign ( resid 38 and name HA )  ( resid 37 and name HA ) 4.0 2.2 1.0
 assign ( resid 38 and name HA )  ( resid 37 and name HG2# ) 4.0 3.7 2.5
 assign ( resid 41 and name HN )  ( resid 40 and name HE# ) 4.0 4.2 3.0
 assign ( resid 39 and name HN )  ( resid 38 and name HD# ) 4.0 4.2 3.0
 assign ( resid 39 and name HN )  ( resid 38 and name HE# ) 4.0 4.2 3.0
 assign ( resid 39 and name HN )  ( resid 38 and name HB# ) 3.0 2.2 1.3
 assign ( resid 39 and name HN )  ( resid 40 and name HB# ) 4.0 3.2 2.0
 assign ( resid 39 and name HA )  ( resid 38 and name HN ) 4.0 2.2 1.0
 assign ( resid 39 and name HB# )  ( resid 40 and name HB# ) 4.0 4.2 3.0
 assign ( resid 40 and name HN )  ( resid 39 and name HB# ) 2.5 1.7 1.2
 assign ( resid 40 and name HA )  ( resid 39 and name HB# ) 4.0 3.2 2.0
 assign ( resid 40 and name HA )  ( resid 39 and name HN ) 4.0 2.2 1.0
 assign ( resid 40 and name HA )  ( resid 39 and name HA ) 4.0 2.2 1.0
 assign ( resid 40 and name HB# )  ( resid 39 and name HN ) 4.0 3.2 2.0
 assign ( resid 40 and name HB# )  ( resid 41 and name HA ) 4.0 3.2 2.0
 assign ( resid 41 and name HN )  ( resid 40 and name HB# ) 4.0 3.2 2.0
 assign ( resid 41 and name HN )  ( resid 40 and name HD# ) 4.0 4.2 3.0
 assign ( resid 41 and name HA )  ( resid 40 and name HA ) 4.0 2.2 1.0
 assign ( resid 42 and name HN )  ( resid 41 and name HB# ) 4.0 3.2 2.0
 assign ( resid 42 and name HN )  ( resid 43 and name HB# ) 4.0 3.2 2.0
 assign ( resid 42 and name HB# )  ( resid 43 and name HA ) 4.0 3.2 2.0
 assign ( resid 42 and name HA )  ( resid 43 and name HA ) 4.0 2.2 1.0
 assign ( resid 43 and name HN )  ( resid 42 and name HB# ) 2.5 1.7 1.2
 assign ( resid 43 and name HN )  ( resid 42 and name HG# ) 4.0 3.2 2.0
 assign ( resid 43 and name HN )  ( resid 44 and name HD# ) 4.0 3.2 2.0
 assign ( resid 43 and name HN )  ( resid 44 and name HG ) 4.0 2.2 1.0
 assign ( resid 43 and name HB# )  ( resid 44 and name HD2# ) 4.0 4.7 3.5
 assign ( resid 43 and name HB# )  ( resid 42 and name HB# ) 4.0 4.2 3.0
 assign ( resid 44 and name HN )  ( resid 43 and name HB# ) 3.0 2.2 1.3
 assign ( resid 44 and name HA )  ( resid 43 and name HG# ) 4.0 3.2 2.0
 assign ( resid 44 and name HA )  ( resid 43 and name HB# ) 4.0 3.2 2.0
 assign ( resid 44 and name HA )  ( resid 43 and name HA ) 4.0 2.2 1.0
 assign ( resid 45 and name HN )  ( resid 44 and name HB# ) 3.0 2.2 1.3
 assign ( resid 45 and name HN )  ( resid 44 and name HD# ) 4.0 3.2 2.0
 assign ( resid 45 and name HN )  ( resid 44 and name HG ) 4.0 2.2 1.0
 assign ( resid 45 and name HA )  ( resid 44 and name HB# ) 4.0 3.2 2.0
 assign ( resid 45 and name HB# )  ( resid 44 and name HA ) 5.0 3.0 2.0
 assign ( resid 45 and name HG# )  ( resid 44 and name HA ) 5.0 3.2 2.0
 assign ( resid 14 and name HN )  ( resid 15 and name HN ) 2.5 0.7 0.6
 assign ( resid 15 and name HN )  ( resid 16 and name HN ) 2.5 0.7 0.6
 assign ( resid 16 and name HN )  ( resid 17 and name HN ) 2.5 0.7 0.6
 assign ( resid 17 and name HN )  ( resid 18 and name HN ) 2.5 0.7 0.6
 assign ( resid 18 and name HN )  ( resid 19 and name HN ) 2.5 0.7 0.6
 assign ( resid 19 and name HN )  ( resid 20 and name HN ) 2.5 0.7 0.6
 assign ( resid 20 and name HN )  ( resid 21 and name HN ) 2.5 0.7 0.6
 assign ( resid 21 and name HN )  ( resid 22 and name HN ) 2.5 0.7 0.6
 assign ( resid 22 and name HN )  ( resid 23 and name HN ) 2.5 0.7 0.6
 assign ( resid 23 and name HN )  ( resid 24 and name HN ) 2.5 0.7 0.6
 assign ( resid 24 and name HN )  ( resid 25 and name HN ) 3.0 1.2 0.5
 assign ( resid 25 and name HN )  ( resid 26 and name HN ) 2.5 0.7 0.6
 assign ( resid 26 and name HN )  ( resid 27 and name HN ) 2.5 0.7 0.6
 assign ( resid 27 and name HN )  ( resid 28 and name HN ) 4.0 2.2 1.0
 assign ( resid 30 and name HN )  ( resid 31 and name HN ) 2.5 0.7 0.6
 assign ( resid 31 and name HN )  ( resid 32 and name HN ) 2.5 0.7 0.6
 assign ( resid 32 and name HN )  ( resid 33 and name HN ) 3.0 1.2 0.5
 assign ( resid 33 and name HN )  ( resid 34 and name HN ) 3.0 1.2 0.5
 assign ( resid 34 and name HN )  ( resid 35 and name HN ) 2.5 0.7 0.6
 assign ( resid 35 and name HN )  ( resid 36 and name HN ) 2.5 0.7 0.6
 assign ( resid 36 and name HN )  ( resid 37 and name HN ) 2.5 0.7 0.6
 assign ( resid 37 and name HN )  ( resid 38 and name HN ) 2.5 0.7 0.6
 assign ( resid 38 and name HN )  ( resid 39 and name HN ) 3.0 1.2 0.5
 assign ( resid 39 and name HN )  ( resid 40 and name HN ) 2.5 0.7 0.6
 assign ( resid 40 and name HN )  ( resid 41 and name HN ) 2.5 0.7 0.6
 assign ( resid 41 and name HN )  ( resid 42 and name HN ) 3.0 1.2 0.5
 assign ( resid 42 and name HN )  ( resid 43 and name HN ) 2.5 0.7 0.6
 assign ( resid 43 and name HN )  ( resid 44 and name HN ) 2.5 0.7 0.6
 assign ( resid 44 and name HN )  ( resid 45 and name HN ) 3.0 1.2 0.5
 assign ( resid 15 and name HN )  ( resid 14 and name HA ) 4.0 2.2 1.0
 assign ( resid 16 and name HN )  ( resid 15 and name HA ) 4.0 2.2 1.0
 assign ( resid 17 and name HN )  ( resid 16 and name HA ) 4.0 2.2 1.0
 assign ( resid 18 and name HN )  ( resid 17 and name HA ) 4.0 2.2 1.0
 assign ( resid 19 and name HN )  ( resid 18 and name HA ) 4.0 2.2 1.0
 assign ( resid 20 and name HN )  ( resid 19 and name HA ) 3.0 1.2 0.3
 assign ( resid 21 and name HN )  ( resid 20 and name HA ) 4.0 2.2 1.0
 assign ( resid 22 and name HN )  ( resid 21 and name HA ) 4.0 2.2 1.0
 assign ( resid 23 and name HN )  ( resid 22 and name HA ) 3.0 1.2 0.3
 assign ( resid 24 and name HN )  ( resid 23 and name HA ) 4.0 2.2 1.0
 assign ( resid 25 and name HN )  ( resid 24 and name HA ) 4.0 2.2 1.0
 assign ( resid 26 and name HN )  ( resid 25 and name HA ) 3.0 1.2 0.3
 assign ( resid 27 and name HN )  ( resid 26 and name HA ) 2.5 0.7 0.2
 assign ( resid 33 and name HN )  ( resid 32 and name HA ) 3.0 1.2 0.3
 assign ( resid 34 and name HN )  ( resid 33 and name HA ) 4.0 2.2 1.0
 assign ( resid 36 and name HN )  ( resid 35 and name HA ) 4.0 2.2 1.0
 assign ( resid 37 and name HN )  ( resid 36 and name HA ) 4.0 2.2 1.0
 assign ( resid 39 and name HN )  ( resid 38 and name HA ) 4.0 2.2 1.0
 assign ( resid 40 and name HN )  ( resid 39 and name HA ) 4.0 2.2 1.0
 assign ( resid 41 and name HN )  ( resid 40 and name HA ) 4.0 2.2 1.0
 assign ( resid 42 and name HN )  ( resid 41 and name HA ) 4.0 2.2 1.0
 assign ( resid 43 and name HN )  ( resid 42 and name HA ) 4.0 2.2 1.0
 assign ( resid 44 and name HN )  ( resid 43 and name HA ) 4.0 2.2 1.0
 assign ( resid 45 and name HN )  ( resid 44 and name HA ) 4.0 2.2 1.0
 assign ( resid 31 and name HN )  ( resid 30 and name HA ) 4.0 2.2 1.0
 assign ( resid 32 and name HN )  ( resid 31 and name HA ) 3.0 1.2 0.3
 assign ( resid 38 and name HN )  ( resid 37 and name HA ) 4.0 2.2 1.0
 assign ( resid 36 and name HN )  ( resid 35 and name HB# ) 4.0 3.2 2.0
 assign ( resid 48 and name HA )  ( resid 49 and name HB# ) 4.0 3.2 2.0
 assign ( resid 48 and name HA )  ( resid 49 and name HA ) 4.0 2.2 1.0
 assign ( resid 48 and name HG2# )  ( resid 47 and name HA ) 4.0 3.7 2.5
 assign ( resid 49 and name HN )  ( resid 48 and name HA ) 3.0 1.2 0.3
 assign ( resid 49 and name HA )  ( resid 50 and name HA ) 4.0 2.2 1.0
 assign ( resid 49 and name HB# )  ( resid 50 and name HA ) 4.0 3.2 2.0
 assign ( resid 49 and name HG2# )  ( resid 50 and name HA ) 4.0 3.7 2.5
 assign ( resid 50 and name HN )  ( resid 51 and name HN ) 4.0 2.2 1.0
 assign ( resid 50 and name HN )  ( resid 49 and name HA ) 2.5 0.7 0.2
 assign ( resid 50 and name HN )  ( resid 49 and name HG2# ) 2.5 2.2 1.7
 assign ( resid 50 and name HN )  ( resid 51 and name HD# ) 4.0 3.2 2.0
 assign ( resid 50 and name HN )  ( resid 51 and name HG ) 4.0 2.2 1.0
 assign ( resid 51 and name HN )  ( resid 50 and name HB# ) 4.0 3.2 2.0
 assign ( resid 51 and name HN )  ( resid 50 and name HG2# ) 4.0 3.7 2.5
 assign ( resid 51 and name HN )  ( resid 50 and name HA ) 3.0 1.2 0.3
 assign ( resid 51 and name HD2# )  ( resid 50 and name HB# ) 4.0 4.7 3.5
 assign ( resid 52 and name HN )  ( resid 51 and name HN ) 4.0 2.2 1.0
 assign ( resid 52 and name HN )  ( resid 51 and name HA ) 2.5 0.7 0.2
 assign ( resid 52 and name HN )  ( resid 51 and name HB# ) 2.5 1.7 1.2
 assign ( resid 53 and name HN )  ( resid 52 and name HN ) 4.0 2.2 1.0
 assign ( resid 53 and name HN )  ( resid 52 and name HA# ) 2.5 1.7 1.2
 assign ( resid 53 and name HN )  ( resid 54 and name HG# ) 4.0 3.2 2.0
 assign ( resid 54 and name HN )  ( resid 53 and name HN ) 5.0 2.2 1.0
 assign ( resid 54 and name HN )  ( resid 53 and name HA ) 2.5 0.7 0.2
 assign ( resid 54 and name HN )  ( resid 55 and name HB# ) 4.0 3.2 2.0
 assign ( resid 54 and name HN ) ( resid 53 and name HG* ) 2.5 0.7 0.2
 assign ( resid 55 and name HN )  ( resid 54 and name HN ) 4.0 2.2 1.0
 assign ( resid 55 and name HN )  ( resid 54 and name HA ) 2.5 0.7 0.2
 assign ( resid 55 and name HN )  ( resid 56 and name HA ) 4.0 2.2 1.0
 assign ( resid 55 and name HN )  ( resid 54 and name HB# ) 4.0 3.2 2.0
 assign ( resid 55 and name HB# )  ( resid 54 and name HA ) 4.0 3.2 2.0
 assign ( resid 55 and name HB# )  ( resid 56 and name HA ) 4.0 3.2 2.0
 assign ( resid 56 and name HN )  ( resid 55 and name HN ) 4.0 2.2 1.0
 assign ( resid 56 and name HN )  ( resid 55 and name HA ) 4.0 2.2 1.0
 assign ( resid 56 and name HN )  ( resid 55 and name HB2 ) 4.0 2.2 1.0
 assign ( resid 56 and name HN )  ( resid 55 and name HB1 ) 3.0 1.2 0.3
 assign ( resid 56 and name HN )  ( resid 55 and name HD2# ) 2.5 2.2 1.7
 assign ( resid 57 and name HN )  ( resid 56 and name HA ) 2.5 0.7 0.2
 assign ( resid 57 and name HN )  ( resid 58 and name HD# ) 3.0 2.2 1.3
 assign ( resid 57 and name HN )  ( resid 56 and name HB1 ) 3.0 1.2 0.3
 assign ( resid 57 and name HN )  ( resid 56 and name HB2 ) 4.0 2.2 1.0
 assign ( resid 57 and name HB1 )  ( resid 58 and name HD# ) 4.0 2.2 1.0
 assign ( resid 57 and name HB2 )  ( resid 58 and name HD# ) 4.0 2.2 1.0
 assign ( resid 57 and name HA )  ( resid 56 and name HB# ) 4.0 3.2 2.0
 assign ( resid 57 and name HB# )  ( resid 58 and name HA ) 4.0 3.2 2.0
 assign ( resid 57 and name HB# )  ( resid 56 and name HB# ) 4.0 4.2 3.0
 assign ( resid 58 and name HA )  ( resid 59 and name HA ) 4.0 2.2 1.0
 assign ( resid 58 and name HD1 )  ( resid 57 and name HB# ) 2.5 0.7 0.2
 assign ( resid 58 and name HD2 )  ( resid 57 and name HB# ) 2.5 0.7 0.2
 assign ( resid 59 and name HN )  ( resid 58 and name HB# ) 3.0 2.2 1.3
 assign ( resid 59 and name HN )  ( resid 60 and name HB# ) 4.0 3.2 2.0
 assign ( resid 59 and name HA )  ( resid 60 and name HA ) 4.0 2.2 1.0
 assign ( resid 59 and name HB# )  ( resid 60 and name HA ) 4.0 3.2 2.0
 assign ( resid 59 and name HG2# )  ( resid 60 and name HN ) 4.0 3.7 2.5
 assign ( resid 60 and name HN )  ( resid 59 and name HB ) 4.0 2.2 1.0
 assign ( resid 60 and name HN )  ( resid 61 and name HG# ) 4.0 3.2 2.0
 assign ( resid 60 and name HN )  ( resid 59 and name HG2# ) 3.0 2.7 1.8
 assign ( resid 60 and name HA )  ( resid 59 and name HA ) 4.0 2.2 1.0
 assign ( resid 60 and name HA )  ( resid 59 and name HB# ) 4.0 3.2 2.0
 assign ( resid 60 and name HB# )  ( resid 61 and name HB# ) 5.0 4.0 3.0
 assign ( resid 60 and name HB1 )  ( resid 61 and name HA ) 4.0 2.2 1.0
 assign ( resid 60 and name HB# )  ( resid 61 and name HN ) 3.0 2.2 1.3
 assign ( resid 60 and name HB# )  ( resid 59 and name HN ) 4.0 3.2 2.0
 assign ( resid 61 and name HN )  ( resid 60 and name HB1 ) 3.0 1.2 0.3
 assign ( resid 61 and name HN )  ( resid 60 and name HB2 ) 4.0 2.2 1.0
 assign ( resid 61 and name HA )  ( resid 62 and name HA ) 4.0 2.2 1.0
 assign ( resid 61 and name HA )  ( resid 60 and name HB# ) 4.0 3.2 2.0
 assign ( resid 61 and name HB# )  ( resid 62 and name HA ) 4.0 3.2 2.0
 assign ( resid 61 and name HB# )  ( resid 62 and name HN ) 4.0 3.2 2.0
 assign ( resid 61 and name HG# )  ( resid 60 and name HB# ) 4.0 4.2 3.0
 assign ( resid 61 and name HG# )  ( resid 62 and name HA ) 4.0 3.2 2.0
 assign ( resid 61 and name HG# )  ( resid 62 and name HB# ) 4.0 4.2 3.0
 assign ( resid 62 and name HN )  ( resid 61 and name HG# ) 3.0 2.2 1.3
 assign ( resid 62 and name HB# )  ( resid 63 and name HA ) 4.0 3.2 2.0
 assign ( resid 62 and name HB# )  ( resid 61 and name HG# ) 4.0 4.2 3.0
 assign ( resid 62 and name HG# )  ( resid 63 and name HA ) 4.0 3.2 2.0
 assign ( resid 63 and name HN )  ( resid 62 and name HB# ) 3.0 2.2 1.3
 assign ( resid 63 and name HN )  ( resid 62 and name HG# ) 4.0 3.2 2.0
 assign ( resid 63 and name HA )  ( resid 62 and name HG# ) 4.0 3.2 2.0
 assign ( resid 64 and name HN )  ( resid 63 and name HG# ) 4.0 3.2 2.0
 assign ( resid 64 and name HN )  ( resid 63 and name HD# ) 4.0 3.2 2.0
 assign ( resid 64 and name HA )  ( resid 63 and name HB# ) 4.0 3.2 2.0
 assign ( resid 64 and name HA )  ( resid 63 and name HB# ) 4.0 3.2 2.0
 assign ( resid 64 and name HB# )  ( resid 63 and name HB# ) 4.0 4.2 3.0
 assign ( resid 64 and name HB# )  ( resid 65 and name HN ) 3.0 2.2 1.3
 assign ( resid 64 and name HD# )  ( resid 65 and name HA ) 4.0 3.2 2.0
 assign ( resid 65 and name HN )  ( resid 64 and name HB# ) 2.5 1.7 1.2
 assign ( resid 65 and name HB# )  ( resid 66 and name HN ) 3.0 2.2 1.3
 assign ( resid 65 and name HB# )  ( resid 64 and name HB# ) 5.0 4.0 3.0
 assign ( resid 66 and name HN )  ( resid 65 and name HB# ) 4.0 3.2 2.0
 assign ( resid 66 and name HA )  ( resid 65 and name HB# ) 4.0 3.2 2.0
 assign ( resid 66 and name HB# )  ( resid 67 and name HA ) 4.0 3.2 2.0
 assign ( resid 67 and name HN )  ( resid 66 and name HB# ) 4.0 3.2 2.0
 assign ( resid 67 and name HN )  ( resid 68 and name HB# ) 4.0 3.2 2.0
 assign ( resid 67 and name HN )  ( resid 68 and name HG# ) 4.0 3.2 2.0
 assign ( resid 67 and name HA )  ( resid 66 and name HB# ) 4.0 3.2 2.0
 assign ( resid 67 and name HB# )  ( resid 68 and name HN ) 3.0 2.2 1.3
 assign ( resid 68 and name HN )  ( resid 67 and name HB# ) 2.5 1.7 1.2
 assign ( resid 68 and name HB1 )  ( resid 69 and name HA ) 4.0 2.2 1.0
 assign ( resid 68 and name HB2 )  ( resid 69 and name HA ) 4.0 2.2 1.0
 assign ( resid 69 and name HN )  ( resid 70 and name HA ) 5.0 2.0 1.0
 assign ( resid 69 and name HN )  ( resid 68 and name HB# ) 2.5 1.7 1.2
 assign ( resid 69 and name HN )  ( resid 68 and name HG# ) 4.0 3.2 2.0
 assign ( resid 69 and name HN )  ( resid 70 and name HG2# ) 4.0 3.7 2.5
 assign ( resid 69 and name HB# )  ( resid 70 and name HB# ) 4.0 4.2 3.0
 assign ( resid 70 and name HN )  ( resid 71 and name HA ) 4.0 2.2 1.0
 assign ( resid 70 and name HN )  ( resid 69 and name HB# ) 4.0 3.2 2.0
 assign ( resid 70 and name HG2# )  ( resid 71 and name HN ) 4.0 3.7 2.5
 assign ( resid 70 and name HG2# )  ( resid 69 and name HB# ) 4.0 4.5 3.5
 assign ( resid 71 and name HN )  ( resid 70 and name HB# ) 4.0 3.2 2.0
 assign ( resid 71 and name HN )  ( resid 70 and name HG2# ) 3.0 2.7 1.8
 assign ( resid 71 and name HN )  ( resid 70 and name HD# ) 4.0 3.2 2.0
 assign ( resid 71 and name HA )  ( resid 70 and name HA ) 4.0 2.2 1.0
 assign ( resid 72 and name HN )  ( resid 73 and name HA ) 4.0 2.2 1.0
 assign ( resid 72 and name HN )  ( resid 71 and name HB1 ) 4.0 2.2 1.0
 assign ( resid 72 and name HN )  ( resid 71 and name HB2 ) 4.0 2.2 1.0
 assign ( resid 72 and name HA )  ( resid 71 and name HA ) 4.0 2.2 1.0
 assign ( resid 73 and name HN )  ( resid 72 and name HA ) 3.0 1.2 0.3
 assign ( resid 73 and name HN )  ( resid 74 and name HD# ) 4.0 3.2 2.0
 assign ( resid 73 and name HN )  ( resid 72 and name HB# ) 3.0 2.2 1.3
 assign ( resid 74 and name HD# )  ( resid 73 and name HA ) 2.5 1.7 1.3
 assign ( resid 74 and name HD# )  ( resid 73 and name HB# ) 4.0 4.2 3.0
 assign ( resid 74 and name HB# )  ( resid 75 and name HA ) 4.0 3.2 2.0
 assign ( resid 74 and name HD# )  ( resid 73 and name HA ) 2.5 2.2 1.2
 assign ( resid 74 and name HD# )  ( resid 73 and name HG2# ) 4.0 4.7 3.5
 assign ( resid 75 and name HN )  ( resid 74 and name HB# ) 4.0 3.2 2.0
 assign ( resid 75 and name HA )  ( resid 74 and name HA ) 4.0 2.2 1.0
 assign ( resid 76 and name HN )  ( resid 75 and name HB# ) 3.0 2.2 1.3
 assign ( resid 76 and name HN )  ( resid 77 and name HB# ) 4.0 3.2 2.0
 assign ( resid 76 and name HA )  ( resid 75 and name HA ) 4.0 2.2 1.0
 assign ( resid 77 and name HN )  ( resid 76 and name HD1# ) 4.0 2.2 1.0
 assign ( resid 77 and name HN )  ( resid 78 and name HA ) 5.0 2.0 1.0
 assign ( resid 77 and name HG )  ( resid 78 and name HA ) 5.0 2.0 1.0
 assign ( resid 78 and name HN )  ( resid 77 and name HB# ) 3.0 2.2 1.3
 assign ( resid 78 and name HA )  ( resid 77 and name HB# ) 4.0 3.2 2.0
 assign ( resid 78 and name HG1# )  ( resid 77 and name HB# ) 4.0 4.7 3.5
 assign ( resid 79 and name HN )  ( resid 78 and name HD1# ) 4.0 3.7 2.5
 assign ( resid 79 and name HN )  ( resid 78 and name HG2# ) 4.0 3.7 2.5
 assign ( resid 79 and name HN )  ( resid 78 and name HB# ) 3.0 2.2 1.3
 assign ( resid 79 and name HA )  ( resid 78 and name HG2# ) 3.0 2.7 1.8
 assign ( resid 79 and name HA )  ( resid 78 and name HB# ) 4.0 3.2 2.0
 assign ( resid 79 and name HB# )  ( resid 80 and name HG# ) 4.0 4.2 3.0
 assign ( resid 80 and name HN )  ( resid 79 and name HB# ) 4.0 3.2 2.0
 assign ( resid 80 and name HN )  ( resid 79 and name HG# ) 4.0 3.2 2.0
 assign ( resid 80 and name HA )  ( resid 81 and name HA ) 4.0 2.2 1.0
 assign ( resid 80 and name HA )  ( resid 79 and name HB# ) 4.0 3.2 2.0
 assign ( resid 80 and name HB# )  ( resid 81 and name HA ) 4.0 3.2 2.0
 assign ( resid 81 and name HN )  ( resid 82 and name HB# ) 4.0 3.2 2.0
 assign ( resid 81 and name HN )  ( resid 80 and name HG# ) 3.0 2.5 1.3
 assign ( resid 81 and name HA )  ( resid 80 and name HA ) 4.0 2.2 1.0
 assign ( resid 81 and name HB# )  ( resid 82 and name HA ) 4.0 3.2 2.0
 assign ( resid 81 and name HB# )  ( resid 82 and name HG1# ) 4.0 4.7 3.5
 assign ( resid 81 and name HA )  ( resid 80 and name HB# ) 4.0 3.2 2.0
 assign ( resid 82 and name HN )  ( resid 81 and name HB# ) 3.0 2.2 1.3
 assign ( resid 82 and name HA )  ( resid 81 and name HB# ) 4.0 3.2 2.0
 assign ( resid 83 and name HN )  ( resid 82 and name HB# ) 3.0 2.2 1.3
 assign ( resid 83 and name HN )  ( resid 82 and name HG2# ) 3.0 2.7 1.8
 assign ( resid 83 and name HA )  ( resid 82 and name HA ) 4.0 2.2 1.0
 assign ( resid 83 and name HA )  ( resid 82 and name HG2# ) 4.0 3.7 2.5
 assign ( resid 86 and name HN )  ( resid 85 and name HE# ) 4.0 4.2 3.0
 assign ( resid 84 and name HN )  ( resid 83 and name HD# ) 4.0 4.2 3.0
 assign ( resid 84 and name HN )  ( resid 83 and name HE# ) 4.0 4.2 3.0
 assign ( resid 84 and name HN )  ( resid 83 and name HB# ) 3.0 2.2 1.3
 assign ( resid 84 and name HN )  ( resid 85 and name HB# ) 4.0 3.2 2.0
 assign ( resid 84 and name HA )  ( resid 83 and name HN ) 4.0 2.2 1.0
 assign ( resid 84 and name HB# )  ( resid 85 and name HB# ) 4.0 4.2 3.0
 assign ( resid 85 and name HN )  ( resid 84 and name HB# ) 2.5 1.7 1.2
 assign ( resid 85 and name HA )  ( resid 84 and name HB# ) 4.0 3.2 2.0
 assign ( resid 85 and name HA )  ( resid 84 and name HN ) 4.0 2.2 1.0
 assign ( resid 85 and name HA )  ( resid 84 and name HA ) 4.0 2.2 1.0
 assign ( resid 85 and name HB# )  ( resid 84 and name HN ) 4.0 3.2 2.0
 assign ( resid 85 and name HB# )  ( resid 86 and name HA ) 4.0 3.2 2.0
 assign ( resid 86 and name HN )  ( resid 85 and name HB# ) 4.0 3.2 2.0
 assign ( resid 86 and name HN )  ( resid 85 and name HD# ) 4.0 4.2 3.0
 assign ( resid 86 and name HA )  ( resid 85 and name HA ) 4.0 2.2 1.0
 assign ( resid 87 and name HN )  ( resid 86 and name HB# ) 4.0 3.2 2.0
 assign ( resid 87 and name HN )  ( resid 88 and name HB# ) 4.0 3.2 2.0
 assign ( resid 87 and name HB# )  ( resid 88 and name HA ) 4.0 3.2 2.0
 assign ( resid 87 and name HA )  ( resid 88 and name HA ) 4.0 2.2 1.0
 assign ( resid 88 and name HN )  ( resid 87 and name HB# ) 2.5 1.7 1.2
 assign ( resid 88 and name HN )  ( resid 87 and name HG# ) 4.0 3.2 2.0
 assign ( resid 88 and name HN )  ( resid 89 and name HD# ) 4.0 3.2 2.0
 assign ( resid 88 and name HN )  ( resid 89 and name HG ) 4.0 2.2 1.0
 assign ( resid 88 and name HB# )  ( resid 89 and name HD2# ) 4.0 4.7 3.5
 assign ( resid 88 and name HB# )  ( resid 87 and name HB# ) 4.0 4.2 3.0
 assign ( resid 89 and name HN )  ( resid 88 and name HB# ) 3.0 2.2 1.3
 assign ( resid 89 and name HA )  ( resid 88 and name HG# ) 4.0 3.2 2.0
 assign ( resid 89 and name HA )  ( resid 88 and name HB# ) 4.0 3.2 2.0
 assign ( resid 89 and name HA )  ( resid 88 and name HA ) 4.0 2.2 1.0
 assign ( resid 90 and name HN )  ( resid 89 and name HB# ) 3.0 2.2 1.3
 assign ( resid 90 and name HN )  ( resid 89 and name HD# ) 4.0 3.2 2.0
 assign ( resid 90 and name HN )  ( resid 89 and name HG ) 4.0 2.2 1.0
 assign ( resid 90 and name HA )  ( resid 89 and name HB# ) 4.0 3.2 2.0
 assign ( resid 90 and name HB# )  ( resid 89 and name HA ) 5.0 3.0 2.0
 assign ( resid 90 and name HG# )  ( resid 89 and name HA ) 5.0 3.2 2.0
 assign ( resid 59 and name HN )  ( resid 60 and name HN ) 2.5 0.7 0.6
 assign ( resid 60 and name HN )  ( resid 61 and name HN ) 2.5 0.7 0.6
 assign ( resid 61 and name HN )  ( resid 62 and name HN ) 2.5 0.7 0.6
 assign ( resid 62 and name HN )  ( resid 63 and name HN ) 2.5 0.7 0.6
 assign ( resid 63 and name HN )  ( resid 64 and name HN ) 2.5 0.7 0.6
 assign ( resid 64 and name HN )  ( resid 65 and name HN ) 2.5 0.7 0.6
 assign ( resid 65 and name HN )  ( resid 66 and name HN ) 2.5 0.7 0.6
 assign ( resid 66 and name HN )  ( resid 67 and name HN ) 2.5 0.7 0.6
 assign ( resid 67 and name HN )  ( resid 68 and name HN ) 2.5 0.7 0.6
 assign ( resid 68 and name HN )  ( resid 69 and name HN ) 2.5 0.7 0.6
 assign ( resid 69 and name HN )  ( resid 70 and name HN ) 3.0 1.2 0.5
 assign ( resid 70 and name HN )  ( resid 71 and name HN ) 2.5 0.7 0.6
 assign ( resid 71 and name HN )  ( resid 72 and name HN ) 2.5 0.7 0.6
 assign ( resid 72 and name HN )  ( resid 73 and name HN ) 4.0 2.2 1.0
 assign ( resid 75 and name HN )  ( resid 76 and name HN ) 2.5 0.7 0.6
 assign ( resid 76 and name HN )  ( resid 77 and name HN ) 2.5 0.7 0.6
 assign ( resid 77 and name HN )  ( resid 78 and name HN ) 3.0 1.2 0.5
 assign ( resid 78 and name HN )  ( resid 79 and name HN ) 3.0 1.2 0.5
 assign ( resid 79 and name HN )  ( resid 80 and name HN ) 2.5 0.7 0.6
 assign ( resid 80 and name HN )  ( resid 81 and name HN ) 2.5 0.7 0.6
 assign ( resid 81 and name HN )  ( resid 82 and name HN ) 2.5 0.7 0.6
 assign ( resid 82 and name HN )  ( resid 83 and name HN ) 2.5 0.7 0.6
 assign ( resid 83 and name HN )  ( resid 84 and name HN ) 3.0 1.2 0.5
 assign ( resid 84 and name HN )  ( resid 85 and name HN ) 2.5 0.7 0.6
 assign ( resid 85 and name HN )  ( resid 86 and name HN ) 2.5 0.7 0.6
 assign ( resid 86 and name HN )  ( resid 87 and name HN ) 3.0 1.2 0.5
 assign ( resid 87 and name HN )  ( resid 88 and name HN ) 2.5 0.7 0.6
 assign ( resid 88 and name HN )  ( resid 89 and name HN ) 2.5 0.7 0.6
 assign ( resid 89 and name HN )  ( resid 90 and name HN ) 3.0 1.2 0.5
 assign ( resid 60 and name HN )  ( resid 59 and name HA ) 4.0 2.2 1.0
 assign ( resid 61 and name HN )  ( resid 60 and name HA ) 4.0 2.2 1.0
 assign ( resid 62 and name HN )  ( resid 61 and name HA ) 4.0 2.2 1.0
 assign ( resid 63 and name HN )  ( resid 62 and name HA ) 4.0 2.2 1.0
 assign ( resid 64 and name HN )  ( resid 63 and name HA ) 4.0 2.2 1.0
 assign ( resid 65 and name HN )  ( resid 64 and name HA ) 3.0 1.2 0.3
 assign ( resid 66 and name HN )  ( resid 65 and name HA ) 4.0 2.2 1.0
 assign ( resid 67 and name HN )  ( resid 66 and name HA ) 4.0 2.2 1.0
 assign ( resid 68 and name HN )  ( resid 67 and name HA ) 3.0 1.2 0.3
 assign ( resid 69 and name HN )  ( resid 68 and name HA ) 4.0 2.2 1.0
 assign ( resid 70 and name HN )  ( resid 69 and name HA ) 4.0 2.2 1.0
 assign ( resid 71 and name HN )  ( resid 70 and name HA ) 3.0 1.2 0.3
 assign ( resid 72 and name HN )  ( resid 71 and name HA ) 2.5 0.7 0.2
 assign ( resid 78 and name HN )  ( resid 77 and name HA ) 3.0 1.2 0.3
 assign ( resid 79 and name HN )  ( resid 78 and name HA ) 4.0 2.2 1.0
 assign ( resid 81 and name HN )  ( resid 80 and name HA ) 4.0 2.2 1.0
 assign ( resid 82 and name HN )  ( resid 81 and name HA ) 4.0 2.2 1.0
 assign ( resid 84 and name HN )  ( resid 83 and name HA ) 4.0 2.2 1.0
 assign ( resid 85 and name HN )  ( resid 84 and name HA ) 4.0 2.2 1.0
 assign ( resid 86 and name HN )  ( resid 85 and name HA ) 4.0 2.2 1.0
 assign ( resid 87 and name HN )  ( resid 86 and name HA ) 4.0 2.2 1.0
 assign ( resid 88 and name HN )  ( resid 87 and name HA ) 4.0 2.2 1.0
 assign ( resid 89 and name HN )  ( resid 88 and name HA ) 4.0 2.2 1.0
 assign ( resid 90 and name HN )  ( resid 89 and name HA ) 4.0 2.2 1.0
 assign ( resid 76 and name HN )  ( resid 75 and name HA ) 4.0 2.2 1.0
 assign ( resid 77 and name HN )  ( resid 76 and name HA ) 3.0 1.2 0.3
 assign ( resid 83 and name HN )  ( resid 82 and name HA ) 4.0 2.2 1.0
 assign ( resid 81 and name HN )  ( resid 80 and name HB# ) 4.0 3.2 2.0
 assign ( resid 16 and name HB# )  ( resid 17 and name HG# ) 4.0 4.2 3.0
 assign ( resid 61 and name HB# )  ( resid 62 and name HG# ) 4.0 4.2 3.0
 assign ( resid 17 and name HN )  ( resid 18 and name HD1# ) 3.0 2.7 1.8
 assign ( resid 62 and name HN )  ( resid 63 and name HD1# ) 3.0 2.7 1.8
 assign ( resid 23 and name HB# )  ( resid 22 and name HA ) 4.0 3.2 2.0
 assign ( resid 68 and name HB# )  ( resid 67 and name HA ) 4.0 3.2 2.0
 assign ( resid 34 and name HN )  ( resid 35 and name HB# ) 4.0 3.2 2.0
 assign ( resid 79 and name HN )  ( resid 80 and name HB# ) 4.0 3.2 2.0
 assign ( resid 39 and name HN )  ( resid 40 and name HD# ) 4.0 4.2 3.0
 assign ( resid 84 and name HN )  ( resid 85 and name HD# ) 4.0 4.2 3.0
! intra_sel.awk RES_COUNT is 513
! intra_sel.awk Range:   2 -   5
 assign ( resid 4 and name HG2# )  ( resid 6 and name HG ) 4.0 3.7 2.5
 assign ( resid 6 and name HN )  ( resid 4 and name HG2# ) 5.0 3.5 2.5
 assign ( resid 6 and name HD# )  ( resid 4 and name HG2# ) 4.0 4.7 3.5
 assign ( resid 8 and name HB )  ( resid 10 and name HG ) 4.0 2.2 1.0
 assign ( resid 8 and name HG1# )  ( resid 10 and name HD2# ) 4.0 5.2 4.0
 assign ( resid 10 and name HD1# )  ( resid 14 and name HG2# ) 4.0 5.2 4.0
 assign ( resid 10 and name HG )  ( resid 8 and name HG1# ) 3.0 2.7 1.8
 assign ( resid 10 and name HD1# )  ( resid 15 and name HB# ) 4.0 4.7 3.5
 assign ( resid 10 and name HD# )  ( resid 8 and name HB ) 4.0 3.2 2.0 
 assign ( resid 11 and name HN )  ( resid 14 and name HN ) 4.0 2.2 1.0
 assign ( resid 11 and name HN )  ( resid 14 and name HB ) 4.0 2.2 1.0
 assign ( resid 11 and name HN )  ( resid 14 and name HG2# ) 3.0 2.7 1.8
 assign ( resid 11 and name HN )  ( resid 15 and name HB2 ) 4.0 2.2 1.0
 assign ( resid 11 and name HB# )  ( resid 13 and name HD# ) 4.0 4.2 3.0
 assign ( resid 12 and name HN )  ( resid 14 and name HG2# ) 5.0 3.5 2.5
 assign ( resid 12 and name HN )  ( resid 15 and name HB# ) 5.0 3.0 2.0
 assign ( resid 13 and name HA )  ( resid 17 and name HB# ) 5.0 3.0 2.0
 assign ( resid 13 and name HA )  ( resid 16 and name HB# ) 4.0 3.2 2.0
 assign ( resid 13 and name HA )  ( resid 16 and name HG# ) 3.0 2.2 1.3
 assign ( resid 13 and name HD1 )  ( resid 11 and name HB# ) 4.0 2.2 1.0
 assign ( resid 13 and name HD2 )  ( resid 11 and name HB# ) 4.0 2.2 1.0
 assign ( resid 13 and name HD# )  ( resid 11 and name HA ) 4.0 3.2 2.0
 assign ( resid 14 and name HN )  ( resid 11 and name HB1 ) 4.0 2.2 1.0
 assign ( resid 14 and name HN )  ( resid 11 and name HB2 ) 4.0 2.2 1.0
 assign ( resid 14 and name HN )  ( resid 10 and name HD2# ) 4.0 3.7 2.5
 assign ( resid 14 and name HG2# )  ( resid 10 and name HD2# ) 4.0 5.2 4.0
 assign ( resid 14 and name HG2# )  ( resid 10 and name HB# ) 4.0 4.7 3.5
 assign ( resid 14 and name HG2# )  ( resid 18 and name HD1# ) 4.0 5.2 4.0
 assign ( resid 14 and name HA )  ( resid 17 and name HB# ) 4.0 3.2 2.0
 assign ( resid 14 and name HG2# )  ( resid 11 and name HB# ) 4.0 4.7 3.5
 assign ( resid 15 and name HN )  ( resid 11 and name HN ) 4.0 2.2 1.0
 assign ( resid 15 and name HN )  ( resid 13 and name HB# ) 4.0 3.2 2.0
 assign ( resid 15 and name HN )  ( resid 11 and name HB1 ) 5.0 2.0 1.0
 assign ( resid 15 and name HN )  ( resid 11 and name HB2 ) 5.0 2.0 1.0
 assign ( resid 15 and name HN )  ( resid 10 and name HB# ) 4.0 3.2 2.0
 assign ( resid 15 and name HN )  ( resid 10 and name HD2# ) 4.0 3.7 2.5
 assign ( resid 15 and name HA )  ( resid 10 and name HB# ) 4.0 3.2 2.0
 assign ( resid 15 and name HA )  ( resid 18 and name HG# ) 4.0 3.2 2.0
 assign ( resid 15 and name HA )  ( resid 18 and name HB# ) 4.0 3.2 2.0
 assign ( resid 15 and name HA )  ( resid 10 and name HD1# ) 3.0 2.7 1.8
 assign ( resid 15 and name HA )  ( resid 10 and name HD2# ) 4.0 3.7 2.5
 assign ( resid 15 and name HB# )  ( resid 13 and name HD# ) 5.0 4.0 3.0
 assign ( resid 15 and name HB# )  ( resid 18 and name HN ) 4.0 3.2 2.0
 assign ( resid 15 and name HD# )  ( resid 12 and name HB# ) 5.0 4.0 3.0
 assign ( resid 15 and name HB# )  ( resid 12 and name HA ) 4.0 3.2 2.0
 assign ( resid 16 and name HN )  ( resid 18 and name HB# ) 4.0 3.2 2.0
 assign ( resid 16 and name HN )  ( resid 14 and name HG2# ) 4.0 3.7 2.5
 assign ( resid 16 and name HB# )  ( resid 13 and name HA ) 4.0 3.2 2.0
 assign ( resid 16 and name HG# )  ( resid 13 and name HB# ) 4.0 4.2 3.0
 assign ( resid 16 and name HA )  ( resid 19 and name HB# ) 3.0 2.2 1.3
 assign ( resid 16 and name HA )  ( resid 19 and name HG# ) 4.0 3.2 2.0
 assign ( resid 16 and name HB# )  ( resid 19 and name HN ) 4.0 3.2 2.0
 assign ( resid 17 and name HA )  ( resid 20 and name HN ) 3.0 1.2 0.3
 assign ( resid 17 and name HA )  ( resid 20 and name HA ) 5.0 2.0 1.0
 assign ( resid 17 and name HB# )  ( resid 19 and name HN ) 5.0 3.0 2.0
 assign ( resid 17 and name HB# )  ( resid 14 and name HA ) 3.0 2.2 1.3
 assign ( resid 18 and name HN )  ( resid 15 and name HB# ) 4.0 3.2 2.0
 assign ( resid 18 and name HN )  ( resid 14 and name HG2# ) 4.0 3.7 2.5
 assign ( resid 18 and name HN )  ( resid 16 and name HG# ) 4.0 3.2 2.0
 assign ( resid 18 and name HD1# )  ( resid 21 and name HB# ) 5.0 4.5 3.5
 assign ( resid 18 and name HD1# )  ( resid 15 and name HA ) 4.0 3.7 2.5
 assign ( resid 18 and name HD1# )  ( resid 14 and name HB# ) 4.0 4.7 3.5
 assign ( resid 18 and name HD1# )  ( resid 14 and name HA ) 4.0 3.7 2.5
 assign ( resid 18 and name HB# )  ( resid 15 and name HA ) 3.0 2.2 1.3
 assign ( resid 19 and name HN )  ( resid 17 and name HB# ) 4.0 3.2 2.0
 assign ( resid 19 and name HA )  ( resid 22 and name HB# ) 4.0 3.2 2.0
 assign ( resid 19 and name HD# )  ( resid 22 and name HB# ) 5.0 4.0 3.0
 assign ( resid 19 and name HA )  ( resid 22 and name HB# ) 3.0 2.2 1.3
 assign ( resid 19 and name HD# )  ( resid 16 and name HA ) 4.0 3.2 2.0
 assign ( resid 20 and name HB# )  ( resid 23 and name HB# ) 5.0 4.0 3.0
 assign ( resid 20 and name HB# )  ( resid 17 and name HA ) 3.0 2.2 1.3
 assign ( resid 20 and name HA )  ( resid 23 and name HB# ) 3.0 2.2 1.3
 assign ( resid 21 and name HB# )  ( resid 18 and name HD1# ) 4.0 4.7 3.5
 assign ( resid 21 and name HA )  ( resid 24 and name HB# ) 4.0 3.2 2.0
 assign ( resid 21 and name HB# )  ( resid 18 and name HA ) 3.0 2.2 1.3
 assign ( resid 22 and name HA )  ( resid 27 and name HN ) 4.0 2.2 1.0
 assign ( resid 22 and name HB# )  ( resid 19 and name HA ) 3.0 2.2 1.3
 assign ( resid 22 and name HA )  ( resid 25 and name HG2# ) 3.0 2.7 1.8
 assign ( resid 23 and name HN )  ( resid 26 and name HN ) 4.0 2.2 1.0
 assign ( resid 23 and name HN )  ( resid 25 and name HG2# ) 4.0 3.7 2.5
 assign ( resid 23 and name HA )  ( resid 26 and name HN ) 4.0 2.2 1.0
 assign ( resid 23 and name HB1 )  ( resid 20 and name HA ) 4.0 2.2 1.0
 assign ( resid 23 and name HB2 )  ( resid 20 and name HA ) 4.0 2.2 1.0
 assign ( resid 23 and name HG1 )  ( resid 20 and name HA ) 3.0 1.2 0.3
 assign ( resid 23 and name HG2 )  ( resid 20 and name HA ) 3.0 1.2 0.3
 assign ( resid 23 and name HG1 )  ( resid 20 and name HN ) 4.0 2.2 1.0
 assign ( resid 23 and name HG2 )  ( resid 20 and name HN ) 4.0 2.2 1.0
 assign ( resid 23 and name HB# )  ( resid 19 and name HD# ) 4.0 4.2 3.0
 assign ( resid 23 and name HN )  ( resid 27 and name HN ) 4.0 2.2 1.0
 assign ( resid 23 and name HA )  ( resid 26 and name HA ) 3.0 1.2 0.3
 assign ( resid 24 and name HB# )  ( resid 21 and name HA ) 4.0 3.2 2.0
 assign ( resid 25 and name HN )  ( resid 23 and name HA ) 4.0 2.2 1.0
 assign ( resid 25 and name HG2# )  ( resid 22 and name HB# ) 4.0 4.7 3.5
 assign ( resid 26 and name HN )  ( resid 22 and name HA ) 4.0 2.2 1.0
 assign ( resid 26 and name HN )  ( resid 22 and name HB# ) 4.0 3.2 2.0
 assign ( resid 26 and name HN )  ( resid 24 and name HB# ) 4.0 3.2 2.0
 assign ( resid 26 and name HN )  ( resid 23 and name HB# ) 4.0 3.2 2.0
 assign ( resid 26 and name HB# )  ( resid 23 and name HA ) 5.0 3.0 2.0
 assign ( resid 27 and name HN )  ( resid 22 and name HA ) 3.0 1.2 0.3
 assign ( resid 27 and name HN )  ( resid 22 and name HB# ) 4.0 3.2 2.0
 assign ( resid 27 and name HN )  ( resid 25 and name HG2# ) 3.0 2.7 1.8
 assign ( resid 27 and name HN )  ( resid 25 and name HD# ) 4.0 3.2 2.0
 assign ( resid 27 and name HB# )  ( resid 25 and name HG1# ) 4.0 4.7 3.5
 assign ( resid 27 and name HN )  ( resid 23 and name HA ) 4.0 2.2 1.0
 assign ( resid 28 and name HN )  ( resid 31 and name HA ) 5.0 2.0 1.0
 assign ( resid 28 and name HG2# )  ( resid 30 and name HA ) 4.0 3.7 2.5
 assign ( resid 29 and name HA )  ( resid 32 and name HB# ) 3.0 2.2 1.3
 assign ( resid 30 and name HN )  ( resid 28 and name HA ) 4.0 2.2 1.0
 assign ( resid 30 and name HN )  ( resid 28 and name HB# ) 4.0 3.2 2.0
 assign ( resid 30 and name HA )  ( resid 33 and name HB# ) 3.0 2.2 1.3
 assign ( resid 30 and name HA )  ( resid 33 and name HG2# ) 4.0 3.7 2.5
 assign ( resid 30 and name HA )  ( resid 33 and name HD1# ) 2.5 2.2 1.7
 assign ( resid 30 and name HB# )  ( resid 28 and name HB ) 4.0 3.2 2.0
 assign ( resid 31 and name HN )  ( resid 29 and name HD# ) 4.0 3.2 2.0
 assign ( resid 31 and name HE1 )  ( resid 27 and name HB# ) 4.0 2.2 1.0
 assign ( resid 32 and name HA )  ( resid 35 and name HB# ) 4.0 3.2 2.0
 assign ( resid 32 and name HB# )  ( resid 29 and name HA ) 3.0 2.2 1.3
 assign ( resid 32 and name HB# )  ( resid 35 and name HN ) 5.0 3.0 2.0
 assign ( resid 32 and name HB# )  ( resid 36 and name HN ) 5.0 3.0 2.0
 assign ( resid 32 and name HD1# )  ( resid 36 and name HB# ) 4.0 4.7 3.5
 assign ( resid 32 and name HB# )  ( resid 27 and name HB# ) 4.0 4.2 3.0
 assign ( resid 33 and name HN )  ( resid 35 and name HG# ) 4.0 3.2 2.0
 assign ( resid 33 and name HA )  ( resid 36 and name HB# ) 4.0 3.2 2.0
 assign ( resid 33 and name HD1# )  ( resid 30 and name HB# ) 4.0 4.7 3.5
 assign ( resid 33 and name HD1# )  ( resid 30 and name HA ) 3.0 2.7 1.8
 assign ( resid 33 and name HA )  ( resid 36 and name HN ) 4.0 2.2 1.0
 assign ( resid 33 and name HB# )  ( resid 30 and name HA ) 4.0 3.2 2.0
 assign ( resid 34 and name HN )  ( resid 30 and name HD2 ) 5.0 2.0 1.0
 assign ( resid 34 and name HA )  ( resid 37 and name HB# ) 4.0 3.2 2.0
 assign ( resid 34 and name HA )  ( resid 38 and name HN ) 4.0 2.2 1.0
 assign ( resid 34 and name HG# )  ( resid 30 and name HA ) 5.0 3.0 2.0
 assign ( resid 34 and name HA )  ( resid 37 and name HN ) 4.0 2.2 1.0
 assign ( resid 34 and name HD# )  ( resid 30 and name HA ) 5.0 3.0 2.0
 assign ( resid 35 and name HN )  ( resid 38 and name HE# ) 4.0 4.2 3.0
 assign ( resid 35 and name HN )  ( resid 38 and name HD# ) 4.0 4.2 3.0
 assign ( resid 35 and name HN )  ( resid 33 and name HB# ) 4.0 3.2 2.0
 assign ( resid 35 and name HA )  ( resid 38 and name HB# ) 4.0 3.2 2.0
 assign ( resid 35 and name HA )  ( resid 38 and name HD# ) 4.0 4.2 3.0
 assign ( resid 35 and name HB# )  ( resid 32 and name HA ) 4.0 3.2 2.0
 assign ( resid 36 and name HN )  ( resid 39 and name HB# ) 4.0 3.2 2.0
 assign ( resid 36 and name HN )  ( resid 34 and name HB# ) 4.0 3.2 2.0
 assign ( resid 36 and name HN )  ( resid 32 and name HG ) 5.0 2.0 1.0
 assign ( resid 36 and name HA )  ( resid 39 and name HB# ) 3.0 2.2 1.3
 assign ( resid 36 and name HA )  ( resid 40 and name HB# ) 4.0 3.2 2.0
 assign ( resid 36 and name HB# )  ( resid 40 and name HB# ) 4.0 4.2 3.0
 assign ( resid 36 and name HB# )  ( resid 39 and name HB# ) 4.0 4.2 3.0
 assign ( resid 37 and name HN )  ( resid 35 and name HB# ) 4.0 3.2 2.0
 assign ( resid 37 and name HN )  ( resid 39 and name HB# ) 4.0 3.2 2.0
 assign ( resid 37 and name HN )  ( resid 33 and name HG2# ) 4.0 3.7 2.5
 assign ( resid 37 and name HA )  ( resid 40 and name HB# ) 4.0 3.2 2.0
 assign ( resid 37 and name HB )  ( resid 34 and name HA ) 4.0 2.2 1.0
 assign ( resid 37 and name HG2# ) ( resid 33 and name HB ) 4.0 3.7 2.5
 assign ( resid 37 and name HG2# )  ( resid 40 and name HB# ) 4.0 4.7 3.5
 assign ( resid 38 and name HN )  ( resid 35 and name HB# ) 4.0 3.2 2.0
 assign ( resid 38 and name HN )  ( resid 35 and name HG# ) 4.0 3.2 2.0
 assign ( resid 38 and name HB# )  ( resid 41 and name HB# ) 4.0 4.2 3.0
 assign ( resid 38 and name HA )  ( resid 41 and name HN ) 4.0 2.2 1.0
 assign ( resid 39 and name HN )  ( resid 35 and name HG# ) 4.0 3.0 2.0
 assign ( resid 39 and name HA )  ( resid 42 and name HB# ) 4.0 3.2 2.0
 assign ( resid 39 and name HB1 )  ( resid 41 and name HN ) 4.0 2.2 1.0
 assign ( resid 40 and name HN )  ( resid 38 and name HD# ) 4.0 4.2 3.0
 assign ( resid 40 and name HN )  ( resid 36 and name HB# ) 4.0 3.2 2.0
 assign ( resid 40 and name HN )  ( resid 43 and name HB# ) 4.0 3.2 2.0
 assign ( resid 40 and name HB# )  ( resid 36 and name HB# ) 4.0 4.2 3.0
 assign ( resid 41 and name HN )  ( resid 44 and name HD2# ) 4.0 3.7 2.5
 assign ( resid 41 and name HA )  ( resid 38 and name HA ) 4.0 2.2 1.0
 assign ( resid 41 and name HG )  ( resid 37 and name HA ) 4.0 2.2 1.0
 assign ( resid 42 and name HN )  ( resid 40 and name HD# ) 5.0 4.0 3.0
 assign ( resid 42 and name HN )  ( resid 38 and name HB# ) 4.0 3.2 2.0
 assign ( resid 42 and name HN )  ( resid 39 and name HB# ) 4.0 3.2 2.0
 assign ( resid 42 and name HN )  ( resid 44 and name HG ) 4.0 2.2 1.0
 assign ( resid 43 and name HN )  ( resid 41 and name HB# ) 4.0 3.2 2.0
 assign ( resid 43 and name HN )  ( resid 39 and name HB# ) 4.0 3.2 2.0
 assign ( resid 43 and name HB# )  ( resid 40 and name HA ) 4.0 3.2 2.0
 assign ( resid 44 and name HN )  ( resid 42 and name HB# ) 4.0 3.2 2.0
 assign ( resid 44 and name HG )  ( resid 42 and name HA ) 5.0 2.0 1.0
 assign ( resid 44 and name HD2# )  ( resid 40 and name HE# ) 4.0 5.7 4.5
 assign ( resid 44 and name HD2# )  ( resid 40 and name HD# ) 4.0 5.7 4.5
 assign ( resid 44 and name HD2# ) ( resid 40 and name HB1 ) 4.0 3.2 2.0
 assign ( resid 45 and name HN )  ( resid 42 and name HG# ) 4.0 3.2 2.0
 assign ( resid 45 and name HN )  ( resid 43 and name HB# ) 4.0 3.2 2.0
 assign ( resid 14 and name HN )  ( resid 12 and name HN ) 4.0 2.2 1.0
 assign ( resid 14 and name HN )  ( resid 16 and name HN ) 4.0 2.2 1.0
 assign ( resid 15 and name HN )  ( resid 17 and name HN ) 4.0 2.2 1.0
 assign ( resid 16 and name HN )  ( resid 18 and name HN ) 4.0 2.2 1.0
 assign ( resid 17 and name HN )  ( resid 19 and name HN ) 4.0 2.2 1.0
 assign ( resid 18 and name HN )  ( resid 20 and name HN ) 4.0 2.2 1.0
 assign ( resid 19 and name HN )  ( resid 21 and name HN ) 4.0 2.2 1.0
 assign ( resid 20 and name HN )  ( resid 22 and name HN ) 4.0 2.2 1.0
 assign ( resid 21 and name HN )  ( resid 23 and name HN ) 4.0 2.2 1.0
 assign ( resid 22 and name HN )  ( resid 24 and name HN ) 4.0 2.2 1.0
 assign ( resid 23 and name HN )  ( resid 25 and name HN ) 4.0 2.2 1.0
 assign ( resid 24 and name HN )  ( resid 26 and name HN ) 4.0 2.2 1.0
 assign ( resid 27 and name HN )  ( resid 25 and name HN ) 3.0 1.2 0.5
 assign ( resid 31 and name HN )  ( resid 33 and name HN ) 4.0 2.2 1.0
 assign ( resid 32 and name HN )  ( resid 34 and name HN ) 4.0 2.2 1.0
 assign ( resid 33 and name HN )  ( resid 35 and name HN ) 5.0 2.0 1.0
 assign ( resid 34 and name HN )  ( resid 36 and name HN ) 4.0 2.2 1.0
 assign ( resid 37 and name HN )  ( resid 39 and name HN ) 4.0 2.2 1.0
 assign ( resid 37 and name HN )  ( resid 35 and name HN ) 4.0 2.2 1.0
 assign ( resid 38 and name HN )  ( resid 40 and name HN ) 4.0 2.2 1.0
 assign ( resid 39 and name HN )  ( resid 41 and name HN ) 4.0 2.2 1.0
 assign ( resid 40 and name HN )  ( resid 42 and name HN ) 4.0 2.2 1.0
 assign ( resid 42 and name HN )  ( resid 44 and name HN ) 4.0 2.2 1.0
 assign ( resid 43 and name HN )  ( resid 41 and name HN ) 5.0 2.0 1.0
 assign ( resid 43 and name HN )  ( resid 45 and name HN ) 4.0 2.2 1.0
 assign ( resid 14 and name HN )  ( resid 17 and name HN ) 4.0 2.2 1.0
 assign ( resid 15 and name HN )  ( resid 18 and name HN ) 4.0 2.2 1.0
 assign ( resid 17 and name HN )  ( resid 20 and name HN ) 4.0 2.2 1.0
 assign ( resid 18 and name HN )  ( resid 21 and name HN ) 4.0 2.2 1.0
 assign ( resid 19 and name HN )  ( resid 22 and name HN ) 4.0 2.2 1.0
 assign ( resid 20 and name HN )  ( resid 23 and name HN ) 4.0 2.2 1.0
 assign ( resid 31 and name HN )  ( resid 28 and name HN ) 4.0 2.2 1.0
 assign ( resid 32 and name HN )  ( resid 35 and name HN ) 4.0 2.2 1.0
 assign ( resid 33 and name HN )  ( resid 36 and name HN ) 4.0 2.2 1.0
 assign ( resid 34 and name HN )  ( resid 31 and name HN ) 4.0 2.2 1.0
 assign ( resid 36 and name HN )  ( resid 39 and name HN ) 4.0 2.2 1.0
 assign ( resid 37 and name HN )  ( resid 40 and name HN ) 4.0 2.2 1.0
 assign ( resid 38 and name HN )  ( resid 41 and name HN ) 4.0 2.2 1.0
 assign ( resid 38 and name HN )  ( resid 35 and name HN ) 4.0 2.2 1.0
 assign ( resid 39 and name HN )  ( resid 42 and name HN ) 4.0 2.2 1.0
 assign ( resid 40 and name HN )  ( resid 43 and name HN ) 4.0 2.2 1.0
 assign ( resid 42 and name HN )  ( resid 45 and name HN ) 4.0 2.2 1.0
 assign ( resid 16 and name HN )  ( resid 14 and name HA ) 4.0 2.2 1.0
 assign ( resid 17 and name HN )  ( resid 15 and name HA ) 4.0 2.2 1.0
 assign ( resid 18 and name HN )  ( resid 16 and name HA ) 4.0 2.2 1.0
 assign ( resid 19 and name HN )  ( resid 17 and name HA ) 4.0 2.2 1.0
 assign ( resid 20 and name HN )  ( resid 18 and name HA ) 4.0 2.2 1.0
 assign ( resid 21 and name HN )  ( resid 19 and name HA ) 4.0 2.2 1.0
 assign ( resid 22 and name HN )  ( resid 20 and name HA ) 4.0 2.2 1.0
 assign ( resid 23 and name HN )  ( resid 21 and name HA ) 4.0 2.2 1.0
 assign ( resid 24 and name HN )  ( resid 22 and name HA ) 4.0 2.2 1.0
 assign ( resid 26 and name HN )  ( resid 24 and name HA ) 4.0 2.2 1.0
 assign ( resid 30 and name HN )  ( resid 28 and name HA ) 4.0 2.2 1.0
 assign ( resid 31 and name HN )  ( resid 29 and name HA ) 4.0 2.2 1.0
 assign ( resid 32 and name HN )  ( resid 30 and name HA ) 4.0 2.2 1.0
 assign ( resid 35 and name HN )  ( resid 33 and name HA ) 4.0 2.2 1.0
 assign ( resid 37 and name HN )  ( resid 35 and name HA ) 4.0 2.2 1.0
 assign ( resid 38 and name HN )  ( resid 36 and name HA ) 4.0 2.2 1.0
 assign ( resid 40 and name HN )  ( resid 38 and name HA ) 4.0 2.2 1.0
 assign ( resid 41 and name HN )  ( resid 39 and name HA ) 4.0 2.2 1.0
 assign ( resid 42 and name HN )  ( resid 40 and name HA ) 4.0 2.2 1.0
 assign ( resid 43 and name HN )  ( resid 41 and name HA ) 4.0 2.2 1.0
 assign ( resid 44 and name HN )  ( resid 42 and name HA ) 4.0 2.2 1.0
 assign ( resid 45 and name HN )  ( resid 43 and name HA ) 4.0 2.2 1.0
 assign ( resid 15 and name HN )  ( resid 12 and name HA ) 4.0 2.2 1.0
 assign ( resid 16 and name HN )  ( resid 13 and name HA ) 4.0 2.2 1.0
 assign ( resid 17 and name HN )  ( resid 14 and name HA ) 3.0 1.2 0.3
 assign ( resid 18 and name HN )  ( resid 15 and name HA ) 4.0 2.2 1.0
 assign ( resid 19 and name HN )  ( resid 16 and name HA ) 4.0 2.2 1.0
 assign ( resid 20 and name HN )  ( resid 17 and name HA ) 4.0 2.2 1.0
 assign ( resid 21 and name HN )  ( resid 18 and name HA ) 4.0 2.2 1.0
 assign ( resid 22 and name HN )  ( resid 19 and name HA ) 4.0 2.2 1.0
 assign ( resid 23 and name HN )  ( resid 20 and name HA ) 4.0 2.2 1.0
 assign ( resid 24 and name HN )  ( resid 21 and name HA ) 4.0 2.2 1.0
 assign ( resid 25 and name HN )  ( resid 22 and name HA ) 4.0 2.2 1.0
 assign ( resid 33 and name HN )  ( resid 30 and name HA ) 4.0 2.2 1.0
 assign ( resid 38 and name HN )  ( resid 35 and name HA ) 4.0 2.2 1.0
 assign ( resid 39 and name HN )  ( resid 36 and name HA ) 4.0 2.2 1.0
 assign ( resid 40 and name HN )  ( resid 37 and name HA ) 3.0 1.2 0.3
 assign ( resid 41 and name HN )  ( resid 38 and name HA ) 4.0 2.2 1.0
 assign ( resid 42 and name HN )  ( resid 39 and name HA ) 4.0 2.2 1.0
 assign ( resid 43 and name HN )  ( resid 40 and name HA ) 4.0 2.2 1.0
 assign ( resid 44 and name HN )  ( resid 41 and name HA ) 4.0 2.2 1.0
 assign ( resid 45 and name HN )  ( resid 42 and name HA ) 4.0 2.2 1.0
 assign ( resid 16 and name HN )  ( resid 12 and name HA ) 4.0 2.2 1.0
 assign ( resid 17 and name HN )  ( resid 13 and name HA ) 4.0 2.2 1.0
 assign ( resid 18 and name HN )  ( resid 14 and name HA ) 4.0 2.2 1.0
 assign ( resid 19 and name HN )  ( resid 15 and name HA ) 4.0 2.2 1.0
 assign ( resid 20 and name HN )  ( resid 16 and name HA ) 4.0 2.2 1.0
 assign ( resid 21 and name HN )  ( resid 17 and name HA ) 4.0 2.2 1.0
 assign ( resid 22 and name HN )  ( resid 18 and name HA ) 4.0 2.2 1.0
 assign ( resid 23 and name HN )  ( resid 19 and name HA ) 4.0 2.2 1.0
 assign ( resid 24 and name HN )  ( resid 20 and name HA ) 4.0 2.2 1.0
 assign ( resid 25 and name HN )  ( resid 21 and name HA ) 4.0 2.2 1.0
 assign ( resid 26 and name HN )  ( resid 22 and name HA ) 4.0 2.2 1.0
 assign ( resid 33 and name HN )  ( resid 29 and name HA ) 4.0 2.2 1.0
 assign ( resid 39 and name HN )  ( resid 35 and name HA ) 4.0 2.2 1.0
 assign ( resid 40 and name HN )  ( resid 36 and name HA ) 4.0 2.2 1.0
 assign ( resid 42 and name HN )  ( resid 38 and name HA ) 4.0 2.2 1.0
 assign ( resid 43 and name HN )  ( resid 39 and name HA ) 4.0 2.2 1.0
 assign ( resid 44 and name HN )  ( resid 40 and name HA ) 4.0 2.2 1.0
 assign ( resid 45 and name HN )  ( resid 41 and name HA ) 4.0 2.2 1.0
 assign ( resid 34 and name HN )  ( resid 30 and name HA ) 4.0 2.2 1.0
 assign ( resid 33 and name HN )  ( resid 31 and name HA ) 4.0 2.2 1.0
 assign ( resid 34 and name HN )  ( resid 31 and name HA ) 4.0 2.2 1.0
 assign ( resid 34 and name HN )  ( resid 32 and name HA ) 4.0 2.2 1.0
 assign ( resid 35 and name HN )  ( resid 31 and name HA ) 4.0 2.2 1.0
 assign ( resid 38 and name HN )  ( resid 34 and name HA ) 4.0 2.2 1.0
 assign ( resid 37 and name HN )  ( resid 34 and name HA ) 4.0 2.2 1.0
 assign ( resid 37 and name HN )  ( resid 33 and name HA ) 4.0 2.2 1.0
 assign ( resid 36 and name HN )  ( resid 32 and name HA ) 4.0 2.2 1.0
 assign ( resid 36 and name HN )  ( resid 33 and name HA ) 4.0 2.2 1.0
 assign ( resid 36 and name HN )  ( resid 34 and name HA ) 4.0 2.2 1.0
 assign ( resid 35 and name HN )  ( resid 32 and name HA ) 4.0 2.2 1.0
 assign ( resid 39 and name HN )  ( resid 37 and name HA ) 4.0 2.2 1.0
 assign ( resid 33 and name HN )  ( resid 30 and name HB# ) 4.0 3.2 2.0
 assign ( resid 36 and name HN )  ( resid 33 and name HB# ) 4.0 3.2 2.0
 assign ( resid 37 and name HN )  ( resid 34 and name HB# ) 4.0 3.2 2.0
 assign ( resid 49 and name HG2# )  ( resid 51 and name HG ) 4.0 3.7 2.5
 assign ( resid 51 and name HN )  ( resid 49 and name HG2# ) 5.0 3.5 2.5
 assign ( resid 51 and name HD# )  ( resid 49 and name HG2# ) 4.0 4.7 3.5
 assign ( resid 53 and name HB )  ( resid 55 and name HG ) 4.0 2.2 1.0
 assign ( resid 53 and name HG1# )  ( resid 55 and name HD2# ) 4.0 5.2 4.0
 assign ( resid 55 and name HD1# )  ( resid 59 and name HG2# ) 4.0 5.2 4.0
 assign ( resid 55 and name HG )  ( resid 53 and name HG1# ) 3.0 2.7 1.8
 assign ( resid 55 and name HD1# )  ( resid 60 and name HB# ) 4.0 4.7 3.5
 assign ( resid 55 and name HD# )  ( resid 53 and name HB ) 4.0 3.2 2.0
 assign ( resid 56 and name HN )  ( resid 59 and name HN ) 4.0 2.2 1.0
 assign ( resid 56 and name HN )  ( resid 59 and name HB ) 4.0 2.2 1.0
 assign ( resid 56 and name HN )  ( resid 59 and name HG2# ) 3.0 2.7 1.8
 assign ( resid 56 and name HN )  ( resid 60 and name HB2 ) 4.0 2.2 1.0
 assign ( resid 56 and name HB# )  ( resid 58 and name HD# ) 4.0 4.2 3.0
 assign ( resid 57 and name HN )  ( resid 59 and name HG2# ) 5.0 3.5 2.5
 assign ( resid 57 and name HN )  ( resid 60 and name HB# ) 5.0 3.0 2.0
 assign ( resid 58 and name HA )  ( resid 62 and name HB# ) 5.0 3.0 2.0
 assign ( resid 58 and name HA )  ( resid 61 and name HB# ) 4.0 3.2 2.0
 assign ( resid 58 and name HA )  ( resid 61 and name HG# ) 3.0 2.2 1.3
 assign ( resid 58 and name HD1 )  ( resid 56 and name HB# ) 4.0 2.2 1.0
 assign ( resid 58 and name HD2 )  ( resid 56 and name HB# ) 4.0 2.2 1.0
 assign ( resid 58 and name HD# )  ( resid 56 and name HA ) 4.0 3.2 2.0
 assign ( resid 59 and name HN )  ( resid 56 and name HB1 ) 4.0 2.2 1.0
 assign ( resid 59 and name HN )  ( resid 56 and name HB2 ) 4.0 2.2 1.0
 assign ( resid 59 and name HN )  ( resid 55 and name HD2# ) 4.0 3.7 2.5
 assign ( resid 59 and name HG2# )  ( resid 55 and name HD2# ) 4.0 5.2 4.0
 assign ( resid 59 and name HG2# )  ( resid 55 and name HB# ) 4.0 4.7 3.5
 assign ( resid 59 and name HG2# )  ( resid 63 and name HD1# ) 4.0 5.2 4.0
 assign ( resid 59 and name HA )  ( resid 62 and name HB# ) 4.0 3.2 2.0
 assign ( resid 59 and name HG2# )  ( resid 56 and name HB# ) 4.0 4.7 3.5
 assign ( resid 60 and name HN )  ( resid 56 and name HN ) 4.0 2.2 1.0
 assign ( resid 60 and name HN )  ( resid 58 and name HB# ) 4.0 3.2 2.0
 assign ( resid 60 and name HN )  ( resid 56 and name HB1 ) 5.0 2.0 1.0
 assign ( resid 60 and name HN )  ( resid 56 and name HB2 ) 5.0 2.0 1.0
 assign ( resid 60 and name HN )  ( resid 55 and name HB# ) 4.0 3.2 2.0
 assign ( resid 60 and name HN )  ( resid 55 and name HD2# ) 4.0 3.7 2.5
 assign ( resid 60 and name HA )  ( resid 55 and name HB# ) 4.0 3.2 2.0
 assign ( resid 60 and name HA )  ( resid 63 and name HG# ) 4.0 3.2 2.0
 assign ( resid 60 and name HA )  ( resid 63 and name HB# ) 4.0 3.2 2.0
 assign ( resid 60 and name HA )  ( resid 55 and name HD1# ) 3.0 2.7 1.8
 assign ( resid 60 and name HA )  ( resid 55 and name HD2# ) 4.0 3.7 2.5
 assign ( resid 60 and name HB# )  ( resid 58 and name HD# ) 5.0 4.0 3.0
 assign ( resid 60 and name HB# )  ( resid 63 and name HN ) 4.0 3.2 2.0
 assign ( resid 60 and name HD# )  ( resid 57 and name HB# ) 5.0 4.0 3.0
 assign ( resid 60 and name HB# )  ( resid 57 and name HA ) 4.0 3.2 2.0
 assign ( resid 61 and name HN )  ( resid 63 and name HB# ) 4.0 3.2 2.0
 assign ( resid 61 and name HN )  ( resid 59 and name HG2# ) 4.0 3.7 2.5
 assign ( resid 61 and name HB# )  ( resid 58 and name HA ) 4.0 3.2 2.0
 assign ( resid 61 and name HG# )  ( resid 58 and name HB# ) 4.0 4.2 3.0
 assign ( resid 61 and name HA )  ( resid 64 and name HB# ) 3.0 2.2 1.3
 assign ( resid 61 and name HA )  ( resid 64 and name HG# ) 4.0 3.2 2.0
 assign ( resid 61 and name HB# )  ( resid 64 and name HN ) 4.0 3.2 2.0
 assign ( resid 62 and name HA )  ( resid 65 and name HN ) 3.0 1.2 0.3
 assign ( resid 62 and name HA )  ( resid 65 and name HA ) 5.0 2.0 1.0
 assign ( resid 62 and name HB# )  ( resid 64 and name HN ) 5.0 3.0 2.0
 assign ( resid 62 and name HB# )  ( resid 59 and name HA ) 3.0 2.2 1.3
 assign ( resid 63 and name HN )  ( resid 60 and name HB# ) 4.0 3.2 2.0
 assign ( resid 63 and name HN )  ( resid 59 and name HG2# ) 4.0 3.7 2.5
 assign ( resid 63 and name HN )  ( resid 61 and name HG# ) 4.0 3.2 2.0
 assign ( resid 63 and name HD1# )  ( resid 66 and name HB# ) 5.0 4.5 3.5
 assign ( resid 63 and name HD1# )  ( resid 60 and name HA ) 4.0 3.7 2.5
 assign ( resid 63 and name HD1# )  ( resid 59 and name HB# ) 4.0 4.7 3.5
 assign ( resid 63 and name HD1# )  ( resid 59 and name HA ) 4.0 3.7 2.5
 assign ( resid 63 and name HB# )  ( resid 60 and name HA ) 3.0 2.2 1.3
 assign ( resid 64 and name HN )  ( resid 62 and name HB# ) 4.0 3.2 2.0
 assign ( resid 64 and name HA )  ( resid 67 and name HB# ) 4.0 3.2 2.0
 assign ( resid 64 and name HD# )  ( resid 67 and name HB# ) 5.0 4.0 3.0
 assign ( resid 64 and name HA )  ( resid 67 and name HB# ) 3.0 2.2 1.3
 assign ( resid 64 and name HD# )  ( resid 61 and name HA ) 4.0 3.2 2.0
 assign ( resid 65 and name HB# )  ( resid 68 and name HB# ) 5.0 4.0 3.0
 assign ( resid 65 and name HB# )  ( resid 62 and name HA ) 3.0 2.2 1.3
 assign ( resid 65 and name HA )  ( resid 68 and name HB# ) 3.0 2.2 1.3
 assign ( resid 66 and name HB# )  ( resid 63 and name HD1# ) 4.0 4.7 3.5
 assign ( resid 66 and name HA )  ( resid 69 and name HB# ) 4.0 3.2 2.0
 assign ( resid 66 and name HB# )  ( resid 63 and name HA ) 3.0 2.2 1.3
 assign ( resid 67 and name HA )  ( resid 72 and name HN ) 4.0 2.2 1.0
 assign ( resid 67 and name HB# )  ( resid 64 and name HA ) 3.0 2.2 1.3
 assign ( resid 67 and name HA )  ( resid 70 and name HG2# ) 3.0 2.7 1.8
 assign ( resid 68 and name HN )  ( resid 71 and name HN ) 4.0 2.2 1.0
 assign ( resid 68 and name HN )  ( resid 70 and name HG2# ) 4.0 3.7 2.5
 assign ( resid 68 and name HA )  ( resid 71 and name HN ) 4.0 2.2 1.0
 assign ( resid 68 and name HB1 )  ( resid 65 and name HA ) 4.0 2.2 1.0
 assign ( resid 68 and name HB2 )  ( resid 65 and name HA ) 4.0 2.2 1.0
 assign ( resid 68 and name HG1 )  ( resid 65 and name HA ) 3.0 1.2 0.3
 assign ( resid 68 and name HG2 )  ( resid 65 and name HA ) 3.0 1.2 0.3
 assign ( resid 68 and name HG1 )  ( resid 65 and name HN ) 4.0 2.2 1.0
 assign ( resid 68 and name HG2 )  ( resid 65 and name HN ) 4.0 2.2 1.0
 assign ( resid 68 and name HB# )  ( resid 64 and name HD# ) 4.0 4.2 3.0
 assign ( resid 68 and name HN )  ( resid 72 and name HN ) 4.0 2.2 1.0
 assign ( resid 68 and name HA )  ( resid 71 and name HA ) 3.0 1.2 0.3
 assign ( resid 69 and name HB# )  ( resid 66 and name HA ) 4.0 3.2 2.0
 assign ( resid 70 and name HN )  ( resid 68 and name HA ) 4.0 2.2 1.0
 assign ( resid 70 and name HG2# )  ( resid 67 and name HB# ) 4.0 4.7 3.5
 assign ( resid 71 and name HN )  ( resid 67 and name HA ) 4.0 2.2 1.0
 assign ( resid 71 and name HN )  ( resid 67 and name HB# ) 4.0 3.2 2.0
 assign ( resid 71 and name HN )  ( resid 69 and name HB# ) 4.0 3.2 2.0
 assign ( resid 71 and name HN )  ( resid 68 and name HB# ) 4.0 3.2 2.0
 assign ( resid 71 and name HB# )  ( resid 68 and name HA ) 5.0 3.0 2.0
 assign ( resid 72 and name HN )  ( resid 67 and name HA ) 3.0 1.2 0.3
 assign ( resid 72 and name HN )  ( resid 67 and name HB# ) 4.0 3.2 2.0
 assign ( resid 72 and name HN )  ( resid 70 and name HG2# ) 3.0 2.7 1.8
 assign ( resid 72 and name HN )  ( resid 70 and name HD# ) 4.0 3.2 2.0
 assign ( resid 72 and name HB# )  ( resid 70 and name HG1# ) 4.0 4.7 3.5
 assign ( resid 72 and name HN )  ( resid 68 and name HA ) 4.0 2.2 1.0
 assign ( resid 73 and name HN )  ( resid 76 and name HA ) 5.0 2.0 1.0
 assign ( resid 73 and name HG2# )  ( resid 75 and name HA ) 4.0 3.7 2.5
 assign ( resid 74 and name HA )  ( resid 77 and name HB# ) 3.0 2.2 1.3
 assign ( resid 75 and name HN )  ( resid 73 and name HA ) 4.0 2.2 1.0
 assign ( resid 75 and name HN )  ( resid 73 and name HB# ) 4.0 3.2 2.0
 assign ( resid 75 and name HA )  ( resid 78 and name HB# ) 3.0 2.2 1.3
 assign ( resid 75 and name HA )  ( resid 78 and name HG2# ) 4.0 3.7 2.5
 assign ( resid 75 and name HA )  ( resid 78 and name HD1# ) 2.5 2.2 1.7
 assign ( resid 75 and name HB# )  ( resid 73 and name HB ) 4.0 3.2 2.0
 assign ( resid 76 and name HN )  ( resid 74 and name HD# ) 4.0 3.2 2.0
 assign ( resid 76 and name HE1 )  ( resid 72 and name HB# ) 4.0 2.2 1.0
 assign ( resid 77 and name HA )  ( resid 80 and name HB# ) 4.0 3.2 2.0
 assign ( resid 77 and name HB# )  ( resid 74 and name HA ) 3.0 2.2 1.3
 assign ( resid 77 and name HB# )  ( resid 80 and name HN ) 5.0 3.0 2.0
 assign ( resid 77 and name HB# )  ( resid 81 and name HN ) 5.0 3.0 2.0
 assign ( resid 77 and name HD1# )  ( resid 81 and name HB# ) 4.0 4.7 3.5
 assign ( resid 77 and name HB# )  ( resid 72 and name HB# ) 4.0 4.2 3.0
 assign ( resid 78 and name HN )  ( resid 80 and name HG# ) 4.0 3.2 2.0
 assign ( resid 78 and name HA )  ( resid 81 and name HB# ) 4.0 3.2 2.0
 assign ( resid 78 and name HD1# )  ( resid 75 and name HB# ) 4.0 4.7 3.5
 assign ( resid 78 and name HD1# )  ( resid 75 and name HA ) 3.0 2.7 1.8
 assign ( resid 78 and name HA )  ( resid 81 and name HN ) 4.0 2.2 1.0
 assign ( resid 78 and name HB# )  ( resid 75 and name HA ) 4.0 3.2 2.0
 assign ( resid 79 and name HN )  ( resid 75 and name HD2 ) 5.0 2.0 1.0
 assign ( resid 79 and name HA )  ( resid 82 and name HB# ) 4.0 3.2 2.0
 assign ( resid 79 and name HA )  ( resid 83 and name HN ) 4.0 2.2 1.0
 assign ( resid 79 and name HG# )  ( resid 75 and name HA ) 5.0 3.0 2.0
 assign ( resid 79 and name HA )  ( resid 82 and name HN ) 4.0 2.2 1.0
 assign ( resid 79 and name HD# )  ( resid 75 and name HA ) 5.0 3.0 2.0
 assign ( resid 80 and name HN )  ( resid 83 and name HE# ) 4.0 4.2 3.0
 assign ( resid 80 and name HN )  ( resid 83 and name HD# ) 4.0 4.2 3.0
 assign ( resid 80 and name HN )  ( resid 78 and name HB# ) 4.0 3.2 2.0
 assign ( resid 80 and name HA )  ( resid 83 and name HB# ) 4.0 3.2 2.0
 assign ( resid 80 and name HA )  ( resid 83 and name HD# ) 4.0 4.2 3.0
 assign ( resid 80 and name HB# )  ( resid 77 and name HA ) 4.0 3.2 2.0
 assign ( resid 81 and name HN )  ( resid 84 and name HB# ) 4.0 3.2 2.0
 assign ( resid 81 and name HN )  ( resid 77 and name HG ) 5.0 2.0 1.0
 assign ( resid 81 and name HN )  ( resid 79 and name HB# ) 4.0 3.2 2.0
 assign ( resid 81 and name HA )  ( resid 84 and name HB# ) 3.0 2.2 1.3
 assign ( resid 81 and name HA )  ( resid 85 and name HB# ) 4.0 3.2 2.0
 assign ( resid 81 and name HB# )  ( resid 85 and name HB# ) 4.0 4.2 3.0
 assign ( resid 81 and name HB# )  ( resid 84 and name HB# ) 4.0 4.2 3.0
 assign ( resid 82 and name HN )  ( resid 80 and name HB# ) 4.0 3.2 2.0
 assign ( resid 82 and name HN )  ( resid 84 and name HB# ) 4.0 3.2 2.0
 assign ( resid 82 and name HN )  ( resid 78 and name HG2# ) 4.0 3.7 2.5
 assign ( resid 82 and name HA )  ( resid 85 and name HB# ) 4.0 3.2 2.0
 assign ( resid 82 and name HB )  ( resid 79 and name HA ) 4.0 2.2 1.0
 assign ( resid 82 and name HG2# )  ( resid 85 and name HB# ) 4.0 4.7 3.5
 assign ( resid 83 and name HN )  ( resid 80 and name HB# ) 4.0 3.2 2.0
 assign ( resid 83 and name HN )  ( resid 80 and name HG# ) 4.0 3.2 2.0
 assign ( resid 83 and name HB# )  ( resid 86 and name HB# ) 4.0 4.2 3.0
 assign ( resid 83 and name HA )  ( resid 86 and name HN ) 4.0 2.2 1.0
 assign ( resid 84 and name HN )  ( resid 80 and name HG# ) 4.0 3.2 2.0
 assign ( resid 84 and name HA )  ( resid 87 and name HB# ) 4.0 3.2 2.0
 assign ( resid 84 and name HB1 )  ( resid 86 and name HN ) 4.0 2.2 1.0
 assign ( resid 85 and name HN )  ( resid 83 and name HD# ) 4.0 4.2 3.0
 assign ( resid 85 and name HN )  ( resid 81 and name HB# ) 4.0 3.2 2.0
 assign ( resid 85 and name HN )  ( resid 88 and name HB# ) 4.0 3.2 2.0
 assign ( resid 85 and name HB# )  ( resid 81 and name HB# ) 4.0 4.2 3.0
 assign ( resid 86 and name HN )  ( resid 89 and name HD2# ) 4.0 3.7 2.5
 assign ( resid 86 and name HA )  ( resid 83 and name HA ) 4.0 2.2 1.0
 assign ( resid 86 and name HG )  ( resid 82 and name HA ) 4.0 2.2 1.0
 assign ( resid 87 and name HN )  ( resid 85 and name HD# ) 5.0 4.0 3.0
 assign ( resid 87 and name HN )  ( resid 83 and name HB# ) 4.0 3.2 2.0
 assign ( resid 87 and name HN )  ( resid 84 and name HB# ) 4.0 3.2 2.0
 assign ( resid 87 and name HN )  ( resid 89 and name HG ) 4.0 2.2 1.0
 assign ( resid 88 and name HN )  ( resid 86 and name HB# ) 4.0 3.2 2.0
 assign ( resid 88 and name HN )  ( resid 84 and name HB# ) 4.0 3.2 2.0
 assign ( resid 88 and name HB# )  ( resid 85 and name HA ) 4.0 3.2 2.0
 assign ( resid 89 and name HN )  ( resid 87 and name HB# ) 4.0 3.2 2.0
 assign ( resid 89 and name HG )  ( resid 87 and name HA ) 5.0 2.0 1.0
 assign ( resid 89 and name HD2# )  ( resid 85 and name HE# ) 4.0 5.7 4.5
 assign ( resid 89 and name HD2# )  ( resid 85 and name HD# ) 4.0 5.7 4.5
 assign ( resid 89 and name HD2# )  ( resid 85 and name HB1 ) 4.0 3.2 2.0
 assign ( resid 90 and name HN )  ( resid 87 and name HG# ) 4.0 3.2 2.0
 assign ( resid 90 and name HN )  ( resid 88 and name HB# ) 4.0 3.2 2.0
 assign ( resid 59 and name HN )  ( resid 57 and name HN ) 4.0 2.2 1.0
 assign ( resid 59 and name HN )  ( resid 61 and name HN ) 4.0 2.2 1.0
 assign ( resid 60 and name HN )  ( resid 62 and name HN ) 4.0 2.2 1.0
 assign ( resid 61 and name HN )  ( resid 63 and name HN ) 4.0 2.2 1.0
 assign ( resid 62 and name HN )  ( resid 64 and name HN ) 4.0 2.2 1.0
 assign ( resid 63 and name HN )  ( resid 65 and name HN ) 4.0 2.2 1.0
 assign ( resid 64 and name HN )  ( resid 66 and name HN ) 4.0 2.2 1.0
 assign ( resid 65 and name HN )  ( resid 67 and name HN ) 4.0 2.2 1.0
 assign ( resid 66 and name HN )  ( resid 68 and name HN ) 4.0 2.2 1.0
 assign ( resid 67 and name HN )  ( resid 69 and name HN ) 4.0 2.2 1.0
 assign ( resid 68 and name HN )  ( resid 70 and name HN ) 4.0 2.2 1.0
 assign ( resid 69 and name HN )  ( resid 71 and name HN ) 4.0 2.2 1.0
 assign ( resid 72 and name HN )  ( resid 70 and name HN ) 3.0 1.2 0.5
 assign ( resid 76 and name HN )  ( resid 78 and name HN ) 4.0 2.2 1.0
 assign ( resid 77 and name HN )  ( resid 79 and name HN ) 4.0 2.2 1.0
 assign ( resid 78 and name HN )  ( resid 80 and name HN ) 5.0 2.0 1.0
 assign ( resid 79 and name HN )  ( resid 81 and name HN ) 4.0 2.2 1.0
 assign ( resid 82 and name HN )  ( resid 84 and name HN ) 4.0 2.2 1.0
 assign ( resid 82 and name HN )  ( resid 80 and name HN ) 4.0 2.2 1.0
 assign ( resid 83 and name HN )  ( resid 85 and name HN ) 4.0 2.2 1.0
 assign ( resid 84 and name HN )  ( resid 86 and name HN ) 4.0 2.2 1.0
 assign ( resid 85 and name HN )  ( resid 87 and name HN ) 4.0 2.2 1.0
 assign ( resid 87 and name HN )  ( resid 89 and name HN ) 4.0 2.2 1.0
 assign ( resid 88 and name HN )  ( resid 86 and name HN ) 5.0 2.0 1.0
 assign ( resid 88 and name HN )  ( resid 90 and name HN ) 4.0 2.2 1.0
 assign ( resid 59 and name HN )  ( resid 62 and name HN ) 4.0 2.2 1.0
 assign ( resid 60 and name HN )  ( resid 63 and name HN ) 4.0 2.2 1.0
 assign ( resid 62 and name HN )  ( resid 65 and name HN ) 4.0 2.2 1.0
 assign ( resid 63 and name HN )  ( resid 66 and name HN ) 4.0 2.2 1.0
 assign ( resid 64 and name HN )  ( resid 67 and name HN ) 4.0 2.2 1.0
 assign ( resid 65 and name HN )  ( resid 68 and name HN ) 4.0 2.2 1.0
 assign ( resid 76 and name HN )  ( resid 73 and name HN ) 4.0 2.2 1.0
 assign ( resid 77 and name HN )  ( resid 80 and name HN ) 4.0 2.2 1.0
 assign ( resid 78 and name HN )  ( resid 81 and name HN ) 4.0 2.2 1.0
 assign ( resid 79 and name HN )  ( resid 76 and name HN ) 4.0 2.2 1.0
 assign ( resid 81 and name HN )  ( resid 84 and name HN ) 4.0 2.2 1.0
 assign ( resid 82 and name HN )  ( resid 85 and name HN ) 4.0 2.2 1.0
 assign ( resid 83 and name HN )  ( resid 86 and name HN ) 4.0 2.2 1.0
 assign ( resid 83 and name HN )  ( resid 80 and name HN ) 4.0 2.2 1.0
 assign ( resid 84 and name HN )  ( resid 87 and name HN ) 4.0 2.2 1.0
 assign ( resid 85 and name HN )  ( resid 88 and name HN ) 4.0 2.2 1.0
 assign ( resid 87 and name HN )  ( resid 90 and name HN ) 4.0 2.2 1.0
 assign ( resid 61 and name HN )  ( resid 59 and name HA ) 4.0 2.2 1.0
 assign ( resid 62 and name HN )  ( resid 60 and name HA ) 4.0 2.2 1.0
 assign ( resid 63 and name HN )  ( resid 61 and name HA ) 4.0 2.2 1.0
 assign ( resid 64 and name HN )  ( resid 62 and name HA ) 4.0 2.2 1.0
 assign ( resid 65 and name HN )  ( resid 63 and name HA ) 4.0 2.2 1.0
 assign ( resid 66 and name HN )  ( resid 64 and name HA ) 4.0 2.2 1.0
 assign ( resid 67 and name HN )  ( resid 65 and name HA ) 4.0 2.2 1.0
 assign ( resid 68 and name HN )  ( resid 66 and name HA ) 4.0 2.2 1.0
 assign ( resid 69 and name HN )  ( resid 67 and name HA ) 4.0 2.2 1.0
 assign ( resid 71 and name HN )  ( resid 69 and name HA ) 4.0 2.2 1.0
 assign ( resid 75 and name HN )  ( resid 73 and name HA ) 4.0 2.2 1.0
 assign ( resid 76 and name HN )  ( resid 74 and name HA ) 4.0 2.2 1.0
 assign ( resid 77 and name HN )  ( resid 75 and name HA ) 4.0 2.2 1.0
 assign ( resid 80 and name HN )  ( resid 78 and name HA ) 4.0 2.2 1.0
 assign ( resid 82 and name HN )  ( resid 80 and name HA ) 4.0 2.2 1.0
 assign ( resid 83 and name HN )  ( resid 81 and name HA ) 4.0 2.2 1.0
 assign ( resid 85 and name HN )  ( resid 83 and name HA ) 4.0 2.2 1.0
 assign ( resid 86 and name HN )  ( resid 84 and name HA ) 4.0 2.2 1.0
 assign ( resid 87 and name HN )  ( resid 85 and name HA ) 4.0 2.2 1.0
 assign ( resid 88 and name HN )  ( resid 86 and name HA ) 4.0 2.2 1.0
 assign ( resid 89 and name HN )  ( resid 87 and name HA ) 4.0 2.2 1.0
 assign ( resid 90 and name HN )  ( resid 88 and name HA ) 4.0 2.2 1.0
 assign ( resid 60 and name HN )  ( resid 57 and name HA ) 4.0 2.2 1.0
 assign ( resid 61 and name HN )  ( resid 58 and name HA ) 4.0 2.2 1.0
 assign ( resid 62 and name HN )  ( resid 59 and name HA ) 3.0 1.2 0.3
 assign ( resid 63 and name HN )  ( resid 60 and name HA ) 4.0 2.2 1.0
 assign ( resid 64 and name HN )  ( resid 61 and name HA ) 4.0 2.2 1.0
 assign ( resid 65 and name HN )  ( resid 62 and name HA ) 4.0 2.2 1.0
 assign ( resid 66 and name HN )  ( resid 63 and name HA ) 4.0 2.2 1.0
 assign ( resid 67 and name HN )  ( resid 64 and name HA ) 4.0 2.2 1.0
 assign ( resid 68 and name HN )  ( resid 65 and name HA ) 4.0 2.2 1.0
 assign ( resid 69 and name HN )  ( resid 66 and name HA ) 4.0 2.2 1.0
 assign ( resid 70 and name HN )  ( resid 67 and name HA ) 4.0 2.2 1.0
 assign ( resid 78 and name HN )  ( resid 75 and name HA ) 4.0 2.2 1.0
 assign ( resid 83 and name HN )  ( resid 80 and name HA ) 4.0 2.2 1.0
 assign ( resid 84 and name HN )  ( resid 81 and name HA ) 4.0 2.2 1.0
 assign ( resid 85 and name HN )  ( resid 82 and name HA ) 3.0 1.2 0.3
 assign ( resid 86 and name HN )  ( resid 83 and name HA ) 4.0 2.2 1.0
 assign ( resid 87 and name HN )  ( resid 84 and name HA ) 4.0 2.2 1.0
 assign ( resid 88 and name HN )  ( resid 85 and name HA ) 4.0 2.2 1.0
 assign ( resid 89 and name HN )  ( resid 86 and name HA ) 4.0 2.2 1.0
 assign ( resid 90 and name HN )  ( resid 87 and name HA ) 4.0 2.2 1.0
 assign ( resid 61 and name HN )  ( resid 57 and name HA ) 4.0 2.2 1.0
 assign ( resid 62 and name HN )  ( resid 58 and name HA ) 4.0 2.2 1.0
 assign ( resid 63 and name HN )  ( resid 59 and name HA ) 4.0 2.2 1.0
 assign ( resid 64 and name HN )  ( resid 60 and name HA ) 4.0 2.2 1.0
 assign ( resid 65 and name HN )  ( resid 61 and name HA ) 4.0 2.2 1.0
 assign ( resid 66 and name HN )  ( resid 62 and name HA ) 4.0 2.2 1.0
 assign ( resid 67 and name HN )  ( resid 63 and name HA ) 4.0 2.2 1.0
 assign ( resid 68 and name HN )  ( resid 64 and name HA ) 4.0 2.2 1.0
 assign ( resid 69 and name HN )  ( resid 65 and name HA ) 4.0 2.2 1.0
 assign ( resid 70 and name HN )  ( resid 66 and name HA ) 4.0 2.2 1.0
 assign ( resid 71 and name HN )  ( resid 67 and name HA ) 4.0 2.2 1.0
 assign ( resid 78 and name HN )  ( resid 74 and name HA ) 4.0 2.2 1.0
 assign ( resid 84 and name HN )  ( resid 80 and name HA ) 4.0 2.2 1.0
 assign ( resid 85 and name HN )  ( resid 81 and name HA ) 4.0 2.2 1.0
 assign ( resid 87 and name HN )  ( resid 83 and name HA ) 4.0 2.2 1.0
 assign ( resid 88 and name HN )  ( resid 84 and name HA ) 4.0 2.2 1.0
 assign ( resid 89 and name HN )  ( resid 85 and name HA ) 4.0 2.2 1.0
 assign ( resid 90 and name HN )  ( resid 86 and name HA ) 4.0 2.2 1.0
 assign ( resid 79 and name HN )  ( resid 75 and name HA ) 4.0 2.2 1.0
 assign ( resid 78 and name HN )  ( resid 76 and name HA ) 4.0 2.2 1.0
 assign ( resid 79 and name HN )  ( resid 76 and name HA ) 4.0 2.2 1.0
 assign ( resid 79 and name HN )  ( resid 77 and name HA ) 4.0 2.2 1.0
 assign ( resid 80 and name HN )  ( resid 76 and name HA ) 4.0 2.2 1.0
 assign ( resid 83 and name HN )  ( resid 79 and name HA ) 4.0 2.2 1.0
 assign ( resid 82 and name HN )  ( resid 79 and name HA ) 4.0 2.2 1.0
 assign ( resid 82 and name HN )  ( resid 78 and name HA ) 4.0 2.2 1.0
 assign ( resid 81 and name HN )  ( resid 77 and name HA ) 4.0 2.2 1.0
 assign ( resid 81 and name HN )  ( resid 78 and name HA ) 4.0 2.2 1.0
 assign ( resid 81 and name HN )  ( resid 79 and name HA ) 4.0 2.2 1.0
 assign ( resid 80 and name HN )  ( resid 77 and name HA ) 4.0 2.2 1.0
 assign ( resid 84 and name HN )  ( resid 82 and name HA ) 4.0 2.2 1.0
 assign ( resid 78 and name HN )  ( resid 75 and name HB# ) 4.0 3.2 2.0
 assign ( resid 81 and name HN )  ( resid 78 and name HB# ) 4.0 3.2 2.0
 assign ( resid 82 and name HN )  ( resid 79 and name HB# ) 4.0 3.2 2.0
 assign ( resid 4 and name HB# )  ( resid 6 and name HA ) 4.0 3.2 2.0
 assign ( resid 49 and name HB# )  ( resid 51 and name HA ) 4.0 3.2 2.0
 assign ( resid 10 and name HN )  ( resid 14 and name HG2# ) 4.0 3.7 2.5
 assign ( resid 55 and name HN )  ( resid 59 and name HG2# ) 4.0 3.7 2.5
 assign ( resid 13 and name HD# )  ( resid 15 and name HB# ) 4.0 4.2 3.0
 assign ( resid 58 and name HD# )  ( resid 60 and name HB# ) 4.0 4.2 3.0
 assign ( resid 16 and name HN )  ( resid 12 and name HB# ) 4.0 3.2 2.0
 assign ( resid 61 and name HN )  ( resid 57 and name HB# ) 4.0 3.2 2.0
 assign ( resid 16 and name HA )  ( resid 19 and name HD# ) 4.0 3.2 2.0
 assign ( resid 61 and name HA )  ( resid 64 and name HD# ) 4.0 3.2 2.0
 assign ( resid 16 and name HB# )  ( resid 20 and name HN ) 4.0 3.2 2.0
 assign ( resid 61 and name HB# )  ( resid 65 and name HN ) 4.0 3.2 2.0
 assign ( resid 23 and name HB# )  ( resid 19 and name HA ) 4.0 3.2 2.0
 assign ( resid 68 and name HB# )  ( resid 64 and name HA ) 4.0 3.2 2.0
 assign ( resid 32 and name HD2# )  ( resid 29 and name HA ) 4.0 3.7 2.5
 assign ( resid 77 and name HD2# )  ( resid 74 and name HA ) 4.0 3.7 2.5
 assign ( resid 34 and name HN )  ( resid 30 and name HB# ) 4.0 3.2 2.0
 assign ( resid 79 and name HN )  ( resid 75 and name HB# ) 4.0 3.2 2.0
 assign ( resid 35 and name HN )  ( resid 33 and name HG2# ) 4.0 3.5 2.5
 assign ( resid 80 and name HN )  ( resid 78 and name HG2# ) 4.0 3.5 2.5
 assign ( resid 35 and name HN )  ( resid 32 and name HB# ) 4.0 3.2 2.0
 assign ( resid 80 and name HN )  ( resid 77 and name HB# ) 4.0 3.2 2.0
! intra_sel.awk RES_COUNT is 620

  Entry H atom name         Submitted Coord H atom name
  Start of MODEL    1
    1    H1   MET   1           HT1      MET   1   4.902   1.144  14.219
    2    H2   MET   1           HT2      MET   1   4.405   1.927  12.805
    3    H3   MET   1           HT3      MET   1   4.678   2.824  14.217
    4    HA   MET   1           HA       MET   1   7.040   1.963  14.101
    5    HB2  MET   1           HB2      MET   1   6.502   1.792  11.158
    6    HB3  MET   1           HB1      MET   1   7.824   1.101  12.087
    7    HG2  MET   1           HG2      MET   1   6.571  -0.743  11.456
    8    HG3  MET   1           HG1      MET   1   6.044  -0.434  13.110
    9    HE1  MET   1           HE1      MET   1   4.419  -2.213  12.211
   10    HE2  MET   1           HE2      MET   1   2.852  -1.799  11.519
   11    HE3  MET   1           HE3      MET   1   3.251  -1.292  13.160
   12    H    ALA   2           HN       ALA   2   8.207   3.217  11.758
   13    HA   ALA   2           HA       ALA   2   7.711   5.982  12.503
   14    HB1  ALA   2           HB1      ALA   2   9.752   4.701  10.688
   15    HB2  ALA   2           HB2      ALA   2  10.006   5.292  12.330
   16    HB3  ALA   2           HB3      ALA   2   9.668   6.430  11.025
   17    H    THR   3           HN       THR   3   5.616   4.659  11.135
   18    HA   THR   3           HA       THR   3   5.530   5.231   8.377
   19    HB   THR   3           HB       THR   3   2.909   5.156   9.134
   20    HG1  THR   3           HG1      THR   3   3.926   4.870  11.359
   21   HG21  THR   3          HG21      THR   3   4.778   2.817   8.735
   22   HG22  THR   3          HG22      THR   3   3.930   3.706   7.470
   23   HG23  THR   3          HG23      THR   3   3.019   2.741   8.632
   24    H    THR   4           HN       THR   4   5.452   7.147   7.469
   25    HA   THR   4           HA       THR   4   4.016   9.333   8.826
   26    HB   THR   4           HB       THR   4   5.429  10.797   7.235
   27    HG1  THR   4           HG1      THR   4   6.299   8.394   6.497
   28   HG21  THR   4          HG21      THR   4   5.776  10.774   9.637
   29   HG22  THR   4          HG22      THR   4   7.333  10.800   8.809
   30   HG23  THR   4          HG23      THR   4   6.732   9.297   9.510
   31    H    THR   5           HN       THR   5   2.918  10.883   7.313
   32    HA   THR   5           HA       THR   5   1.425   9.373   5.368
   33    HB   THR   5           HB       THR   5   1.247  12.334   5.972
   34    HG1  THR   5           HG1      THR   5   0.807  10.509   7.665
   35   HG21  THR   5          HG21      THR   5  -0.993  12.167   5.026
   36   HG22  THR   5          HG22      THR   5  -0.758  10.445   4.723
   37   HG23  THR   5          HG23      THR   5   0.204  11.633   3.844
   38    H    LEU   6           HN       LEU   6   2.486   8.885   3.593
   39    HA   LEU   6           HA       LEU   6   3.943  10.988   2.138
   40    HB2  LEU   6           HB2      LEU   6   4.249   7.998   1.844
   41    HB3  LEU   6           HB1      LEU   6   5.251   9.234   1.111
   42    HG   LEU   6           HG       LEU   6   5.135   8.471   4.028
   43   HD11  LEU   6          HD11      LEU   6   7.314   7.674   3.757
   44   HD12  LEU   6          HD12      LEU   6   7.523   8.503   2.215
   45   HD13  LEU   6          HD13      LEU   6   6.457   7.102   2.325
   46   HD21  LEU   6          HD21      LEU   6   5.341  10.855   3.965
   47   HD22  LEU   6          HD22      LEU   6   6.565  10.767   2.699
   48   HD23  LEU   6          HD23      LEU   6   6.929  10.175   4.320
   49    H    GLY   7           HN       GLY   7   3.779  10.856  -0.234
   50    HA2  GLY   7           HA2      GLY   7   1.045  10.487  -1.035
   51    HA3  GLY   7           HA1      GLY   7   2.363  11.050  -2.051
   52    H    VAL   8           HN       VAL   8   0.157   8.712  -1.790
   53    HA   VAL   8           HA       VAL   8   1.828   6.758  -3.227
   54    HB   VAL   8           HB       VAL   8  -0.182   6.225  -1.038
   55   HG11  VAL   8          HG11      VAL   8   0.158   3.803  -1.487
   56   HG12  VAL   8          HG12      VAL   8   0.962   4.238  -2.994
   57   HG13  VAL   8          HG13      VAL   8  -0.737   4.639  -2.756
   58   HG21  VAL   8          HG21      VAL   8   2.080   6.654  -0.310
   59   HG22  VAL   8          HG22      VAL   8   2.696   5.434  -1.425
   60   HG23  VAL   8          HG23      VAL   8   1.681   4.953  -0.066
   61    H    LYS   9           HN       LYS   9   0.521   5.357  -4.689
   62    HA   LYS   9           HA       LYS   9  -1.586   6.977  -5.897
   63    HB2  LYS   9           HB2      LYS   9  -0.035   4.614  -6.973
   64    HB3  LYS   9           HB1      LYS   9  -1.269   5.495  -7.864
   65    HG2  LYS   9           HG2      LYS   9   0.692   6.428  -8.657
   66    HG3  LYS   9           HG1      LYS   9   0.206   7.569  -7.403
   67    HD2  LYS   9           HD2      LYS   9   1.718   6.297  -5.827
   68    HD3  LYS   9           HD1      LYS   9   2.329   5.434  -7.240
   69    HE2  LYS   9           HE2      LYS   9   3.342   7.321  -8.116
   70    HE3  LYS   9           HE1      LYS   9   2.298   8.422  -7.220
   71    HZ1  LYS   9           HZ1      LYS   9   3.948   8.606  -5.768
   72    HZ2  LYS   9           HZ2      LYS   9   4.829   7.353  -6.482
   73    HZ3  LYS   9           HZ3      LYS   9   3.668   7.004  -5.303
   74    H    LEU  10           HN       LEU  10  -3.591   6.529  -5.430
   75    HA   LEU  10           HA       LEU  10  -4.462   3.745  -5.149
   76    HB2  LEU  10           HB2      LEU  10  -4.684   5.921  -3.122
   77    HB3  LEU  10           HB1      LEU  10  -6.027   4.809  -3.286
   78    HG   LEU  10           HG       LEU  10  -3.216   3.851  -2.799
   79   HD11  LEU  10          HD11      LEU  10  -5.343   4.459  -0.750
   80   HD12  LEU  10          HD12      LEU  10  -3.855   5.375  -0.986
   81   HD13  LEU  10          HD13      LEU  10  -3.782   3.700  -0.439
   82   HD21  LEU  10          HD21      LEU  10  -4.406   2.011  -3.428
   83   HD22  LEU  10          HD22      LEU  10  -5.940   2.676  -2.872
   84   HD23  LEU  10          HD23      LEU  10  -4.788   2.027  -1.707
   85    H    ASP  11           HN       ASP  11  -6.421   3.355  -6.060
   86    HA   ASP  11           HA       ASP  11  -7.704   5.489  -7.535
   87    HB2  ASP  11           HB2      ASP  11  -8.897   2.745  -7.187
   88    HB3  ASP  11           HB1      ASP  11  -8.987   3.813  -8.580
   89    H    ASP  12           HN       ASP  12  -9.974   6.112  -7.176
   90    HA   ASP  12           HA       ASP  12 -10.647   6.551  -4.515
   91    HB2  ASP  12           HB2      ASP  12 -12.249   6.657  -7.044
   92    HB3  ASP  12           HB1      ASP  12 -13.077   6.804  -5.498
   93    HA   PRO  13           HA       PRO  13 -13.646   2.723  -4.654
   94    HB2  PRO  13           HB2      PRO  13 -12.997   0.808  -6.520
   95    HB3  PRO  13           HB1      PRO  13 -14.258   2.025  -6.745
   96    HG2  PRO  13           HG2      PRO  13 -11.435   2.019  -7.738
   97    HG3  PRO  13           HG1      PRO  13 -12.920   2.499  -8.583
   98    HD2  PRO  13           HD2      PRO  13 -11.248   4.323  -7.552
   99    HD3  PRO  13           HD1      PRO  13 -13.009   4.558  -7.520
  100    H    THR  14           HN       THR  14 -10.290   2.360  -5.675
  101    HA   THR  14           HA       THR  14  -9.711   0.033  -4.195
  102    HB   THR  14           HB       THR  14  -7.877   2.262  -5.092
  103    HG1  THR  14           HG1      THR  14  -7.679   1.090  -6.935
  104   HG21  THR  14          HG21      THR  14  -7.070  -0.579  -4.544
  105   HG22  THR  14          HG22      THR  14  -7.057   0.643  -3.273
  106   HG23  THR  14          HG23      THR  14  -6.052   0.853  -4.705
  107    H    ARG  15           HN       ARG  15  -9.529   3.480  -3.484
  108    HA   ARG  15           HA       ARG  15  -8.316   3.349  -0.960
  109    HB2  ARG  15           HB2      ARG  15  -8.684   5.423  -2.284
  110    HB3  ARG  15           HB1      ARG  15 -10.406   5.298  -1.963
  111    HG2  ARG  15           HG2      ARG  15  -9.460   6.931  -0.504
  112    HG3  ARG  15           HG1      ARG  15  -9.931   5.524   0.450
  113    HD2  ARG  15           HD2      ARG  15  -7.144   5.660  -0.583
  114    HD3  ARG  15           HD1      ARG  15  -7.584   6.699   0.772
  115    HE   ARG  15           HE       ARG  15  -7.282   3.834   0.797
  116   HH11  ARG  15          HH21      ARG  15  -8.690   6.610   2.389
  117   HH12  ARG  15          HH22      ARG  15  -8.867   5.814   3.915
  118   HH21  ARG  15          HH11      ARG  15  -7.518   2.770   2.807
  119   HH22  ARG  15          HH12      ARG  15  -8.196   3.618   4.153
  120    H    GLU  16           HN       GLU  16 -11.694   3.239  -1.983
  121    HA   GLU  16           HA       GLU  16 -12.844   2.940   0.571
  122    HB2  GLU  16           HB2      GLU  16 -13.806   2.120  -2.168
  123    HB3  GLU  16           HB1      GLU  16 -14.782   1.942  -0.717
  124    HG2  GLU  16           HG2      GLU  16 -14.622   4.373  -0.352
  125    HG3  GLU  16           HG1      GLU  16 -13.726   4.515  -1.865
  126    H    ARG  17           HN       ARG  17 -11.621   0.646  -1.808
  127    HA   ARG  17           HA       ARG  17 -12.445  -1.716  -0.558
  128    HB2  ARG  17           HB2      ARG  17 -11.233  -1.305  -2.878
  129    HB3  ARG  17           HB1      ARG  17  -9.784  -1.616  -1.933
  130    HG2  ARG  17           HG2      ARG  17 -12.129  -3.502  -2.142
  131    HG3  ARG  17           HG1      ARG  17 -10.651  -3.621  -3.095
  132    HD2  ARG  17           HD2      ARG  17  -9.351  -3.923  -1.059
  133    HD3  ARG  17           HD1      ARG  17 -10.803  -3.739  -0.085
  134    HE   ARG  17           HE       ARG  17 -10.819  -5.919  -2.024
  135   HH11  ARG  17          HH21      ARG  17 -10.346  -4.917   1.300
  136   HH12  ARG  17          HH22      ARG  17 -10.495  -6.521   1.936
  137   HH21  ARG  17          HH11      ARG  17 -11.022  -8.018  -1.198
  138   HH22  ARG  17          HH12      ARG  17 -10.872  -8.293   0.518
  139    H    LEU  18           HN       LEU  18  -9.595   0.341  -0.054
  140    HA   LEU  18           HA       LEU  18  -8.314  -1.339   1.802
  141    HB2  LEU  18           HB2      LEU  18  -8.180   1.550   1.158
  142    HB3  LEU  18           HB1      LEU  18  -7.605   1.077   2.745
  143    HG   LEU  18           HG       LEU  18  -6.099  -0.591   1.572
  144   HD11  LEU  18          HD11      LEU  18  -7.281  -0.615  -0.572
  145   HD12  LEU  18          HD12      LEU  18  -5.580  -0.188  -0.756
  146   HD13  LEU  18          HD13      LEU  18  -6.817   1.066  -0.837
  147   HD21  LEU  18          HD21      LEU  18  -5.774   2.377   1.235
  148   HD22  LEU  18          HD22      LEU  18  -4.495   1.225   0.856
  149   HD23  LEU  18          HD23      LEU  18  -5.118   1.340   2.502
  150    H    LYS  19           HN       LYS  19 -10.864   1.113   2.207
  151    HA   LYS  19           HA       LYS  19 -10.969   0.953   5.028
  152    HB2  LYS  19           HB2      LYS  19 -12.104   2.751   3.708
  153    HB3  LYS  19           HB1      LYS  19 -13.281   1.557   3.176
  154    HG2  LYS  19           HG2      LYS  19 -13.941   1.188   5.520
  155    HG3  LYS  19           HG1      LYS  19 -12.796   2.431   6.020
  156    HD2  LYS  19           HD2      LYS  19 -14.024   4.090   4.700
  157    HD3  LYS  19           HD1      LYS  19 -15.166   2.843   4.197
  158    HE2  LYS  19           HE2      LYS  19 -16.311   3.801   5.946
  159    HE3  LYS  19           HE1      LYS  19 -15.466   2.495   6.773
  160    HZ1  LYS  19           HZ1      LYS  19 -14.589   5.333   6.669
  161    HZ2  LYS  19           HZ2      LYS  19 -13.773   4.084   7.462
  162    HZ3  LYS  19           HZ3      LYS  19 -15.301   4.570   7.999
  163    H    ALA  20           HN       ALA  20 -12.630  -0.738   2.476
  164    HA   ALA  20           HA       ALA  20 -14.223  -2.426   4.050
  165    HB1  ALA  20           HB1      ALA  20 -13.082  -2.978   1.307
  166    HB2  ALA  20           HB2      ALA  20 -14.580  -2.107   1.634
  167    HB3  ALA  20           HB3      ALA  20 -14.442  -3.814   2.057
  168    H    ALA  21           HN       ALA  21 -10.941  -2.719   2.798
  169    HA   ALA  21           HA       ALA  21 -10.410  -5.346   3.667
  170    HB1  ALA  21           HB1      ALA  21  -8.084  -4.825   3.359
  171    HB2  ALA  21           HB2      ALA  21  -8.408  -3.094   3.449
  172    HB3  ALA  21           HB3      ALA  21  -8.990  -4.030   2.072
  173    H    ALA  22           HN       ALA  22 -10.072  -2.183   5.144
  174    HA   ALA  22           HA       ALA  22  -8.895  -2.916   7.552
  175    HB1  ALA  22           HB1      ALA  22 -10.950  -0.743   7.319
  176    HB2  ALA  22           HB2      ALA  22  -9.356  -0.579   6.585
  177    HB3  ALA  22           HB3      ALA  22  -9.505  -0.787   8.330
  178    H    GLN  23           HN       GLN  23 -12.236  -2.595   6.628
  179    HA   GLN  23           HA       GLN  23 -13.396  -3.397   9.064
  180    HB2  GLN  23           HB2      GLN  23 -14.471  -3.513   6.239
  181    HB3  GLN  23           HB1      GLN  23 -15.443  -3.730   7.691
  182    HG2  GLN  23           HG2      GLN  23 -13.831  -1.258   7.132
  183    HG3  GLN  23           HG1      GLN  23 -15.520  -1.439   6.665
  184   HE21  GLN  23          HE21      GLN  23 -13.767   0.083   8.791
  185   HE22  GLN  23          HE22      GLN  23 -14.744  -0.013  10.211
  186    H    SER  24           HN       SER  24 -12.439  -5.178   6.179
  187    HA   SER  24           HA       SER  24 -13.500  -7.688   6.912
  188    HB2  SER  24           HB2      SER  24 -11.135  -7.072   5.122
  189    HB3  SER  24           HB1      SER  24 -12.005  -8.603   5.186
  190    HG   SER  24           HG       SER  24 -13.306  -6.159   4.602
  191    H    ILE  25           HN       ILE  25 -10.483  -6.066   7.697
  192    HA   ILE  25           HA       ILE  25  -9.528  -8.496   9.037
  193    HB   ILE  25           HB       ILE  25  -8.042  -7.380   7.348
  194   HG12  ILE  25          HG12      ILE  25  -6.822  -7.358  10.107
  195   HG13  ILE  25          HG11      ILE  25  -7.248  -8.846   9.268
  196   HG21  ILE  25          HG21      ILE  25  -8.753  -5.051   8.261
  197   HG22  ILE  25          HG22      ILE  25  -7.119  -5.299   7.646
  198   HG23  ILE  25          HG23      ILE  25  -7.415  -5.296   9.383
  199   HD11  ILE  25          HD11      ILE  25  -4.868  -8.234   9.068
  200   HD12  ILE  25          HD12      ILE  25  -5.348  -6.775   8.201
  201   HD13  ILE  25          HD13      ILE  25  -5.690  -8.363   7.513
  202    H    ASP  26           HN       ASP  26 -11.376  -6.019   9.741
  203    HA   ASP  26           HA       ASP  26 -12.076  -4.961  11.595
  204    HB2  ASP  26           HB2      ASP  26 -10.591  -7.244  12.884
  205    HB3  ASP  26           HB1      ASP  26 -11.531  -6.075  13.806
  206    H    ARG  27           HN       ARG  27  -9.977  -3.741  10.419
  207    HA   ARG  27           HA       ARG  27  -8.530  -2.627  12.739
  208    HB2  ARG  27           HB2      ARG  27  -7.446  -3.129   9.954
  209    HB3  ARG  27           HB1      ARG  27  -6.612  -2.180  11.177
  210    HG2  ARG  27           HG2      ARG  27  -6.501  -4.144  12.631
  211    HG3  ARG  27           HG1      ARG  27  -7.340  -5.097  11.408
  212    HD2  ARG  27           HD2      ARG  27  -5.465  -4.602   9.836
  213    HD3  ARG  27           HD1      ARG  27  -4.619  -3.813  11.168
  214    HE   ARG  27           HE       ARG  27  -5.452  -6.552  11.653
  215   HH11  ARG  27          HH21      ARG  27  -2.866  -4.427  10.619
  216   HH12  ARG  27          HH22      ARG  27  -1.611  -5.579  10.949
  217   HH21  ARG  27          HH11      ARG  27  -3.795  -8.081  12.084
  218   HH22  ARG  27          HH12      ARG  27  -2.139  -7.662  11.778
  219    H    THR  28           HN       THR  28  -8.114  -0.337  12.612
  220    HA   THR  28           HA       THR  28 -10.171   1.111  11.218
  221    HB   THR  28           HB       THR  28  -9.652   1.984  13.367
  222    HG1  THR  28           HG1      THR  28  -9.587   3.525  11.381
  223   HG21  THR  28          HG21      THR  28  -7.415   2.683  14.064
  224   HG22  THR  28          HG22      THR  28  -6.759   2.131  12.523
  225   HG23  THR  28          HG23      THR  28  -7.447   0.968  13.656
  226    HA   PRO  29           HA       PRO  29  -8.307   2.068   7.301
  227    HB2  PRO  29           HB2      PRO  29  -8.821   4.887   8.199
  228    HB3  PRO  29           HB1      PRO  29  -9.083   4.153   6.611
  229    HG2  PRO  29           HG2      PRO  29 -11.110   4.482   8.313
  230    HG3  PRO  29           HG1      PRO  29 -10.994   3.036   7.294
  231    HD2  PRO  29           HD2      PRO  29 -10.597   3.317  10.205
  232    HD3  PRO  29           HD1      PRO  29 -11.024   1.881   9.260
  233    H    HIS  30           HN       HIS  30  -7.322   4.255   9.990
  234    HA   HIS  30           HA       HIS  30  -4.884   5.061   8.844
  235    HB2  HIS  30           HB2      HIS  30  -5.867   6.207  10.784
  236    HB3  HIS  30           HB1      HIS  30  -5.602   4.780  11.777
  237    HD1  HIS  30           HD1      HIS  30  -3.706   7.591  10.104
  238    HD2  HIS  30           HD2      HIS  30  -3.086   4.560  12.879
  239    HE1  HIS  30           HE1      HIS  30  -1.423   8.008  11.056
  240    HE2  HIS  30           HE2      HIS  30  -1.230   6.361  12.945
  241    H    TRP  31           HN       TRP  31  -5.601   2.447  11.117
  242    HA   TRP  31           HA       TRP  31  -2.967   1.418  11.241
  243    HB2  TRP  31           HB2      TRP  31  -4.583   1.040  13.017
  244    HB3  TRP  31           HB1      TRP  31  -5.653   0.210  11.904
  245    HD1  TRP  31           HD1      TRP  31  -5.724  -1.913  13.438
  246    HE1  TRP  31           HE1      TRP  31  -4.078  -3.838  13.857
  247    HE3  TRP  31           HE3      TRP  31  -1.480   0.170  11.452
  248    HZ2  TRP  31           HZ2      TRP  31  -1.363  -4.410  13.410
  249    HZ3  TRP  31           HZ3      TRP  31   0.594  -1.145  11.493
  250    HH2  TRP  31           HH2      TRP  31   0.652  -3.387  12.453
  251    H    LEU  32           HN       LEU  32  -5.830   0.565   9.424
  252    HA   LEU  32           HA       LEU  32  -4.816  -1.693   8.135
  253    HB2  LEU  32           HB2      LEU  32  -7.199  -1.185   8.160
  254    HB3  LEU  32           HB1      LEU  32  -6.919   0.223   7.159
  255    HG   LEU  32           HG       LEU  32  -7.860  -1.909   6.052
  256   HD11  LEU  32          HD11      LEU  32  -5.418  -0.742   4.750
  257   HD12  LEU  32          HD12      LEU  32  -6.955   0.111   4.875
  258   HD13  LEU  32          HD13      LEU  32  -6.858  -1.401   3.973
  259   HD21  LEU  32          HD21      LEU  32  -6.270  -3.556   5.315
  260   HD22  LEU  32          HD22      LEU  32  -6.224  -3.451   7.076
  261   HD23  LEU  32          HD23      LEU  32  -4.954  -2.696   6.114
  262    H    ILE  33           HN       ILE  33  -4.854   1.672   7.102
  263    HA   ILE  33           HA       ILE  33  -3.749   1.238   4.559
  264    HB   ILE  33           HB       ILE  33  -3.628   3.664   6.355
  265   HG12  ILE  33          HG12      ILE  33  -5.140   3.278   3.772
  266   HG13  ILE  33          HG11      ILE  33  -5.829   2.870   5.340
  267   HG21  ILE  33          HG21      ILE  33  -2.680   3.379   3.510
  268   HG22  ILE  33          HG22      ILE  33  -1.700   3.777   4.922
  269   HG23  ILE  33          HG23      ILE  33  -2.913   4.918   4.339
  270   HD11  ILE  33          HD11      ILE  33  -6.573   5.053   4.638
  271   HD12  ILE  33          HD12      ILE  33  -4.905   5.592   4.449
  272   HD13  ILE  33          HD13      ILE  33  -5.529   5.201   6.051
  273    H    LYS  34           HN       LYS  34  -2.232   1.895   7.681
  274    HA   LYS  34           HA       LYS  34   0.434   2.018   6.805
  275    HB2  LYS  34           HB2      LYS  34  -0.777   1.139   9.434
  276    HB3  LYS  34           HB1      LYS  34   0.954   1.298   9.181
  277    HG2  LYS  34           HG2      LYS  34   0.803   3.629   8.917
  278    HG3  LYS  34           HG1      LYS  34  -0.951   3.573   8.738
  279    HD2  LYS  34           HD2      LYS  34  -0.318   4.393  10.950
  280    HD3  LYS  34           HD1      LYS  34  -1.170   2.853  11.064
  281    HE2  LYS  34           HE2      LYS  34   0.940   1.682  11.351
  282    HE3  LYS  34           HE1      LYS  34   1.826   3.194  11.158
  283    HZ1  LYS  34           HZ1      LYS  34   0.591   2.114  13.488
  284    HZ2  LYS  34           HZ2      LYS  34   0.016   3.669  13.168
  285    HZ3  LYS  34           HZ3      LYS  34   1.673   3.408  13.351
  286    H    GLN  35           HN       GLN  35  -1.478  -0.680   8.105
  287    HA   GLN  35           HA       GLN  35   0.599  -2.566   7.656
  288    HB2  GLN  35           HB2      GLN  35  -0.768  -4.163   8.606
  289    HB3  GLN  35           HB1      GLN  35  -1.352  -2.690   9.356
  290    HG2  GLN  35           HG2      GLN  35  -3.350  -3.556   8.820
  291    HG3  GLN  35           HG1      GLN  35  -3.014  -2.805   7.261
  292   HE21  GLN  35          HE21      GLN  35  -3.199  -5.799   9.021
  293   HE22  GLN  35          HE22      GLN  35  -3.163  -6.835   7.639
  294    H    ALA  36           HN       ALA  36  -2.100  -1.445   5.709
  295    HA   ALA  36           HA       ALA  36  -2.264  -3.578   3.927
  296    HB1  ALA  36           HB1      ALA  36  -2.977  -1.789   2.248
  297    HB2  ALA  36           HB2      ALA  36  -2.756  -0.638   3.566
  298    HB3  ALA  36           HB3      ALA  36  -3.930  -1.944   3.722
  299    H    ILE  37           HN       ILE  37  -0.128  -0.768   3.919
  300    HA   ILE  37           HA       ILE  37   1.211  -1.765   1.566
  301    HB   ILE  37           HB       ILE  37   0.802   0.668   1.968
  302   HG12  ILE  37          HG12      ILE  37   3.122   1.375   1.256
  303   HG13  ILE  37          HG11      ILE  37   3.620  -0.296   1.503
  304   HG21  ILE  37          HG21      ILE  37   1.298   0.774   4.335
  305   HG22  ILE  37          HG22      ILE  37   2.306   1.906   3.434
  306   HG23  ILE  37          HG23      ILE  37   2.988   0.386   4.014
  307   HD11  ILE  37          HD11      ILE  37   1.287  -0.284  -0.114
  308   HD12  ILE  37          HD12      ILE  37   2.920  -0.806  -0.524
  309   HD13  ILE  37          HD13      ILE  37   2.441   0.872  -0.776
  310    H    PHE  38           HN       PHE  38   1.960  -1.492   5.031
  311    HA   PHE  38           HA       PHE  38   4.624  -2.500   4.717
  312    HB2  PHE  38           HB2      PHE  38   4.605  -1.325   6.666
  313    HB3  PHE  38           HB1      PHE  38   2.889  -1.591   6.928
  314    HD1  PHE  38           HD1      PHE  38   6.036  -3.626   6.944
  315    HD2  PHE  38           HD2      PHE  38   2.335  -2.702   8.830
  316    HE1  PHE  38           HE1      PHE  38   6.547  -5.237   8.730
  317    HE2  PHE  38           HE2      PHE  38   2.839  -4.312  10.618
  318    HZ   PHE  38           HZ       PHE  38   4.947  -5.584  10.569
  319    H    ASN  39           HN       ASN  39   1.523  -3.918   5.687
  320    HA   ASN  39           HA       ASN  39   2.620  -6.484   6.198
  321    HB2  ASN  39           HB2      ASN  39   0.307  -5.615   6.953
  322    HB3  ASN  39           HB1      ASN  39  -0.221  -6.024   5.327
  323   HD21  ASN  39          HD21      ASN  39  -1.159  -7.099   7.797
  324   HD22  ASN  39          HD22      ASN  39  -0.828  -8.796   7.790
  325    H    TYR  40           HN       TYR  40   1.607  -4.706   3.379
  326    HA   TYR  40           HA       TYR  40   1.379  -6.864   1.599
  327    HB2  TYR  40           HB2      TYR  40   0.758  -4.695   0.761
  328    HB3  TYR  40           HB1      TYR  40   2.341  -4.024   1.156
  329    HD1  TYR  40           HD1      TYR  40   0.852  -6.770  -0.881
  330    HD2  TYR  40           HD2      TYR  40   3.879  -3.800  -0.562
  331    HE1  TYR  40           HE1      TYR  40   1.683  -7.391  -3.102
  332    HE2  TYR  40           HE2      TYR  40   4.716  -4.411  -2.795
  333    HH   TYR  40           HH       TYR  40   3.492  -5.632  -4.962
  334    H    LEU  41           HN       LEU  41   4.057  -4.946   2.777
  335    HA   LEU  41           HA       LEU  41   6.089  -6.231   1.327
  336    HB2  LEU  41           HB2      LEU  41   6.264  -4.858   3.997
  337    HB3  LEU  41           HB1      LEU  41   7.631  -5.293   2.988
  338    HG   LEU  41           HG       LEU  41   5.485  -3.286   2.302
  339   HD11  LEU  41          HD11      LEU  41   8.405  -2.908   2.932
  340   HD12  LEU  41          HD12      LEU  41   7.068  -2.552   4.025
  341   HD13  LEU  41          HD13      LEU  41   7.244  -1.645   2.522
  342   HD21  LEU  41          HD21      LEU  41   7.752  -4.445   0.733
  343   HD22  LEU  41          HD22      LEU  41   7.211  -2.794   0.434
  344   HD23  LEU  41          HD23      LEU  41   6.089  -4.139   0.237
  345    H    GLU  42           HN       GLU  42   4.650  -6.794   4.482
  346    HA   GLU  42           HA       GLU  42   6.342  -8.834   5.386
  347    HB2  GLU  42           HB2      GLU  42   4.738  -7.627   6.820
  348    HB3  GLU  42           HB1      GLU  42   3.406  -8.417   5.989
  349    HG2  GLU  42           HG2      GLU  42   4.211 -10.591   6.791
  350    HG3  GLU  42           HG1      GLU  42   5.517  -9.778   7.650
  351    H    LYS  43           HN       LYS  43   3.410  -8.969   3.405
  352    HA   LYS  43           HA       LYS  43   3.169 -11.783   3.404
  353    HB2  LYS  43           HB2      LYS  43   2.126  -9.692   1.510
  354    HB3  LYS  43           HB1      LYS  43   1.774 -11.402   1.320
  355    HG2  LYS  43           HG2      LYS  43   0.711 -11.424   3.524
  356    HG3  LYS  43           HG1      LYS  43   1.064  -9.703   3.702
  357    HD2  LYS  43           HD2      LYS  43  -0.311  -9.207   1.748
  358    HD3  LYS  43           HD1      LYS  43  -0.639 -10.927   1.532
  359    HE2  LYS  43           HE2      LYS  43  -2.434  -9.549   2.689
  360    HE3  LYS  43           HE1      LYS  43  -1.932 -11.040   3.484
  361    HZ1  LYS  43           HZ1      LYS  43  -1.045  -9.929   5.202
  362    HZ2  LYS  43           HZ2      LYS  43  -2.099  -8.695   4.721
  363    HZ3  LYS  43           HZ3      LYS  43  -0.474  -8.654   4.251
  364    H    LEU  44           HN       LEU  44   4.860  -9.575   1.221
  365    HA   LEU  44           HA       LEU  44   5.583 -11.745  -0.542
  366    HB2  LEU  44           HB2      LEU  44   6.840 -10.033  -1.791
  367    HB3  LEU  44           HB1      LEU  44   5.149  -9.634  -1.565
  368    HG   LEU  44           HG       LEU  44   6.133  -8.285   0.513
  369   HD11  LEU  44          HD11      LEU  44   8.266  -7.305   0.033
  370   HD12  LEU  44          HD12      LEU  44   8.380  -8.190  -1.488
  371   HD13  LEU  44          HD13      LEU  44   8.443  -9.059   0.046
  372   HD21  LEU  44          HD21      LEU  44   6.128  -7.406  -2.364
  373   HD22  LEU  44          HD22      LEU  44   6.267  -6.311  -0.989
  374   HD23  LEU  44          HD23      LEU  44   4.807  -7.278  -1.203
  375    H    GLU  45           HN       GLU  45   6.906 -10.341   2.279
  376    HA   GLU  45           HA       GLU  45   9.660 -10.892   1.722
  377    HB2  GLU  45           HB2      GLU  45   8.107 -10.066   4.145
  378    HB3  GLU  45           HB1      GLU  45   9.746 -10.670   4.344
  379    HG2  GLU  45           HG2      GLU  45   9.111  -8.444   2.438
  380    HG3  GLU  45           HG1      GLU  45   9.404  -8.148   4.149
  381    H1   MET  46           HT1      MET  46  -4.824   1.204 -14.489
  382    H2   MET  46           HT2      MET  46  -4.268   1.849 -13.027
  383    H3   MET  46           HT3      MET  46  -4.558   2.871 -14.347
  384    HA   MET  46           HA       MET  46  -6.941   1.960 -14.209
  385    HB2  MET  46           HB2      MET  46  -6.311   1.817 -11.288
  386    HB3  MET  46           HB1      MET  46  -7.642   1.092 -12.177
  387    HG2  MET  46           HG2      MET  46  -6.344  -0.723 -11.565
  388    HG3  MET  46           HG1      MET  46  -5.855  -0.415 -13.231
  389    HE1  MET  46           HE1      MET  46  -4.203  -2.159 -12.338
  390    HE2  MET  46           HE2      MET  46  -2.643  -1.735 -11.636
  391    HE3  MET  46           HE3      MET  46  -3.026  -1.251 -13.288
  392    H    ALA  47           HN       ALA  47  -8.035   3.204 -11.834
  393    HA   ALA  47           HA       ALA  47  -7.573   5.978 -12.593
  394    HB1  ALA  47           HB1      ALA  47  -9.621   4.678 -10.800
  395    HB2  ALA  47           HB2      ALA  47  -9.867   5.278 -12.440
  396    HB3  ALA  47           HB3      ALA  47  -9.543   6.409 -11.126
  397    H    THR  48           HN       THR  48  -5.486   4.655 -11.218
  398    HA   THR  48           HA       THR  48  -5.415   5.218  -8.462
  399    HB   THR  48           HB       THR  48  -2.790   5.188  -9.218
  400    HG1  THR  48           HG1      THR  48  -3.816   4.893 -11.442
  401   HG21  THR  48          HG21      THR  48  -4.626   2.822  -8.828
  402   HG22  THR  48          HG22      THR  48  -3.790   3.717  -7.559
  403   HG23  THR  48          HG23      THR  48  -2.866   2.770  -8.726
  404    H    THR  49           HN       THR  49  -5.347   7.123  -7.531
  405    HA   THR  49           HA       THR  49  -3.951   9.338  -8.881
  406    HB   THR  49           HB       THR  49  -5.373  10.787  -7.301
  407    HG1  THR  49           HG1      THR  49  -6.269   8.322  -6.629
  408   HG21  THR  49          HG21      THR  49  -5.757  10.739  -9.693
  409   HG22  THR  49          HG22      THR  49  -7.303  10.743  -8.845
  410   HG23  THR  49          HG23      THR  49  -6.684   9.247  -9.542
  411    H    THR  50           HN       THR  50  -2.871  10.888  -7.372
  412    HA   THR  50           HA       THR  50  -1.359   9.394  -5.431
  413    HB   THR  50           HB       THR  50  -1.213  12.360  -6.016
  414    HG1  THR  50           HG1      THR  50  -0.824  10.798  -7.833
  415   HG21  THR  50          HG21      THR  50   1.037  12.196  -5.095
  416   HG22  THR  50          HG22      THR  50   0.814  10.470  -4.810
  417   HG23  THR  50          HG23      THR  50  -0.146  11.643  -3.909
  418    H    LEU  51           HN       LEU  51  -2.426   8.890  -3.660
  419    HA   LEU  51           HA       LEU  51  -3.899  10.976  -2.193
  420    HB2  LEU  51           HB2      LEU  51  -4.182   7.984  -1.901
  421    HB3  LEU  51           HB1      LEU  51  -5.198   9.215  -1.179
  422    HG   LEU  51           HG       LEU  51  -5.056   8.455  -4.095
  423   HD11  LEU  51          HD11      LEU  51  -7.228   7.628  -3.837
  424   HD12  LEU  51          HD12      LEU  51  -7.449   8.439  -2.287
  425   HD13  LEU  51          HD13      LEU  51  -6.363   7.055  -2.410
  426   HD21  LEU  51          HD21      LEU  51  -5.299  10.834  -4.027
  427   HD22  LEU  51          HD22      LEU  51  -6.524  10.724  -2.763
  428   HD23  LEU  51          HD23      LEU  51  -6.877  10.132  -4.387
  429    H    GLY  52           HN       GLY  52  -3.753  10.810   0.185
  430    HA2  GLY  52           HA2      GLY  52  -1.012  10.477   0.991
  431    HA3  GLY  52           HA1      GLY  52  -2.341  11.012   2.008
  432    H    VAL  53           HN       VAL  53  -0.101   8.708   1.734
  433    HA   VAL  53           HA       VAL  53  -1.748   6.717   3.148
  434    HB   VAL  53           HB       VAL  53   0.274   6.231   0.960
  435   HG11  VAL  53          HG11      VAL  53  -0.033   3.800   1.389
  436   HG12  VAL  53          HG12      VAL  53  -0.841   4.213   2.901
  437   HG13  VAL  53          HG13      VAL  53   0.853   4.640   2.663
  438   HG21  VAL  53          HG21      VAL  53  -1.991   6.629   0.227
  439   HG22  VAL  53          HG22      VAL  53  -2.593   5.396   1.335
  440   HG23  VAL  53          HG23      VAL  53  -1.567   4.935  -0.024
  441    H    LYS  54           HN       LYS  54  -0.437   5.328   4.605
  442    HA   LYS  54           HA       LYS  54   1.651   6.953   5.834
  443    HB2  LYS  54           HB2      LYS  54   0.101   4.574   6.871
  444    HB3  LYS  54           HB1      LYS  54   1.337   5.430   7.780
  445    HG2  LYS  54           HG2      LYS  54  -0.622   6.358   8.586
  446    HG3  LYS  54           HG1      LYS  54  -0.122   7.522   7.360
  447    HD2  LYS  54           HD2      LYS  54  -1.648   6.317   5.751
  448    HD3  LYS  54           HD1      LYS  54  -2.260   5.406   7.132
  449    HE2  LYS  54           HE2      LYS  54  -3.251   7.274   8.088
  450    HE3  LYS  54           HE1      LYS  54  -2.219   8.397   7.205
  451    HZ1  LYS  54           HZ1      LYS  54  -4.076   8.642   5.973
  452    HZ2  LYS  54           HZ2      LYS  54  -4.704   7.129   6.383
  453    HZ3  LYS  54           HZ3      LYS  54  -3.515   7.251   5.188
  454    H    LEU  55           HN       LEU  55   3.664   6.530   5.362
  455    HA   LEU  55           HA       LEU  55   4.567   3.758   5.058
  456    HB2  LEU  55           HB2      LEU  55   4.765   5.953   3.050
  457    HB3  LEU  55           HB1      LEU  55   6.124   4.861   3.208
  458    HG   LEU  55           HG       LEU  55   3.329   3.866   2.702
  459   HD11  LEU  55          HD11      LEU  55   5.456   4.520   0.667
  460   HD12  LEU  55          HD12      LEU  55   3.956   5.416   0.906
  461   HD13  LEU  55          HD13      LEU  55   3.906   3.745   0.344
  462   HD21  LEU  55          HD21      LEU  55   4.544   2.039   3.324
  463   HD22  LEU  55          HD22      LEU  55   6.070   2.729   2.772
  464   HD23  LEU  55          HD23      LEU  55   4.927   2.073   1.603
  465    H    ASP  56           HN       ASP  56   6.530   3.383   5.972
  466    HA   ASP  56           HA       ASP  56   7.786   5.519   7.465
  467    HB2  ASP  56           HB2      ASP  56   9.016   2.795   7.097
  468    HB3  ASP  56           HB1      ASP  56   9.090   3.855   8.497
  469    H    ASP  57           HN       ASP  57  10.055   6.155   7.125
  470    HA   ASP  57           HA       ASP  57  10.723   6.644   4.470
  471    HB2  ASP  57           HB2      ASP  57  12.306   6.744   7.009
  472    HB3  ASP  57           HB1      ASP  57  13.152   6.900   5.474
  473    HA   PRO  58           HA       PRO  58  13.768   2.849   4.564
  474    HB2  PRO  58           HB2      PRO  58  13.143   0.906   6.411
  475    HB3  PRO  58           HB1      PRO  58  14.391   2.135   6.645
  476    HG2  PRO  58           HG2      PRO  58  11.571   2.087   7.645
  477    HG3  PRO  58           HG1      PRO  58  13.052   2.576   8.491
  478    HD2  PRO  58           HD2      PRO  58  11.355   4.390   7.483
  479    HD3  PRO  58           HD1      PRO  58  13.112   4.646   7.448
  480    H    THR  59           HN       THR  59  10.409   2.473   5.547
  481    HA   THR  59           HA       THR  59   9.871   0.126   4.068
  482    HB   THR  59           HB       THR  59   7.998   2.324   4.974
  483    HG1  THR  59           HG1      THR  59   7.826   1.148   6.816
  484   HG21  THR  59          HG21      THR  59   7.242  -0.532   4.420
  485   HG22  THR  59          HG22      THR  59   7.207   0.692   3.150
  486   HG23  THR  59          HG23      THR  59   6.197   0.880   4.582
  487    H    ARG  60           HN       ARG  60   9.649   3.574   3.380
  488    HA   ARG  60           HA       ARG  60   8.444   3.442   0.853
  489    HB2  ARG  60           HB2      ARG  60   8.763   5.513   2.181
  490    HB3  ARG  60           HB1      ARG  60  10.491   5.419   1.887
  491    HG2  ARG  60           HG2      ARG  60   9.546   7.044   0.421
  492    HG3  ARG  60           HG1      ARG  60  10.045   5.647  -0.534
  493    HD2  ARG  60           HD2      ARG  60   7.246   5.748   0.469
  494    HD3  ARG  60           HD1      ARG  60   7.688   6.793  -0.880
  495    HE   ARG  60           HE       ARG  60   7.437   3.919  -0.905
  496   HH11  ARG  60          HH21      ARG  60   8.771   6.729  -2.495
  497   HH12  ARG  60          HH22      ARG  60   8.945   5.951  -4.030
  498   HH21  ARG  60          HH11      ARG  60   7.687   2.865  -2.919
  499   HH22  ARG  60          HH12      ARG  60   8.334   3.734  -4.266
  500    H    GLU  61           HN       GLU  61  11.821   3.364   1.879
  501    HA   GLU  61           HA       GLU  61  12.982   3.105  -0.679
  502    HB2  GLU  61           HB2      GLU  61  13.948   2.254   2.055
  503    HB3  GLU  61           HB1      GLU  61  14.933   2.150   0.603
  504    HG2  GLU  61           HG2      GLU  61  14.765   4.568   0.313
  505    HG3  GLU  61           HG1      GLU  61  13.776   4.671   1.770
  506    H    ARG  62           HN       ARG  62  11.760   0.798   1.681
  507    HA   ARG  62           HA       ARG  62  12.626  -1.559   0.443
  508    HB2  ARG  62           HB2      ARG  62  11.419  -1.167   2.760
  509    HB3  ARG  62           HB1      ARG  62   9.965  -1.476   1.822
  510    HG2  ARG  62           HG2      ARG  62  12.315  -3.357   2.020
  511    HG3  ARG  62           HG1      ARG  62  10.832  -3.486   2.966
  512    HD2  ARG  62           HD2      ARG  62   9.540  -3.791   0.936
  513    HD3  ARG  62           HD1      ARG  62  10.984  -3.570  -0.043
  514    HE   ARG  62           HE       ARG  62  11.037  -5.774   1.864
  515   HH11  ARG  62          HH21      ARG  62  10.566  -4.720  -1.440
  516   HH12  ARG  62          HH22      ARG  62  10.740  -6.308  -2.107
  517   HH21  ARG  62          HH11      ARG  62  11.273  -7.858   0.999
  518   HH22  ARG  62          HH12      ARG  62  11.135  -8.099  -0.722
  519    H    LEU  63           HN       LEU  63   9.749   0.455  -0.062
  520    HA   LEU  63           HA       LEU  63   8.497  -1.228  -1.930
  521    HB2  LEU  63           HB2      LEU  63   8.325   1.657  -1.274
  522    HB3  LEU  63           HB1      LEU  63   7.756   1.181  -2.862
  523    HG   LEU  63           HG       LEU  63   6.271  -0.508  -1.697
  524   HD11  LEU  63          HD11      LEU  63   7.456  -0.530   0.446
  525   HD12  LEU  63          HD12      LEU  63   5.749  -0.127   0.634
  526   HD13  LEU  63          HD13      LEU  63   6.970   1.143   0.722
  527   HD21  LEU  63          HD21      LEU  63   5.912   2.453  -1.341
  528   HD22  LEU  63          HD22      LEU  63   4.646   1.283  -0.971
  529   HD23  LEU  63          HD23      LEU  63   5.268   1.418  -2.615
  530    H    LYS  64           HN       LYS  64  11.012   1.258  -2.313
  531    HA   LYS  64           HA       LYS  64  11.126   1.130  -5.132
  532    HB2  LYS  64           HB2      LYS  64  12.236   2.922  -3.800
  533    HB3  LYS  64           HB1      LYS  64  13.414   1.734  -3.250
  534    HG2  LYS  64           HG2      LYS  64  14.070   1.360  -5.612
  535    HG3  LYS  64           HG1      LYS  64  12.973   2.658  -6.083
  536    HD2  LYS  64           HD2      LYS  64  14.247   4.217  -4.664
  537    HD3  LYS  64           HD1      LYS  64  15.364   2.912  -4.260
  538    HE2  LYS  64           HE2      LYS  64  16.512   3.886  -5.979
  539    HE3  LYS  64           HE1      LYS  64  15.548   2.722  -6.885
  540    HZ1  LYS  64           HZ1      LYS  64  15.019   5.620  -6.544
  541    HZ2  LYS  64           HZ2      LYS  64  13.908   4.547  -7.232
  542    HZ3  LYS  64           HZ3      LYS  64  15.402   4.809  -7.979
  543    H    ALA  65           HN       ALA  65  12.811  -0.566  -2.601
  544    HA   ALA  65           HA       ALA  65  14.416  -2.230  -4.186
  545    HB1  ALA  65           HB1      ALA  65  13.278  -2.813  -1.448
  546    HB2  ALA  65           HB2      ALA  65  14.767  -1.924  -1.768
  547    HB3  ALA  65           HB3      ALA  65  14.648  -3.629  -2.203
  548    H    ALA  66           HN       ALA  66  11.135  -2.553  -2.946
  549    HA   ALA  66           HA       ALA  66  10.628  -5.184  -3.824
  550    HB1  ALA  66           HB1      ALA  66   8.297  -4.683  -3.521
  551    HB2  ALA  66           HB2      ALA  66   8.608  -2.950  -3.599
  552    HB3  ALA  66           HB3      ALA  66   9.193  -3.888  -2.226
  553    H    ALA  67           HN       ALA  67  10.268  -2.018  -5.286
  554    HA   ALA  67           HA       ALA  67   9.094  -2.755  -7.697
  555    HB1  ALA  67           HB1      ALA  67  11.120  -0.555  -7.450
  556    HB2  ALA  67           HB2      ALA  67   9.523  -0.416  -6.716
  557    HB3  ALA  67           HB3      ALA  67   9.677  -0.612  -8.462
  558    H    GLN  68           HN       GLN  68  12.425  -2.419  -6.750
  559    HA   GLN  68           HA       GLN  68  13.603  -3.178  -9.197
  560    HB2  GLN  68           HB2      GLN  68  14.662  -3.302  -6.365
  561    HB3  GLN  68           HB1      GLN  68  15.646  -3.521  -7.808
  562    HG2  GLN  68           HG2      GLN  68  14.040  -1.044  -7.258
  563    HG3  GLN  68           HG1      GLN  68  15.725  -1.233  -6.780
  564   HE21  GLN  68          HE21      GLN  68  13.873   0.165  -9.000
  565   HE22  GLN  68          HE22      GLN  68  14.910   0.118 -10.380
  566    H    SER  69           HN       SER  69  12.652  -4.988  -6.329
  567    HA   SER  69           HA       SER  69  13.741  -7.480  -7.082
  568    HB2  SER  69           HB2      SER  69  11.375  -6.909  -5.281
  569    HB3  SER  69           HB1      SER  69  12.266  -8.428  -5.362
  570    HG   SER  69           HG       SER  69  13.529  -5.968  -4.755
  571    H    ILE  70           HN       ILE  70  10.713  -5.884  -7.856
  572    HA   ILE  70           HA       ILE  70   9.779  -8.318  -9.202
  573    HB   ILE  70           HB       ILE  70   8.277  -7.218  -7.517
  574   HG12  ILE  70          HG12      ILE  70   7.067  -7.193 -10.281
  575   HG13  ILE  70          HG11      ILE  70   7.508  -8.683  -9.454
  576   HG21  ILE  70          HG21      ILE  70   8.977  -4.882  -8.425
  577   HG22  ILE  70          HG22      ILE  70   7.345  -5.141  -7.811
  578   HG23  ILE  70          HG23      ILE  70   7.641  -5.133  -9.548
  579   HD11  ILE  70          HD11      ILE  70   5.121  -8.102  -9.258
  580   HD12  ILE  70          HD12      ILE  70   5.579  -6.644  -8.377
  581   HD13  ILE  70          HD13      ILE  70   5.938  -8.233  -7.701
  582    H    ASP  71           HN       ASP  71  11.604  -5.815  -9.910
  583    HA   ASP  71           HA       ASP  71  12.302  -4.786 -11.783
  584    HB2  ASP  71           HB2      ASP  71  10.774  -7.062 -13.037
  585    HB3  ASP  71           HB1      ASP  71  11.705  -5.906 -13.984
  586    H    ARG  72           HN       ARG  72  10.200  -3.561 -10.577
  587    HA   ARG  72           HA       ARG  72   8.751  -2.431 -12.890
  588    HB2  ARG  72           HB2      ARG  72   7.662  -2.948 -10.111
  589    HB3  ARG  72           HB1      ARG  72   6.830  -2.002 -11.337
  590    HG2  ARG  72           HG2      ARG  72   6.735  -3.962 -12.792
  591    HG3  ARG  72           HG1      ARG  72   7.574  -4.913 -11.568
  592    HD2  ARG  72           HD2      ARG  72   5.687  -4.405 -10.001
  593    HD3  ARG  72           HD1      ARG  72   4.841  -3.655 -11.355
  594    HE   ARG  72           HE       ARG  72   5.725  -6.382 -11.790
  595   HH11  ARG  72          HH21      ARG  72   3.095  -4.294 -10.790
  596   HH12  ARG  72          HH22      ARG  72   1.864  -5.477 -11.101
  597   HH21  ARG  72          HH11      ARG  72   4.104  -7.954 -12.187
  598   HH22  ARG  72          HH12      ARG  72   2.440  -7.563 -11.893
  599    H    THR  73           HN       THR  73   8.315  -0.152 -12.745
  600    HA   THR  73           HA       THR  73  10.349   1.305 -11.329
  601    HB   THR  73           HB       THR  73   9.811   2.155 -13.496
  602    HG1  THR  73           HG1      THR  73   9.482   3.674 -11.332
  603   HG21  THR  73          HG21      THR  73   7.573   2.919 -14.137
  604   HG22  THR  73          HG22      THR  73   6.940   2.361 -12.589
  605   HG23  THR  73          HG23      THR  73   7.582   1.199 -13.750
  606    HA   PRO  74           HA       PRO  74   8.457   2.226  -7.424
  607    HB2  PRO  74           HB2      PRO  74   8.918   5.063  -8.290
  608    HB3  PRO  74           HB1      PRO  74   9.200   4.314  -6.713
  609    HG2  PRO  74           HG2      PRO  74  11.217   4.704  -8.406
  610    HG3  PRO  74           HG1      PRO  74  11.126   3.234  -7.420
  611    HD2  PRO  74           HD2      PRO  74  10.698   3.581 -10.325
  612    HD3  PRO  74           HD1      PRO  74  11.187   2.137  -9.422
  613    H    HIS  75           HN       HIS  75   7.440   4.431 -10.088
  614    HA   HIS  75           HA       HIS  75   4.992   5.190  -8.945
  615    HB2  HIS  75           HB2      HIS  75   5.964   6.350 -10.884
  616    HB3  HIS  75           HB1      HIS  75   5.710   4.923 -11.879
  617    HD1  HIS  75           HD1      HIS  75   3.749   7.621 -10.095
  618    HD2  HIS  75           HD2      HIS  75   3.238   4.765 -13.063
  619    HE1  HIS  75           HE1      HIS  75   1.480   8.073 -11.074
  620    HE2  HIS  75           HE2      HIS  75   1.361   6.551 -13.074
  621    H    TRP  76           HN       TRP  76   5.742   2.597 -11.229
  622    HA   TRP  76           HA       TRP  76   3.123   1.532 -11.362
  623    HB2  TRP  76           HB2      TRP  76   4.748   1.192 -13.139
  624    HB3  TRP  76           HB1      TRP  76   5.824   0.364 -12.032
  625    HD1  TRP  76           HD1      TRP  76   5.919  -1.739 -13.596
  626    HE1  TRP  76           HE1      TRP  76   4.298  -3.682 -14.031
  627    HE3  TRP  76           HE3      TRP  76   1.655   0.267 -11.577
  628    HZ2  TRP  76           HZ2      TRP  76   1.590  -4.294 -13.581
  629    HZ3  TRP  76           HZ3      TRP  76  -0.402  -1.072 -11.626
  630    HH2  TRP  76           HH2      TRP  76  -0.435  -3.305 -12.608
  631    H    LEU  77           HN       LEU  77   5.994   0.709  -9.542
  632    HA   LEU  77           HA       LEU  77   5.006  -1.577  -8.276
  633    HB2  LEU  77           HB2      LEU  77   7.385  -1.036  -8.292
  634    HB3  LEU  77           HB1      LEU  77   7.082   0.360  -7.280
  635    HG   LEU  77           HG       LEU  77   8.047  -1.770  -6.187
  636   HD11  LEU  77          HD11      LEU  77   5.589  -0.639  -4.882
  637   HD12  LEU  77          HD12      LEU  77   7.117   0.233  -4.998
  638   HD13  LEU  77          HD13      LEU  77   7.034  -1.286  -4.106
  639   HD21  LEU  77          HD21      LEU  77   6.474  -3.439  -5.467
  640   HD22  LEU  77          HD22      LEU  77   6.428  -3.321  -7.226
  641   HD23  LEU  77          HD23      LEU  77   5.149  -2.586  -6.260
  642    H    ILE  78           HN       ILE  78   5.008   1.780  -7.214
  643    HA   ILE  78           HA       ILE  78   3.910   1.309  -4.673
  644    HB   ILE  78           HB       ILE  78   3.768   3.749  -6.445
  645   HG12  ILE  78          HG12      ILE  78   5.285   3.361  -3.867
  646   HG13  ILE  78          HG11      ILE  78   5.978   2.969  -5.438
  647   HG21  ILE  78          HG21      ILE  78   2.824   3.434  -3.602
  648   HG22  ILE  78          HG22      ILE  78   1.841   3.834  -5.011
  649   HG23  ILE  78          HG23      ILE  78   3.044   4.981  -4.420
  650   HD11  ILE  78          HD11      ILE  78   6.700   5.155  -4.729
  651   HD12  ILE  78          HD12      ILE  78   5.026   5.674  -4.525
  652   HD13  ILE  78          HD13      ILE  78   5.645   5.304  -6.134
  653    H    LYS  79           HN       LYS  79   2.391   1.981  -7.793
  654    HA   LYS  79           HA       LYS  79  -0.276   2.074  -6.912
  655    HB2  LYS  79           HB2      LYS  79   0.941   1.229  -9.549
  656    HB3  LYS  79           HB1      LYS  79  -0.792   1.369  -9.293
  657    HG2  LYS  79           HG2      LYS  79  -0.656   3.701  -8.987
  658    HG3  LYS  79           HG1      LYS  79   1.103   3.653  -8.845
  659    HD2  LYS  79           HD2      LYS  79   0.416   4.492 -11.034
  660    HD3  LYS  79           HD1      LYS  79   1.279   2.961 -11.181
  661    HE2  LYS  79           HE2      LYS  79  -0.795   1.769 -11.473
  662    HE3  LYS  79           HE1      LYS  79  -1.724   3.236 -11.169
  663    HZ1  LYS  79           HZ1      LYS  79  -0.527   2.319 -13.594
  664    HZ2  LYS  79           HZ2      LYS  79  -0.044   3.895 -13.223
  665    HZ3  LYS  79           HZ3      LYS  79  -1.686   3.528 -13.357
  666    H    GLN  80           HN       GLN  80   1.658  -0.595  -8.235
  667    HA   GLN  80           HA       GLN  80  -0.402  -2.504  -7.803
  668    HB2  GLN  80           HB2      GLN  80   0.984  -4.083  -8.759
  669    HB3  GLN  80           HB1      GLN  80   1.549  -2.598  -9.503
  670    HG2  GLN  80           HG2      GLN  80   3.558  -3.445  -8.972
  671    HG3  GLN  80           HG1      GLN  80   3.216  -2.701  -7.411
  672   HE21  GLN  80          HE21      GLN  80   3.428  -5.688  -9.177
  673   HE22  GLN  80          HE22      GLN  80   3.408  -6.726  -7.797
  674    H    ALA  81           HN       ALA  81   2.282  -1.370  -5.845
  675    HA   ALA  81           HA       ALA  81   2.471  -3.515  -4.081
  676    HB1  ALA  81           HB1      ALA  81   3.164  -1.731  -2.389
  677    HB2  ALA  81           HB2      ALA  81   2.928  -0.573  -3.698
  678    HB3  ALA  81           HB3      ALA  81   4.117  -1.864  -3.865
  679    H    ILE  82           HN       ILE  82   0.301  -0.731  -4.052
  680    HA   ILE  82           HA       ILE  82  -1.028  -1.764  -1.708
  681    HB   ILE  82           HB       ILE  82  -0.647   0.676  -2.091
  682   HG12  ILE  82          HG12      ILE  82  -2.975   1.351  -1.374
  683   HG13  ILE  82          HG11      ILE  82  -3.453  -0.324  -1.633
  684   HG21  ILE  82          HG21      ILE  82  -1.144   0.794  -4.457
  685   HG22  ILE  82          HG22      ILE  82  -2.166   1.908  -3.548
  686   HG23  ILE  82          HG23      ILE  82  -2.830   0.385  -4.140
  687   HD11  ILE  82          HD11      ILE  82  -1.120  -0.297  -0.017
  688   HD12  ILE  82          HD12      ILE  82  -2.747  -0.840   0.391
  689   HD13  ILE  82          HD13      ILE  82  -2.287   0.842   0.654
  690    H    PHE  83           HN       PHE  83  -1.779  -1.470  -5.171
  691    HA   PHE  83           HA       PHE  83  -4.429  -2.515  -4.869
  692    HB2  PHE  83           HB2      PHE  83  -4.423  -1.324  -6.807
  693    HB3  PHE  83           HB1      PHE  83  -2.703  -1.567  -7.070
  694    HD1  PHE  83           HD1      PHE  83  -5.824  -3.642  -7.103
  695    HD2  PHE  83           HD2      PHE  83  -2.135  -2.654  -8.981
  696    HE1  PHE  83           HE1      PHE  83  -6.312  -5.245  -8.902
  697    HE2  PHE  83           HE2      PHE  83  -2.617  -4.256 -10.782
  698    HZ   PHE  83           HZ       PHE  83  -4.708  -5.556 -10.743
  699    H    ASN  84           HN       ASN  84  -1.311  -3.885  -5.851
  700    HA   ASN  84           HA       ASN  84  -2.370  -6.463  -6.378
  701    HB2  ASN  84           HB2      ASN  84  -0.073  -5.553  -7.130
  702    HB3  ASN  84           HB1      ASN  84   0.466  -5.963  -5.508
  703   HD21  ASN  84          HD21      ASN  84   1.400  -7.000  -8.004
  704   HD22  ASN  84          HD22      ASN  84   1.102  -8.702  -8.006
  705    H    TYR  85           HN       TYR  85  -1.397  -4.688  -3.547
  706    HA   TYR  85           HA       TYR  85  -1.130  -6.857  -1.782
  707    HB2  TYR  85           HB2      TYR  85  -0.544  -4.687  -0.924
  708    HB3  TYR  85           HB1      TYR  85  -2.137  -4.037  -1.316
  709    HD1  TYR  85           HD1      TYR  85  -0.615  -6.782   0.700
  710    HD2  TYR  85           HD2      TYR  85  -3.676  -3.846   0.402
  711    HE1  TYR  85           HE1      TYR  85  -1.439  -7.429   2.918
  712    HE2  TYR  85           HE2      TYR  85  -4.507  -4.482   2.629
  713    HH   TYR  85           HH       TYR  85  -3.242  -5.717   4.794
  714    H    LEU  86           HN       LEU  86  -3.832  -4.981  -2.967
  715    HA   LEU  86           HA       LEU  86  -5.848  -6.308  -1.528
  716    HB2  LEU  86           HB2      LEU  86  -6.035  -4.913  -4.188
  717    HB3  LEU  86           HB1      LEU  86  -7.398  -5.376  -3.187
  718    HG   LEU  86           HG       LEU  86  -5.284  -3.342  -2.481
  719   HD11  LEU  86          HD11      LEU  86  -8.211  -3.005  -3.099
  720   HD12  LEU  86          HD12      LEU  86  -6.884  -2.619  -4.193
  721   HD13  LEU  86          HD13      LEU  86  -7.069  -1.728  -2.682
  722   HD21  LEU  86          HD21      LEU  86  -7.533  -4.545  -0.917
  723   HD22  LEU  86          HD22      LEU  86  -7.006  -2.892  -0.603
  724   HD23  LEU  86          HD23      LEU  86  -5.871  -4.230  -0.423
  725    H    GLU  87           HN       GLU  87  -4.397  -6.822  -4.692
  726    HA   GLU  87           HA       GLU  87  -6.037  -8.889  -5.625
  727    HB2  GLU  87           HB2      GLU  87  -4.438  -7.649  -7.032
  728    HB3  GLU  87           HB1      GLU  87  -3.102  -8.408  -6.181
  729    HG2  GLU  87           HG2      GLU  87  -3.830 -10.598  -7.014
  730    HG3  GLU  87           HG1      GLU  87  -5.144  -9.816  -7.889
  731    H    LYS  88           HN       LYS  88  -3.126  -8.987  -3.613
  732    HA   LYS  88           HA       LYS  88  -2.844 -11.800  -3.617
  733    HB2  LYS  88           HB2      LYS  88  -1.830  -9.690  -1.729
  734    HB3  LYS  88           HB1      LYS  88  -1.458 -11.394  -1.526
  735    HG2  LYS  88           HG2      LYS  88  -0.393 -11.415  -3.731
  736    HG3  LYS  88           HG1      LYS  88  -0.762  -9.697  -3.914
  737    HD2  LYS  88           HD2      LYS  88   0.599  -9.194  -1.943
  738    HD3  LYS  88           HD1      LYS  88   0.958 -10.911  -1.751
  739    HE2  LYS  88           HE2      LYS  88   2.739  -9.524  -2.884
  740    HE3  LYS  88           HE1      LYS  88   2.219 -10.972  -3.743
  741    HZ1  LYS  88           HZ1      LYS  88   1.256  -9.771  -5.377
  742    HZ2  LYS  88           HZ2      LYS  88   2.417  -8.628  -4.914
  743    HZ3  LYS  88           HZ3      LYS  88   0.824  -8.491  -4.362
  744    H    LEU  89           HN       LEU  89  -4.563  -9.610  -1.434
  745    HA   LEU  89           HA       LEU  89  -5.233 -11.780   0.342
  746    HB2  LEU  89           HB2      LEU  89  -6.559 -10.100   1.567
  747    HB3  LEU  89           HB1      LEU  89  -4.877  -9.662   1.361
  748    HG   LEU  89           HG       LEU  89  -5.874  -8.345  -0.735
  749   HD11  LEU  89          HD11      LEU  89  -8.030  -7.408  -0.261
  750   HD12  LEU  89          HD12      LEU  89  -8.130  -8.302   1.256
  751   HD13  LEU  89          HD13      LEU  89  -8.167  -9.167  -0.281
  752   HD21  LEU  89          HD21      LEU  89  -5.901  -7.458   2.140
  753   HD22  LEU  89          HD22      LEU  89  -6.059  -6.370   0.763
  754   HD23  LEU  89          HD23      LEU  89  -4.578  -7.302   0.984
  755    H    GLU  90           HN       GLU  90  -6.632 -10.382  -2.468
  756    HA   GLU  90           HA       GLU  90  -9.346 -11.081  -1.923
  757    HB2  GLU  90           HB2      GLU  90  -7.835 -10.309  -4.410
  758    HB3  GLU  90           HB1      GLU  90  -9.494 -10.877  -4.515
  759    HG2  GLU  90           HG2      GLU  90  -8.712  -8.578  -2.748
  760    HG3  GLU  90           HG1      GLU  90  -9.085  -8.360  -4.452
  Start of MODEL    2
    1    H1   MET   1           HT1      MET   1   4.284  -0.132  10.565
    2    H2   MET   1           HT2      MET   1   5.267   1.253  10.568
    3    H3   MET   1           HT3      MET   1   3.615   1.382  10.217
    4    HA   MET   1           HA       MET   1   2.966   0.902  12.396
    5    HB2  MET   1           HB2      MET   1   5.885   0.272  12.906
    6    HB3  MET   1           HB1      MET   1   4.617   0.275  14.128
    7    HG2  MET   1           HG2      MET   1   4.697  -1.523  11.712
    8    HG3  MET   1           HG1      MET   1   5.161  -1.984  13.350
    9    HE1  MET   1           HE1      MET   1   3.666  -2.405  15.255
   10    HE2  MET   1           HE2      MET   1   1.914  -2.206  15.298
   11    HE3  MET   1           HE3      MET   1   2.962  -0.788  15.294
   12    H    ALA   2           HN       ALA   2   6.194   2.317  11.947
   13    HA   ALA   2           HA       ALA   2   5.323   4.772  13.305
   14    HB1  ALA   2           HB1      ALA   2   7.768   5.334  13.199
   15    HB2  ALA   2           HB2      ALA   2   8.050   3.748  12.481
   16    HB3  ALA   2           HB3      ALA   2   7.414   3.872  14.121
   17    H    THR   3           HN       THR   3   4.309   3.933  10.875
   18    HA   THR   3           HA       THR   3   5.511   4.940   8.556
   19    HB   THR   3           HB       THR   3   3.051   4.746   7.738
   20    HG1  THR   3           HG1      THR   3   2.476   4.762  10.166
   21   HG21  THR   3          HG21      THR   3   4.502   2.350   8.880
   22   HG22  THR   3          HG22      THR   3   4.731   3.040   7.273
   23   HG23  THR   3          HG23      THR   3   3.195   2.283   7.696
   24    H    THR   4           HN       THR   4   5.580   6.886   7.715
   25    HA   THR   4           HA       THR   4   4.031   9.058   8.925
   26    HB   THR   4           HB       THR   4   6.338   9.242   6.964
   27    HG1  THR   4           HG1      THR   4   7.055   8.313   8.914
   28   HG21  THR   4          HG21      THR   4   6.510  11.556   7.763
   29   HG22  THR   4          HG22      THR   4   5.108  11.305   8.803
   30   HG23  THR   4          HG23      THR   4   4.927  11.249   7.049
   31    H    THR   5           HN       THR   5   2.942  10.607   7.461
   32    HA   THR   5           HA       THR   5   1.494   9.208   5.426
   33    HB   THR   5           HB       THR   5   1.405  12.177   5.962
   34    HG1  THR   5           HG1      THR   5  -0.283  11.585   7.478
   35   HG21  THR   5          HG21      THR   5  -0.675  10.221   4.969
   36   HG22  THR   5          HG22      THR   5   0.190  11.396   3.977
   37   HG23  THR   5          HG23      THR   5  -0.922  11.948   5.230
   38    H    LEU   6           HN       LEU   6   2.483   8.739   3.615
   39    HA   LEU   6           HA       LEU   6   4.014  10.820   2.200
   40    HB2  LEU   6           HB2      LEU   6   4.338   7.825   1.950
   41    HB3  LEU   6           HB1      LEU   6   5.322   9.048   1.174
   42    HG   LEU   6           HG       LEU   6   5.254   8.346   4.109
   43   HD11  LEU   6          HD11      LEU   6   6.578   6.968   2.409
   44   HD12  LEU   6          HD12      LEU   6   7.436   7.569   3.827
   45   HD13  LEU   6          HD13      LEU   6   7.624   8.381   2.273
   46   HD21  LEU   6          HD21      LEU   6   6.673  10.622   2.733
   47   HD22  LEU   6          HD22      LEU   6   7.000  10.079   4.378
   48   HD23  LEU   6          HD23      LEU   6   5.419  10.744   3.968
   49    H    GLY   7           HN       GLY   7   3.832  10.699  -0.171
   50    HA2  GLY   7           HA2      GLY   7   1.096  10.316  -0.958
   51    HA3  GLY   7           HA1      GLY   7   2.407  10.876  -1.984
   52    H    VAL   8           HN       VAL   8   0.200   8.539  -1.709
   53    HA   VAL   8           HA       VAL   8   1.842   6.575  -3.168
   54    HB   VAL   8           HB       VAL   8  -0.148   6.056  -0.958
   55   HG11  VAL   8          HG11      VAL   8   0.111   3.641  -1.413
   56   HG12  VAL   8          HG12      VAL   8   0.953   4.039  -2.909
   57   HG13  VAL   8          HG13      VAL   8  -0.737   4.496  -2.701
   58   HG21  VAL   8          HG21      VAL   8   1.694   4.753   0.001
   59   HG22  VAL   8          HG22      VAL   8   2.138   6.441  -0.257
   60   HG23  VAL   8          HG23      VAL   8   2.709   5.198  -1.371
   61    H    LYS   9           HN       LYS   9   0.483   5.185  -4.634
   62    HA   LYS   9           HA       LYS   9  -1.693   6.818  -5.720
   63    HB2  LYS   9           HB2      LYS   9  -0.315   4.482  -7.034
   64    HB3  LYS   9           HB1      LYS   9  -1.342   5.689  -7.798
   65    HG2  LYS   9           HG2      LYS   9   0.497   7.331  -6.841
   66    HG3  LYS   9           HG1      LYS   9   1.488   5.874  -6.943
   67    HD2  LYS   9           HD2      LYS   9   1.806   6.400  -9.088
   68    HD3  LYS   9           HD1      LYS   9   0.129   5.916  -9.350
   69    HE2  LYS   9           HE2      LYS   9   1.125   8.694  -8.729
   70    HE3  LYS   9           HE1      LYS   9   0.522   8.120 -10.282
   71    HZ1  LYS   9           HZ1      LYS   9  -1.647   7.929  -9.434
   72    HZ2  LYS   9           HZ2      LYS   9  -1.077   9.425  -8.876
   73    HZ3  LYS   9           HZ3      LYS   9  -1.132   8.100  -7.829
   74    H    LEU  10           HN       LEU  10  -3.723   6.238  -5.393
   75    HA   LEU  10           HA       LEU  10  -4.353   3.394  -4.957
   76    HB2  LEU  10           HB2      LEU  10  -5.065   5.771  -3.311
   77    HB3  LEU  10           HB1      LEU  10  -6.236   4.476  -3.448
   78    HG   LEU  10           HG       LEU  10  -3.418   3.921  -2.569
   79   HD11  LEU  10          HD11      LEU  10  -5.748   4.814  -0.878
   80   HD12  LEU  10          HD12      LEU  10  -4.191   5.623  -1.059
   81   HD13  LEU  10          HD13      LEU  10  -4.284   4.062  -0.244
   82   HD21  LEU  10          HD21      LEU  10  -4.723   2.103  -1.343
   83   HD22  LEU  10          HD22      LEU  10  -4.577   1.952  -3.093
   84   HD23  LEU  10          HD23      LEU  10  -6.078   2.545  -2.381
   85    H    ASP  11           HN       ASP  11  -6.135   2.642  -5.935
   86    HA   ASP  11           HA       ASP  11  -7.506   4.336  -7.863
   87    HB2  ASP  11           HB2      ASP  11  -6.977   1.495  -7.528
   88    HB3  ASP  11           HB1      ASP  11  -8.689   1.772  -7.818
   89    H    ASP  12           HN       ASP  12  -9.753   4.839  -7.720
   90    HA   ASP  12           HA       ASP  12 -10.831   5.272  -5.213
   91    HB2  ASP  12           HB2      ASP  12 -11.951   5.261  -7.956
   92    HB3  ASP  12           HB1      ASP  12 -13.116   5.147  -6.642
   93    HA   PRO  13           HA       PRO  13 -13.560   1.249  -5.502
   94    HB2  PRO  13           HB2      PRO  13 -12.618  -0.686  -7.215
   95    HB3  PRO  13           HB1      PRO  13 -13.911   0.447  -7.620
   96    HG2  PRO  13           HG2      PRO  13 -11.006   0.559  -8.321
   97    HG3  PRO  13           HG1      PRO  13 -12.417   0.941  -9.325
   98    HD2  PRO  13           HD2      PRO  13 -10.931   2.869  -8.191
   99    HD3  PRO  13           HD1      PRO  13 -12.691   3.031  -8.365
  100    H    THR  14           HN       THR  14 -10.132   1.200  -6.078
  101    HA   THR  14           HA       THR  14  -9.539  -1.125  -4.571
  102    HB   THR  14           HB       THR  14  -8.070   0.956  -5.993
  103    HG1  THR  14           HG1      THR  14  -7.714  -0.880  -6.957
  104   HG21  THR  14          HG21      THR  14  -7.027   1.513  -3.934
  105   HG22  THR  14          HG22      THR  14  -5.902   0.477  -4.813
  106   HG23  THR  14          HG23      THR  14  -6.857  -0.183  -3.486
  107    H    ARG  15           HN       ARG  15  -9.786   2.307  -3.858
  108    HA   ARG  15           HA       ARG  15  -8.773   2.315  -1.242
  109    HB2  ARG  15           HB2      ARG  15  -9.286   4.337  -2.612
  110    HB3  ARG  15           HB1      ARG  15 -11.000   4.014  -2.393
  111    HG2  ARG  15           HG2      ARG  15 -10.447   5.688  -0.845
  112    HG3  ARG  15           HG1      ARG  15 -10.589   4.195   0.088
  113    HD2  ARG  15           HD2      ARG  15  -8.115   3.943  -0.075
  114    HD3  ARG  15           HD1      ARG  15  -8.052   5.534  -0.832
  115    HE   ARG  15           HE       ARG  15  -8.662   6.518   1.205
  116   HH11  ARG  15          HH21      ARG  15  -8.370   3.037   1.438
  117   HH12  ARG  15          HH22      ARG  15  -8.307   3.026   3.167
  118   HH21  ARG  15          HH11      ARG  15  -8.627   6.514   3.483
  119   HH22  ARG  15          HH12      ARG  15  -8.458   5.015   4.336
  120    H    GLU  16           HN       GLU  16 -11.981   1.690  -2.552
  121    HA   GLU  16           HA       GLU  16 -13.388   1.396  -0.141
  122    HB2  GLU  16           HB2      GLU  16 -13.813   0.002  -2.793
  123    HB3  GLU  16           HB1      GLU  16 -14.975   0.031  -1.476
  124    HG2  GLU  16           HG2      GLU  16 -15.153   2.456  -1.682
  125    HG3  GLU  16           HG1      GLU  16 -13.985   2.427  -3.004
  126    H    ARG  17           HN       ARG  17 -11.512  -0.868  -2.083
  127    HA   ARG  17           HA       ARG  17 -12.093  -3.181  -0.584
  128    HB2  ARG  17           HB2      ARG  17  -9.738  -2.525  -2.357
  129    HB3  ARG  17           HB1      ARG  17  -9.995  -4.106  -1.628
  130    HG2  ARG  17           HG2      ARG  17 -12.273  -4.084  -2.760
  131    HG3  ARG  17           HG1      ARG  17 -11.671  -2.711  -3.688
  132    HD2  ARG  17           HD2      ARG  17 -10.405  -5.446  -3.574
  133    HD3  ARG  17           HD1      ARG  17 -11.407  -4.837  -4.888
  134    HE   ARG  17           HE       ARG  17  -9.285  -3.054  -4.506
  135   HH11  ARG  17          HH21      ARG  17  -9.840  -6.336  -5.592
  136   HH12  ARG  17          HH22      ARG  17  -8.456  -6.371  -6.634
  137   HH21  ARG  17          HH11      ARG  17  -7.456  -3.079  -5.898
  138   HH22  ARG  17          HH12      ARG  17  -7.097  -4.516  -6.806
  139    H    LEU  18           HN       LEU  18  -9.742  -0.607  -0.167
  140    HA   LEU  18           HA       LEU  18  -8.178  -1.867   1.804
  141    HB2  LEU  18           HB2      LEU  18  -8.639   0.936   0.969
  142    HB3  LEU  18           HB1      LEU  18  -8.085   0.717   2.617
  143    HG   LEU  18           HG       LEU  18  -6.181  -0.673   1.637
  144   HD11  LEU  18          HD11      LEU  18  -5.628  -0.426  -0.643
  145   HD12  LEU  18          HD12      LEU  18  -6.897   0.773  -0.895
  146   HD13  LEU  18          HD13      LEU  18  -7.323  -0.911  -0.590
  147   HD21  LEU  18          HD21      LEU  18  -4.896   1.360   1.010
  148   HD22  LEU  18          HD22      LEU  18  -5.773   1.510   2.533
  149   HD23  LEU  18          HD23      LEU  18  -6.401   2.278   1.075
  150    H    LYS  19           HN       LYS  19 -11.217  -0.049   1.951
  151    HA   LYS  19           HA       LYS  19 -11.462  -0.034   4.764
  152    HB2  LYS  19           HB2      LYS  19 -13.639  -0.117   2.678
  153    HB3  LYS  19           HB1      LYS  19 -13.898   0.225   4.382
  154    HG2  LYS  19           HG2      LYS  19 -12.543   2.241   4.191
  155    HG3  LYS  19           HG1      LYS  19 -12.271   1.898   2.480
  156    HD2  LYS  19           HD2      LYS  19 -14.717   1.986   2.113
  157    HD3  LYS  19           HD1      LYS  19 -14.931   2.424   3.807
  158    HE2  LYS  19           HE2      LYS  19 -13.439   4.007   1.717
  159    HE3  LYS  19           HE1      LYS  19 -15.020   4.396   2.392
  160    HZ1  LYS  19           HZ1      LYS  19 -12.387   4.491   3.730
  161    HZ2  LYS  19           HZ2      LYS  19 -13.830   4.465   4.612
  162    HZ3  LYS  19           HZ3      LYS  19 -13.519   5.736   3.539
  163    H    ALA  20           HN       ALA  20 -12.420  -2.319   2.320
  164    HA   ALA  20           HA       ALA  20 -13.711  -4.178   3.990
  165    HB1  ALA  20           HB1      ALA  20 -14.012  -4.151   1.553
  166    HB2  ALA  20           HB2      ALA  20 -13.495  -5.737   2.127
  167    HB3  ALA  20           HB3      ALA  20 -12.337  -4.661   1.344
  168    H    ALA  21           HN       ALA  21 -10.383  -3.797   2.880
  169    HA   ALA  21           HA       ALA  21  -9.328  -6.136   4.033
  170    HB1  ALA  21           HB1      ALA  21  -8.126  -4.747   2.373
  171    HB2  ALA  21           HB2      ALA  21  -7.157  -5.070   3.811
  172    HB3  ALA  21           HB3      ALA  21  -7.924  -3.496   3.599
  173    H    ALA  22           HN       ALA  22  -9.842  -2.877   5.226
  174    HA   ALA  22           HA       ALA  22  -8.662  -3.125   7.756
  175    HB1  ALA  22           HB1      ALA  22  -9.408  -0.999   6.630
  176    HB2  ALA  22           HB2      ALA  22  -9.827  -1.137   8.337
  177    HB3  ALA  22           HB3      ALA  22 -11.053  -1.425   7.102
  178    H    GLN  23           HN       GLN  23 -12.011  -3.452   6.772
  179    HA   GLN  23           HA       GLN  23 -12.987  -4.268   9.282
  180    HB2  GLN  23           HB2      GLN  23 -15.029  -4.515   8.248
  181    HB3  GLN  23           HB1      GLN  23 -14.209  -3.483   7.109
  182    HG2  GLN  23           HG2      GLN  23 -15.135  -4.958   5.677
  183    HG3  GLN  23           HG1      GLN  23 -13.575  -5.729   5.949
  184   HE21  GLN  23          HE21      GLN  23 -14.257  -7.795   5.549
  185   HE22  GLN  23          HE22      GLN  23 -15.353  -8.652   6.572
  186    H    SER  24           HN       SER  24 -11.678  -6.006   6.551
  187    HA   SER  24           HA       SER  24 -12.343  -8.556   7.478
  188    HB2  SER  24           HB2      SER  24 -11.738  -8.002   5.110
  189    HB3  SER  24           HB1      SER  24 -10.063  -7.829   5.626
  190    HG   SER  24           HG       SER  24  -9.872  -9.909   5.553
  191    H    ILE  25           HN       ILE  25  -9.746  -6.370   8.148
  192    HA   ILE  25           HA       ILE  25  -8.263  -8.427   9.609
  193    HB   ILE  25           HB       ILE  25  -7.356  -6.573   7.863
  194   HG12  ILE  25          HG12      ILE  25  -6.121  -8.517   8.747
  195   HG13  ILE  25          HG11      ILE  25  -5.120  -7.078   8.628
  196   HG21  ILE  25          HG21      ILE  25  -7.934  -4.708   9.359
  197   HG22  ILE  25          HG22      ILE  25  -6.220  -4.776   8.950
  198   HG23  ILE  25          HG23      ILE  25  -6.771  -5.327  10.531
  199   HD11  ILE  25          HD11      ILE  25  -5.441  -6.728  11.062
  200   HD12  ILE  25          HD12      ILE  25  -4.602  -8.225  10.654
  201   HD13  ILE  25          HD13      ILE  25  -6.301  -8.267  11.124
  202    H    ASP  26           HN       ASP  26 -10.716  -6.466  10.145
  203    HA   ASP  26           HA       ASP  26 -11.775  -5.638  11.952
  204    HB2  ASP  26           HB2      ASP  26 -11.099  -7.899  12.864
  205    HB3  ASP  26           HB1      ASP  26  -9.740  -7.095  13.642
  206    H    ARG  27           HN       ARG  27 -10.001  -3.907  10.785
  207    HA   ARG  27           HA       ARG  27  -9.247  -2.315  13.140
  208    HB2  ARG  27           HB2      ARG  27  -7.454  -2.765  10.749
  209    HB3  ARG  27           HB1      ARG  27  -7.161  -1.576  12.011
  210    HG2  ARG  27           HG2      ARG  27  -7.011  -3.367  13.666
  211    HG3  ARG  27           HG1      ARG  27  -7.304  -4.559  12.400
  212    HD2  ARG  27           HD2      ARG  27  -4.970  -4.526  12.746
  213    HD3  ARG  27           HD1      ARG  27  -5.253  -3.649  11.244
  214    HE   ARG  27           HE       ARG  27  -5.215  -1.663  13.043
  215   HH11  ARG  27          HH21      ARG  27  -3.052  -4.353  12.501
  216   HH12  ARG  27          HH22      ARG  27  -1.656  -3.535  13.116
  217   HH21  ARG  27          HH11      ARG  27  -3.374  -0.565  13.881
  218   HH22  ARG  27          HH12      ARG  27  -1.845  -1.378  13.912
  219    H    THR  28           HN       THR  28  -8.946  -0.027  12.646
  220    HA   THR  28           HA       THR  28 -11.034   0.959  10.973
  221    HB   THR  28           HB       THR  28  -8.840   2.598  12.247
  222    HG1  THR  28           HG1      THR  28  -9.530   1.894  14.109
  223   HG21  THR  28          HG21      THR  28 -10.393   3.845  10.840
  224   HG22  THR  28          HG22      THR  28 -10.645   4.252  12.537
  225   HG23  THR  28          HG23      THR  28 -11.762   3.162  11.717
  226    HA   PRO  29           HA       PRO  29  -9.197   1.260   6.944
  227    HB2  PRO  29           HB2      PRO  29 -10.112   4.097   7.272
  228    HB3  PRO  29           HB1      PRO  29 -10.232   3.040   5.859
  229    HG2  PRO  29           HG2      PRO  29 -12.322   3.388   7.474
  230    HG3  PRO  29           HG1      PRO  29 -11.969   1.802   6.764
  231    HD2  PRO  29           HD2      PRO  29 -11.687   2.713   9.559
  232    HD3  PRO  29           HD1      PRO  29 -11.867   1.069   8.921
  233    H    HIS  30           HN       HIS  30  -8.464   3.950   9.188
  234    HA   HIS  30           HA       HIS  30  -6.205   4.861   7.745
  235    HB2  HIS  30           HB2      HIS  30  -7.226   5.300  10.521
  236    HB3  HIS  30           HB1      HIS  30  -5.602   5.841  10.104
  237    HD1  HIS  30           HD1      HIS  30  -8.694   7.314  10.469
  238    HD2  HIS  30           HD2      HIS  30  -5.993   7.252   7.307
  239    HE1  HIS  30           HE1      HIS  30  -9.264   9.315   9.056
  240    HE2  HIS  30           HE2      HIS  30  -7.511   9.348   7.243
  241    H    TRP  31           HN       TRP  31  -6.498   2.667  10.526
  242    HA   TRP  31           HA       TRP  31  -3.716   2.250  10.824
  243    HB2  TRP  31           HB2      TRP  31  -5.677   0.092  11.512
  244    HB3  TRP  31           HB1      TRP  31  -4.209   0.550  12.353
  245    HD1  TRP  31           HD1      TRP  31  -7.090   0.115  13.719
  246    HE1  TRP  31           HE1      TRP  31  -8.092   2.010  15.143
  247    HE3  TRP  31           HE3      TRP  31  -4.412   4.064  11.847
  248    HZ2  TRP  31           HZ2      TRP  31  -7.813   4.792  15.416
  249    HZ3  TRP  31           HZ3      TRP  31  -4.848   6.307  12.752
  250    HH2  TRP  31           HH2      TRP  31  -6.513   6.663  14.500
  251    H    LEU  32           HN       LEU  32  -6.278   0.794   9.055
  252    HA   LEU  32           HA       LEU  32  -4.935  -1.407   7.999
  253    HB2  LEU  32           HB2      LEU  32  -7.361  -1.198   7.916
  254    HB3  LEU  32           HB1      LEU  32  -7.214   0.167   6.828
  255    HG   LEU  32           HG       LEU  32  -7.856  -2.112   5.834
  256   HD11  LEU  32          HD11      LEU  32  -5.507  -0.687   4.604
  257   HD12  LEU  32          HD12      LEU  32  -7.182  -0.144   4.506
  258   HD13  LEU  32          HD13      LEU  32  -6.707  -1.676   3.771
  259   HD21  LEU  32          HD21      LEU  32  -6.043  -3.610   5.275
  260   HD22  LEU  32          HD22      LEU  32  -6.149  -3.416   7.025
  261   HD23  LEU  32          HD23      LEU  32  -4.892  -2.574   6.118
  262    H    ILE  33           HN       ILE  33  -5.185   1.909   6.873
  263    HA   ILE  33           HA       ILE  33  -4.048   1.566   4.346
  264    HB   ILE  33           HB       ILE  33  -3.848   3.909   6.249
  265   HG12  ILE  33          HG12      ILE  33  -5.416   3.609   3.683
  266   HG13  ILE  33          HG11      ILE  33  -6.086   3.312   5.284
  267   HG21  ILE  33          HG21      ILE  33  -2.918   3.736   3.389
  268   HG22  ILE  33          HG22      ILE  33  -1.923   4.026   4.816
  269   HG23  ILE  33          HG23      ILE  33  -3.097   5.236   4.299
  270   HD11  ILE  33          HD11      ILE  33  -4.920   5.842   5.430
  271   HD12  ILE  33          HD12      ILE  33  -6.639   5.452   5.359
  272   HD13  ILE  33          HD13      ILE  33  -5.749   5.787   3.874
  273    H    LYS  34           HN       LYS  34  -2.522   2.305   7.451
  274    HA   LYS  34           HA       LYS  34   0.157   2.234   6.594
  275    HB2  LYS  34           HB2      LYS  34  -0.602   1.148   9.281
  276    HB3  LYS  34           HB1      LYS  34   0.749   2.181   8.847
  277    HG2  LYS  34           HG2      LYS  34  -0.889   4.033   8.494
  278    HG3  LYS  34           HG1      LYS  34  -2.133   2.972   9.156
  279    HD2  LYS  34           HD2      LYS  34   0.382   3.842  10.582
  280    HD3  LYS  34           HD1      LYS  34  -1.233   4.494  10.858
  281    HE2  LYS  34           HE2      LYS  34  -1.121   2.963  12.555
  282    HE3  LYS  34           HE1      LYS  34  -1.817   1.961  11.284
  283    HZ1  LYS  34           HZ1      LYS  34  -0.033   0.659  11.261
  284    HZ2  LYS  34           HZ2      LYS  34   0.433   1.406  12.708
  285    HZ3  LYS  34           HZ3      LYS  34   1.039   1.969  11.233
  286    H    GLN  35           HN       GLN  35  -1.952  -0.288   7.880
  287    HA   GLN  35           HA       GLN  35  -0.001  -2.347   7.810
  288    HB2  GLN  35           HB2      GLN  35  -3.011  -2.483   7.970
  289    HB3  GLN  35           HB1      GLN  35  -1.947  -3.872   8.140
  290    HG2  GLN  35           HG2      GLN  35  -1.981  -1.448   9.922
  291    HG3  GLN  35           HG1      GLN  35  -2.679  -3.020  10.300
  292   HE21  GLN  35          HE21      GLN  35  -0.548  -4.582   9.193
  293   HE22  GLN  35          HE22      GLN  35   0.810  -4.406  10.245
  294    H    ALA  36           HN       ALA  36  -2.504  -1.336   5.527
  295    HA   ALA  36           HA       ALA  36  -2.472  -3.546   3.854
  296    HB1  ALA  36           HB1      ALA  36  -3.167  -1.926   2.057
  297    HB2  ALA  36           HB2      ALA  36  -2.943  -0.639   3.242
  298    HB3  ALA  36           HB3      ALA  36  -4.143  -1.900   3.525
  299    H    ILE  37           HN       ILE  37  -0.379  -0.676   3.826
  300    HA   ILE  37           HA       ILE  37   1.110  -1.786   1.620
  301    HB   ILE  37           HB       ILE  37   0.739   0.656   1.851
  302   HG12  ILE  37          HG12      ILE  37   3.092   1.319   1.313
  303   HG13  ILE  37          HG11      ILE  37   3.603  -0.300   1.782
  304   HG21  ILE  37          HG21      ILE  37   2.677   0.444   4.143
  305   HG22  ILE  37          HG22      ILE  37   0.975   0.899   4.241
  306   HG23  ILE  37          HG23      ILE  37   2.122   1.947   3.406
  307   HD11  ILE  37          HD11      ILE  37   2.468  -1.286  -0.018
  308   HD12  ILE  37          HD12      ILE  37   3.278   0.132  -0.685
  309   HD13  ILE  37          HD13      ILE  37   1.548   0.182  -0.346
  310    H    PHE  38           HN       PHE  38   1.656  -1.417   5.108
  311    HA   PHE  38           HA       PHE  38   4.334  -2.445   4.979
  312    HB2  PHE  38           HB2      PHE  38   4.147  -1.148   6.860
  313    HB3  PHE  38           HB1      PHE  38   2.448  -1.530   7.087
  314    HD1  PHE  38           HD1      PHE  38   5.696  -3.402   7.204
  315    HD2  PHE  38           HD2      PHE  38   1.957  -2.549   9.046
  316    HE1  PHE  38           HE1      PHE  38   6.267  -4.914   9.059
  317    HE2  PHE  38           HE2      PHE  38   2.521  -4.059  10.902
  318    HZ   PHE  38           HZ       PHE  38   4.677  -5.245  10.910
  319    H    ASN  39           HN       ASN  39   1.173  -3.800   5.789
  320    HA   ASN  39           HA       ASN  39   2.136  -6.363   6.485
  321    HB2  ASN  39           HB2      ASN  39  -0.182  -5.516   7.023
  322    HB3  ASN  39           HB1      ASN  39  -0.573  -5.731   5.321
  323   HD21  ASN  39          HD21      ASN  39  -2.027  -7.321   5.400
  324   HD22  ASN  39          HD22      ASN  39  -1.737  -8.886   6.074
  325    H    TYR  40           HN       TYR  40   1.399  -4.701   3.504
  326    HA   TYR  40           HA       TYR  40   1.346  -6.913   1.792
  327    HB2  TYR  40           HB2      TYR  40   0.797  -4.736   0.892
  328    HB3  TYR  40           HB1      TYR  40   2.370  -4.094   1.351
  329    HD1  TYR  40           HD1      TYR  40   0.816  -6.692  -0.823
  330    HD2  TYR  40           HD2      TYR  40   4.089  -4.040  -0.229
  331    HE1  TYR  40           HE1      TYR  40   1.677  -7.269  -3.049
  332    HE2  TYR  40           HE2      TYR  40   4.962  -4.611  -2.458
  333    HH   TYR  40           HH       TYR  40   4.422  -5.588  -4.455
  334    H    LEU  41           HN       LEU  41   3.950  -4.911   3.021
  335    HA   LEU  41           HA       LEU  41   6.053  -6.271   1.753
  336    HB2  LEU  41           HB2      LEU  41   6.045  -4.630   4.265
  337    HB3  LEU  41           HB1      LEU  41   7.494  -5.156   3.425
  338    HG   LEU  41           HG       LEU  41   5.368  -3.390   2.210
  339   HD11  LEU  41          HD11      LEU  41   8.005  -2.712   3.474
  340   HD12  LEU  41          HD12      LEU  41   6.401  -2.142   3.937
  341   HD13  LEU  41          HD13      LEU  41   7.115  -1.626   2.410
  342   HD21  LEU  41          HD21      LEU  41   6.507  -4.580   0.494
  343   HD22  LEU  41          HD22      LEU  41   8.074  -4.294   1.250
  344   HD23  LEU  41          HD23      LEU  41   7.181  -2.951   0.537
  345    H    GLU  42           HN       GLU  42   4.530  -6.666   4.889
  346    HA   GLU  42           HA       GLU  42   6.215  -8.702   5.913
  347    HB2  GLU  42           HB2      GLU  42   4.679  -7.291   7.280
  348    HB3  GLU  42           HB1      GLU  42   3.310  -8.110   6.549
  349    HG2  GLU  42           HG2      GLU  42   4.058 -10.226   7.544
  350    HG3  GLU  42           HG1      GLU  42   5.412  -9.381   8.290
  351    H    LYS  43           HN       LYS  43   3.447  -8.674   3.820
  352    HA   LYS  43           HA       LYS  43   2.728 -11.401   3.962
  353    HB2  LYS  43           HB2      LYS  43   1.465  -9.313   3.021
  354    HB3  LYS  43           HB1      LYS  43   2.289  -9.717   1.523
  355    HG2  LYS  43           HG2      LYS  43   0.320 -10.831   1.236
  356    HG3  LYS  43           HG1      LYS  43   1.296 -12.098   1.984
  357    HD2  LYS  43           HD2      LYS  43   0.334 -11.584   4.160
  358    HD3  LYS  43           HD1      LYS  43  -0.597 -10.262   3.455
  359    HE2  LYS  43           HE2      LYS  43  -1.771 -11.891   2.023
  360    HE3  LYS  43           HE1      LYS  43  -0.874 -13.194   2.802
  361    HZ1  LYS  43           HZ1      LYS  43  -1.857 -12.421   4.942
  362    HZ2  LYS  43           HZ2      LYS  43  -2.978 -13.052   3.846
  363    HZ3  LYS  43           HZ3      LYS  43  -2.858 -11.378   4.058
  364    H    LEU  44           HN       LEU  44   4.891  -9.607   1.784
  365    HA   LEU  44           HA       LEU  44   5.327 -11.868   0.076
  366    HB2  LEU  44           HB2      LEU  44   7.485  -9.977  -0.092
  367    HB3  LEU  44           HB1      LEU  44   6.329 -10.467  -1.309
  368    HG   LEU  44           HG       LEU  44   5.522  -8.464   0.752
  369   HD11  LEU  44          HD11      LEU  44   6.410  -6.671  -0.551
  370   HD12  LEU  44          HD12      LEU  44   6.994  -7.786  -1.787
  371   HD13  LEU  44          HD13      LEU  44   7.732  -7.780  -0.184
  372   HD21  LEU  44          HD21      LEU  44   3.833  -9.365  -0.746
  373   HD22  LEU  44          HD22      LEU  44   4.815  -8.923  -2.143
  374   HD23  LEU  44          HD23      LEU  44   4.138  -7.666  -1.107
  375    H    GLU  45           HN       GLU  45   7.063 -10.489   2.837
  376    HA   GLU  45           HA       GLU  45   9.388 -12.083   2.389
  377    HB2  GLU  45           HB2      GLU  45  10.052 -11.405   4.690
  378    HB3  GLU  45           HB1      GLU  45   9.655 -10.064   3.637
  379    HG2  GLU  45           HG2      GLU  45   7.880  -9.431   4.870
  380    HG3  GLU  45           HG1      GLU  45   7.470 -11.081   5.337
  381    H1   MET  46           HT1      MET  46  -4.107  -0.335 -10.520
  382    H2   MET  46           HT2      MET  46  -5.101   1.042 -10.537
  383    H3   MET  46           HT3      MET  46  -3.453   1.184 -10.172
  384    HA   MET  46           HA       MET  46  -2.780   0.718 -12.342
  385    HB2  MET  46           HB2      MET  46  -5.677   0.017 -12.877
  386    HB3  MET  46           HB1      MET  46  -4.398   0.044 -14.087
  387    HG2  MET  46           HG2      MET  46  -4.461  -1.742 -11.661
  388    HG3  MET  46           HG1      MET  46  -4.897  -2.224 -13.302
  389    HE1  MET  46           HE1      MET  46  -3.372  -2.608 -15.195
  390    HE2  MET  46           HE2      MET  46  -1.625  -2.372 -15.218
  391    HE3  MET  46           HE3      MET  46  -2.703  -0.976 -15.229
  392    H    ALA  47           HN       ALA  47  -6.035   2.072 -11.915
  393    HA   ALA  47           HA       ALA  47  -5.209   4.523 -13.310
  394    HB1  ALA  47           HB1      ALA  47  -7.666   5.039 -13.218
  395    HB2  ALA  47           HB2      ALA  47  -7.918   3.455 -12.483
  396    HB3  ALA  47           HB3      ALA  47  -7.279   3.575 -14.122
  397    H    THR  48           HN       THR  48  -4.187   3.740 -10.867
  398    HA   THR  48           HA       THR  48  -5.417   4.754  -8.566
  399    HB   THR  48           HB       THR  48  -2.968   4.615  -7.726
  400    HG1  THR  48           HG1      THR  48  -2.356   4.633 -10.138
  401   HG21  THR  48          HG21      THR  48  -4.349   2.179  -8.867
  402   HG22  THR  48          HG22      THR  48  -4.612   2.874  -7.268
  403   HG23  THR  48          HG23      THR  48  -3.055   2.151  -7.670
  404    H    THR  49           HN       THR  49  -5.509   6.704  -7.733
  405    HA   THR  49           HA       THR  49  -3.992   8.887  -8.970
  406    HB   THR  49           HB       THR  49  -6.338   9.053  -7.055
  407    HG1  THR  49           HG1      THR  49  -7.290   8.293  -8.840
  408   HG21  THR  49          HG21      THR  49  -6.527  11.361  -7.862
  409   HG22  THR  49          HG22      THR  49  -5.103  11.129  -8.875
  410   HG23  THR  49          HG23      THR  49  -4.953  11.080  -7.118
  411    H    THR  50           HN       THR  50  -2.894  10.436  -7.564
  412    HA   THR  50           HA       THR  50  -1.472   9.134  -5.467
  413    HB   THR  50           HB       THR  50  -1.462  12.098  -6.028
  414    HG1  THR  50           HG1      THR  50   0.187  11.587  -7.573
  415   HG21  THR  50          HG21      THR  50   0.664  10.199  -5.022
  416   HG22  THR  50          HG22      THR  50  -0.229  11.360  -4.040
  417   HG23  THR  50          HG23      THR  50   0.873  11.928  -5.295
  418    H    LEU  51           HN       LEU  51  -2.409   8.686  -3.633
  419    HA   LEU  51           HA       LEU  51  -4.027  10.736  -2.266
  420    HB2  LEU  51           HB2      LEU  51  -4.298   7.734  -2.000
  421    HB3  LEU  51           HB1      LEU  51  -5.306   8.943  -1.234
  422    HG   LEU  51           HG       LEU  51  -5.218   8.227  -4.164
  423   HD11  LEU  51          HD11      LEU  51  -6.511   6.829  -2.452
  424   HD12  LEU  51          HD12      LEU  51  -7.377   7.394  -3.880
  425   HD13  LEU  51          HD13      LEU  51  -7.593   8.217  -2.335
  426   HD21  LEU  51          HD21      LEU  51  -6.691  10.475  -2.798
  427   HD22  LEU  51          HD22      LEU  51  -7.008   9.915  -4.440
  428   HD23  LEU  51          HD23      LEU  51  -5.443  10.620  -4.036
  429    H    GLY  52           HN       GLY  52  -3.839  10.665   0.098
  430    HA2  GLY  52           HA2      GLY  52  -1.112  10.316   0.910
  431    HA3  GLY  52           HA1      GLY  52  -2.443  10.842   1.931
  432    H    VAL  53           HN       VAL  53  -0.175   8.582   1.717
  433    HA   VAL  53           HA       VAL  53  -1.784   6.570   3.146
  434    HB   VAL  53           HB       VAL  53   0.221   6.089   0.938
  435   HG11  VAL  53          HG11      VAL  53   0.016   3.669   1.401
  436   HG12  VAL  53          HG12      VAL  53  -0.836   4.055   2.896
  437   HG13  VAL  53          HG13      VAL  53   0.844   4.549   2.686
  438   HG21  VAL  53          HG21      VAL  53  -1.591   4.735  -0.013
  439   HG22  VAL  53          HG22      VAL  53  -2.071   6.415   0.229
  440   HG23  VAL  53          HG23      VAL  53  -2.618   5.171   1.353
  441    H    LYS  54           HN       LYS  54  -0.393   5.209   4.613
  442    HA   LYS  54           HA       LYS  54   1.746   6.892   5.693
  443    HB2  LYS  54           HB2      LYS  54   0.435   4.534   7.032
  444    HB3  LYS  54           HB1      LYS  54   1.413   5.791   7.780
  445    HG2  LYS  54           HG2      LYS  54  -0.489   7.343   6.783
  446    HG3  LYS  54           HG1      LYS  54  -1.421   5.851   6.925
  447    HD2  LYS  54           HD2      LYS  54  -1.763   6.465   9.048
  448    HD3  LYS  54           HD1      LYS  54  -0.092   5.971   9.325
  449    HE2  LYS  54           HE2      LYS  54  -1.085   8.742   8.678
  450    HE3  LYS  54           HE1      LYS  54  -0.424   8.186  10.214
  451    HZ1  LYS  54           HZ1      LYS  54   1.713   8.024   9.315
  452    HZ2  LYS  54           HZ2      LYS  54   1.105   9.478   8.686
  453    HZ3  LYS  54           HZ3      LYS  54   1.154   8.095   7.717
  454    H    LEU  55           HN       LEU  55   3.788   6.352   5.378
  455    HA   LEU  55           HA       LEU  55   4.476   3.519   4.956
  456    HB2  LEU  55           HB2      LEU  55   5.131   5.898   3.291
  457    HB3  LEU  55           HB1      LEU  55   6.336   4.636   3.440
  458    HG   LEU  55           HG       LEU  55   3.533   3.998   2.568
  459   HD11  LEU  55          HD11      LEU  55   5.838   4.931   0.865
  460   HD12  LEU  55          HD12      LEU  55   4.264   5.707   1.042
  461   HD13  LEU  55          HD13      LEU  55   4.391   4.141   0.241
  462   HD21  LEU  55          HD21      LEU  55   4.884   2.201   1.361
  463   HD22  LEU  55          HD22      LEU  55   4.743   2.065   3.113
  464   HD23  LEU  55          HD23      LEU  55   6.228   2.689   2.393
  465    H    ASP  56           HN       ASP  56   6.273   2.810   5.934
  466    HA   ASP  56           HA       ASP  56   7.614   4.542   7.849
  467    HB2  ASP  56           HB2      ASP  56   7.148   1.686   7.528
  468    HB3  ASP  56           HB1      ASP  56   8.850   2.008   7.830
  469    H    ASP  57           HN       ASP  57   9.849   5.085   7.700
  470    HA   ASP  57           HA       ASP  57  10.910   5.515   5.182
  471    HB2  ASP  57           HB2      ASP  57  12.050   5.553   7.920
  472    HB3  ASP  57           HB1      ASP  57  13.198   5.488   6.587
  473    HA   PRO  58           HA       PRO  58  13.743   1.571   5.525
  474    HB2  PRO  58           HB2      PRO  58  12.844  -0.366   7.260
  475    HB3  PRO  58           HB1      PRO  58  14.108   0.803   7.655
  476    HG2  PRO  58           HG2      PRO  58  11.198   0.851   8.346
  477    HG3  PRO  58           HG1      PRO  58  12.596   1.282   9.349
  478    HD2  PRO  58           HD2      PRO  58  11.064   3.156   8.185
  479    HD3  PRO  58           HD1      PRO  58  12.818   3.367   8.363
  480    H    THR  59           HN       THR  59  10.321   1.449   6.099
  481    HA   THR  59           HA       THR  59   9.774  -0.907   4.618
  482    HB   THR  59           HB       THR  59   8.266   1.159   6.026
  483    HG1  THR  59           HG1      THR  59   7.948  -0.662   7.025
  484   HG21  THR  59          HG21      THR  59   7.183   1.651   3.973
  485   HG22  THR  59          HG22      THR  59   6.102   0.590   4.876
  486   HG23  THR  59          HG23      THR  59   7.066  -0.056   3.550
  487    H    ARG  60           HN       ARG  60   9.930   2.525   3.876
  488    HA   ARG  60           HA       ARG  60   8.910   2.482   1.264
  489    HB2  ARG  60           HB2      ARG  60   9.380   4.532   2.614
  490    HB3  ARG  60           HB1      ARG  60  11.100   4.252   2.383
  491    HG2  ARG  60           HG2      ARG  60  10.484   5.894   0.820
  492    HG3  ARG  60           HG1      ARG  60  10.666   4.395  -0.095
  493    HD2  ARG  60           HD2      ARG  60   8.198   4.070   0.094
  494    HD3  ARG  60           HD1      ARG  60   8.096   5.674   0.819
  495    HE   ARG  60           HE       ARG  60   8.628   6.631  -1.242
  496   HH11  ARG  60          HH21      ARG  60   8.559   3.136  -1.402
  497   HH12  ARG  60          HH22      ARG  60   8.505   3.083  -3.131
  498   HH21  ARG  60          HH11      ARG  60   8.607   6.573  -3.526
  499   HH22  ARG  60          HH12      ARG  60   8.533   5.047  -4.342
  500    H    GLU  61           HN       GLU  61  12.132   1.944   2.574
  501    HA   GLU  61           HA       GLU  61  13.564   1.664   0.177
  502    HB2  GLU  61           HB2      GLU  61  13.990   0.254   2.824
  503    HB3  GLU  61           HB1      GLU  61  15.173   0.362   1.531
  504    HG2  GLU  61           HG2      GLU  61  15.264   2.780   1.803
  505    HG3  GLU  61           HG1      GLU  61  14.062   2.684   3.090
  506    H    ARG  62           HN       ARG  62  11.714  -0.624   2.122
  507    HA   ARG  62           HA       ARG  62  12.349  -2.931   0.635
  508    HB2  ARG  62           HB2      ARG  62   9.966  -2.329   2.387
  509    HB3  ARG  62           HB1      ARG  62  10.273  -3.904   1.665
  510    HG2  ARG  62           HG2      ARG  62  12.535  -3.822   2.817
  511    HG3  ARG  62           HG1      ARG  62  11.893  -2.460   3.736
  512    HD2  ARG  62           HD2      ARG  62  10.680  -5.219   3.616
  513    HD3  ARG  62           HD1      ARG  62  11.670  -4.597   4.933
  514    HE   ARG  62           HE       ARG  62   9.526  -2.843   4.549
  515   HH11  ARG  62          HH21      ARG  62  10.119  -6.124   5.612
  516   HH12  ARG  62          HH22      ARG  62   8.733  -6.184   6.651
  517   HH21  ARG  62          HH11      ARG  62   7.692  -2.899   5.934
  518   HH22  ARG  62          HH12      ARG  62   7.348  -4.346   6.832
  519    H    LEU  63           HN       LEU  63   9.932  -0.422   0.206
  520    HA   LEU  63           HA       LEU  63   8.410  -1.718  -1.768
  521    HB2  LEU  63           HB2      LEU  63   8.816   1.099  -0.953
  522    HB3  LEU  63           HB1      LEU  63   8.262   0.854  -2.598
  523    HG   LEU  63           HG       LEU  63   6.391  -0.568  -1.599
  524   HD11  LEU  63          HD11      LEU  63   5.840  -0.310   0.680
  525   HD12  LEU  63          HD12      LEU  63   7.083   0.917   0.916
  526   HD13  LEU  63          HD13      LEU  63   7.545  -0.760   0.626
  527   HD21  LEU  63          HD21      LEU  63   5.066   1.445  -0.988
  528   HD22  LEU  63          HD22      LEU  63   5.936   1.598  -2.514
  529   HD23  LEU  63          HD23      LEU  63   6.551   2.392  -1.065
  530    H    LYS  64           HN       LYS  64  11.419   0.154  -1.919
  531    HA   LYS  64           HA       LYS  64  11.668   0.158  -4.736
  532    HB2  LYS  64           HB2      LYS  64  13.847   0.108  -2.646
  533    HB3  LYS  64           HB1      LYS  64  14.100   0.447  -4.350
  534    HG2  LYS  64           HG2      LYS  64  12.726   2.450  -4.167
  535    HG3  LYS  64           HG1      LYS  64  12.460   2.112  -2.452
  536    HD2  LYS  64           HD2      LYS  64  14.900   2.226  -2.087
  537    HD3  LYS  64           HD1      LYS  64  15.119   2.643  -3.786
  538    HE2  LYS  64           HE2      LYS  64  13.625   4.245  -1.713
  539    HE3  LYS  64           HE1      LYS  64  15.198   4.635  -2.406
  540    HZ1  LYS  64           HZ1      LYS  64  12.573   4.632  -3.772
  541    HZ2  LYS  64           HZ2      LYS  64  14.042   4.718  -4.606
  542    HZ3  LYS  64           HZ3      LYS  64  13.613   5.945  -3.519
  543    H    ALA  65           HN       ALA  65  12.687  -2.084  -2.271
  544    HA   ALA  65           HA       ALA  65  13.996  -3.941  -3.917
  545    HB1  ALA  65           HB1      ALA  65  14.285  -3.883  -1.478
  546    HB2  ALA  65           HB2      ALA  65  13.803  -5.484  -2.040
  547    HB3  ALA  65           HB3      ALA  65  12.619  -4.425  -1.273
  548    H    ALA  66           HN       ALA  66  10.659  -3.605  -2.824
  549    HA   ALA  66           HA       ALA  66   9.654  -5.975  -3.963
  550    HB1  ALA  66           HB1      ALA  66   8.423  -4.602  -2.310
  551    HB2  ALA  66           HB2      ALA  66   7.461  -4.955  -3.746
  552    HB3  ALA  66           HB3      ALA  66   8.193  -3.364  -3.544
  553    H    ALA  67           HN       ALA  67  10.100  -2.713  -5.179
  554    HA   ALA  67           HA       ALA  67   8.926  -3.007  -7.708
  555    HB1  ALA  67           HB1      ALA  67   9.629  -0.856  -6.601
  556    HB2  ALA  67           HB2      ALA  67  10.050  -1.001  -8.307
  557    HB3  ALA  67           HB3      ALA  67  11.282  -1.253  -7.070
  558    H    GLN  68           HN       GLN  68  12.275  -3.265  -6.710
  559    HA   GLN  68           HA       GLN  68  13.276  -4.081  -9.212
  560    HB2  GLN  68           HB2      GLN  68  15.318  -4.259  -8.168
  561    HB3  GLN  68           HB1      GLN  68  14.465  -3.261  -7.022
  562    HG2  GLN  68           HG2      GLN  68  15.416  -4.712  -5.592
  563    HG3  GLN  68           HG1      GLN  68  13.894  -5.548  -5.891
  564   HE21  GLN  68          HE21      GLN  68  14.594  -7.617  -5.596
  565   HE22  GLN  68          HE22      GLN  68  15.777  -8.391  -6.587
  566    H    SER  69           HN       SER  69  11.992  -5.809  -6.465
  567    HA   SER  69           HA       SER  69  12.698  -8.364  -7.346
  568    HB2  SER  69           HB2      SER  69  12.052  -7.774  -4.995
  569    HB3  SER  69           HB1      SER  69  10.382  -7.638  -5.537
  570    HG   SER  69           HG       SER  69  10.413  -9.679  -4.945
  571    H    ILE  70           HN       ILE  70  10.064  -6.232  -8.065
  572    HA   ILE  70           HA       ILE  70   8.636  -8.330  -9.517
  573    HB   ILE  70           HB       ILE  70   7.681  -6.483  -7.791
  574   HG12  ILE  70          HG12      ILE  70   6.493  -8.461  -8.659
  575   HG13  ILE  70          HG11      ILE  70   5.459  -7.044  -8.561
  576   HG21  ILE  70          HG21      ILE  70   8.225  -4.622  -9.312
  577   HG22  ILE  70          HG22      ILE  70   6.516  -4.718  -8.886
  578   HG23  ILE  70          HG23      ILE  70   7.063  -5.274 -10.467
  579   HD11  ILE  70          HD11      ILE  70   5.784  -6.714 -10.997
  580   HD12  ILE  70          HD12      ILE  70   4.977  -8.224 -10.576
  581   HD13  ILE  70          HD13      ILE  70   6.679  -8.233 -11.038
  582    H    ASP  71           HN       ASP  71  11.050  -6.319 -10.071
  583    HA   ASP  71           HA       ASP  71  12.096  -5.488 -11.884
  584    HB2  ASP  71           HB2      ASP  71  11.484  -7.773 -12.778
  585    HB3  ASP  71           HB1      ASP  71  10.111  -7.012 -13.572
  586    H    ARG  72           HN       ARG  72  10.263  -3.816 -10.731
  587    HA   ARG  72           HA       ARG  72   9.497  -2.248 -13.093
  588    HB2  ARG  72           HB2      ARG  72   7.694  -2.689 -10.706
  589    HB3  ARG  72           HB1      ARG  72   7.393  -1.540 -12.004
  590    HG2  ARG  72           HG2      ARG  72   7.297  -3.379 -13.610
  591    HG3  ARG  72           HG1      ARG  72   7.584  -4.530 -12.306
  592    HD2  ARG  72           HD2      ARG  72   5.258  -4.544 -12.668
  593    HD3  ARG  72           HD1      ARG  72   5.505  -3.586 -11.208
  594    HE   ARG  72           HE       ARG  72   5.479  -1.709 -13.135
  595   HH11  ARG  72          HH21      ARG  72   3.314  -4.343 -12.379
  596   HH12  ARG  72          HH22      ARG  72   1.923  -3.579 -13.071
  597   HH21  ARG  72          HH11      ARG  72   3.645  -0.686 -14.065
  598   HH22  ARG  72          HH12      ARG  72   2.115  -1.498 -14.040
  599    H    THR  73           HN       THR  73   9.086   0.021 -12.573
  600    HA   THR  73           HA       THR  73  11.194   1.064 -10.944
  601    HB   THR  73           HB       THR  73   8.972   2.648 -12.234
  602    HG1  THR  73           HG1      THR  73  11.211   1.384 -13.470
  603   HG21  THR  73          HG21      THR  73  10.532   3.936 -10.870
  604   HG22  THR  73          HG22      THR  73  10.743   4.331 -12.574
  605   HG23  THR  73          HG23      THR  73  11.897   3.268 -11.768
  606    HA   PRO  74           HA       PRO  74   9.347   1.382  -6.903
  607    HB2  PRO  74           HB2      PRO  74  10.221   4.231  -7.252
  608    HB3  PRO  74           HB1      PRO  74  10.373   3.180  -5.837
  609    HG2  PRO  74           HG2      PRO  74  12.439   3.558  -7.475
  610    HG3  PRO  74           HG1      PRO  74  12.121   1.970  -6.756
  611    HD2  PRO  74           HD2      PRO  74  11.791   2.868  -9.550
  612    HD3  PRO  74           HD1      PRO  74  12.020   1.230  -8.911
  613    H    HIS  75           HN       HIS  75   8.569   3.998  -9.199
  614    HA   HIS  75           HA       HIS  75   6.307   4.931  -7.774
  615    HB2  HIS  75           HB2      HIS  75   7.350   5.310 -10.546
  616    HB3  HIS  75           HB1      HIS  75   5.701   5.814 -10.185
  617    HD1  HIS  75           HD1      HIS  75   8.752   7.366 -10.534
  618    HD2  HIS  75           HD2      HIS  75   5.979   7.342  -7.438
  619    HE1  HIS  75           HE1      HIS  75   9.221   9.440  -9.197
  620    HE2  HIS  75           HE2      HIS  75   7.359   9.533  -7.502
  621    H    TRP  76           HN       TRP  76   6.603   2.700 -10.537
  622    HA   TRP  76           HA       TRP  76   3.821   2.236 -10.767
  623    HB2  TRP  76           HB2      TRP  76   5.739   0.075 -11.513
  624    HB3  TRP  76           HB1      TRP  76   4.298   0.615 -12.356
  625    HD1  TRP  76           HD1      TRP  76   7.324   0.150 -13.554
  626    HE1  TRP  76           HE1      TRP  76   8.369   2.049 -14.935
  627    HE3  TRP  76           HE3      TRP  76   4.410   4.042 -11.943
  628    HZ2  TRP  76           HZ2      TRP  76   8.010   4.815 -15.301
  629    HZ3  TRP  76           HZ3      TRP  76   4.831   6.281 -12.866
  630    HH2  TRP  76           HH2      TRP  76   6.594   6.659 -14.510
  631    H    LEU  77           HN       LEU  77   6.442   0.848  -9.032
  632    HA   LEU  77           HA       LEU  77   5.159  -1.378  -7.949
  633    HB2  LEU  77           HB2      LEU  77   7.583  -1.104  -7.875
  634    HB3  LEU  77           HB1      LEU  77   7.402   0.261  -6.793
  635    HG   LEU  77           HG       LEU  77   8.102  -1.999  -5.790
  636   HD11  LEU  77          HD11      LEU  77   5.722  -0.621  -4.567
  637   HD12  LEU  77          HD12      LEU  77   7.384  -0.040  -4.473
  638   HD13  LEU  77          HD13      LEU  77   6.944  -1.578  -3.728
  639   HD21  LEU  77          HD21      LEU  77   6.324  -3.534  -5.215
  640   HD22  LEU  77          HD22      LEU  77   6.425  -3.353  -6.966
  641   HD23  LEU  77          HD23      LEU  77   5.149  -2.532  -6.067
  642    H    ILE  78           HN       ILE  78   5.338   1.957  -6.854
  643    HA   ILE  78           HA       ILE  78   4.209   1.616  -4.324
  644    HB   ILE  78           HB       ILE  78   3.956   3.931  -6.250
  645   HG12  ILE  78          HG12      ILE  78   5.534   3.696  -3.684
  646   HG13  ILE  78          HG11      ILE  78   6.207   3.394  -5.283
  647   HG21  ILE  78          HG21      ILE  78   3.032   3.764  -3.389
  648   HG22  ILE  78          HG22      ILE  78   2.030   4.020  -4.818
  649   HG23  ILE  78          HG23      ILE  78   3.177   5.260  -4.311
  650   HD11  ILE  78          HD11      ILE  78   4.984   5.892  -5.462
  651   HD12  ILE  78          HD12      ILE  78   6.711   5.543  -5.388
  652   HD13  ILE  78          HD13      ILE  78   5.815   5.879  -3.906
  653    H    LYS  79           HN       LYS  79   2.666   2.284  -7.437
  654    HA   LYS  79           HA       LYS  79  -0.010   2.164  -6.584
  655    HB2  LYS  79           HB2      LYS  79   0.790   1.063  -9.255
  656    HB3  LYS  79           HB1      LYS  79  -0.599   2.053  -8.839
  657    HG2  LYS  79           HG2      LYS  79   0.966   3.968  -8.509
  658    HG3  LYS  79           HG1      LYS  79   2.254   2.944  -9.143
  659    HD2  LYS  79           HD2      LYS  79  -0.282   3.687 -10.603
  660    HD3  LYS  79           HD1      LYS  79   1.307   4.399 -10.880
  661    HE2  LYS  79           HE2      LYS  79   1.313   2.835 -12.538
  662    HE3  LYS  79           HE1      LYS  79   1.975   1.858 -11.231
  663    HZ1  LYS  79           HZ1      LYS  79   0.212   0.529 -11.260
  664    HZ2  LYS  79           HZ2      LYS  79  -0.207   1.249 -12.735
  665    HZ3  LYS  79           HZ3      LYS  79  -0.882   1.820 -11.293
  666    H    GLN  80           HN       GLN  80   2.149  -0.325  -7.849
  667    HA   GLN  80           HA       GLN  80   0.247  -2.426  -7.749
  668    HB2  GLN  80           HB2      GLN  80   3.260  -2.492  -7.907
  669    HB3  GLN  80           HB1      GLN  80   2.231  -3.910  -8.058
  670    HG2  GLN  80           HG2      GLN  80   2.212  -1.511  -9.875
  671    HG3  GLN  80           HG1      GLN  80   2.936  -3.076 -10.231
  672   HE21  GLN  80          HE21      GLN  80   0.836  -4.656  -9.095
  673   HE22  GLN  80          HE22      GLN  80  -0.529  -4.519 -10.144
  674    H    ALA  81           HN       ALA  81   2.731  -1.335  -5.477
  675    HA   ALA  81           HA       ALA  81   2.744  -3.525  -3.778
  676    HB1  ALA  81           HB1      ALA  81   3.404  -1.872  -2.000
  677    HB2  ALA  81           HB2      ALA  81   3.149  -0.601  -3.197
  678    HB3  ALA  81           HB3      ALA  81   4.377  -1.837  -3.469
  679    H    ILE  82           HN       ILE  82   0.587  -0.702  -3.788
  680    HA   ILE  82           HA       ILE  82  -0.883  -1.821  -1.571
  681    HB   ILE  82           HB       ILE  82  -0.560   0.626  -1.822
  682   HG12  ILE  82          HG12      ILE  82  -2.927   1.244  -1.290
  683   HG13  ILE  82          HG11      ILE  82  -3.403  -0.389  -1.746
  684   HG21  ILE  82          HG21      ILE  82  -2.492   0.358  -4.113
  685   HG22  ILE  82          HG22      ILE  82  -0.800   0.846  -4.214
  686   HG23  ILE  82          HG23      ILE  82  -1.968   1.877  -3.386
  687   HD11  ILE  82          HD11      ILE  82  -2.252  -1.336   0.064
  688   HD12  ILE  82          HD12      ILE  82  -3.089   0.072   0.717
  689   HD13  ILE  82          HD13      ILE  82  -1.360   0.152   0.380
  690    H    PHE  83           HN       PHE  83  -1.428  -1.495  -5.063
  691    HA   PHE  83           HA       PHE  83  -4.085  -2.577  -4.930
  692    HB2  PHE  83           HB2      PHE  83  -3.921  -1.291  -6.821
  693    HB3  PHE  83           HB1      PHE  83  -2.215  -1.643  -7.044
  694    HD1  PHE  83           HD1      PHE  83  -5.426  -3.577  -7.144
  695    HD2  PHE  83           HD2      PHE  83  -1.703  -2.671  -8.993
  696    HE1  PHE  83           HE1      PHE  83  -5.968  -5.117  -8.985
  697    HE2  PHE  83           HE2      PHE  83  -2.237  -4.208 -10.835
  698    HZ   PHE  83           HZ       PHE  83  -4.370  -5.436 -10.832
  699    H    ASN  84           HN       ASN  84  -0.896  -3.874  -5.726
  700    HA   ASN  84           HA       ASN  84  -1.803  -6.461  -6.402
  701    HB2  ASN  84           HB2      ASN  84   0.493  -5.582  -6.953
  702    HB3  ASN  84           HB1      ASN  84   0.891  -5.741  -5.246
  703   HD21  ASN  84          HD21      ASN  84   2.372  -7.301  -5.254
  704   HD22  ASN  84          HD22      ASN  84   2.130  -8.888  -5.897
  705    H    TYR  85           HN       TYR  85  -1.111  -4.759  -3.434
  706    HA   TYR  85           HA       TYR  85  -1.014  -6.954  -1.700
  707    HB2  TYR  85           HB2      TYR  85  -0.505  -4.760  -0.821
  708    HB3  TYR  85           HB1      TYR  85  -2.090  -4.151  -1.288
  709    HD1  TYR  85           HD1      TYR  85  -0.479  -6.683   0.922
  710    HD2  TYR  85           HD2      TYR  85  -3.821  -4.128   0.282
  711    HE1  TYR  85           HE1      TYR  85  -1.332  -7.254   3.153
  712    HE2  TYR  85           HE2      TYR  85  -4.686  -4.695   2.516
  713    HH   TYR  85           HH       TYR  85  -3.902  -5.542   4.636
  714    H    LEU  86           HN       LEU  86  -3.653  -5.009  -2.952
  715    HA   LEU  86           HA       LEU  86  -5.729  -6.400  -1.673
  716    HB2  LEU  86           HB2      LEU  86  -5.757  -4.783  -4.202
  717    HB3  LEU  86           HB1      LEU  86  -7.194  -5.333  -3.357
  718    HG   LEU  86           HG       LEU  86  -5.107  -3.509  -2.159
  719   HD11  LEU  86          HD11      LEU  86  -7.762  -2.903  -3.426
  720   HD12  LEU  86          HD12      LEU  86  -6.172  -2.300  -3.897
  721   HD13  LEU  86          HD13      LEU  86  -6.896  -1.786  -2.373
  722   HD21  LEU  86          HD21      LEU  86  -6.218  -4.711  -0.433
  723   HD22  LEU  86          HD22      LEU  86  -7.792  -4.464  -1.188
  724   HD23  LEU  86          HD23      LEU  86  -6.926  -3.097  -0.487
  725    H    GLU  87           HN       GLU  87  -4.194  -6.795  -4.803
  726    HA   GLU  87           HA       GLU  87  -5.832  -8.867  -5.820
  727    HB2  GLU  87           HB2      GLU  87  -4.320  -7.460  -7.197
  728    HB3  GLU  87           HB1      GLU  87  -2.935  -8.214  -6.428
  729    HG2  GLU  87           HG2      GLU  87  -3.570 -10.367  -7.391
  730    HG3  GLU  87           HG1      GLU  87  -4.964  -9.613  -8.158
  731    H    LYS  88           HN       LYS  88  -3.057  -8.778  -3.736
  732    HA   LYS  88           HA       LYS  88  -2.305 -11.491  -3.841
  733    HB2  LYS  88           HB2      LYS  88  -1.051  -9.399  -2.959
  734    HB3  LYS  88           HB1      LYS  88  -1.889  -9.726  -1.451
  735    HG2  LYS  88           HG2      LYS  88   0.050 -10.848  -1.076
  736    HG3  LYS  88           HG1      LYS  88  -0.900 -12.137  -1.819
  737    HD2  LYS  88           HD2      LYS  88   0.122 -11.669  -3.981
  738    HD3  LYS  88           HD1      LYS  88   1.039 -10.337  -3.274
  739    HE2  LYS  88           HE2      LYS  88   2.107 -11.978  -1.735
  740    HE3  LYS  88           HE1      LYS  88   1.284 -13.267  -2.610
  741    HZ1  LYS  88           HZ1      LYS  88   2.420 -12.350  -4.654
  742    HZ2  LYS  88           HZ2      LYS  88   3.412 -13.138  -3.534
  743    HZ3  LYS  88           HZ3      LYS  88   3.394 -11.448  -3.603
  744    H    LEU  89           HN       LEU  89  -4.500  -9.719  -1.671
  745    HA   LEU  89           HA       LEU  89  -4.880 -11.987   0.048
  746    HB2  LEU  89           HB2      LEU  89  -7.066 -10.149   0.272
  747    HB3  LEU  89           HB1      LEU  89  -5.853 -10.590   1.452
  748    HG   LEU  89           HG       LEU  89  -5.154  -8.591  -0.646
  749   HD11  LEU  89          HD11      LEU  89  -6.087  -6.802   0.638
  750   HD12  LEU  89          HD12      LEU  89  -6.640  -7.917   1.887
  751   HD13  LEU  89          HD13      LEU  89  -7.376  -7.952   0.285
  752   HD21  LEU  89          HD21      LEU  89  -3.428  -9.408   0.856
  753   HD22  LEU  89          HD22      LEU  89  -4.415  -8.973   2.252
  754   HD23  LEU  89          HD23      LEU  89  -3.787  -7.714   1.189
  755    H    GLU  90           HN       GLU  90  -6.647 -10.649  -2.709
  756    HA   GLU  90           HA       GLU  90  -8.985 -12.196  -2.213
  757    HB2  GLU  90           HB2      GLU  90  -9.599 -11.649  -4.573
  758    HB3  GLU  90           HB1      GLU  90  -9.236 -10.262  -3.570
  759    HG2  GLU  90           HG2      GLU  90  -7.377  -9.711  -4.742
  760    HG3  GLU  90           HG1      GLU  90  -7.038 -11.376  -5.212
  Start of MODEL    3
    1    H1   MET   1           HT1      MET   1   5.898   1.311  14.944
    2    H2   MET   1           HT2      MET   1   4.770   0.162  14.419
    3    H3   MET   1           HT3      MET   1   4.247   1.675  14.970
    4    HA   MET   1           HA       MET   1   5.921   1.235  12.566
    5    HB2  MET   1           HB2      MET   1   2.983   1.938  12.781
    6    HB3  MET   1           HB1      MET   1   3.906   1.905  11.287
    7    HG2  MET   1           HG2      MET   1   3.173  -0.410  13.055
    8    HG3  MET   1           HG1      MET   1   2.644  -0.097  11.401
    9    HE1  MET   1           HE1      MET   1   5.897  -0.725   9.340
   10    HE2  MET   1           HE2      MET   1   5.581   0.839  10.094
   11    HE3  MET   1           HE3      MET   1   4.263  -0.065   9.346
   12    H    ALA   2           HN       ALA   2   6.935   3.019  11.876
   13    HA   ALA   2           HA       ALA   2   6.170   5.587  13.115
   14    HB1  ALA   2           HB1      ALA   2   8.390   4.846  13.796
   15    HB2  ALA   2           HB2      ALA   2   8.510   6.267  12.757
   16    HB3  ALA   2           HB3      ALA   2   8.863   4.667  12.106
   17    H    THR   3           HN       THR   3   4.955   4.444  10.819
   18    HA   THR   3           HA       THR   3   6.034   5.415   8.418
   19    HB   THR   3           HB       THR   3   3.798   4.955   7.462
   20    HG1  THR   3           HG1      THR   3   2.130   4.415   8.716
   21   HG21  THR   3          HG21      THR   3   3.728   2.519   8.092
   22   HG22  THR   3          HG22      THR   3   5.010   2.864   9.254
   23   HG23  THR   3          HG23      THR   3   5.291   3.113   7.530
   24    H    THR   4           HN       THR   4   5.844   7.265   7.382
   25    HA   THR   4           HA       THR   4   4.380   9.440   8.690
   26    HB   THR   4           HB       THR   4   6.469   9.716   6.521
   27    HG1  THR   4           HG1      THR   4   6.965   8.687   8.818
   28   HG21  THR   4          HG21      THR   4   6.733  11.972   7.467
   29   HG22  THR   4          HG22      THR   4   5.455  11.632   8.633
   30   HG23  THR   4          HG23      THR   4   5.083  11.696   6.910
   31    H    THR   5           HN       THR   5   3.277  11.006   7.211
   32    HA   THR   5           HA       THR   5   1.642   9.560   5.358
   33    HB   THR   5           HB       THR   5   1.670  12.541   5.852
   34    HG1  THR   5           HG1      THR   5   1.374  11.156   7.764
   35   HG21  THR   5          HG21      THR   5   0.419  11.715   3.846
   36   HG22  THR   5          HG22      THR   5  -0.614  12.476   5.053
   37   HG23  THR   5          HG23      THR   5  -0.564  10.718   4.919
   38    H    LEU   6           HN       LEU   6   2.647   8.946   3.542
   39    HA   LEU   6           HA       LEU   6   4.145  10.936   1.971
   40    HB2  LEU   6           HB2      LEU   6   4.212   7.927   1.693
   41    HB3  LEU   6           HB1      LEU   6   5.272   9.083   0.909
   42    HG   LEU   6           HG       LEU   6   5.216   8.384   3.846
   43   HD11  LEU   6          HD11      LEU   6   7.483   8.119   1.890
   44   HD12  LEU   6          HD12      LEU   6   6.331   6.820   2.194
   45   HD13  LEU   6          HD13      LEU   6   7.346   7.424   3.505
   46   HD21  LEU   6          HD21      LEU   6   7.146   9.931   4.037
   47   HD22  LEU   6          HD22      LEU   6   5.631  10.751   3.656
   48   HD23  LEU   6          HD23      LEU   6   6.828  10.478   2.390
   49    H    GLY   7           HN       GLY   7   3.753  10.988  -0.323
   50    HA2  GLY   7           HA2      GLY   7   0.980  10.669  -0.993
   51    HA3  GLY   7           HA1      GLY   7   2.248  11.257  -2.057
   52    H    VAL   8           HN       VAL   8   0.067   8.861  -1.616
   53    HA   VAL   8           HA       VAL   8   1.630   6.939  -3.215
   54    HB   VAL   8           HB       VAL   8  -0.264   6.492  -0.931
   55   HG11  VAL   8          HG11      VAL   8  -1.222   5.091  -2.636
   56   HG12  VAL   8          HG12      VAL   8  -0.338   4.080  -1.492
   57   HG13  VAL   8          HG13      VAL   8   0.367   4.459  -3.062
   58   HG21  VAL   8          HG21      VAL   8   2.422   5.347  -1.676
   59   HG22  VAL   8          HG22      VAL   8   1.506   4.936  -0.226
   60   HG23  VAL   8          HG23      VAL   8   2.103   6.580  -0.456
   61    H    LYS   9           HN       LYS   9   0.363   5.690  -4.788
   62    HA   LYS   9           HA       LYS   9  -1.859   7.307  -5.802
   63    HB2  LYS   9           HB2      LYS   9  -0.117   5.244  -7.162
   64    HB3  LYS   9           HB1      LYS   9  -1.470   6.061  -7.936
   65    HG2  LYS   9           HG2      LYS   9   0.294   7.338  -8.659
   66    HG3  LYS   9           HG1      LYS   9  -0.197   8.230  -7.218
   67    HD2  LYS   9           HD2      LYS   9   1.542   6.910  -5.949
   68    HD3  LYS   9           HD1      LYS   9   2.114   6.316  -7.508
   69    HE2  LYS   9           HE2      LYS   9   3.496   8.105  -7.322
   70    HE3  LYS   9           HE1      LYS   9   2.115   8.931  -8.040
   71    HZ1  LYS   9           HZ1      LYS   9   2.770   8.815  -5.139
   72    HZ2  LYS   9           HZ2      LYS   9   1.404   9.566  -5.799
   73    HZ3  LYS   9           HZ3      LYS   9   2.948  10.162  -6.153
   74    H    LEU  10           HN       LEU  10  -3.801   6.647  -5.246
   75    HA   LEU  10           HA       LEU  10  -4.388   3.764  -5.195
   76    HB2  LEU  10           HB2      LEU  10  -4.687   5.764  -3.047
   77    HB3  LEU  10           HB1      LEU  10  -6.064   4.706  -3.286
   78    HG   LEU  10           HG       LEU  10  -3.287   3.616  -2.913
   79   HD11  LEU  10          HD11      LEU  10  -3.787   5.036  -0.990
   80   HD12  LEU  10          HD12      LEU  10  -3.824   3.329  -0.546
   81   HD13  LEU  10          HD13      LEU  10  -5.333   4.213  -0.778
   82   HD21  LEU  10          HD21      LEU  10  -4.393   1.740  -3.394
   83   HD22  LEU  10          HD22      LEU  10  -5.954   2.550  -3.296
   84   HD23  LEU  10          HD23      LEU  10  -5.195   1.925  -1.833
   85    H    ASP  11           HN       ASP  11  -6.417   3.159  -5.869
   86    HA   ASP  11           HA       ASP  11  -7.951   5.147  -7.353
   87    HB2  ASP  11           HB2      ASP  11  -7.487   2.300  -7.568
   88    HB3  ASP  11           HB1      ASP  11  -9.212   2.625  -7.519
   89    H    ASP  12           HN       ASP  12 -10.368   5.125  -7.096
   90    HA   ASP  12           HA       ASP  12 -11.088   5.540  -4.407
   91    HB2  ASP  12           HB2      ASP  12 -12.588   5.500  -6.974
   92    HB3  ASP  12           HB1      ASP  12 -13.515   5.388  -5.484
   93    HA   PRO  13           HA       PRO  13 -13.822   1.458  -4.705
   94    HB2  PRO  13           HB2      PRO  13 -12.683  -0.425  -6.398
   95    HB3  PRO  13           HB1      PRO  13 -14.103   0.557  -6.767
   96    HG2  PRO  13           HG2      PRO  13 -11.252   0.970  -7.544
   97    HG3  PRO  13           HG1      PRO  13 -12.724   1.239  -8.497
   98    HD2  PRO  13           HD2      PRO  13 -11.394   3.281  -7.402
   99    HD3  PRO  13           HD1      PRO  13 -13.169   3.272  -7.454
  100    H    THR  14           HN       THR  14 -10.310   1.211  -5.259
  101    HA   THR  14           HA       THR  14 -10.016  -1.048  -3.557
  102    HB   THR  14           HB       THR  14  -8.117  -1.058  -4.753
  103    HG1  THR  14           HG1      THR  14  -7.208   0.987  -3.003
  104   HG21  THR  14          HG21      THR  14  -8.726   0.787  -6.171
  105   HG22  THR  14          HG22      THR  14  -7.031   0.941  -5.707
  106   HG23  THR  14          HG23      THR  14  -8.254   1.943  -4.928
  107    H    ARG  15           HN       ARG  15  -9.942   2.427  -3.066
  108    HA   ARG  15           HA       ARG  15  -8.804   2.469  -0.496
  109    HB2  ARG  15           HB2      ARG  15  -9.209   4.478  -1.916
  110    HB3  ARG  15           HB1      ARG  15 -10.934   4.307  -1.624
  111    HG2  ARG  15           HG2      ARG  15 -10.143   5.998  -0.180
  112    HG3  ARG  15           HG1      ARG  15 -10.454   4.575   0.818
  113    HD2  ARG  15           HD2      ARG  15  -8.036   4.018   0.661
  114    HD3  ARG  15           HD1      ARG  15  -7.787   5.541  -0.193
  115    HE   ARG  15           HE       ARG  15  -8.282   6.713   1.788
  116   HH11  ARG  15          HH21      ARG  15  -8.257   3.246   2.215
  117   HH12  ARG  15          HH22      ARG  15  -8.141   3.321   3.939
  118   HH21  ARG  15          HH11      ARG  15  -8.167   6.833   4.076
  119   HH22  ARG  15          HH12      ARG  15  -8.103   5.373   5.005
  120    H    GLU  16           HN       GLU  16 -12.133   2.096  -1.608
  121    HA   GLU  16           HA       GLU  16 -13.373   1.954   0.931
  122    HB2  GLU  16           HB2      GLU  16 -14.180   0.816  -1.756
  123    HB3  GLU  16           HB1      GLU  16 -15.227   0.854  -0.343
  124    HG2  GLU  16           HG2      GLU  16 -15.136   3.287  -0.322
  125    HG3  GLU  16           HG1      GLU  16 -14.066   3.266  -1.725
  126    H    ARG  17           HN       ARG  17 -12.138  -0.478  -1.307
  127    HA   ARG  17           HA       ARG  17 -12.822  -2.750   0.208
  128    HB2  ARG  17           HB2      ARG  17 -11.887  -2.451  -2.275
  129    HB3  ARG  17           HB1      ARG  17 -10.368  -2.824  -1.470
  130    HG2  ARG  17           HG2      ARG  17 -12.118  -4.718  -0.480
  131    HG3  ARG  17           HG1      ARG  17 -12.562  -4.569  -2.182
  132    HD2  ARG  17           HD2      ARG  17 -10.877  -6.260  -1.988
  133    HD3  ARG  17           HD1      ARG  17 -10.160  -4.846  -2.763
  134    HE   ARG  17           HE       ARG  17  -8.911  -4.437  -0.841
  135   HH11  ARG  17          HH21      ARG  17 -10.931  -7.264  -0.511
  136   HH12  ARG  17          HH22      ARG  17 -10.152  -7.815   0.930
  137   HH21  ARG  17          HH11      ARG  17  -7.887  -5.145   1.079
  138   HH22  ARG  17          HH12      ARG  17  -8.425  -6.603   1.844
  139    H    LEU  18           HN       LEU  18 -10.106  -0.559   0.277
  140    HA   LEU  18           HA       LEU  18  -8.373  -2.019   1.917
  141    HB2  LEU  18           HB2      LEU  18  -8.648   0.765   1.074
  142    HB3  LEU  18           HB1      LEU  18  -8.043   0.624   2.711
  143    HG   LEU  18           HG       LEU  18  -6.253  -0.921   1.805
  144   HD11  LEU  18          HD11      LEU  18  -7.409  -1.458  -0.304
  145   HD12  LEU  18          HD12      LEU  18  -5.766  -0.862  -0.540
  146   HD13  LEU  18          HD13      LEU  18  -7.142   0.200  -0.838
  147   HD21  LEU  18          HD21      LEU  18  -6.508   1.986   1.228
  148   HD22  LEU  18          HD22      LEU  18  -5.115   1.113   0.593
  149   HD23  LEU  18          HD23      LEU  18  -5.417   1.144   2.329
  150    H    LYS  19           HN       LYS  19 -11.110   0.111   2.682
  151    HA   LYS  19           HA       LYS  19 -10.816   0.042   5.481
  152    HB2  LYS  19           HB2      LYS  19 -12.408   1.547   4.244
  153    HB3  LYS  19           HB1      LYS  19 -13.453   0.153   4.004
  154    HG2  LYS  19           HG2      LYS  19 -13.557  -0.092   6.492
  155    HG3  LYS  19           HG1      LYS  19 -12.695   1.443   6.618
  156    HD2  LYS  19           HD2      LYS  19 -15.312   1.072   5.167
  157    HD3  LYS  19           HD1      LYS  19 -15.170   1.641   6.831
  158    HE2  LYS  19           HE2      LYS  19 -13.873   2.988   4.468
  159    HE3  LYS  19           HE1      LYS  19 -15.446   3.443   5.122
  160    HZ1  LYS  19           HZ1      LYS  19 -13.860   4.889   6.064
  161    HZ2  LYS  19           HZ2      LYS  19 -12.814   3.618   6.472
  162    HZ3  LYS  19           HZ3      LYS  19 -14.287   3.799   7.291
  163    H    ALA  20           HN       ALA  20 -12.416  -2.098   3.241
  164    HA   ALA  20           HA       ALA  20 -13.517  -3.907   5.088
  165    HB1  ALA  20           HB1      ALA  20 -12.510  -4.527   2.310
  166    HB2  ALA  20           HB2      ALA  20 -14.104  -3.874   2.685
  167    HB3  ALA  20           HB3      ALA  20 -13.658  -5.485   3.250
  168    H    ALA  21           HN       ALA  21 -10.302  -3.656   3.644
  169    HA   ALA  21           HA       ALA  21  -9.237  -6.075   4.649
  170    HB1  ALA  21           HB1      ALA  21  -7.113  -5.258   4.055
  171    HB2  ALA  21           HB2      ALA  21  -7.620  -3.578   4.231
  172    HB3  ALA  21           HB3      ALA  21  -8.222  -4.543   2.883
  173    H    ALA  22           HN       ALA  22  -9.444  -2.807   5.950
  174    HA   ALA  22           HA       ALA  22  -7.994  -3.195   8.311
  175    HB1  ALA  22           HB1      ALA  22  -8.897  -1.180   9.039
  176    HB2  ALA  22           HB2      ALA  22 -10.447  -1.482   8.256
  177    HB3  ALA  22           HB3      ALA  22  -9.046  -1.029   7.287
  178    H    GLN  23           HN       GLN  23 -11.287  -3.777   7.457
  179    HA   GLN  23           HA       GLN  23 -12.254  -4.544   9.982
  180    HB2  GLN  23           HB2      GLN  23 -13.222  -5.191   7.199
  181    HB3  GLN  23           HB1      GLN  23 -14.115  -5.569   8.666
  182    HG2  GLN  23           HG2      GLN  23 -13.257  -2.792   7.914
  183    HG3  GLN  23           HG1      GLN  23 -14.824  -3.479   7.491
  184   HE21  GLN  23          HE21      GLN  23 -13.904  -1.240   9.298
  185   HE22  GLN  23          HE22      GLN  23 -14.712  -1.545  10.792
  186    H    SER  24           HN       SER  24 -10.779  -6.402   7.337
  187    HA   SER  24           HA       SER  24 -11.287  -8.928   8.530
  188    HB2  SER  24           HB2      SER  24  -9.791  -9.858   6.873
  189    HB3  SER  24           HB1      SER  24 -10.806  -8.643   6.108
  190    HG   SER  24           HG       SER  24  -8.069  -8.549   6.742
  191    H    ILE  25           HN       ILE  25  -8.886  -6.492   9.075
  192    HA   ILE  25           HA       ILE  25  -7.355  -8.386  10.717
  193    HB   ILE  25           HB       ILE  25  -6.057  -7.166   8.987
  194   HG12  ILE  25          HG12      ILE  25  -4.200  -6.495  10.438
  195   HG13  ILE  25          HG11      ILE  25  -5.290  -6.421  11.818
  196   HG21  ILE  25          HG21      ILE  25  -5.533  -4.746   9.465
  197   HG22  ILE  25          HG22      ILE  25  -6.918  -4.759  10.559
  198   HG23  ILE  25          HG23      ILE  25  -7.149  -5.082   8.842
  199   HD11  ILE  25          HD11      ILE  25  -4.700  -8.924  10.255
  200   HD12  ILE  25          HD12      ILE  25  -5.626  -8.792  11.751
  201   HD13  ILE  25          HD13      ILE  25  -3.894  -8.459  11.754
  202    H    ASP  26           HN       ASP  26  -9.850  -6.436  11.019
  203    HA   ASP  26           HA       ASP  26 -10.953  -5.449  12.713
  204    HB2  ASP  26           HB2      ASP  26  -8.961  -7.039  14.323
  205    HB3  ASP  26           HB1      ASP  26 -10.235  -6.087  15.075
  206    H    ARG  27           HN       ARG  27  -9.080  -3.848  11.454
  207    HA   ARG  27           HA       ARG  27  -8.253  -2.113  13.695
  208    HB2  ARG  27           HB2      ARG  27  -6.713  -2.654  11.151
  209    HB3  ARG  27           HB1      ARG  27  -6.290  -1.422  12.331
  210    HG2  ARG  27           HG2      ARG  27  -5.966  -3.152  14.026
  211    HG3  ARG  27           HG1      ARG  27  -6.395  -4.388  12.841
  212    HD2  ARG  27           HD2      ARG  27  -4.491  -3.624  11.443
  213    HD3  ARG  27           HD1      ARG  27  -4.030  -2.525  12.742
  214    HE   ARG  27           HE       ARG  27  -4.149  -4.925  13.979
  215   HH11  ARG  27          HH21      ARG  27  -2.500  -3.792  11.113
  216   HH12  ARG  27          HH22      ARG  27  -1.184  -4.907  11.267
  217   HH21  ARG  27          HH11      ARG  27  -2.423  -6.414  14.187
  218   HH22  ARG  27          HH12      ARG  27  -1.144  -6.416  13.017
  219    H    THR  28           HN       THR  28  -7.929   0.174  13.017
  220    HA   THR  28           HA       THR  28 -10.173   1.030  11.417
  221    HB   THR  28           HB       THR  28  -9.068   2.023  13.684
  222    HG1  THR  28           HG1      THR  28 -10.648   3.476  13.465
  223   HG21  THR  28          HG21      THR  28  -7.067   2.817  12.349
  224   HG22  THR  28          HG22      THR  28  -7.878   4.052  13.310
  225   HG23  THR  28          HG23      THR  28  -8.149   3.968  11.570
  226    HA   PRO  29           HA       PRO  29  -8.387   1.933   7.464
  227    HB2  PRO  29           HB2      PRO  29  -8.874   4.825   8.059
  228    HB3  PRO  29           HB1      PRO  29  -9.241   3.898   6.598
  229    HG2  PRO  29           HG2      PRO  29 -11.171   4.453   8.329
  230    HG3  PRO  29           HG1      PRO  29 -11.084   2.856   7.562
  231    HD2  PRO  29           HD2      PRO  29 -10.409   3.655  10.350
  232    HD3  PRO  29           HD1      PRO  29 -11.063   2.124   9.735
  233    H    HIS  30           HN       HIS  30  -7.215   3.932  10.141
  234    HA   HIS  30           HA       HIS  30  -4.953   5.028   8.864
  235    HB2  HIS  30           HB2      HIS  30  -5.901   5.796  11.039
  236    HB3  HIS  30           HB1      HIS  30  -5.269   4.341  11.795
  237    HD1  HIS  30           HD1      HIS  30  -3.145   4.739  12.982
  238    HD2  HIS  30           HD2      HIS  30  -3.622   7.331   9.771
  239    HE1  HIS  30           HE1      HIS  30  -1.122   6.232  13.017
  240    HE2  HIS  30           HE2      HIS  30  -1.596   7.959  11.246
  241    H    TRP  31           HN       TRP  31  -5.285   2.136  10.893
  242    HA   TRP  31           HA       TRP  31  -2.579   1.297  10.632
  243    HB2  TRP  31           HB2      TRP  31  -5.028  -0.329  11.332
  244    HB3  TRP  31           HB1      TRP  31  -3.359  -0.817  11.602
  245    HD1  TRP  31           HD1      TRP  31  -6.169   1.131  13.128
  246    HE1  TRP  31           HE1      TRP  31  -5.433   2.077  15.406
  247    HE3  TRP  31           HE3      TRP  31  -1.169   0.108  12.842
  248    HZ2  TRP  31           HZ2      TRP  31  -3.047   2.343  16.883
  249    HZ3  TRP  31           HZ3      TRP  31   0.272   0.735  14.737
  250    HH2  TRP  31           HH2      TRP  31  -0.650   1.829  16.715
  251    H    LEU  32           HN       LEU  32  -5.556   0.696   9.050
  252    HA   LEU  32           HA       LEU  32  -4.880  -1.427   7.411
  253    HB2  LEU  32           HB2      LEU  32  -7.125  -0.963   7.584
  254    HB3  LEU  32           HB1      LEU  32  -6.890   0.754   7.389
  255    HG   LEU  32           HG       LEU  32  -8.123  -0.596   5.563
  256   HD11  LEU  32          HD11      LEU  32  -6.614   1.770   5.567
  257   HD12  LEU  32          HD12      LEU  32  -7.958   1.331   4.516
  258   HD13  LEU  32          HD13      LEU  32  -6.304   0.965   4.031
  259   HD21  LEU  32          HD21      LEU  32  -5.356  -1.009   4.481
  260   HD22  LEU  32          HD22      LEU  32  -6.886  -1.657   3.889
  261   HD23  LEU  32          HD23      LEU  32  -6.192  -2.267   5.393
  262    H    ILE  33           HN       ILE  33  -4.606   2.037   6.820
  263    HA   ILE  33           HA       ILE  33  -3.686   1.855   4.177
  264    HB   ILE  33           HB       ILE  33  -3.199   3.954   6.289
  265   HG12  ILE  33          HG12      ILE  33  -4.918   4.043   3.806
  266   HG13  ILE  33          HG11      ILE  33  -5.529   3.604   5.398
  267   HG21  ILE  33          HG21      ILE  33  -2.485   4.032   3.366
  268   HG22  ILE  33          HG22      ILE  33  -1.359   4.037   4.723
  269   HG23  ILE  33          HG23      ILE  33  -2.433   5.411   4.463
  270   HD11  ILE  33          HD11      ILE  33  -5.932   5.966   4.713
  271   HD12  ILE  33          HD12      ILE  33  -4.189   6.225   4.802
  272   HD13  ILE  33          HD13      ILE  33  -5.089   5.772   6.251
  273    H    LYS  34           HN       LYS  34  -1.827   2.205   7.220
  274    HA   LYS  34           HA       LYS  34   0.669   1.943   5.881
  275    HB2  LYS  34           HB2      LYS  34   1.637   1.628   8.161
  276    HB3  LYS  34           HB1      LYS  34   0.682   3.087   7.963
  277    HG2  LYS  34           HG2      LYS  34  -1.183   2.049   9.117
  278    HG3  LYS  34           HG1      LYS  34  -0.266   0.549   9.276
  279    HD2  LYS  34           HD2      LYS  34  -0.061   1.670  11.353
  280    HD3  LYS  34           HD1      LYS  34   1.477   1.896  10.520
  281    HE2  LYS  34           HE2      LYS  34   0.335   4.101   9.670
  282    HE3  LYS  34           HE1      LYS  34  -0.690   3.873  11.086
  283    HZ1  LYS  34           HZ1      LYS  34   0.916   4.779  12.303
  284    HZ2  LYS  34           HZ2      LYS  34   1.938   4.898  10.954
  285    HZ3  LYS  34           HZ3      LYS  34   1.945   3.497  11.903
  286    H    GLN  35           HN       GLN  35  -1.412  -0.393   7.535
  287    HA   GLN  35           HA       GLN  35   0.476  -2.507   7.310
  288    HB2  GLN  35           HB2      GLN  35  -1.009  -3.819   8.414
  289    HB3  GLN  35           HB1      GLN  35  -1.665  -2.254   8.857
  290    HG2  GLN  35           HG2      GLN  35  -3.582  -3.299   8.266
  291    HG3  GLN  35           HG1      GLN  35  -3.122  -2.673   6.684
  292   HE21  GLN  35          HE21      GLN  35  -3.363  -4.088   5.136
  293   HE22  GLN  35          HE22      GLN  35  -3.151  -5.800   5.260
  294    H    ALA  36           HN       ALA  36  -2.201  -1.407   5.265
  295    HA   ALA  36           HA       ALA  36  -2.313  -3.633   3.589
  296    HB1  ALA  36           HB1      ALA  36  -3.181  -2.074   1.850
  297    HB2  ALA  36           HB2      ALA  36  -2.805  -0.734   2.933
  298    HB3  ALA  36           HB3      ALA  36  -3.998  -1.941   3.408
  299    H    ILE  37           HN       ILE  37  -0.181  -0.817   3.515
  300    HA   ILE  37           HA       ILE  37   1.168  -1.926   1.206
  301    HB   ILE  37           HB       ILE  37   0.782   0.487   1.372
  302   HG12  ILE  37          HG12      ILE  37   3.423   1.053   1.191
  303   HG13  ILE  37          HG11      ILE  37   3.452  -0.696   0.983
  304   HG21  ILE  37          HG21      ILE  37   2.118   1.869   2.893
  305   HG22  ILE  37          HG22      ILE  37   2.712   0.405   3.676
  306   HG23  ILE  37          HG23      ILE  37   0.997   0.808   3.747
  307   HD11  ILE  37          HD11      ILE  37   1.858   1.265  -0.647
  308   HD12  ILE  37          HD12      ILE  37   1.833  -0.488  -0.840
  309   HD13  ILE  37          HD13      ILE  37   3.316   0.412  -1.154
  310    H    PHE  38           HN       PHE  38   2.037  -1.321   4.617
  311    HA   PHE  38           HA       PHE  38   4.653  -2.437   4.275
  312    HB2  PHE  38           HB2      PHE  38   4.938  -1.170   6.100
  313    HB3  PHE  38           HB1      PHE  38   3.205  -1.027   6.349
  314    HD1  PHE  38           HD2      PHE  38   6.131  -3.205   7.039
  315    HD2  PHE  38           HD1      PHE  38   2.157  -2.124   8.117
  316    HE1  PHE  38           HE2      PHE  38   6.309  -4.580   9.071
  317    HE2  PHE  38           HE1      PHE  38   2.330  -3.494  10.149
  318    HZ   PHE  38           HZ       PHE  38   4.407  -4.724  10.627
  319    H    ASN  39           HN       ASN  39   1.561  -3.656   5.538
  320    HA   ASN  39           HA       ASN  39   2.724  -6.131   6.330
  321    HB2  ASN  39           HB2      ASN  39   0.454  -5.158   7.127
  322    HB3  ASN  39           HB1      ASN  39  -0.185  -5.854   5.644
  323   HD21  ASN  39          HD21      ASN  39  -0.390  -6.424   8.649
  324   HD22  ASN  39          HD22      ASN  39  -0.164  -8.132   8.755
  325    H    TYR  40           HN       TYR  40   1.556  -4.730   3.355
  326    HA   TYR  40           HA       TYR  40   1.237  -7.117   1.889
  327    HB2  TYR  40           HB2      TYR  40   0.578  -5.121   0.755
  328    HB3  TYR  40           HB1      TYR  40   2.133  -4.350   1.054
  329    HD1  TYR  40           HD1      TYR  40   0.949  -7.528  -0.549
  330    HD2  TYR  40           HD2      TYR  40   3.440  -4.090  -0.837
  331    HE1  TYR  40           HE1      TYR  40   1.733  -8.291  -2.745
  332    HE2  TYR  40           HE2      TYR  40   4.232  -4.848  -3.040
  333    HH   TYR  40           HH       TYR  40   4.445  -7.062  -4.265
  334    H    LEU  41           HN       LEU  41   3.947  -5.112   2.762
  335    HA   LEU  41           HA       LEU  41   5.940  -6.528   1.394
  336    HB2  LEU  41           HB2      LEU  41   6.178  -4.948   3.944
  337    HB3  LEU  41           HB1      LEU  41   7.527  -5.519   2.978
  338    HG   LEU  41           HG       LEU  41   5.544  -3.359   2.324
  339   HD11  LEU  41          HD11      LEU  41   8.539  -3.412   2.106
  340   HD12  LEU  41          HD12      LEU  41   7.682  -2.926   3.568
  341   HD13  LEU  41          HD13      LEU  41   7.469  -2.011   2.076
  342   HD21  LEU  41          HD21      LEU  41   7.317  -4.855   0.396
  343   HD22  LEU  41          HD22      LEU  41   6.592  -3.284   0.057
  344   HD23  LEU  41          HD23      LEU  41   5.562  -4.687   0.331
  345    H    GLU  42           HN       GLU  42   4.527  -6.932   4.610
  346    HA   GLU  42           HA       GLU  42   6.230  -9.020   5.468
  347    HB2  GLU  42           HB2      GLU  42   3.427  -8.265   6.295
  348    HB3  GLU  42           HB1      GLU  42   4.294  -9.611   7.017
  349    HG2  GLU  42           HG2      GLU  42   6.044  -8.078   7.766
  350    HG3  GLU  42           HG1      GLU  42   5.165  -6.733   7.043
  351    H    LYS  43           HN       LYS  43   3.201  -9.019   3.651
  352    HA   LYS  43           HA       LYS  43   2.692 -11.765   3.704
  353    HB2  LYS  43           HB2      LYS  43   1.824  -9.492   2.054
  354    HB3  LYS  43           HB1      LYS  43   1.746 -11.047   1.238
  355    HG2  LYS  43           HG2      LYS  43  -0.352 -10.876   2.161
  356    HG3  LYS  43           HG1      LYS  43   0.504 -11.821   3.380
  357    HD2  LYS  43           HD2      LYS  43   0.864  -9.814   4.708
  358    HD3  LYS  43           HD1      LYS  43   0.077  -8.838   3.467
  359    HE2  LYS  43           HE2      LYS  43  -1.984 -10.206   3.806
  360    HE3  LYS  43           HE1      LYS  43  -1.185 -10.981   5.173
  361    HZ1  LYS  43           HZ1      LYS  43  -0.843  -8.455   5.839
  362    HZ2  LYS  43           HZ2      LYS  43  -2.236  -9.332   6.271
  363    HZ3  LYS  43           HZ3      LYS  43  -2.276  -8.284   4.928
  364    H    LEU  44           HN       LEU  44   4.489  -9.910   1.274
  365    HA   LEU  44           HA       LEU  44   5.236 -12.324  -0.126
  366    HB2  LEU  44           HB2      LEU  44   6.405 -10.860  -1.651
  367    HB3  LEU  44           HB1      LEU  44   4.808 -10.214  -1.331
  368    HG   LEU  44           HG       LEU  44   6.335  -8.886   0.532
  369   HD11  LEU  44          HD11      LEU  44   7.958  -9.103  -2.005
  370   HD12  LEU  44          HD12      LEU  44   8.387  -9.836  -0.461
  371   HD13  LEU  44          HD13      LEU  44   8.325  -8.079  -0.616
  372   HD21  LEU  44          HD21      LEU  44   4.619  -7.913  -0.910
  373   HD22  LEU  44          HD22      LEU  44   5.705  -8.039  -2.295
  374   HD23  LEU  44          HD23      LEU  44   6.104  -6.960  -0.959
  375    H    GLU  45           HN       GLU  45   6.604 -10.017   2.123
  376    HA   GLU  45           HA       GLU  45   8.432  -9.888   3.391
  377    HB2  GLU  45           HB2      GLU  45   7.625 -12.242   3.961
  378    HB3  GLU  45           HB1      GLU  45   8.967 -12.816   2.983
  379    HG2  GLU  45           HG2      GLU  45  10.552 -11.852   4.413
  380    HG3  GLU  45           HG1      GLU  45   9.350 -10.844   5.212
  381    H1   MET  46           HT1      MET  46  -5.830   1.467 -14.957
  382    H2   MET  46           HT2      MET  46  -4.577   0.442 -14.470
  383    H3   MET  46           HT3      MET  46  -4.227   1.996 -15.042
  384    HA   MET  46           HA       MET  46  -5.826   1.464 -12.614
  385    HB2  MET  46           HB2      MET  46  -2.900   2.229 -12.820
  386    HB3  MET  46           HB1      MET  46  -3.828   2.136 -11.331
  387    HG2  MET  46           HG2      MET  46  -3.029  -0.112 -13.149
  388    HG3  MET  46           HG1      MET  46  -2.519   0.170 -11.485
  389    HE1  MET  46           HE1      MET  46  -5.821  -0.555  -9.497
  390    HE2  MET  46           HE2      MET  46  -5.520   1.020 -10.232
  391    HE3  MET  46           HE3      MET  46  -4.204   0.145  -9.447
  392    H    ALA  47           HN       ALA  47  -6.863   3.228 -11.914
  393    HA   ALA  47           HA       ALA  47  -6.124   5.810 -13.139
  394    HB1  ALA  47           HB1      ALA  47  -8.331   5.066 -13.840
  395    HB2  ALA  47           HB2      ALA  47  -8.475   6.465 -12.775
  396    HB3  ALA  47           HB3      ALA  47  -8.813   4.849 -12.157
  397    H    THR  48           HN       THR  48  -4.912   4.652 -10.847
  398    HA   THR  48           HA       THR  48  -5.999   5.592  -8.437
  399    HB   THR  48           HB       THR  48  -3.764   5.121  -7.485
  400    HG1  THR  48           HG1      THR  48  -2.099   4.550  -8.760
  401   HG21  THR  48          HG21      THR  48  -3.682   2.695  -8.158
  402   HG22  THR  48          HG22      THR  48  -4.964   3.056  -9.315
  403   HG23  THR  48          HG23      THR  48  -5.249   3.272  -7.588
  404    H    THR  49           HN       THR  49  -5.787   7.419  -7.350
  405    HA   THR  49           HA       THR  49  -4.346   9.634  -8.627
  406    HB   THR  49           HB       THR  49  -6.457   9.832  -6.467
  407    HG1  THR  49           HG1      THR  49  -6.986   8.824  -8.713
  408   HG21  THR  49          HG21      THR  49  -6.748  12.112  -7.351
  409   HG22  THR  49          HG22      THR  49  -5.445  11.829  -8.504
  410   HG23  THR  49          HG23      THR  49  -5.104  11.845  -6.773
  411    H    THR  50           HN       THR  50  -3.301  11.206  -7.075
  412    HA   THR  50           HA       THR  50  -1.630   9.757  -5.256
  413    HB   THR  50           HB       THR  50  -1.764  12.757  -5.509
  414    HG1  THR  50           HG1      THR  50  -1.340  11.015  -7.465
  415   HG21  THR  50          HG21      THR  50  -0.315  11.784  -3.739
  416   HG22  THR  50          HG22      THR  50   0.606  12.632  -4.980
  417   HG23  THR  50          HG23      THR  50   0.542  10.871  -4.983
  418    H    LEU  51           HN       LEU  51  -2.638   9.030  -3.495
  419    HA   LEU  51           HA       LEU  51  -4.197  10.908  -1.853
  420    HB2  LEU  51           HB2      LEU  51  -4.197   7.889  -1.715
  421    HB3  LEU  51           HB1      LEU  51  -5.271   8.983  -0.864
  422    HG   LEU  51           HG       LEU  51  -5.238   8.408  -3.828
  423   HD11  LEU  51          HD11      LEU  51  -7.493   8.080  -1.870
  424   HD12  LEU  51          HD12      LEU  51  -6.333   6.795  -2.201
  425   HD13  LEU  51          HD13      LEU  51  -7.351   7.421  -3.500
  426   HD21  LEU  51          HD21      LEU  51  -7.168   9.956  -3.958
  427   HD22  LEU  51          HD22      LEU  51  -5.659  10.772  -3.548
  428   HD23  LEU  51          HD23      LEU  51  -6.854  10.444  -2.293
  429    H    GLY  52           HN       GLY  52  -3.790  10.931   0.417
  430    HA2  GLY  52           HA2      GLY  52  -1.025  10.625   1.097
  431    HA3  GLY  52           HA1      GLY  52  -2.310  11.152   2.174
  432    H    VAL  53           HN       VAL  53  -0.067   8.831   1.717
  433    HA   VAL  53           HA       VAL  53  -1.608   6.830   3.238
  434    HB   VAL  53           HB       VAL  53   0.277   6.471   0.932
  435   HG11  VAL  53          HG11      VAL  53   1.256   5.037   2.594
  436   HG12  VAL  53          HG12      VAL  53   0.379   4.047   1.427
  437   HG13  VAL  53          HG13      VAL  53  -0.324   4.375   3.009
  438   HG21  VAL  53          HG21      VAL  53  -2.394   5.278   1.653
  439   HG22  VAL  53          HG22      VAL  53  -1.478   4.916   0.191
  440   HG23  VAL  53          HG23      VAL  53  -2.092   6.546   0.465
  441    H    LYS  54           HN       LYS  54  -0.357   5.600   4.802
  442    HA   LYS  54           HA       LYS  54   1.874   7.190   5.829
  443    HB2  LYS  54           HB2      LYS  54   0.161   5.077   7.150
  444    HB3  LYS  54           HB1      LYS  54   1.505   5.896   7.935
  445    HG2  LYS  54           HG2      LYS  54  -0.285   7.119   8.695
  446    HG3  LYS  54           HG1      LYS  54   0.206   8.062   7.288
  447    HD2  LYS  54           HD2      LYS  54  -1.507   6.747   5.968
  448    HD3  LYS  54           HD1      LYS  54  -2.092   6.127   7.513
  449    HE2  LYS  54           HE2      LYS  54  -3.470   7.917   7.367
  450    HE3  LYS  54           HE1      LYS  54  -2.083   8.746   8.070
  451    HZ1  LYS  54           HZ1      LYS  54  -2.712   8.608   5.164
  452    HZ2  LYS  54           HZ2      LYS  54  -1.403   9.428   5.857
  453    HZ3  LYS  54           HZ3      LYS  54  -2.983   9.945   6.165
  454    H    LEU  55           HN       LEU  55   3.824   6.559   5.268
  455    HA   LEU  55           HA       LEU  55   4.430   3.682   5.140
  456    HB2  LEU  55           HB2      LEU  55   4.717   5.740   3.048
  457    HB3  LEU  55           HB1      LEU  55   6.103   4.689   3.262
  458    HG   LEU  55           HG       LEU  55   3.337   3.582   2.855
  459   HD11  LEU  55          HD11      LEU  55   3.823   5.060   0.972
  460   HD12  LEU  55          HD12      LEU  55   3.877   3.367   0.482
  461   HD13  LEU  55          HD13      LEU  55   5.376   4.259   0.737
  462   HD21  LEU  55          HD21      LEU  55   4.462   1.704   3.283
  463   HD22  LEU  55          HD22      LEU  55   6.015   2.534   3.211
  464   HD23  LEU  55          HD23      LEU  55   5.264   1.943   1.729
  465    H    ASP  56           HN       ASP  56   6.452   3.074   5.824
  466    HA   ASP  56           HA       ASP  56   7.978   5.026   7.362
  467    HB2  ASP  56           HB2      ASP  56   7.527   2.175   7.490
  468    HB3  ASP  56           HB1      ASP  56   9.253   2.496   7.419
  469    H    ASP  57           HN       ASP  57  10.398   5.026   7.097
  470    HA   ASP  57           HA       ASP  57  11.088   5.515   4.408
  471    HB2  ASP  57           HB2      ASP  57  12.591   5.481   6.970
  472    HB3  ASP  57           HB1      ASP  57  13.521   5.406   5.477
  473    HA   PRO  58           HA       PRO  58  13.890   1.473   4.624
  474    HB2  PRO  58           HB2      PRO  58  12.750  -0.461   6.265
  475    HB3  PRO  58           HB1      PRO  58  14.172   0.510   6.658
  476    HG2  PRO  58           HG2      PRO  58  11.323   0.900   7.451
  477    HG3  PRO  58           HG1      PRO  58  12.796   1.153   8.405
  478    HD2  PRO  58           HD2      PRO  58  11.454   3.215   7.362
  479    HD3  PRO  58           HD1      PRO  58  13.230   3.212   7.405
  480    H    THR  59           HN       THR  59  10.376   1.180   5.157
  481    HA   THR  59           HA       THR  59  10.111  -1.034   3.391
  482    HB   THR  59           HB       THR  59   8.214  -1.094   4.592
  483    HG1  THR  59           HG1      THR  59   7.239   0.975   2.918
  484   HG21  THR  59          HG21      THR  59   8.788   0.731   6.046
  485   HG22  THR  59          HG22      THR  59   7.093   0.872   5.576
  486   HG23  THR  59          HG23      THR  59   8.309   1.905   4.822
  487    H    ARG  60           HN       ARG  60   9.999   2.455   2.995
  488    HA   ARG  60           HA       ARG  60   8.859   2.543   0.425
  489    HB2  ARG  60           HB2      ARG  60   9.232   4.522   1.896
  490    HB3  ARG  60           HB1      ARG  60  10.958   4.388   1.590
  491    HG2  ARG  60           HG2      ARG  60  10.125   6.098   0.192
  492    HG3  ARG  60           HG1      ARG  60  10.458   4.706  -0.841
  493    HD2  ARG  60           HD2      ARG  60   8.057   4.094  -0.686
  494    HD3  ARG  60           HD1      ARG  60   7.778   5.585   0.213
  495    HE   ARG  60           HE       ARG  60   8.185   6.822  -1.735
  496   HH11  ARG  60          HH21      ARG  60   8.389   3.375  -2.272
  497   HH12  ARG  60          HH22      ARG  60   8.286   3.499  -3.994
  498   HH21  ARG  60          HH11      ARG  60   8.089   7.009  -4.017
  499   HH22  ARG  60          HH12      ARG  60   8.127   5.580  -4.994
  500    H    GLU  61           HN       GLU  61  12.197   2.194   1.526
  501    HA   GLU  61           HA       GLU  61  13.441   2.131  -1.012
  502    HB2  GLU  61           HB2      GLU  61  14.256   0.904   1.635
  503    HB3  GLU  61           HB1      GLU  61  15.302   1.025   0.228
  504    HG2  GLU  61           HG2      GLU  61  15.193   3.446   0.322
  505    HG3  GLU  61           HG1      GLU  61  14.095   3.361   1.700
  506    H    ARG  62           HN       ARG  62  12.224  -0.372   1.158
  507    HA   ARG  62           HA       ARG  62  12.931  -2.602  -0.409
  508    HB2  ARG  62           HB2      ARG  62  11.994  -2.370   2.080
  509    HB3  ARG  62           HB1      ARG  62  10.478  -2.736   1.267
  510    HG2  ARG  62           HG2      ARG  62  12.258  -4.591   0.240
  511    HG3  ARG  62           HG1      ARG  62  12.678  -4.480   1.951
  512    HD2  ARG  62           HD2      ARG  62  11.014  -6.178   1.708
  513    HD3  ARG  62           HD1      ARG  62  10.262  -4.785   2.486
  514    HE   ARG  62           HE       ARG  62   9.077  -4.340   0.513
  515   HH11  ARG  62          HH21      ARG  62  11.031  -7.225   0.290
  516   HH12  ARG  62          HH22      ARG  62  10.265  -7.792  -1.153
  517   HH21  ARG  62          HH11      ARG  62   8.072  -5.067  -1.407
  518   HH22  ARG  62          HH12      ARG  62   8.584  -6.556  -2.130
  519    H    LEU  63           HN       LEU  63  10.193  -0.437  -0.426
  520    HA   LEU  63           HA       LEU  63   8.484  -1.878  -2.108
  521    HB2  LEU  63           HB2      LEU  63   8.728   0.884  -1.195
  522    HB3  LEU  63           HB1      LEU  63   8.130   0.779  -2.837
  523    HG   LEU  63           HG       LEU  63   6.346  -0.798  -1.978
  524   HD11  LEU  63          HD11      LEU  63   7.504  -1.387   0.117
  525   HD12  LEU  63          HD12      LEU  63   5.856  -0.811   0.367
  526   HD13  LEU  63          HD13      LEU  63   7.222   0.254   0.698
  527   HD21  LEU  63          HD21      LEU  63   6.574   2.096  -1.315
  528   HD22  LEU  63          HD22      LEU  63   5.188   1.191  -0.711
  529   HD23  LEU  63          HD23      LEU  63   5.493   1.277  -2.444
  530    H    LYS  64           HN       LYS  64  11.197   0.301  -2.806
  531    HA   LYS  64           HA       LYS  64  10.905   0.310  -5.604
  532    HB2  LYS  64           HB2      LYS  64  12.480   1.782  -4.292
  533    HB3  LYS  64           HB1      LYS  64  13.541   0.390  -4.134
  534    HG2  LYS  64           HG2      LYS  64  13.654   0.274  -6.621
  535    HG3  LYS  64           HG1      LYS  64  12.733   1.776  -6.684
  536    HD2  LYS  64           HD2      LYS  64  15.406   1.419  -5.330
  537    HD3  LYS  64           HD1      LYS  64  15.156   2.148  -6.917
  538    HE2  LYS  64           HE2      LYS  64  14.017   3.172  -4.316
  539    HE3  LYS  64           HE1      LYS  64  15.435   3.824  -5.136
  540    HZ1  LYS  64           HZ1      LYS  64  13.597   5.187  -5.692
  541    HZ2  LYS  64           HZ2      LYS  64  12.632   3.855  -6.100
  542    HZ3  LYS  64           HZ3      LYS  64  13.955   4.267  -7.072
  543    H    ALA  65           HN       ALA  65  12.530  -1.871  -3.426
  544    HA   ALA  65           HA       ALA  65  13.649  -3.620  -5.324
  545    HB1  ALA  65           HB1      ALA  65  12.662  -4.327  -2.556
  546    HB2  ALA  65           HB2      ALA  65  14.246  -3.641  -2.922
  547    HB3  ALA  65           HB3      ALA  65  13.815  -5.241  -3.525
  548    H    ALA  66           HN       ALA  66  10.432  -3.430  -3.876
  549    HA   ALA  66           HA       ALA  66   9.398  -5.842  -4.933
  550    HB1  ALA  66           HB1      ALA  66   7.263  -5.069  -4.322
  551    HB2  ALA  66           HB2      ALA  66   7.745  -3.378  -4.457
  552    HB3  ALA  66           HB3      ALA  66   8.360  -4.366  -3.132
  553    H    ALA  67           HN       ALA  67   9.581  -2.548  -6.154
  554    HA   ALA  67           HA       ALA  67   8.136  -2.885  -8.530
  555    HB1  ALA  67           HB1      ALA  67   9.026  -0.846  -9.205
  556    HB2  ALA  67           HB2      ALA  67  10.572  -1.154  -8.422
  557    HB3  ALA  67           HB3      ALA  67   9.165  -0.735  -7.448
  558    H    GLN  68           HN       GLN  68  11.433  -3.465  -7.672
  559    HA   GLN  68           HA       GLN  68  12.403  -4.159 -10.222
  560    HB2  GLN  68           HB2      GLN  68  13.392  -4.868  -7.460
  561    HB3  GLN  68           HB1      GLN  68  14.284  -5.186  -8.943
  562    HG2  GLN  68           HG2      GLN  68  13.383  -2.449  -8.097
  563    HG3  GLN  68           HG1      GLN  68  14.966  -3.120  -7.710
  564   HE21  GLN  68          HE21      GLN  68  14.015  -0.831  -9.419
  565   HE22  GLN  68          HE22      GLN  68  14.796  -1.074 -10.940
  566    H    SER  69           HN       SER  69  10.960  -6.093  -7.610
  567    HA   SER  69           HA       SER  69  11.475  -8.584  -8.861
  568    HB2  SER  69           HB2      SER  69   9.971  -9.558  -7.231
  569    HB3  SER  69           HB1      SER  69  10.996  -8.374  -6.440
  570    HG   SER  69           HG       SER  69   8.287  -8.078  -7.219
  571    H    ILE  70           HN       ILE  70   9.067  -6.157  -9.367
  572    HA   ILE  70           HA       ILE  70   7.554  -8.034 -11.043
  573    HB   ILE  70           HB       ILE  70   6.236  -6.857  -9.299
  574   HG12  ILE  70          HG12      ILE  70   4.383  -6.168 -10.743
  575   HG13  ILE  70          HG11      ILE  70   5.477  -6.059 -12.118
  576   HG21  ILE  70          HG21      ILE  70   5.699  -4.432  -9.723
  577   HG22  ILE  70          HG22      ILE  70   7.086  -4.408 -10.814
  578   HG23  ILE  70          HG23      ILE  70   7.317  -4.770  -9.104
  579   HD11  ILE  70          HD11      ILE  70   4.900  -8.594 -10.605
  580   HD12  ILE  70          HD12      ILE  70   5.828  -8.429 -12.096
  581   HD13  ILE  70          HD13      ILE  70   4.094  -8.108 -12.096
  582    H    ASP  71           HN       ASP  71  10.034  -6.051 -11.284
  583    HA   ASP  71           HA       ASP  71  11.135  -5.014 -12.948
  584    HB2  ASP  71           HB2      ASP  71   9.188  -6.602 -14.615
  585    HB3  ASP  71           HB1      ASP  71  10.465  -5.625 -15.327
  586    H    ARG  72           HN       ARG  72   9.240  -3.457 -11.678
  587    HA   ARG  72           HA       ARG  72   8.404  -1.696 -13.890
  588    HB2  ARG  72           HB2      ARG  72   6.868  -2.298 -11.360
  589    HB3  ARG  72           HB1      ARG  72   6.434  -1.050 -12.518
  590    HG2  ARG  72           HG2      ARG  72   6.119  -2.753 -14.245
  591    HG3  ARG  72           HG1      ARG  72   6.567  -4.004 -13.082
  592    HD2  ARG  72           HD2      ARG  72   4.655  -3.316 -11.672
  593    HD3  ARG  72           HD1      ARG  72   4.191  -2.155 -12.917
  594    HE   ARG  72           HE       ARG  72   4.312  -4.500 -14.262
  595   HH11  ARG  72          HH21      ARG  72   2.666  -3.490 -11.351
  596   HH12  ARG  72          HH22      ARG  72   1.335  -4.577 -11.564
  597   HH21  ARG  72          HH11      ARG  72   2.563  -5.946 -14.558
  598   HH22  ARG  72          HH12      ARG  72   1.272  -5.981 -13.401
  599    H    THR  73           HN       THR  73   8.050   0.569 -13.170
  600    HA   THR  73           HA       THR  73  10.277   1.422 -11.546
  601    HB   THR  73           HB       THR  73   9.226   2.459 -13.792
  602    HG1  THR  73           HG1      THR  73  10.828   3.800 -13.458
  603   HG21  THR  73          HG21      THR  73   7.126   3.102 -12.506
  604   HG22  THR  73          HG22      THR  73   7.895   4.386 -13.438
  605   HG23  THR  73          HG23      THR  73   8.118   4.308 -11.691
  606    HA   PRO  74           HA       PRO  74   8.474   2.197  -7.571
  607    HB2  PRO  74           HB2      PRO  74   8.934   5.109  -8.087
  608    HB3  PRO  74           HB1      PRO  74   9.306   4.147  -6.650
  609    HG2  PRO  74           HG2      PRO  74  11.234   4.767  -8.362
  610    HG3  PRO  74           HG1      PRO  74  11.162   3.151  -7.636
  611    HD2  PRO  74           HD2      PRO  74  10.487   4.012 -10.404
  612    HD3  PRO  74           HD1      PRO  74  11.152   2.472  -9.826
  613    H    HIS  75           HN       HIS  75   7.280   4.253 -10.195
  614    HA   HIS  75           HA       HIS  75   5.011   5.292  -8.882
  615    HB2  HIS  75           HB2      HIS  75   5.935   6.143 -11.028
  616    HB3  HIS  75           HB1      HIS  75   5.341   4.696 -11.830
  617    HD1  HIS  75           HD1      HIS  75   3.170   5.024 -12.967
  618    HD2  HIS  75           HD2      HIS  75   3.642   7.623  -9.759
  619    HE1  HIS  75           HE1      HIS  75   1.123   6.483 -12.974
  620    HE2  HIS  75           HE2      HIS  75   1.581   8.208 -11.202
  621    H    TRP  76           HN       TRP  76   5.368   2.459 -10.990
  622    HA   TRP  76           HA       TRP  76   2.672   1.587 -10.758
  623    HB2  TRP  76           HB2      TRP  76   5.139   0.002 -11.481
  624    HB3  TRP  76           HB1      TRP  76   3.478  -0.507 -11.754
  625    HD1  TRP  76           HD1      TRP  76   6.268   1.449 -13.282
  626    HE1  TRP  76           HE1      TRP  76   5.516   2.421 -15.542
  627    HE3  TRP  76           HE3      TRP  76   1.262   0.474 -12.952
  628    HZ2  TRP  76           HZ2      TRP  76   3.119   2.732 -16.989
  629    HZ3  TRP  76           HZ3      TRP  76  -0.193   1.136 -14.825
  630    HH2  TRP  76           HH2      TRP  76   0.719   2.241 -16.800
  631    H    LEU  77           HN       LEU  77   5.653   0.974  -9.185
  632    HA   LEU  77           HA       LEU  77   4.995  -1.189  -7.595
  633    HB2  LEU  77           HB2      LEU  77   7.236  -0.694  -7.749
  634    HB3  LEU  77           HB1      LEU  77   6.979   1.014  -7.511
  635    HG   LEU  77           HG       LEU  77   8.224  -0.367  -5.717
  636   HD11  LEU  77          HD11      LEU  77   6.684   1.980  -5.665
  637   HD12  LEU  77          HD12      LEU  77   8.034   1.533  -4.626
  638   HD13  LEU  77          HD13      LEU  77   6.387   1.133  -4.149
  639   HD21  LEU  77          HD21      LEU  77   5.458  -0.836  -4.656
  640   HD22  LEU  77          HD22      LEU  77   6.993  -1.481  -4.072
  641   HD23  LEU  77          HD23      LEU  77   6.313  -2.063  -5.594
  642    H    ILE  78           HN       ILE  78   4.677   2.257  -6.919
  643    HA   ILE  78           HA       ILE  78   3.751   2.007  -4.286
  644    HB   ILE  78           HB       ILE  78   3.249   4.151  -6.350
  645   HG12  ILE  78          HG12      ILE  78   4.967   4.191  -3.861
  646   HG13  ILE  78          HG11      ILE  78   5.581   3.802  -5.464
  647   HG21  ILE  78          HG21      ILE  78   2.529   4.143  -3.429
  648   HG22  ILE  78          HG22      ILE  78   1.407   4.169  -4.790
  649   HG23  ILE  78          HG23      ILE  78   2.461   5.551  -4.488
  650   HD11  ILE  78          HD11      ILE  78   5.957   6.148  -4.717
  651   HD12  ILE  78          HD12      ILE  78   4.211   6.387  -4.803
  652   HD13  ILE  78          HD13      ILE  78   5.119   5.982  -6.261
  653    H    LYS  79           HN       LYS  79   1.899   2.402  -7.324
  654    HA   LYS  79           HA       LYS  79  -0.597   2.080  -5.991
  655    HB2  LYS  79           HB2      LYS  79  -1.562   1.807  -8.284
  656    HB3  LYS  79           HB1      LYS  79  -0.650   3.283  -8.034
  657    HG2  LYS  79           HG2      LYS  79   1.242   2.338  -9.226
  658    HG3  LYS  79           HG1      LYS  79   0.360   0.824  -9.443
  659    HD2  LYS  79           HD2      LYS  79   0.106   2.003 -11.475
  660    HD3  LYS  79           HD1      LYS  79  -1.425   2.196 -10.619
  661    HE2  LYS  79           HE2      LYS  79  -0.288   4.384  -9.720
  662    HE3  LYS  79           HE1      LYS  79   0.728   4.200 -11.148
  663    HZ1  LYS  79           HZ1      LYS  79  -0.892   5.210 -12.275
  664    HZ2  LYS  79           HZ2      LYS  79  -1.954   5.147 -10.954
  665    HZ3  LYS  79           HZ3      LYS  79  -1.861   3.843 -12.030
  666    H    GLN  80           HN       GLN  80   1.514  -0.185  -7.706
  667    HA   GLN  80           HA       GLN  80  -0.344  -2.329  -7.537
  668    HB2  GLN  80           HB2      GLN  80   1.153  -3.580  -8.690
  669    HB3  GLN  80           HB1      GLN  80   1.810  -1.996  -9.062
  670    HG2  GLN  80           HG2      GLN  80   3.724  -3.054  -8.494
  671    HG3  GLN  80           HG1      GLN  80   3.247  -2.492  -6.893
  672   HE21  GLN  80          HE21      GLN  80   3.493  -3.964  -5.403
  673   HE22  GLN  80          HE22      GLN  80   3.291  -5.671  -5.591
  674    H    ALA  81           HN       ALA  81   2.313  -1.249  -5.453
  675    HA   ALA  81           HA       ALA  81   2.446  -3.519  -3.838
  676    HB1  ALA  81           HB1      ALA  81   3.291  -1.994  -2.059
  677    HB2  ALA  81           HB2      ALA  81   2.904  -0.632  -3.111
  678    HB3  ALA  81           HB3      ALA  81   4.111  -1.816  -3.610
  679    H    ILE  82           HN       ILE  82   0.287  -0.727  -3.694
  680    HA   ILE  82           HA       ILE  82  -1.056  -1.906  -1.417
  681    HB   ILE  82           HB       ILE  82  -0.698   0.517  -1.524
  682   HG12  ILE  82          HG12      ILE  82  -3.344   1.048  -1.329
  683   HG13  ILE  82          HG11      ILE  82  -3.356  -0.707  -1.168
  684   HG21  ILE  82          HG21      ILE  82  -2.046   1.920  -3.011
  685   HG22  ILE  82          HG22      ILE  82  -2.627   0.469  -3.829
  686   HG23  ILE  82          HG23      ILE  82  -0.916   0.891  -3.891
  687   HD11  ILE  82          HD11      ILE  82  -1.784   1.228   0.516
  688   HD12  ILE  82          HD12      ILE  82  -1.738  -0.529   0.662
  689   HD13  ILE  82          HD13      ILE  82  -3.232   0.344   0.999
  690    H    PHE  83           HN       PHE  83  -1.928  -1.226  -4.813
  691    HA   PHE  83           HA       PHE  83  -4.533  -2.378  -4.501
  692    HB2  PHE  83           HB2      PHE  83  -4.830  -1.076  -6.302
  693    HB3  PHE  83           HB1      PHE  83  -3.099  -0.908  -6.544
  694    HD1  PHE  83           HD2      PHE  83  -5.997  -3.109  -7.283
  695    HD2  PHE  83           HD1      PHE  83  -2.036  -1.955  -8.334
  696    HE1  PHE  83           HE2      PHE  83  -6.154  -4.447  -9.341
  697    HE2  PHE  83           HE1      PHE  83  -2.188  -3.289 -10.393
  698    HZ   PHE  83           HZ       PHE  83  -4.248  -4.537 -10.898
  699    H    ASN  84           HN       ASN  84  -1.425  -3.536  -5.790
  700    HA   ASN  84           HA       ASN  84  -2.565  -6.003  -6.638
  701    HB2  ASN  84           HB2      ASN  84  -0.300  -4.982  -7.402
  702    HB3  ASN  84           HB1      ASN  84   0.340  -5.729  -5.944
  703   HD21  ASN  84          HD21      ASN  84   0.592  -6.197  -8.948
  704   HD22  ASN  84          HD22      ASN  84   0.353  -7.898  -9.123
  705    H    TYR  85           HN       TYR  85  -1.424  -4.658  -3.634
  706    HA   TYR  85           HA       TYR  85  -1.073  -7.074  -2.220
  707    HB2  TYR  85           HB2      TYR  85  -0.436  -5.097  -1.043
  708    HB3  TYR  85           HB1      TYR  85  -2.001  -4.339  -1.320
  709    HD1  TYR  85           HD1      TYR  85  -0.781  -7.545   0.197
  710    HD2  TYR  85           HD2      TYR  85  -3.300  -4.136   0.579
  711    HE1  TYR  85           HE1      TYR  85  -1.553  -8.370   2.376
  712    HE2  TYR  85           HE2      TYR  85  -4.080  -4.956   2.764
  713    HH   TYR  85           HH       TYR  85  -4.273  -7.196   3.933
  714    H    LEU  86           HN       LEU  86  -3.808  -5.085  -3.051
  715    HA   LEU  86           HA       LEU  86  -5.779  -6.562  -1.709
  716    HB2  LEU  86           HB2      LEU  86  -6.044  -4.925  -4.221
  717    HB3  LEU  86           HB1      LEU  86  -7.382  -5.525  -3.259
  718    HG   LEU  86           HG       LEU  86  -5.407  -3.367  -2.567
  719   HD11  LEU  86          HD11      LEU  86  -8.404  -3.441  -2.367
  720   HD12  LEU  86          HD12      LEU  86  -7.536  -2.907  -3.806
  721   HD13  LEU  86          HD13      LEU  86  -7.343  -2.034  -2.286
  722   HD21  LEU  86          HD21      LEU  86  -7.166  -4.924  -0.678
  723   HD22  LEU  86          HD22      LEU  86  -6.480  -3.345  -0.302
  724   HD23  LEU  86          HD23      LEU  86  -5.416  -4.718  -0.599
  725    H    GLU  87           HN       GLU  87  -4.366  -6.854  -4.936
  726    HA   GLU  87           HA       GLU  87  -6.041  -8.932  -5.859
  727    HB2  GLU  87           HB2      GLU  87  -3.234  -8.151  -6.651
  728    HB3  GLU  87           HB1      GLU  87  -4.115  -9.456  -7.429
  729    HG2  GLU  87           HG2      GLU  87  -5.875  -7.838  -8.054
  730    HG3  GLU  87           HG1      GLU  87  -4.890  -6.550  -7.364
  731    H    LYS  88           HN       LYS  88  -3.039  -8.958  -4.023
  732    HA   LYS  88           HA       LYS  88  -2.514 -11.702  -4.148
  733    HB2  LYS  88           HB2      LYS  88  -1.646  -9.465  -2.448
  734    HB3  LYS  88           HB1      LYS  88  -1.552 -11.042  -1.677
  735    HG2  LYS  88           HG2      LYS  88   0.535 -10.838  -2.604
  736    HG3  LYS  88           HG1      LYS  88  -0.319 -11.743  -3.855
  737    HD2  LYS  88           HD2      LYS  88  -0.691  -9.685  -5.103
  738    HD3  LYS  88           HD1      LYS  88   0.102  -8.758  -3.828
  739    HE2  LYS  88           HE2      LYS  88   2.167 -10.062  -4.226
  740    HE3  LYS  88           HE1      LYS  88   1.368 -10.862  -5.578
  741    HZ1  LYS  88           HZ1      LYS  88   0.969  -8.405  -6.326
  742    HZ2  LYS  88           HZ2      LYS  88   2.443  -9.191  -6.654
  743    HZ3  LYS  88           HZ3      LYS  88   2.333  -8.101  -5.346
  744    H    LEU  89           HN       LEU  89  -4.284  -9.903  -1.649
  745    HA   LEU  89           HA       LEU  89  -5.021 -12.334  -0.289
  746    HB2  LEU  89           HB2      LEU  89  -6.150 -10.921   1.270
  747    HB3  LEU  89           HB1      LEU  89  -4.570 -10.243   0.938
  748    HG   LEU  89           HG       LEU  89  -6.183  -8.916  -0.881
  749   HD11  LEU  89          HD11      LEU  89  -7.694  -9.176   1.718
  750   HD12  LEU  89          HD12      LEU  89  -8.187  -9.884   0.181
  751   HD13  LEU  89          HD13      LEU  89  -8.122  -8.129   0.365
  752   HD21  LEU  89          HD21      LEU  89  -4.414  -7.935   0.504
  753   HD22  LEU  89          HD22      LEU  89  -5.452  -8.078   1.923
  754   HD23  LEU  89          HD23      LEU  89  -5.904  -6.995   0.609
  755    H    GLU  90           HN       GLU  90  -6.400 -10.046  -2.531
  756    HA   GLU  90           HA       GLU  90  -8.322  -9.898  -3.688
  757    HB2  GLU  90           HB2      GLU  90  -7.343 -12.159  -4.428
  758    HB3  GLU  90           HB1      GLU  90  -8.636 -12.882  -3.482
  759    HG2  GLU  90           HG2      GLU  90 -10.304 -11.872  -4.847
  760    HG3  GLU  90           HG1      GLU  90  -9.108 -10.852  -5.643
  Start of MODEL    4
    1    H1   MET   1           HT1      MET   1   4.965   0.560  14.613
    2    H2   MET   1           HT2      MET   1   6.573   0.488  14.099
    3    H3   MET   1           HT3      MET   1   5.466  -0.680  13.575
    4    HA   MET   1           HA       MET   1   5.894   0.900  11.814
    5    HB2  MET   1           HB2      MET   1   3.153   1.171  13.080
    6    HB3  MET   1           HB1      MET   1   3.543   1.721  11.460
    7    HG2  MET   1           HG2      MET   1   4.054  -0.578  10.801
    8    HG3  MET   1           HG1      MET   1   3.661  -1.126  12.431
    9    HE1  MET   1           HE1      MET   1   0.623  -2.492  10.388
   10    HE2  MET   1           HE2      MET   1   2.026  -2.887  11.382
   11    HE3  MET   1           HE3      MET   1   2.250  -2.319   9.728
   12    H    ALA   2           HN       ALA   2   7.105   2.738  11.780
   13    HA   ALA   2           HA       ALA   2   6.126   5.037  13.365
   14    HB1  ALA   2           HB1      ALA   2   8.238   4.170  14.269
   15    HB2  ALA   2           HB2      ALA   2   8.450   5.776  13.573
   16    HB3  ALA   2           HB3      ALA   2   8.990   4.352  12.684
   17    H    THR   3           HN       THR   3   5.387   4.221  10.779
   18    HA   THR   3           HA       THR   3   6.779   5.580   8.741
   19    HB   THR   3           HB       THR   3   5.511   4.188   7.548
   20    HG1  THR   3           HG1      THR   3   4.264   6.002   7.070
   21   HG21  THR   3          HG21      THR   3   5.033   2.850   9.507
   22   HG22  THR   3          HG22      THR   3   3.579   2.963   8.514
   23   HG23  THR   3          HG23      THR   3   3.728   3.942   9.973
   24    H    THR   4           HN       THR   4   6.072   7.316   7.480
   25    HA   THR   4           HA       THR   4   4.471   9.306   8.933
   26    HB   THR   4           HB       THR   4   5.668  10.964   7.405
   27    HG1  THR   4           HG1      THR   4   7.269   8.646   6.963
   28   HG21  THR   4          HG21      THR   4   7.309   9.393   9.396
   29   HG22  THR   4          HG22      THR   4   6.253  10.759   9.758
   30   HG23  THR   4          HG23      THR   4   7.709  11.000   8.792
   31    H    THR   5           HN       THR   5   3.380  10.887   7.293
   32    HA   THR   5           HA       THR   5   1.830   9.207   5.517
   33    HB   THR   5           HB       THR   5   1.537  12.157   6.112
   34    HG1  THR   5           HG1      THR   5   1.303  10.607   7.915
   35   HG21  THR   5          HG21      THR   5  -0.712  11.917   5.234
   36   HG22  THR   5          HG22      THR   5  -0.444  10.200   4.936
   37   HG23  THR   5          HG23      THR   5   0.451  11.405   4.011
   38    H    LEU   6           HN       LEU   6   2.716   8.754   3.643
   39    HA   LEU   6           HA       LEU   6   4.061  10.885   2.119
   40    HB2  LEU   6           HB2      LEU   6   4.409   7.903   1.804
   41    HB3  LEU   6           HB1      LEU   6   5.332   9.158   1.003
   42    HG   LEU   6           HG       LEU   6   5.414   8.439   3.933
   43   HD11  LEU   6          HD11      LEU   6   7.838   8.518   2.262
   44   HD12  LEU   6          HD12      LEU   6   6.693   7.226   1.904
   45   HD13  LEU   6          HD13      LEU   6   7.362   7.385   3.528
   46   HD21  LEU   6          HD21      LEU   6   5.590  10.828   3.781
   47   HD22  LEU   6          HD22      LEU   6   6.751  10.703   2.459
   48   HD23  LEU   6          HD23      LEU   6   7.197  10.164   4.078
   49    H    GLY   7           HN       GLY   7   3.798  10.767  -0.232
   50    HA2  GLY   7           HA2      GLY   7   1.046  10.408  -0.938
   51    HA3  GLY   7           HA1      GLY   7   2.335  10.943  -2.004
   52    H    VAL   8           HN       VAL   8   0.105   8.632  -1.605
   53    HA   VAL   8           HA       VAL   8   1.655   6.656  -3.141
   54    HB   VAL   8           HB       VAL   8  -0.204   6.143  -0.822
   55   HG11  VAL   8          HG11      VAL   8   0.001   3.729  -1.289
   56   HG12  VAL   8          HG12      VAL   8   0.783   4.113  -2.823
   57   HG13  VAL   8          HG13      VAL   8  -0.892   4.586  -2.546
   58   HG21  VAL   8          HG21      VAL   8   1.692   4.838   0.019
   59   HG22  VAL   8          HG22      VAL   8   2.120   6.525  -0.267
   60   HG23  VAL   8          HG23      VAL   8   2.617   5.281  -1.415
   61    H    LYS   9           HN       LYS   9   0.213   5.253  -4.476
   62    HA   LYS   9           HA       LYS   9  -1.920   6.921  -5.553
   63    HB2  LYS   9           HB2      LYS   9  -0.367   4.600  -6.690
   64    HB3  LYS   9           HB1      LYS   9  -1.748   5.319  -7.505
   65    HG2  LYS   9           HG2      LYS   9   0.049   6.377  -8.508
   66    HG3  LYS   9           HG1      LYS   9  -0.443   7.537  -7.274
   67    HD2  LYS   9           HD2      LYS   9   1.388   5.829  -6.016
   68    HD3  LYS   9           HD1      LYS   9   2.075   6.174  -7.605
   69    HE2  LYS   9           HE2      LYS   9   2.054   8.504  -7.215
   70    HE3  LYS   9           HE1      LYS   9   1.009   8.335  -5.806
   71    HZ1  LYS   9           HZ1      LYS   9   3.795   7.317  -5.964
   72    HZ2  LYS   9           HZ2      LYS   9   2.793   7.302  -4.602
   73    HZ3  LYS   9           HZ3      LYS   9   3.341   8.773  -5.230
   74    H    LEU  10           HN       LEU  10  -3.898   6.514  -4.914
   75    HA   LEU  10           HA       LEU  10  -4.749   3.722  -4.559
   76    HB2  LEU  10           HB2      LEU  10  -5.159   6.056  -2.736
   77    HB3  LEU  10           HB1      LEU  10  -6.379   4.803  -2.819
   78    HG   LEU  10           HG       LEU  10  -3.497   4.212  -2.171
   79   HD11  LEU  10          HD11      LEU  10  -4.298   5.747  -0.494
   80   HD12  LEU  10          HD12      LEU  10  -4.256   4.120   0.185
   81   HD13  LEU  10          HD13      LEU  10  -5.792   4.827  -0.316
   82   HD21  LEU  10          HD21      LEU  10  -4.602   2.211  -1.118
   83   HD22  LEU  10          HD22      LEU  10  -4.676   2.274  -2.879
   84   HD23  LEU  10          HD23      LEU  10  -6.092   2.706  -1.919
   85    H    ASP  11           HN       ASP  11  -6.556   3.199  -5.581
   86    HA   ASP  11           HA       ASP  11  -7.993   5.230  -7.113
   87    HB2  ASP  11           HB2      ASP  11  -7.234   2.799  -7.878
   88    HB3  ASP  11           HB1      ASP  11  -8.738   2.327  -7.098
   89    H    ASP  12           HN       ASP  12 -10.458   5.173  -6.959
   90    HA   ASP  12           HA       ASP  12 -11.289   5.407  -4.279
   91    HB2  ASP  12           HB2      ASP  12 -12.538   5.651  -6.879
   92    HB3  ASP  12           HB1      ASP  12 -13.622   4.873  -5.730
   93    HA   PRO  13           HA       PRO  13 -13.333   0.913  -5.013
   94    HB2  PRO  13           HB2      PRO  13 -11.132   0.006  -6.811
   95    HB3  PRO  13           HB1      PRO  13 -12.831  -0.476  -6.784
   96    HG2  PRO  13           HG2      PRO  13 -11.860   1.216  -8.631
   97    HG3  PRO  13           HG1      PRO  13 -13.510   1.350  -7.999
   98    HD2  PRO  13           HD2      PRO  13 -11.164   3.076  -7.503
   99    HD3  PRO  13           HD1      PRO  13 -12.890   3.445  -7.379
  100    H    THR  14           HN       THR  14  -9.818   1.515  -5.233
  101    HA   THR  14           HA       THR  14  -9.148  -0.645  -3.508
  102    HB   THR  14           HB       THR  14  -6.900   0.184  -3.469
  103    HG1  THR  14           HG1      THR  14  -8.115   2.612  -4.162
  104   HG21  THR  14          HG21      THR  14  -6.582   0.681  -5.989
  105   HG22  THR  14          HG22      THR  14  -8.318   0.385  -6.094
  106   HG23  THR  14          HG23      THR  14  -7.243  -0.879  -5.498
  107    H    ARG  15           HN       ARG  15  -9.707   2.819  -3.000
  108    HA   ARG  15           HA       ARG  15  -8.839   2.938  -0.326
  109    HB2  ARG  15           HB2      ARG  15  -9.355   4.909  -1.792
  110    HB3  ARG  15           HB1      ARG  15 -11.064   4.548  -1.599
  111    HG2  ARG  15           HG2      ARG  15 -10.541   6.298  -0.091
  112    HG3  ARG  15           HG1      ARG  15 -10.757   4.834   0.871
  113    HD2  ARG  15           HD2      ARG  15  -8.333   4.540   0.978
  114    HD3  ARG  15           HD1      ARG  15  -8.106   5.985  -0.007
  115    HE   ARG  15           HE       ARG  15  -9.630   6.526   2.344
  116   HH11  ARG  15          HH21      ARG  15  -6.367   6.061   1.169
  117   HH12  ARG  15          HH22      ARG  15  -5.639   7.000   2.428
  118   HH21  ARG  15          HH11      ARG  15  -8.685   7.746   4.028
  119   HH22  ARG  15          HH12      ARG  15  -6.969   7.964   4.063
  120    H    GLU  16           HN       GLU  16 -11.983   2.264  -1.778
  121    HA   GLU  16           HA       GLU  16 -13.375   1.839   0.655
  122    HB2  GLU  16           HB2      GLU  16 -13.944   0.901  -2.163
  123    HB3  GLU  16           HB1      GLU  16 -15.059   0.709  -0.817
  124    HG2  GLU  16           HG2      GLU  16 -14.046   3.324  -1.911
  125    HG3  GLU  16           HG1      GLU  16 -15.643   2.630  -2.188
  126    H    ARG  17           HN       ARG  17 -11.668  -0.265  -1.599
  127    HA   ARG  17           HA       ARG  17 -12.329  -2.716  -0.393
  128    HB2  ARG  17           HB2      ARG  17 -11.333  -2.569  -2.642
  129    HB3  ARG  17           HB1      ARG  17  -9.832  -1.981  -1.941
  130    HG2  ARG  17           HG2      ARG  17  -9.616  -4.318  -2.491
  131    HG3  ARG  17           HG1      ARG  17  -9.587  -4.114  -0.738
  132    HD2  ARG  17           HD2      ARG  17 -11.947  -4.751  -0.623
  133    HD3  ARG  17           HD1      ARG  17 -11.978  -4.943  -2.374
  134    HE   ARG  17           HE       ARG  17 -10.871  -6.952  -2.165
  135   HH11  ARG  17          HH21      ARG  17 -10.842  -5.300   0.933
  136   HH12  ARG  17          HH22      ARG  17 -10.389  -6.718   1.821
  137   HH21  ARG  17          HH11      ARG  17 -10.283  -8.817  -1.023
  138   HH22  ARG  17          HH12      ARG  17 -10.072  -8.720   0.708
  139    H    LEU  18           HN       LEU  18  -9.772  -0.371   0.178
  140    HA   LEU  18           HA       LEU  18  -8.318  -1.817   2.089
  141    HB2  LEU  18           HB2      LEU  18  -8.497   0.983   1.218
  142    HB3  LEU  18           HB1      LEU  18  -8.045   0.795   2.900
  143    HG   LEU  18           HG       LEU  18  -6.226  -0.817   2.042
  144   HD11  LEU  18          HD11      LEU  18  -7.128  -1.064  -0.226
  145   HD12  LEU  18          HD12      LEU  18  -5.464  -0.479  -0.216
  146   HD13  LEU  18          HD13      LEU  18  -6.791   0.641  -0.527
  147   HD21  LEU  18          HD21      LEU  18  -4.724   1.085   1.509
  148   HD22  LEU  18          HD22      LEU  18  -5.680   1.323   2.971
  149   HD23  LEU  18          HD23      LEU  18  -6.138   2.139   1.476
  150    H    LYS  19           HN       LYS  19 -11.164   0.309   2.405
  151    HA   LYS  19           HA       LYS  19 -11.282   0.240   5.215
  152    HB2  LYS  19           HB2      LYS  19 -12.661   1.795   3.882
  153    HB3  LYS  19           HB1      LYS  19 -13.594   0.432   3.276
  154    HG2  LYS  19           HG2      LYS  19 -14.337  -0.061   5.565
  155    HG3  LYS  19           HG1      LYS  19 -13.429   1.334   6.147
  156    HD2  LYS  19           HD2      LYS  19 -15.318   1.848   3.940
  157    HD3  LYS  19           HD1      LYS  19 -16.043   1.411   5.487
  158    HE2  LYS  19           HE2      LYS  19 -15.895   3.759   5.508
  159    HE3  LYS  19           HE1      LYS  19 -14.562   3.199   6.516
  160    HZ1  LYS  19           HZ1      LYS  19 -13.020   3.663   4.822
  161    HZ2  LYS  19           HZ2      LYS  19 -14.040   5.010   4.868
  162    HZ3  LYS  19           HZ3      LYS  19 -14.222   3.854   3.646
  163    H    ALA  20           HN       ALA  20 -12.614  -1.838   2.755
  164    HA   ALA  20           HA       ALA  20 -13.924  -3.682   4.416
  165    HB1  ALA  20           HB1      ALA  20 -12.679  -4.176   1.706
  166    HB2  ALA  20           HB2      ALA  20 -14.307  -3.558   1.989
  167    HB3  ALA  20           HB3      ALA  20 -13.883  -5.192   2.500
  168    H    ALA  21           HN       ALA  21 -10.623  -3.454   3.215
  169    HA   ALA  21           HA       ALA  21  -9.653  -5.900   4.235
  170    HB1  ALA  21           HB1      ALA  21  -7.448  -4.984   3.890
  171    HB2  ALA  21           HB2      ALA  21  -8.099  -3.347   3.814
  172    HB3  ALA  21           HB3      ALA  21  -8.480  -4.506   2.541
  173    H    ALA  22           HN       ALA  22  -9.939  -2.656   5.559
  174    HA   ALA  22           HA       ALA  22  -8.647  -3.057   8.011
  175    HB1  ALA  22           HB1      ALA  22  -9.407  -0.847   7.064
  176    HB2  ALA  22           HB2      ALA  22  -9.770  -1.089   8.772
  177    HB3  ALA  22           HB3      ALA  22 -11.041  -1.281   7.565
  178    H    GLN  23           HN       GLN  23 -11.913  -3.542   6.959
  179    HA   GLN  23           HA       GLN  23 -12.989  -4.373   9.433
  180    HB2  GLN  23           HB2      GLN  23 -13.909  -4.860   6.595
  181    HB3  GLN  23           HB1      GLN  23 -14.863  -5.231   8.027
  182    HG2  GLN  23           HG2      GLN  23 -13.827  -2.484   7.392
  183    HG3  GLN  23           HG1      GLN  23 -15.415  -3.061   6.893
  184   HE21  GLN  23          HE21      GLN  23 -14.381  -0.958   8.839
  185   HE22  GLN  23          HE22      GLN  23 -15.266  -1.259  10.290
  186    H    SER  24           HN       SER  24 -11.573  -6.151   6.692
  187    HA   SER  24           HA       SER  24 -12.112  -8.716   7.810
  188    HB2  SER  24           HB2      SER  24 -10.592  -9.595   6.093
  189    HB3  SER  24           HB1      SER  24 -11.732  -8.445   5.395
  190    HG   SER  24           HG       SER  24  -9.067  -7.826   6.187
  191    H    ILE  25           HN       ILE  25  -9.749  -6.325   8.434
  192    HA   ILE  25           HA       ILE  25  -8.035  -8.282   9.780
  193    HB   ILE  25           HB       ILE  25  -7.341  -6.297   8.037
  194   HG12  ILE  25          HG12      ILE  25  -5.945  -8.189   8.592
  195   HG13  ILE  25          HG11      ILE  25  -5.013  -6.707   8.753
  196   HG21  ILE  25          HG21      ILE  25  -6.745  -5.205  10.770
  197   HG22  ILE  25          HG22      ILE  25  -7.851  -4.514   9.583
  198   HG23  ILE  25          HG23      ILE  25  -6.121  -4.577   9.245
  199   HD11  ILE  25          HD11      ILE  25  -6.157  -8.387  10.967
  200   HD12  ILE  25          HD12      ILE  25  -5.390  -6.817  11.206
  201   HD13  ILE  25          HD13      ILE  25  -4.457  -8.164  10.552
  202    H    ASP  26           HN       ASP  26 -10.559  -6.369  10.354
  203    HA   ASP  26           HA       ASP  26 -11.612  -5.549  12.153
  204    HB2  ASP  26           HB2      ASP  26  -9.679  -7.391  13.549
  205    HB3  ASP  26           HB1      ASP  26 -10.931  -6.499  14.409
  206    H    ARG  27           HN       ARG  27  -9.744  -3.822  11.096
  207    HA   ARG  27           HA       ARG  27  -8.969  -2.367  13.536
  208    HB2  ARG  27           HB2      ARG  27  -7.154  -2.837  11.165
  209    HB3  ARG  27           HB1      ARG  27  -6.801  -1.744  12.500
  210    HG2  ARG  27           HG2      ARG  27  -6.857  -3.623  14.062
  211    HG3  ARG  27           HG1      ARG  27  -7.215  -4.721  12.730
  212    HD2  ARG  27           HD2      ARG  27  -5.062  -3.996  11.680
  213    HD3  ARG  27           HD1      ARG  27  -4.705  -3.118  13.167
  214    HE   ARG  27           HE       ARG  27  -5.213  -5.604  14.068
  215   HH11  ARG  27          HH21      ARG  27  -3.181  -4.444  11.474
  216   HH12  ARG  27          HH22      ARG  27  -1.985  -5.684  11.666
  217   HH21  ARG  27          HH11      ARG  27  -3.652  -7.266  14.329
  218   HH22  ARG  27          HH12      ARG  27  -2.256  -7.298  13.301
  219    H    THR  28           HN       THR  28  -8.365  -0.062  13.050
  220    HA   THR  28           HA       THR  28 -10.468   1.149  11.547
  221    HB   THR  28           HB       THR  28  -9.865   2.264  13.553
  222    HG1  THR  28           HG1      THR  28  -9.528   4.313  12.823
  223   HG21  THR  28          HG21      THR  28  -7.664   1.411  13.947
  224   HG22  THR  28          HG22      THR  28  -7.567   3.172  13.936
  225   HG23  THR  28          HG23      THR  28  -7.026   2.250  12.533
  226    HA   PRO  29           HA       PRO  29  -8.874   1.684   7.449
  227    HB2  PRO  29           HB2      PRO  29  -9.530   4.558   7.988
  228    HB3  PRO  29           HB1      PRO  29  -9.876   3.579   6.556
  229    HG2  PRO  29           HG2      PRO  29 -11.772   4.051   8.360
  230    HG3  PRO  29           HG1      PRO  29 -11.633   2.464   7.580
  231    HD2  PRO  29           HD2      PRO  29 -10.965   3.268  10.356
  232    HD3  PRO  29           HD1      PRO  29 -11.453   1.685   9.722
  233    H    HIS  30           HN       HIS  30  -7.896   4.247   9.768
  234    HA   HIS  30           HA       HIS  30  -5.640   5.103   8.315
  235    HB2  HIS  30           HB2      HIS  30  -6.555   6.437  10.160
  236    HB3  HIS  30           HB1      HIS  30  -6.082   5.192  11.310
  237    HD1  HIS  30           HD1      HIS  30  -3.843   5.498  12.371
  238    HD2  HIS  30           HD2      HIS  30  -4.195   7.648   8.829
  239    HE1  HIS  30           HE1      HIS  30  -1.706   6.801  12.158
  240    HE2  HIS  30           HE2      HIS  30  -2.065   8.293  10.167
  241    H    TRP  31           HN       TRP  31  -5.920   2.755  10.968
  242    HA   TRP  31           HA       TRP  31  -3.181   2.064  10.968
  243    HB2  TRP  31           HB2      TRP  31  -4.632   1.534  12.899
  244    HB3  TRP  31           HB1      TRP  31  -5.525   0.390  11.898
  245    HD1  TRP  31           HD1      TRP  31  -4.028  -1.783  10.979
  246    HE1  TRP  31           HE1      TRP  31  -2.115  -3.049  12.148
  247    HE3  TRP  31           HE3      TRP  31  -2.772   1.697  14.509
  248    HZ2  TRP  31           HZ2      TRP  31  -0.333  -2.646  14.281
  249    HZ3  TRP  31           HZ3      TRP  31  -0.951   1.172  16.078
  250    HH2  TRP  31           HH2      TRP  31   0.242  -0.955  15.965
  251    H    LEU  32           HN       LEU  32  -6.012   0.864   9.363
  252    HA   LEU  32           HA       LEU  32  -4.909  -1.423   8.221
  253    HB2  LEU  32           HB2      LEU  32  -7.318  -1.001   8.244
  254    HB3  LEU  32           HB1      LEU  32  -7.098   0.325   7.122
  255    HG   LEU  32           HG       LEU  32  -7.965  -1.904   6.192
  256   HD11  LEU  32          HD11      LEU  32  -7.103  -0.002   4.834
  257   HD12  LEU  32          HD12      LEU  32  -6.900  -1.588   4.091
  258   HD13  LEU  32          HD13      LEU  32  -5.523  -0.785   4.843
  259   HD21  LEU  32          HD21      LEU  32  -6.357  -3.347   7.353
  260   HD22  LEU  32          HD22      LEU  32  -5.047  -2.629   6.414
  261   HD23  LEU  32          HD23      LEU  32  -6.303  -3.565   5.603
  262    H    ILE  33           HN       ILE  33  -4.941   1.899   7.128
  263    HA   ILE  33           HA       ILE  33  -3.905   1.435   4.565
  264    HB   ILE  33           HB       ILE  33  -3.555   3.834   6.372
  265   HG12  ILE  33          HG12      ILE  33  -5.288   3.481   3.919
  266   HG13  ILE  33          HG11      ILE  33  -5.865   3.246   5.566
  267   HG21  ILE  33          HG21      ILE  33  -2.870   5.053   4.338
  268   HG22  ILE  33          HG22      ILE  33  -2.831   3.523   3.462
  269   HG23  ILE  33          HG23      ILE  33  -1.720   3.800   4.804
  270   HD11  ILE  33          HD11      ILE  33  -4.807   5.802   4.387
  271   HD12  ILE  33          HD12      ILE  33  -5.291   5.584   6.069
  272   HD13  ILE  33          HD13      ILE  33  -6.486   5.431   4.780
  273    H    LYS  34           HN       LYS  34  -2.302   2.060   7.665
  274    HA   LYS  34           HA       LYS  34   0.355   1.855   6.697
  275    HB2  LYS  34           HB2      LYS  34  -0.503   1.016   9.465
  276    HB3  LYS  34           HB1      LYS  34   1.022   1.737   8.970
  277    HG2  LYS  34           HG2      LYS  34  -0.420   3.786   8.347
  278    HG3  LYS  34           HG1      LYS  34  -1.635   3.036   9.377
  279    HD2  LYS  34           HD2      LYS  34   1.173   3.749  10.216
  280    HD3  LYS  34           HD1      LYS  34  -0.275   4.683  10.588
  281    HE2  LYS  34           HE2      LYS  34  -1.173   2.659  11.756
  282    HE3  LYS  34           HE1      LYS  34   0.402   1.899  11.522
  283    HZ1  LYS  34           HZ1      LYS  34  -0.062   4.442  12.996
  284    HZ2  LYS  34           HZ2      LYS  34   1.422   3.655  12.810
  285    HZ3  LYS  34           HZ3      LYS  34   0.190   2.931  13.713
  286    H    GLN  35           HN       GLN  35  -1.851  -0.432   8.204
  287    HA   GLN  35           HA       GLN  35  -0.215  -2.697   8.209
  288    HB2  GLN  35           HB2      GLN  35  -2.142  -2.721   9.578
  289    HB3  GLN  35           HB1      GLN  35  -3.193  -2.296   8.238
  290    HG2  GLN  35           HG2      GLN  35  -3.643  -4.537   8.632
  291    HG3  GLN  35           HG1      GLN  35  -2.574  -4.541   7.235
  292   HE21  GLN  35          HE21      GLN  35  -2.991  -6.780   8.765
  293   HE22  GLN  35          HE22      GLN  35  -1.525  -7.184   9.589
  294    H    ALA  36           HN       ALA  36  -2.450  -1.486   5.755
  295    HA   ALA  36           HA       ALA  36  -2.500  -3.739   4.093
  296    HB1  ALA  36           HB1      ALA  36  -2.963  -0.823   3.548
  297    HB2  ALA  36           HB2      ALA  36  -4.155  -2.108   3.749
  298    HB3  ALA  36           HB3      ALA  36  -3.142  -2.062   2.306
  299    H    ILE  37           HN       ILE  37  -0.509  -0.788   3.820
  300    HA   ILE  37           HA       ILE  37   0.939  -1.792   1.597
  301    HB   ILE  37           HB       ILE  37   0.761   0.638   2.161
  302   HG12  ILE  37          HG12      ILE  37   3.175   1.143   1.613
  303   HG13  ILE  37          HG11      ILE  37   3.491  -0.582   1.763
  304   HG21  ILE  37          HG21      ILE  37   1.158   0.504   4.561
  305   HG22  ILE  37          HG22      ILE  37   2.290   1.611   3.784
  306   HG23  ILE  37          HG23      ILE  37   2.821  -0.001   4.262
  307   HD11  ILE  37          HD11      ILE  37   2.520   0.870  -0.473
  308   HD12  ILE  37          HD12      ILE  37   1.279  -0.275   0.035
  309   HD13  ILE  37          HD13      ILE  37   2.902  -0.847  -0.348
  310    H    PHE  38           HN       PHE  38   1.397  -1.859   5.076
  311    HA   PHE  38           HA       PHE  38   3.965  -3.080   5.015
  312    HB2  PHE  38           HB2      PHE  38   1.877  -2.595   7.092
  313    HB3  PHE  38           HB1      PHE  38   3.027  -3.887   7.401
  314    HD1  PHE  38           HD1      PHE  38   2.835  -0.271   6.552
  315    HD2  PHE  38           HD2      PHE  38   5.099  -3.418   8.303
  316    HE1  PHE  38           HE1      PHE  38   4.448   1.372   7.411
  317    HE2  PHE  38           HE2      PHE  38   6.717  -1.779   9.166
  318    HZ   PHE  38           HZ       PHE  38   6.391   0.620   8.722
  319    H    ASN  39           HN       ASN  39   0.664  -4.223   4.847
  320    HA   ASN  39           HA       ASN  39   1.188  -6.934   5.358
  321    HB2  ASN  39           HB2      ASN  39  -1.017  -5.443   4.043
  322    HB3  ASN  39           HB1      ASN  39  -0.869  -7.155   3.684
  323   HD21  ASN  39          HD21      ASN  39   0.218  -7.690   6.400
  324   HD22  ASN  39          HD22      ASN  39  -1.151  -7.628   7.444
  325    H    TYR  40           HN       TYR  40   1.217  -4.959   2.472
  326    HA   TYR  40           HA       TYR  40   1.637  -7.024   0.649
  327    HB2  TYR  40           HB2      TYR  40   1.116  -4.873  -0.252
  328    HB3  TYR  40           HB1      TYR  40   2.463  -4.116   0.595
  329    HD1  TYR  40           HD2      TYR  40   1.905  -6.891  -1.846
  330    HD2  TYR  40           HD1      TYR  40   4.312  -3.581  -0.691
  331    HE1  TYR  40           HE2      TYR  40   3.332  -7.250  -3.810
  332    HE2  TYR  40           HE1      TYR  40   5.752  -3.937  -2.655
  333    HH   TYR  40           HH       TYR  40   4.892  -6.186  -5.169
  334    H    LEU  41           HN       LEU  41   3.759  -5.172   2.690
  335    HA   LEU  41           HA       LEU  41   6.139  -6.406   1.684
  336    HB2  LEU  41           HB2      LEU  41   5.707  -4.664   4.091
  337    HB3  LEU  41           HB1      LEU  41   7.272  -5.159   3.468
  338    HG   LEU  41           HG       LEU  41   5.253  -3.411   2.056
  339   HD11  LEU  41          HD11      LEU  41   6.921  -1.688   2.268
  340   HD12  LEU  41          HD12      LEU  41   8.023  -2.810   3.065
  341   HD13  LEU  41          HD13      LEU  41   6.523  -2.333   3.860
  342   HD21  LEU  41          HD21      LEU  41   6.257  -4.728   0.373
  343   HD22  LEU  41          HD22      LEU  41   7.848  -4.600   1.119
  344   HD23  LEU  41          HD23      LEU  41   7.113  -3.186   0.365
  345    H    GLU  42           HN       GLU  42   4.453  -6.565   4.791
  346    HA   GLU  42           HA       GLU  42   6.081  -8.485   6.017
  347    HB2  GLU  42           HB2      GLU  42   4.637  -6.997   7.279
  348    HB3  GLU  42           HB1      GLU  42   3.207  -7.723   6.563
  349    HG2  GLU  42           HG2      GLU  42   3.726  -9.837   7.676
  350    HG3  GLU  42           HG1      GLU  42   5.162  -9.110   8.393
  351    H    LYS  43           HN       LYS  43   3.122  -8.902   4.087
  352    HA   LYS  43           HA       LYS  43   2.659 -11.591   4.757
  353    HB2  LYS  43           HB2      LYS  43   1.047 -10.103   3.563
  354    HB3  LYS  43           HB1      LYS  43   2.022 -10.283   2.112
  355    HG2  LYS  43           HG2      LYS  43   1.601 -12.684   2.115
  356    HG3  LYS  43           HG1      LYS  43   0.634 -12.514   3.581
  357    HD2  LYS  43           HD2      LYS  43   0.026 -11.148   0.960
  358    HD3  LYS  43           HD1      LYS  43  -0.722 -12.651   1.503
  359    HE2  LYS  43           HE2      LYS  43  -1.413 -11.354   3.589
  360    HE3  LYS  43           HE1      LYS  43  -0.967  -9.902   2.696
  361    HZ1  LYS  43           HZ1      LYS  43  -3.349 -10.468   2.551
  362    HZ2  LYS  43           HZ2      LYS  43  -2.946 -11.903   1.751
  363    HZ3  LYS  43           HZ3      LYS  43  -2.594 -10.410   1.037
  364    H    LEU  44           HN       LEU  44   4.467 -10.225   1.998
  365    HA   LEU  44           HA       LEU  44   5.359 -12.893   1.295
  366    HB2  LEU  44           HB2      LEU  44   6.526 -11.810  -0.586
  367    HB3  LEU  44           HB1      LEU  44   4.812 -11.465  -0.559
  368    HG   LEU  44           HG       LEU  44   5.654  -9.261   0.692
  369   HD11  LEU  44          HD11      LEU  44   7.745  -8.475  -0.089
  370   HD12  LEU  44          HD12      LEU  44   7.932  -9.845  -1.184
  371   HD13  LEU  44          HD13      LEU  44   8.033 -10.090   0.560
  372   HD21  LEU  44          HD21      LEU  44   5.693  -8.159  -1.527
  373   HD22  LEU  44          HD22      LEU  44   4.323  -9.249  -1.318
  374   HD23  LEU  44          HD23      LEU  44   5.710  -9.751  -2.285
  375    H    GLU  45           HN       GLU  45   6.573  -9.964   2.691
  376    HA   GLU  45           HA       GLU  45   8.438  -9.319   3.708
  377    HB2  GLU  45           HB2      GLU  45   7.539 -11.108   5.242
  378    HB3  GLU  45           HB1      GLU  45   8.771 -12.175   4.574
  379    HG2  GLU  45           HG2      GLU  45  10.525 -10.800   5.387
  380    HG3  GLU  45           HG1      GLU  45   9.400  -9.519   5.827
  381    H1   MET  46           HT1      MET  46  -4.886   0.968 -14.563
  382    H2   MET  46           HT2      MET  46  -6.487   0.910 -14.025
  383    H3   MET  46           HT3      MET  46  -5.385  -0.269 -13.518
  384    HA   MET  46           HA       MET  46  -5.762   1.307 -11.749
  385    HB2  MET  46           HB2      MET  46  -3.049   1.617 -13.062
  386    HB3  MET  46           HB1      MET  46  -3.417   2.103 -11.416
  387    HG2  MET  46           HG2      MET  46  -3.902  -0.220 -10.837
  388    HG3  MET  46           HG1      MET  46  -3.531  -0.707 -12.491
  389    HE1  MET  46           HE1      MET  46  -0.457  -2.119 -10.537
  390    HE2  MET  46           HE2      MET  46  -1.858  -2.489 -11.542
  391    HE3  MET  46           HE3      MET  46  -2.083  -1.990  -9.865
  392    H    ALA  47           HN       ALA  47  -6.993   3.126 -11.706
  393    HA   ALA  47           HA       ALA  47  -6.021   5.466 -13.235
  394    HB1  ALA  47           HB1      ALA  47  -8.130   4.618 -14.163
  395    HB2  ALA  47           HB2      ALA  47  -8.349   6.203 -13.421
  396    HB3  ALA  47           HB3      ALA  47  -8.883   4.751 -12.574
  397    H    THR  48           HN       THR  48  -5.297   4.567 -10.669
  398    HA   THR  48           HA       THR  48  -6.685   5.867  -8.594
  399    HB   THR  48           HB       THR  48  -5.434   4.418  -7.457
  400    HG1  THR  48           HG1      THR  48  -4.197   6.171  -6.846
  401   HG21  THR  48          HG21      THR  48  -4.921   3.156  -9.448
  402   HG22  THR  48          HG22      THR  48  -3.469   3.254  -8.451
  403   HG23  THR  48          HG23      THR  48  -3.631   4.280  -9.875
  404    H    THR  49           HN       THR  49  -5.962   7.547  -7.264
  405    HA   THR  49           HA       THR  49  -4.365   9.590  -8.646
  406    HB   THR  49           HB       THR  49  -5.579  11.188  -7.065
  407    HG1  THR  49           HG1      THR  49  -7.330   8.945  -6.817
  408   HG21  THR  49          HG21      THR  49  -7.202   9.686  -9.124
  409   HG22  THR  49          HG22      THR  49  -6.146  11.064  -9.432
  410   HG23  THR  49          HG23      THR  49  -7.607  11.271  -8.466
  411    H    THR  50           HN       THR  50  -3.271  11.105  -6.974
  412    HA   THR  50           HA       THR  50  -1.739   9.392  -5.224
  413    HB   THR  50           HB       THR  50  -1.458  12.363  -5.703
  414    HG1  THR  50           HG1      THR  50  -1.248  10.861  -7.574
  415   HG21  THR  50          HG21      THR  50   0.800  12.081  -4.864
  416   HG22  THR  50          HG22      THR  50   0.536  10.351  -4.649
  417   HG23  THR  50          HG23      THR  50  -0.348  11.508  -3.654
  418    H    LEU  51           HN       LEU  51  -2.607   8.884  -3.364
  419    HA   LEU  51           HA       LEU  51  -3.980  10.949  -1.779
  420    HB2  LEU  51           HB2      LEU  51  -4.319   7.956  -1.575
  421    HB3  LEU  51           HB1      LEU  51  -5.247   9.178  -0.728
  422    HG   LEU  51           HG       LEU  51  -5.323   8.569  -3.683
  423   HD11  LEU  51          HD11      LEU  51  -7.748   8.581  -2.012
  424   HD12  LEU  51          HD12      LEU  51  -6.601   7.278  -1.702
  425   HD13  LEU  51          HD13      LEU  51  -7.270   7.497  -3.319
  426   HD21  LEU  51          HD21      LEU  51  -5.504  10.951  -3.442
  427   HD22  LEU  51          HD22      LEU  51  -6.666  10.775  -2.127
  428   HD23  LEU  51          HD23      LEU  51  -7.109  10.295  -3.766
  429    H    GLY  52           HN       GLY  52  -3.736  10.727   0.573
  430    HA2  GLY  52           HA2      GLY  52  -0.976  10.375   1.268
  431    HA3  GLY  52           HA1      GLY  52  -2.272  10.855   2.352
  432    H    VAL  53           HN       VAL  53  -0.021   8.569   1.846
  433    HA   VAL  53           HA       VAL  53  -1.557   6.532   3.318
  434    HB   VAL  53           HB       VAL  53   0.304   6.114   0.980
  435   HG11  VAL  53          HG11      VAL  53   0.101   3.683   1.356
  436   HG12  VAL  53          HG12      VAL  53  -0.675   4.009   2.905
  437   HG13  VAL  53          HG13      VAL  53   0.999   4.494   2.640
  438   HG21  VAL  53          HG21      VAL  53  -1.589   4.835   0.091
  439   HG22  VAL  53          HG22      VAL  53  -2.020   6.510   0.437
  440   HG23  VAL  53          HG23      VAL  53  -2.516   5.225   1.539
  441    H    LYS  54           HN       LYS  54  -0.109   5.091   4.602
  442    HA   LYS  54           HA       LYS  54   2.021   6.726   5.735
  443    HB2  LYS  54           HB2      LYS  54   0.463   4.371   6.789
  444    HB3  LYS  54           HB1      LYS  54   1.847   5.053   7.631
  445    HG2  LYS  54           HG2      LYS  54   0.047   6.078   8.668
  446    HG3  LYS  54           HG1      LYS  54   0.560   7.285   7.488
  447    HD2  LYS  54           HD2      LYS  54  -1.275   5.665   6.135
  448    HD3  LYS  54           HD1      LYS  54  -1.972   5.915   7.737
  449    HE2  LYS  54           HE2      LYS  54  -1.932   8.269   7.490
  450    HE3  LYS  54           HE1      LYS  54  -0.893   8.174   6.070
  451    HZ1  LYS  54           HZ1      LYS  54  -3.677   7.145   6.166
  452    HZ2  LYS  54           HZ2      LYS  54  -2.682   7.253   4.803
  453    HZ3  LYS  54           HZ3      LYS  54  -3.243   8.661   5.553
  454    H    LEU  55           HN       LEU  55   4.005   6.342   5.101
  455    HA   LEU  55           HA       LEU  55   4.865   3.566   4.653
  456    HB2  LEU  55           HB2      LEU  55   5.275   5.959   2.903
  457    HB3  LEU  55           HB1      LEU  55   6.488   4.698   2.942
  458    HG   LEU  55           HG       LEU  55   3.602   4.139   2.283
  459   HD11  LEU  55          HD11      LEU  55   4.395   5.733   0.657
  460   HD12  LEU  55          HD12      LEU  55   4.352   4.131  -0.080
  461   HD13  LEU  55          HD13      LEU  55   5.889   4.822   0.440
  462   HD21  LEU  55          HD21      LEU  55   4.703   2.180   1.146
  463   HD22  LEU  55          HD22      LEU  55   4.776   2.174   2.908
  464   HD23  LEU  55          HD23      LEU  55   6.193   2.641   1.967
  465    H    ASP  56           HN       ASP  56   6.681   3.022   5.661
  466    HA   ASP  56           HA       ASP  56   8.113   5.024   7.240
  467    HB2  ASP  56           HB2      ASP  56   7.368   2.578   7.965
  468    HB3  ASP  56           HB1      ASP  56   8.870   2.124   7.168
  469    H    ASP  57           HN       ASP  57  10.580   4.974   7.083
  470    HA   ASP  57           HA       ASP  57  11.424   5.288   4.419
  471    HB2  ASP  57           HB2      ASP  57  12.652   5.454   7.027
  472    HB3  ASP  57           HB1      ASP  57  13.737   4.656   5.895
  473    HA   PRO  58           HA       PRO  58  13.430   0.746   5.007
  474    HB2  PRO  58           HB2      PRO  58  11.213  -0.199   6.765
  475    HB3  PRO  58           HB1      PRO  58  12.906  -0.700   6.725
  476    HG2  PRO  58           HG2      PRO  58  11.952   0.941   8.626
  477    HG3  PRO  58           HG1      PRO  58  13.604   1.077   8.001
  478    HD2  PRO  58           HD2      PRO  58  11.280   2.846   7.562
  479    HD3  PRO  58           HD1      PRO  58  13.010   3.198   7.449
  480    H    THR  59           HN       THR  59   9.916   1.348   5.233
  481    HA   THR  59           HA       THR  59   9.248  -0.748   3.431
  482    HB   THR  59           HB       THR  59   7.002   0.090   3.415
  483    HG1  THR  59           HG1      THR  59   8.222   2.488   4.199
  484   HG21  THR  59          HG21      THR  59   6.675   0.491   5.948
  485   HG22  THR  59          HG22      THR  59   8.412   0.199   6.052
  486   HG23  THR  59          HG23      THR  59   7.345  -1.048   5.406
  487    H    ARG  60           HN       ARG  60   9.819   2.728   3.047
  488    HA   ARG  60           HA       ARG  60   8.953   2.944   0.379
  489    HB2  ARG  60           HB2      ARG  60   9.468   4.859   1.917
  490    HB3  ARG  60           HB1      ARG  60  11.177   4.506   1.711
  491    HG2  ARG  60           HG2      ARG  60  10.646   6.310   0.268
  492    HG3  ARG  60           HG1      ARG  60  10.872   4.882  -0.745
  493    HD2  ARG  60           HD2      ARG  60   8.454   4.575  -0.869
  494    HD3  ARG  60           HD1      ARG  60   8.212   5.977   0.172
  495    HE   ARG  60           HE       ARG  60   9.737   6.630  -2.147
  496   HH11  ARG  60          HH21      ARG  60   6.478   6.068  -1.004
  497   HH12  ARG  60          HH22      ARG  60   5.736   7.038  -2.232
  498   HH21  ARG  60          HH11      ARG  60   8.776   7.900  -3.785
  499   HH22  ARG  60          HH12      ARG  60   7.057   8.085  -3.829
  500    H    GLU  61           HN       GLU  61  12.101   2.227   1.803
  501    HA   GLU  61           HA       GLU  61  13.490   1.885  -0.643
  502    HB2  GLU  61           HB2      GLU  61  14.055   0.825   2.134
  503    HB3  GLU  61           HB1      GLU  61  15.175   0.709   0.783
  504    HG2  GLU  61           HG2      GLU  61  14.148   3.258   2.013
  505    HG3  GLU  61           HG1      GLU  61  15.746   2.556   2.257
  506    H    ARG  62           HN       ARG  62  11.783  -0.305   1.535
  507    HA   ARG  62           HA       ARG  62  12.448  -2.712   0.242
  508    HB2  ARG  62           HB2      ARG  62  11.454  -2.644   2.495
  509    HB3  ARG  62           HB1      ARG  62   9.951  -2.037   1.818
  510    HG2  ARG  62           HG2      ARG  62   9.744  -4.389   2.294
  511    HG3  ARG  62           HG1      ARG  62   9.708  -4.132   0.547
  512    HD2  ARG  62           HD2      ARG  62  12.067  -4.754   0.405
  513    HD3  ARG  62           HD1      ARG  62  12.112  -5.004   2.148
  514    HE   ARG  62           HE       ARG  62  11.027  -7.016   1.876
  515   HH11  ARG  62          HH21      ARG  62  10.927  -5.248  -1.153
  516   HH12  ARG  62          HH22      ARG  62  10.431  -6.626  -2.079
  517   HH21  ARG  62          HH11      ARG  62  10.391  -8.825   0.686
  518   HH22  ARG  62          HH12      ARG  62  10.126  -8.666  -1.030
  519    H    LEU  63           HN       LEU  63   9.884  -0.352  -0.241
  520    HA   LEU  63           HA       LEU  63   8.435  -1.732  -2.203
  521    HB2  LEU  63           HB2      LEU  63   8.606   1.034  -1.233
  522    HB3  LEU  63           HB1      LEU  63   8.152   0.905  -2.920
  523    HG   LEU  63           HG       LEU  63   6.339  -0.744  -2.116
  524   HD11  LEU  63          HD11      LEU  63   7.240  -1.065   0.141
  525   HD12  LEU  63          HD12      LEU  63   5.577  -0.480   0.153
  526   HD13  LEU  63          HD13      LEU  63   6.904   0.628   0.500
  527   HD21  LEU  63          HD21      LEU  63   4.830   1.134  -1.520
  528   HD22  LEU  63          HD22      LEU  63   5.787   1.426  -2.972
  529   HD23  LEU  63          HD23      LEU  63   6.239   2.192  -1.450
  530    H    LYS  64           HN       LYS  64  11.270   0.415  -2.443
  531    HA   LYS  64           HA       LYS  64  11.393   0.452  -5.253
  532    HB2  LYS  64           HB2      LYS  64  12.765   1.955  -3.856
  533    HB3  LYS  64           HB1      LYS  64  13.700   0.571  -3.303
  534    HG2  LYS  64           HG2      LYS  64  14.456   0.175  -5.604
  535    HG3  LYS  64           HG1      LYS  64  13.541   1.586  -6.136
  536    HD2  LYS  64           HD2      LYS  64  15.442   1.992  -3.905
  537    HD3  LYS  64           HD1      LYS  64  16.141   1.682  -5.494
  538    HE2  LYS  64           HE2      LYS  64  15.957   4.024  -5.333
  539    HE3  LYS  64           HE1      LYS  64  14.617   3.518  -6.360
  540    HZ1  LYS  64           HZ1      LYS  64  13.106   3.770  -4.555
  541    HZ2  LYS  64           HZ2      LYS  64  14.031   5.185  -4.627
  542    HZ3  LYS  64           HZ3      LYS  64  14.359   4.019  -3.444
  543    H    ALA  65           HN       ALA  65  12.708  -1.721  -2.869
  544    HA   ALA  65           HA       ALA  65  14.031  -3.496  -4.601
  545    HB1  ALA  65           HB1      ALA  65  12.792  -4.093  -1.910
  546    HB2  ALA  65           HB2      ALA  65  14.418  -3.462  -2.171
  547    HB3  ALA  65           HB3      ALA  65  13.997  -5.076  -2.743
  548    H    ALA  66           HN       ALA  66  10.728  -3.306  -3.401
  549    HA   ALA  66           HA       ALA  66   9.766  -5.721  -4.506
  550    HB1  ALA  66           HB1      ALA  66   7.559  -4.826  -4.125
  551    HB2  ALA  66           HB2      ALA  66   8.204  -3.190  -3.987
  552    HB3  ALA  66           HB3      ALA  66   8.590  -4.396  -2.760
  553    H    ALA  67           HN       ALA  67  10.086  -2.440  -5.715
  554    HA   ALA  67           HA       ALA  67   8.774  -2.755  -8.174
  555    HB1  ALA  67           HB1      ALA  67   9.522  -0.577  -7.153
  556    HB2  ALA  67           HB2      ALA  67   9.888  -0.757  -8.868
  557    HB3  ALA  67           HB3      ALA  67  11.159  -0.985  -7.667
  558    H    GLN  68           HN       GLN  68  12.038  -3.281  -7.137
  559    HA   GLN  68           HA       GLN  68  13.115  -4.025  -9.641
  560    HB2  GLN  68           HB2      GLN  68  14.037  -4.659  -6.831
  561    HB3  GLN  68           HB1      GLN  68  14.989  -4.929  -8.286
  562    HG2  GLN  68           HG2      GLN  68  13.942  -2.236  -7.466
  563    HG3  GLN  68           HG1      GLN  68  15.534  -2.839  -7.010
  564   HE21  GLN  68          HE21      GLN  68  14.491  -0.614  -8.802
  565   HE22  GLN  68          HE22      GLN  68  15.382  -0.808 -10.267
  566    H    SER  69           HN       SER  69  11.690  -5.881  -6.961
  567    HA   SER  69           HA       SER  69  12.218  -8.412  -8.149
  568    HB2  SER  69           HB2      SER  69  10.653  -9.321  -6.469
  569    HB3  SER  69           HB1      SER  69  11.840  -8.240  -5.740
  570    HG   SER  69           HG       SER  69   9.186  -7.510  -6.470
  571    H    ILE  70           HN       ILE  70   9.857  -6.001  -8.710
  572    HA   ILE  70           HA       ILE  70   8.147  -7.917 -10.123
  573    HB   ILE  70           HB       ILE  70   7.453  -5.985  -8.323
  574   HG12  ILE  70          HG12      ILE  70   6.059  -7.862  -8.952
  575   HG13  ILE  70          HG11      ILE  70   5.128  -6.374  -9.040
  576   HG21  ILE  70          HG21      ILE  70   6.868  -4.805 -11.023
  577   HG22  ILE  70          HG22      ILE  70   7.974  -4.158  -9.811
  578   HG23  ILE  70          HG23      ILE  70   6.243  -4.223  -9.480
  579   HD11  ILE  70          HD11      ILE  70   6.250  -7.960 -11.335
  580   HD12  ILE  70          HD12      ILE  70   5.485  -6.379 -11.500
  581   HD13  ILE  70          HD13      ILE  70   4.555  -7.751 -10.895
  582    H    ASP  71           HN       ASP  71  10.672  -5.988 -10.632
  583    HA   ASP  71           HA       ASP  71  11.739  -5.131 -12.409
  584    HB2  ASP  71           HB2      ASP  71   9.754  -6.862 -13.876
  585    HB3  ASP  71           HB1      ASP  71  11.023  -5.965 -14.699
  586    H    ARG  72           HN       ARG  72   9.866  -3.421 -11.277
  587    HA   ARG  72           HA       ARG  72   9.116  -1.878 -13.668
  588    HB2  ARG  72           HB2      ARG  72   7.278  -2.428 -11.334
  589    HB3  ARG  72           HB1      ARG  72   6.946  -1.271 -12.618
  590    HG2  ARG  72           HG2      ARG  72   6.988  -3.078 -14.266
  591    HG3  ARG  72           HG1      ARG  72   7.327  -4.239 -12.983
  592    HD2  ARG  72           HD2      ARG  72   5.188  -3.584 -11.909
  593    HD3  ARG  72           HD1      ARG  72   4.848  -2.560 -13.302
  594    HE   ARG  72           HE       ARG  72   5.244  -4.925 -14.477
  595   HH11  ARG  72          HH21      ARG  72   3.374  -4.076 -11.648
  596   HH12  ARG  72          HH22      ARG  72   2.163  -5.288 -11.912
  597   HH21  ARG  72          HH11      ARG  72   3.662  -6.540 -14.843
  598   HH22  ARG  72          HH12      ARG  72   2.330  -6.700 -13.740
  599    H    THR  73           HN       THR  73   8.479   0.403 -13.094
  600    HA   THR  73           HA       THR  73  10.581   1.577 -11.560
  601    HB   THR  73           HB       THR  73   9.971   2.753 -13.523
  602    HG1  THR  73           HG1      THR  73   9.729   4.746 -12.717
  603   HG21  THR  73          HG21      THR  73   7.787   1.881 -13.960
  604   HG22  THR  73          HG22      THR  73   7.659   3.638 -13.891
  605   HG23  THR  73          HG23      THR  73   7.127   2.661 -12.523
  606    HA   PRO  74           HA       PRO  74   8.986   1.952  -7.443
  607    HB2  PRO  74           HB2      PRO  74   9.634   4.848  -7.852
  608    HB3  PRO  74           HB1      PRO  74   9.992   3.802  -6.471
  609    HG2  PRO  74           HG2      PRO  74  11.876   4.370  -8.260
  610    HG3  PRO  74           HG1      PRO  74  11.748   2.747  -7.556
  611    HD2  PRO  74           HD2      PRO  74  11.053   3.683 -10.286
  612    HD3  PRO  74           HD1      PRO  74  11.567   2.076  -9.736
  613    H    HIS  75           HN       HIS  75   8.014   4.618  -9.640
  614    HA   HIS  75           HA       HIS  75   5.755   5.409  -8.167
  615    HB2  HIS  75           HB2      HIS  75   6.688   6.798  -9.968
  616    HB3  HIS  75           HB1      HIS  75   6.200   5.595 -11.157
  617    HD1  HIS  75           HD1      HIS  75   3.964   5.958 -12.200
  618    HD2  HIS  75           HD2      HIS  75   4.351   7.978  -8.591
  619    HE1  HIS  75           HE1      HIS  75   1.843   7.279 -11.938
  620    HE2  HIS  75           HE2      HIS  75   2.263   8.731  -9.926
  621    H    TRP  76           HN       TRP  76   6.038   3.166 -10.914
  622    HA   TRP  76           HA       TRP  76   3.299   2.476 -10.943
  623    HB2  TRP  76           HB2      TRP  76   4.743   2.015 -12.892
  624    HB3  TRP  76           HB1      TRP  76   5.644   0.839 -11.935
  625    HD1  TRP  76           HD1      TRP  76   4.160  -1.374 -11.095
  626    HE1  TRP  76           HE1      TRP  76   2.253  -2.606 -12.310
  627    HE3  TRP  76           HE3      TRP  76   2.875   2.232 -14.482
  628    HZ2  TRP  76           HZ2      TRP  76   0.461  -2.131 -14.421
  629    HZ3  TRP  76           HZ3      TRP  76   1.053   1.759 -16.067
  630    HH2  TRP  76           HH2      TRP  76  -0.127  -0.377 -16.036
  631    H    LEU  77           HN       LEU  77   6.125   1.215  -9.376
  632    HA   LEU  77           HA       LEU  77   5.019  -1.117  -8.329
  633    HB2  LEU  77           HB2      LEU  77   7.428  -0.699  -8.334
  634    HB3  LEU  77           HB1      LEU  77   7.208   0.586  -7.166
  635    HG   LEU  77           HG       LEU  77   8.075  -1.673  -6.314
  636   HD11  LEU  77          HD11      LEU  77   7.214   0.181  -4.890
  637   HD12  LEU  77          HD12      LEU  77   7.012  -1.430  -4.203
  638   HD13  LEU  77          HD13      LEU  77   5.633  -0.602  -4.927
  639   HD21  LEU  77          HD21      LEU  77   6.468  -3.076  -7.523
  640   HD22  LEU  77          HD22      LEU  77   5.158  -2.391  -6.561
  641   HD23  LEU  77          HD23      LEU  77   6.414  -3.354  -5.783
  642    H    ILE  78           HN       ILE  78   5.064   2.158  -7.101
  643    HA   ILE  78           HA       ILE  78   4.018   1.602  -4.564
  644    HB   ILE  78           HB       ILE  78   3.666   4.064  -6.285
  645   HG12  ILE  78          HG12      ILE  78   5.401   3.624  -3.847
  646   HG13  ILE  78          HG11      ILE  78   5.978   3.449  -5.502
  647   HG21  ILE  78          HG21      ILE  78   2.983   5.208  -4.207
  648   HG22  ILE  78          HG22      ILE  78   2.944   3.646  -3.388
  649   HG23  ILE  78          HG23      ILE  78   1.833   3.973  -4.719
  650   HD11  ILE  78          HD11      ILE  78   4.920   5.960  -4.231
  651   HD12  ILE  78          HD12      ILE  78   5.406   5.804  -5.919
  652   HD13  ILE  78          HD13      ILE  78   6.599   5.603  -4.635
  653    H    LYS  79           HN       LYS  79   2.412   2.350  -7.638
  654    HA   LYS  79           HA       LYS  79  -0.245   2.103  -6.689
  655    HB2  LYS  79           HB2      LYS  79   0.629   1.350  -9.477
  656    HB3  LYS  79           HB1      LYS  79  -0.904   2.043  -8.968
  657    HG2  LYS  79           HG2      LYS  79   0.501   4.089  -8.285
  658    HG3  LYS  79           HG1      LYS  79   1.746   3.380  -9.307
  659    HD2  LYS  79           HD2      LYS  79  -1.052   4.105 -10.173
  660    HD3  LYS  79           HD1      LYS  79   0.411   5.024 -10.527
  661    HE2  LYS  79           HE2      LYS  79   1.294   3.005 -11.708
  662    HE3  LYS  79           HE1      LYS  79  -0.284   2.251 -11.481
  663    HZ1  LYS  79           HZ1      LYS  79   0.262   4.750 -12.995
  664    HZ2  LYS  79           HZ2      LYS  79  -1.274   4.099 -12.728
  665    HZ3  LYS  79           HZ3      LYS  79  -0.146   3.248 -13.656
  666    H    GLN  80           HN       GLN  80   1.950  -0.133  -8.288
  667    HA   GLN  80           HA       GLN  80   0.323  -2.399  -8.359
  668    HB2  GLN  80           HB2      GLN  80   2.243  -2.377  -9.732
  669    HB3  GLN  80           HB1      GLN  80   3.298  -1.987  -8.385
  670    HG2  GLN  80           HG2      GLN  80   3.759  -4.212  -8.851
  671    HG3  GLN  80           HG1      GLN  80   2.699  -4.266  -7.448
  672   HE21  GLN  80          HE21      GLN  80   3.137  -6.445  -9.078
  673   HE22  GLN  80          HE22      GLN  80   1.664  -6.838  -9.896
  674    H    ALA  81           HN       ALA  81   2.557  -1.271  -5.865
  675    HA   ALA  81           HA       ALA  81   2.613  -3.581  -4.283
  676    HB1  ALA  81           HB1      ALA  81   3.067  -0.685  -3.635
  677    HB2  ALA  81           HB2      ALA  81   4.263  -1.959  -3.880
  678    HB3  ALA  81           HB3      ALA  81   3.249  -1.966  -2.437
  679    H    ILE  82           HN       ILE  82   0.618  -0.646  -3.899
  680    HA   ILE  82           HA       ILE  82  -0.830  -1.734  -1.717
  681    HB   ILE  82           HB       ILE  82  -0.656   0.715  -2.193
  682   HG12  ILE  82          HG12      ILE  82  -3.071   1.196  -1.626
  683   HG13  ILE  82          HG11      ILE  82  -3.384  -0.522  -1.838
  684   HG21  ILE  82          HG21      ILE  82  -1.052   0.667  -4.595
  685   HG22  ILE  82          HG22      ILE  82  -2.186   1.744  -3.779
  686   HG23  ILE  82          HG23      ILE  82  -2.715   0.149  -4.315
  687   HD11  ILE  82          HD11      ILE  82  -2.413   0.851   0.448
  688   HD12  ILE  82          HD12      ILE  82  -1.172  -0.275  -0.101
  689   HD13  ILE  82          HD13      ILE  82  -2.795  -0.861   0.263
  690    H    PHE  83           HN       PHE  83  -1.281  -1.679  -5.195
  691    HA   PHE  83           HA       PHE  83  -3.850  -2.902  -5.184
  692    HB2  PHE  83           HB2      PHE  83  -1.762  -2.334  -7.238
  693    HB3  PHE  83           HB1      PHE  83  -2.907  -3.618  -7.597
  694    HD1  PHE  83           HD1      PHE  83  -2.728  -0.036  -6.614
  695    HD2  PHE  83           HD2      PHE  83  -4.980  -3.124  -8.480
  696    HE1  PHE  83           HE1      PHE  83  -4.346   1.632  -7.413
  697    HE2  PHE  83           HE2      PHE  83  -6.605  -1.461  -9.283
  698    HZ   PHE  83           HZ       PHE  83  -6.287   0.922  -8.751
  699    H    ASN  84           HN       ASN  84  -0.550  -4.052  -5.055
  700    HA   ASN  84           HA       ASN  84  -1.084  -6.741  -5.664
  701    HB2  ASN  84           HB2      ASN  84   1.133  -5.317  -4.289
  702    HB3  ASN  84           HB1      ASN  84   0.978  -7.045  -4.020
  703   HD21  ASN  84          HD21      ASN  84  -0.127  -7.409  -6.768
  704   HD22  ASN  84          HD22      ASN  84   1.240  -7.296  -7.811
  705    H    TYR  85           HN       TYR  85  -1.105  -4.868  -2.714
  706    HA   TYR  85           HA       TYR  85  -1.531  -6.991  -0.959
  707    HB2  TYR  85           HB2      TYR  85  -1.012  -4.868   0.011
  708    HB3  TYR  85           HB1      TYR  85  -2.365  -4.088  -0.806
  709    HD1  TYR  85           HD2      TYR  85  -1.792  -6.955   1.516
  710    HD2  TYR  85           HD1      TYR  85  -4.215  -3.610   0.509
  711    HE1  TYR  85           HE2      TYR  85  -3.213  -7.407   3.464
  712    HE2  TYR  85           HE1      TYR  85  -5.651  -4.059   2.458
  713    HH   TYR  85           HH       TYR  85  -4.754  -6.305   4.908
  714    H    LEU  86           HN       LEU  86  -3.647  -5.082  -2.956
  715    HA   LEU  86           HA       LEU  86  -6.027  -6.343  -1.970
  716    HB2  LEU  86           HB2      LEU  86  -5.615  -4.495  -4.300
  717    HB3  LEU  86           HB1      LEU  86  -7.175  -5.015  -3.685
  718    HG   LEU  86           HG       LEU  86  -5.139  -3.339  -2.211
  719   HD11  LEU  86          HD11      LEU  86  -6.798  -1.599  -2.336
  720   HD12  LEU  86          HD12      LEU  86  -7.909  -2.677  -3.180
  721   HD13  LEU  86          HD13      LEU  86  -6.409  -2.172  -3.958
  722   HD21  LEU  86          HD21      LEU  86  -6.140  -4.717  -0.579
  723   HD22  LEU  86          HD22      LEU  86  -7.733  -4.558  -1.315
  724   HD23  LEU  86          HD23      LEU  86  -6.996  -3.176  -0.506
  725    H    GLU  87           HN       GLU  87  -4.289  -6.432  -5.048
  726    HA   GLU  87           HA       GLU  87  -5.965  -8.279  -6.354
  727    HB2  GLU  87           HB2      GLU  87  -4.515  -6.741  -7.555
  728    HB3  GLU  87           HB1      GLU  87  -3.091  -7.511  -6.875
  729    HG2  GLU  87           HG2      GLU  87  -3.624  -9.568  -8.079
  730    HG3  GLU  87           HG1      GLU  87  -5.055  -8.797  -8.761
  731    H    LYS  88           HN       LYS  88  -2.991  -8.760  -4.464
  732    HA   LYS  88           HA       LYS  88  -2.534 -11.427  -5.209
  733    HB2  LYS  88           HB2      LYS  88  -0.918  -9.977  -3.966
  734    HB3  LYS  88           HB1      LYS  88  -1.897 -10.202  -2.522
  735    HG2  LYS  88           HG2      LYS  88  -1.480 -12.605  -2.608
  736    HG3  LYS  88           HG1      LYS  88  -0.503 -12.383  -4.060
  737    HD2  LYS  88           HD2      LYS  88   0.088 -11.109  -1.389
  738    HD3  LYS  88           HD1      LYS  88   0.835 -12.597  -1.973
  739    HE2  LYS  88           HE2      LYS  88   1.571 -11.253  -4.000
  740    HE3  LYS  88           HE1      LYS  88   1.090  -9.818  -3.096
  741    HZ1  LYS  88           HZ1      LYS  88   3.471 -10.354  -2.894
  742    HZ2  LYS  88           HZ2      LYS  88   3.069 -11.817  -2.144
  743    HZ3  LYS  88           HZ3      LYS  88   2.677 -10.349  -1.400
  744    H    LEU  89           HN       LEU  89  -4.346 -10.135  -2.410
  745    HA   LEU  89           HA       LEU  89  -5.242 -12.823  -1.790
  746    HB2  LEU  89           HB2      LEU  89  -6.410 -11.810   0.122
  747    HB3  LEU  89           HB1      LEU  89  -4.695 -11.468   0.109
  748    HG   LEU  89           HG       LEU  89  -5.536  -9.215  -1.050
  749   HD11  LEU  89          HD11      LEU  89  -7.626  -8.461  -0.238
  750   HD12  LEU  89          HD12      LEU  89  -7.811  -9.870   0.806
  751   HD13  LEU  89          HD13      LEU  89  -7.918 -10.050  -0.946
  752   HD21  LEU  89          HD21      LEU  89  -5.562  -8.215   1.217
  753   HD22  LEU  89          HD22      LEU  89  -4.198  -9.299   0.950
  754   HD23  LEU  89          HD23      LEU  89  -5.581  -9.841   1.900
  755    H    GLU  90           HN       GLU  90  -6.475  -9.856  -3.097
  756    HA   GLU  90           HA       GLU  90  -8.378  -9.189  -4.053
  757    HB2  GLU  90           HB2      GLU  90  -7.430 -10.854  -5.687
  758    HB3  GLU  90           HB1      GLU  90  -8.624 -12.001  -5.078
  759    HG2  GLU  90           HG2      GLU  90 -10.426 -10.630  -5.784
  760    HG3  GLU  90           HG1      GLU  90  -9.338  -9.298  -6.166
  Start of MODEL    5
    1    H1   MET   1           HT1      MET   1   5.923  -0.938  14.125
    2    H2   MET   1           HT2      MET   1   5.633   0.402  15.112
    3    H3   MET   1           HT3      MET   1   6.911   0.431  14.007
    4    HA   MET   1           HA       MET   1   5.346   0.323  12.163
    5    HB2  MET   1           HB2      MET   1   3.558  -0.845  13.511
    6    HB3  MET   1           HB1      MET   1   3.231   0.687  14.306
    7    HG2  MET   1           HG2      MET   1   2.755   1.637  12.016
    8    HG3  MET   1           HG1      MET   1   2.817  -0.017  11.413
    9    HE1  MET   1           HE1      MET   1   1.333  -1.616  13.976
   10    HE2  MET   1           HE2      MET   1   1.315  -1.918  12.240
   11    HE3  MET   1           HE3      MET   1  -0.203  -1.726  13.115
   12    H    ALA   2           HN       ALA   2   6.650   2.225  11.882
   13    HA   ALA   2           HA       ALA   2   5.485   4.647  13.102
   14    HB1  ALA   2           HB1      ALA   2   8.327   4.121  12.234
   15    HB2  ALA   2           HB2      ALA   2   7.739   4.317  13.885
   16    HB3  ALA   2           HB3      ALA   2   7.717   5.685  12.773
   17    H    THR   3           HN       THR   3   4.164   3.797  10.982
   18    HA   THR   3           HA       THR   3   5.193   4.568   8.461
   19    HB   THR   3           HB       THR   3   2.814   4.342   7.718
   20    HG1  THR   3           HG1      THR   3   2.176   4.916  10.083
   21   HG21  THR   3          HG21      THR   3   3.829   2.079   9.442
   22   HG22  THR   3          HG22      THR   3   4.358   2.415   7.794
   23   HG23  THR   3          HG23      THR   3   2.688   1.943   8.105
   24    H    THR   4           HN       THR   4   5.248   6.464   7.478
   25    HA   THR   4           HA       THR   4   3.944   8.783   8.734
   26    HB   THR   4           HB       THR   4   6.251   8.766   6.774
   27    HG1  THR   4           HG1      THR   4   6.803   7.737   8.780
   28   HG21  THR   4          HG21      THR   4   5.060  10.883   6.849
   29   HG22  THR   4          HG22      THR   4   6.631  11.049   7.634
   30   HG23  THR   4          HG23      THR   4   5.168  10.906   8.609
   31    H    THR   5           HN       THR   5   2.834  10.314   7.373
   32    HA   THR   5           HA       THR   5   1.338   9.153   5.275
   33    HB   THR   5           HB       THR   5   1.629  12.124   5.694
   34    HG1  THR   5           HG1      THR   5   0.658  11.945   7.564
   35   HG21  THR   5          HG21      THR   5   0.302  11.459   3.776
   36   HG22  THR   5          HG22      THR   5  -0.752  12.119   5.027
   37   HG23  THR   5          HG23      THR   5  -0.660  10.375   4.782
   38    H    LEU   6           HN       LEU   6   2.316   8.532   3.450
   39    HA   LEU   6           HA       LEU   6   3.950  10.507   1.996
   40    HB2  LEU   6           HB2      LEU   6   4.262   7.498   1.897
   41    HB3  LEU   6           HB1      LEU   6   5.257   8.676   1.064
   42    HG   LEU   6           HG       LEU   6   5.134   8.227   4.049
   43   HD11  LEU   6          HD11      LEU   6   6.410   6.625   2.462
   44   HD12  LEU   6          HD12      LEU   6   7.212   7.238   3.907
   45   HD13  LEU   6          HD13      LEU   6   7.563   7.953   2.334
   46   HD21  LEU   6          HD21      LEU   6   5.447  10.568   3.681
   47   HD22  LEU   6          HD22      LEU   6   6.658  10.263   2.436
   48   HD23  LEU   6          HD23      LEU   6   7.006   9.868   4.119
   49    H    GLY   7           HN       GLY   7   3.626  10.557  -0.290
   50    HA2  GLY   7           HA2      GLY   7   0.946  10.035  -1.089
   51    HA3  GLY   7           HA1      GLY   7   2.239  10.613  -2.127
   52    H    VAL   8           HN       VAL   8   0.054   8.285  -1.890
   53    HA   VAL   8           HA       VAL   8   1.719   6.312  -3.313
   54    HB   VAL   8           HB       VAL   8  -0.343   5.807  -1.161
   55   HG11  VAL   8          HG11      VAL   8  -0.066   3.385  -1.623
   56   HG12  VAL   8          HG12      VAL   8   0.799   3.804  -3.101
   57   HG13  VAL   8          HG13      VAL   8  -0.894   4.255  -2.914
   58   HG21  VAL   8          HG21      VAL   8   1.461   4.487  -0.150
   59   HG22  VAL   8          HG22      VAL   8   1.921   6.174  -0.384
   60   HG23  VAL   8          HG23      VAL   8   2.522   4.935  -1.486
   61    H    LYS   9           HN       LYS   9   0.395   4.948  -4.831
   62    HA   LYS   9           HA       LYS   9  -1.718   6.600  -6.002
   63    HB2  LYS   9           HB2      LYS   9  -0.164   4.283  -7.159
   64    HB3  LYS   9           HB1      LYS   9  -1.390   5.204  -8.018
   65    HG2  LYS   9           HG2      LYS   9   1.052   6.494  -6.852
   66    HG3  LYS   9           HG1      LYS   9   1.024   5.806  -8.477
   67    HD2  LYS   9           HD2      LYS   9  -0.822   7.288  -9.077
   68    HD3  LYS   9           HD1      LYS   9  -0.813   7.967  -7.448
   69    HE2  LYS   9           HE2      LYS   9   1.677   7.996  -9.102
   70    HE3  LYS   9           HE1      LYS   9   0.424   9.206  -9.372
   71    HZ1  LYS   9           HZ1      LYS   9   0.596   9.901  -7.099
   72    HZ2  LYS   9           HZ2      LYS   9   2.136   9.946  -7.795
   73    HZ3  LYS   9           HZ3      LYS   9   1.719   8.682  -6.749
   74    H    LEU  10           HN       LEU  10  -3.723   6.121  -5.557
   75    HA   LEU  10           HA       LEU  10  -4.563   3.315  -5.342
   76    HB2  LEU  10           HB2      LEU  10  -4.983   5.542  -3.402
   77    HB3  LEU  10           HB1      LEU  10  -6.257   4.356  -3.604
   78    HG   LEU  10           HG       LEU  10  -3.436   3.553  -2.933
   79   HD11  LEU  10          HD11      LEU  10  -5.686   4.237  -1.045
   80   HD12  LEU  10          HD12      LEU  10  -4.161   5.106  -1.216
   81   HD13  LEU  10          HD13      LEU  10  -4.172   3.459  -0.587
   82   HD21  LEU  10          HD21      LEU  10  -4.686   1.711  -3.678
   83   HD22  LEU  10          HD22      LEU  10  -6.142   2.253  -2.844
   84   HD23  LEU  10          HD23      LEU  10  -4.778   1.629  -1.918
   85    H    ASP  11           HN       ASP  11  -6.411   2.869  -6.362
   86    HA   ASP  11           HA       ASP  11  -7.605   4.897  -8.069
   87    HB2  ASP  11           HB2      ASP  11  -7.016   2.425  -8.676
   88    HB3  ASP  11           HB1      ASP  11  -8.483   2.021  -7.802
   89    H    ASP  12           HN       ASP  12 -10.071   4.938  -8.144
   90    HA   ASP  12           HA       ASP  12 -11.119   5.666  -5.642
   91    HB2  ASP  12           HB2      ASP  12 -12.188   5.347  -8.360
   92    HB3  ASP  12           HB1      ASP  12 -13.373   5.021  -7.103
   93    HA   PRO  13           HA       PRO  13 -13.357   1.351  -5.555
   94    HB2  PRO  13           HB2      PRO  13 -12.256  -0.594  -7.137
   95    HB3  PRO  13           HB1      PRO  13 -13.650   0.386  -7.604
   96    HG2  PRO  13           HG2      PRO  13 -10.768   0.718  -8.333
   97    HG3  PRO  13           HG1      PRO  13 -12.209   0.881  -9.357
   98    HD2  PRO  13           HD2      PRO  13 -10.932   3.026  -8.376
   99    HD3  PRO  13           HD1      PRO  13 -12.698   2.995  -8.549
  100    H    THR  14           HN       THR  14  -9.839   1.560  -6.071
  101    HA   THR  14           HA       THR  14  -9.287  -0.719  -4.452
  102    HB   THR  14           HB       THR  14  -6.975  -0.038  -4.382
  103    HG1  THR  14           HG1      THR  14  -7.751   2.346  -4.303
  104   HG21  THR  14          HG21      THR  14  -8.459   0.009  -6.931
  105   HG22  THR  14          HG22      THR  14  -7.138  -1.034  -6.404
  106   HG23  THR  14          HG23      THR  14  -6.797   0.595  -6.986
  107    H    ARG  15           HN       ARG  15  -9.481   2.779  -3.774
  108    HA   ARG  15           HA       ARG  15  -8.651   2.546  -1.073
  109    HB2  ARG  15           HB2      ARG  15  -8.697   4.717  -2.185
  110    HB3  ARG  15           HB1      ARG  15 -10.446   4.612  -2.362
  111    HG2  ARG  15           HG2      ARG  15 -10.813   4.858  -0.052
  112    HG3  ARG  15           HG1      ARG  15  -9.119   4.553   0.331
  113    HD2  ARG  15           HD2      ARG  15  -9.831   6.878  -1.394
  114    HD3  ARG  15           HD1      ARG  15 -10.078   6.992   0.349
  115    HE   ARG  15           HE       ARG  15  -7.547   6.865  -1.062
  116   HH11  ARG  15          HH21      ARG  15  -9.218   6.674   1.999
  117   HH12  ARG  15          HH22      ARG  15  -7.799   6.968   2.945
  118   HH21  ARG  15          HH11      ARG  15  -5.653   7.238   0.176
  119   HH22  ARG  15          HH12      ARG  15  -5.756   7.293   1.902
  120    H    GLU  16           HN       GLU  16 -11.794   2.397  -2.657
  121    HA   GLU  16           HA       GLU  16 -13.334   2.091  -0.308
  122    HB2  GLU  16           HB2      GLU  16 -13.849   1.205  -3.159
  123    HB3  GLU  16           HB1      GLU  16 -15.046   1.123  -1.872
  124    HG2  GLU  16           HG2      GLU  16 -14.939   3.545  -1.608
  125    HG3  GLU  16           HG1      GLU  16 -13.735   3.636  -2.893
  126    H    ARG  17           HN       ARG  17 -11.729  -0.165  -2.490
  127    HA   ARG  17           HA       ARG  17 -12.637  -2.532  -1.238
  128    HB2  ARG  17           HB2      ARG  17 -11.656  -2.448  -3.540
  129    HB3  ARG  17           HB1      ARG  17 -10.076  -2.180  -2.809
  130    HG2  ARG  17           HG2      ARG  17 -10.257  -4.331  -1.648
  131    HG3  ARG  17           HG1      ARG  17 -11.830  -4.592  -2.399
  132    HD2  ARG  17           HD2      ARG  17 -10.784  -4.564  -4.610
  133    HD3  ARG  17           HD1      ARG  17  -9.210  -4.300  -3.859
  134    HE   ARG  17           HE       ARG  17 -10.367  -6.587  -2.735
  135   HH11  ARG  17          HH21      ARG  17  -9.000  -5.542  -5.793
  136   HH12  ARG  17          HH22      ARG  17  -8.506  -7.141  -6.257
  137   HH21  ARG  17          HH11      ARG  17  -9.704  -8.677  -3.348
  138   HH22  ARG  17          HH12      ARG  17  -8.899  -8.909  -4.864
  139    H    LEU  18           HN       LEU  18  -9.998  -0.318  -0.639
  140    HA   LEU  18           HA       LEU  18  -8.511  -1.910   1.120
  141    HB2  LEU  18           HB2      LEU  18  -8.679   0.939   0.479
  142    HB3  LEU  18           HB1      LEU  18  -8.313   0.654   2.170
  143    HG   LEU  18           HG       LEU  18  -6.417  -0.843   1.387
  144   HD11  LEU  18          HD11      LEU  18  -5.600  -0.633  -0.833
  145   HD12  LEU  18          HD12      LEU  18  -6.844   0.550  -1.238
  146   HD13  LEU  18          HD13      LEU  18  -7.291  -1.125  -0.919
  147   HD21  LEU  18          HD21      LEU  18  -4.970   1.121   0.770
  148   HD22  LEU  18          HD22      LEU  18  -5.880   1.282   2.271
  149   HD23  LEU  18          HD23      LEU  18  -6.431   2.107   0.813
  150    H    LYS  19           HN       LYS  19 -11.371   0.146   1.592
  151    HA   LYS  19           HA       LYS  19 -11.542  -0.237   4.375
  152    HB2  LYS  19           HB2      LYS  19 -12.907   1.473   3.272
  153    HB3  LYS  19           HB1      LYS  19 -13.813   0.218   2.435
  154    HG2  LYS  19           HG2      LYS  19 -14.627  -0.631   4.583
  155    HG3  LYS  19           HG1      LYS  19 -13.717   0.621   5.423
  156    HD2  LYS  19           HD2      LYS  19 -15.059   2.344   4.339
  157    HD3  LYS  19           HD1      LYS  19 -15.937   1.107   3.437
  158    HE2  LYS  19           HE2      LYS  19 -17.296   1.777   5.293
  159    HE3  LYS  19           HE1      LYS  19 -16.698   0.151   5.610
  160    HZ1  LYS  19           HZ1      LYS  19 -15.773   2.692   6.826
  161    HZ2  LYS  19           HZ2      LYS  19 -14.916   1.243   6.975
  162    HZ3  LYS  19           HZ3      LYS  19 -16.480   1.365   7.603
  163    H    ALA  20           HN       ALA  20 -12.766  -2.088   1.675
  164    HA   ALA  20           HA       ALA  20 -14.162  -4.052   3.110
  165    HB1  ALA  20           HB1      ALA  20 -14.305  -3.772   0.653
  166    HB2  ALA  20           HB2      ALA  20 -13.980  -5.439   1.130
  167    HB3  ALA  20           HB3      ALA  20 -12.675  -4.429   0.506
  168    H    ALA  21           HN       ALA  21 -10.765  -3.808   2.131
  169    HA   ALA  21           HA       ALA  21  -9.893  -6.271   3.205
  170    HB1  ALA  21           HB1      ALA  21  -8.515  -4.986   1.644
  171    HB2  ALA  21           HB2      ALA  21  -7.639  -5.286   3.146
  172    HB3  ALA  21           HB3      ALA  21  -8.344  -3.700   2.839
  173    H    ALA  22           HN       ALA  22 -10.235  -3.034   4.495
  174    HA   ALA  22           HA       ALA  22  -9.163  -3.412   7.043
  175    HB1  ALA  22           HB1      ALA  22 -10.389  -1.447   7.691
  176    HB2  ALA  22           HB2      ALA  22 -11.493  -1.641   6.331
  177    HB3  ALA  22           HB3      ALA  22  -9.808  -1.214   6.042
  178    H    GLN  23           HN       GLN  23 -12.367  -3.825   5.777
  179    HA   GLN  23           HA       GLN  23 -13.633  -4.602   8.165
  180    HB2  GLN  23           HB2      GLN  23 -14.321  -5.129   5.271
  181    HB3  GLN  23           HB1      GLN  23 -15.385  -5.524   6.614
  182    HG2  GLN  23           HG2      GLN  23 -14.365  -2.758   6.014
  183    HG3  GLN  23           HG1      GLN  23 -15.921  -3.380   5.472
  184   HE21  GLN  23          HE21      GLN  23 -14.077  -2.184   8.136
  185   HE22  GLN  23          HE22      GLN  23 -15.376  -2.092   9.274
  186    H    SER  24           HN       SER  24 -12.027  -6.457   5.599
  187    HA   SER  24           HA       SER  24 -12.673  -8.995   6.702
  188    HB2  SER  24           HB2      SER  24 -10.959  -9.884   5.152
  189    HB3  SER  24           HB1      SER  24 -12.099  -8.808   4.349
  190    HG   SER  24           HG       SER  24  -9.931  -7.472   5.321
  191    H    ILE  25           HN       ILE  25 -10.365  -6.623   7.548
  192    HA   ILE  25           HA       ILE  25  -8.867  -8.590   9.136
  193    HB   ILE  25           HB       ILE  25  -7.846  -6.881   7.318
  194   HG12  ILE  25          HG12      ILE  25  -6.676  -8.739   8.459
  195   HG13  ILE  25          HG11      ILE  25  -5.666  -7.314   8.258
  196   HG21  ILE  25          HG21      ILE  25  -7.459  -5.415   9.907
  197   HG22  ILE  25          HG22      ILE  25  -8.524  -4.902   8.599
  198   HG23  ILE  25          HG23      ILE  25  -6.783  -4.995   8.334
  199   HD11  ILE  25          HD11      ILE  25  -5.270  -8.256  10.414
  200   HD12  ILE  25          HD12      ILE  25  -6.993  -8.258  10.785
  201   HD13  ILE  25          HD13      ILE  25  -6.128  -6.730  10.624
  202    H    ASP  26           HN       ASP  26 -11.358  -6.641   9.409
  203    HA   ASP  26           HA       ASP  26 -12.516  -5.677  11.080
  204    HB2  ASP  26           HB2      ASP  26 -10.592  -7.311  12.727
  205    HB3  ASP  26           HB1      ASP  26 -11.905  -6.382  13.440
  206    H    ARG  27           HN       ARG  27 -10.718  -3.994   9.932
  207    HA   ARG  27           HA       ARG  27  -9.924  -2.303  12.219
  208    HB2  ARG  27           HB2      ARG  27  -8.337  -2.849   9.714
  209    HB3  ARG  27           HB1      ARG  27  -8.011  -1.489  10.774
  210    HG2  ARG  27           HG2      ARG  27  -7.868  -4.395  11.529
  211    HG3  ARG  27           HG1      ARG  27  -6.498  -3.334  11.201
  212    HD2  ARG  27           HD2      ARG  27  -7.541  -1.869  13.087
  213    HD3  ARG  27           HD1      ARG  27  -8.369  -3.361  13.533
  214    HE   ARG  27           HE       ARG  27  -5.689  -2.713  14.082
  215   HH11  ARG  27          HH21      ARG  27  -7.662  -5.419  13.047
  216   HH12  ARG  27          HH22      ARG  27  -6.570  -6.615  13.666
  217   HH21  ARG  27          HH11      ARG  27  -4.247  -4.293  14.911
  218   HH22  ARG  27          HH12      ARG  27  -4.628  -5.973  14.738
  219    H    THR  28           HN       THR  28  -9.698  -0.002  11.647
  220    HA   THR  28           HA       THR  28 -11.869   0.868   9.966
  221    HB   THR  28           HB       THR  28 -11.556   2.095  12.026
  222    HG1  THR  28           HG1      THR  28 -10.899   4.262  11.030
  223   HG21  THR  28          HG21      THR  28  -9.210   1.677  12.436
  224   HG22  THR  28          HG22      THR  28  -9.525   3.413  12.467
  225   HG23  THR  28          HG23      THR  28  -8.769   2.680  11.053
  226    HA   PRO  29           HA       PRO  29 -10.017   1.500   5.996
  227    HB2  PRO  29           HB2      PRO  29 -10.733   4.363   6.501
  228    HB3  PRO  29           HB1      PRO  29 -10.967   3.388   5.046
  229    HG2  PRO  29           HG2      PRO  29 -12.963   3.860   6.789
  230    HG3  PRO  29           HG1      PRO  29 -12.835   2.346   5.879
  231    HD2  PRO  29           HD2      PRO  29 -12.458   2.828   8.745
  232    HD3  PRO  29           HD1      PRO  29 -12.711   1.299   7.887
  233    H    HIS  30           HN       HIS  30  -9.333   4.313   8.117
  234    HA   HIS  30           HA       HIS  30  -6.905   4.987   6.889
  235    HB2  HIS  30           HB2      HIS  30  -8.115   6.545   8.321
  236    HB3  HIS  30           HB1      HIS  30  -7.816   5.520   9.719
  237    HD1  HIS  30           HD1      HIS  30  -5.719   5.937  10.994
  238    HD2  HIS  30           HD2      HIS  30  -5.683   7.776   7.272
  239    HE1  HIS  30           HE1      HIS  30  -3.666   7.378  10.980
  240    HE2  HIS  30           HE2      HIS  30  -3.878   8.719   8.869
  241    H    TRP  31           HN       TRP  31  -7.489   3.073   9.833
  242    HA   TRP  31           HA       TRP  31  -4.786   2.575  10.392
  243    HB2  TRP  31           HB2      TRP  31  -6.654   2.153  12.007
  244    HB3  TRP  31           HB1      TRP  31  -7.102   0.746  11.044
  245    HD1  TRP  31           HD1      TRP  31  -5.482  -1.382  11.147
  246    HE1  TRP  31           HE1      TRP  31  -3.669  -2.090  12.825
  247    HE3  TRP  31           HE3      TRP  31  -4.857   3.064  13.598
  248    HZ2  TRP  31           HZ2      TRP  31  -2.180  -0.930  14.919
  249    HZ3  TRP  31           HZ3      TRP  31  -3.216   3.176  15.429
  250    HH2  TRP  31           HH2      TRP  31  -1.907   1.219  16.074
  251    H    LEU  32           HN       LEU  32  -7.164   0.933   8.467
  252    HA   LEU  32           HA       LEU  32  -5.646  -1.303   7.762
  253    HB2  LEU  32           HB2      LEU  32  -8.050  -1.213   7.386
  254    HB3  LEU  32           HB1      LEU  32  -7.833   0.057   6.202
  255    HG   LEU  32           HG       LEU  32  -8.273  -2.325   5.349
  256   HD11  LEU  32          HD11      LEU  32  -5.848  -0.900   4.282
  257   HD12  LEU  32          HD12      LEU  32  -7.517  -0.463   3.931
  258   HD13  LEU  32          HD13      LEU  32  -6.886  -2.022   3.406
  259   HD21  LEU  32          HD21      LEU  32  -6.648  -3.417   6.863
  260   HD22  LEU  32          HD22      LEU  32  -5.343  -2.648   5.961
  261   HD23  LEU  32          HD23      LEU  32  -6.400  -3.811   5.162
  262    H    ILE  33           HN       ILE  33  -5.895   1.881   6.318
  263    HA   ILE  33           HA       ILE  33  -4.488   1.426   3.973
  264    HB   ILE  33           HB       ILE  33  -4.510   3.878   5.742
  265   HG12  ILE  33          HG12      ILE  33  -5.839   3.388   3.072
  266   HG13  ILE  33          HG11      ILE  33  -6.640   3.133   4.619
  267   HG21  ILE  33          HG21      ILE  33  -3.658   5.084   3.713
  268   HG22  ILE  33          HG22      ILE  33  -3.273   3.507   3.024
  269   HG23  ILE  33          HG23      ILE  33  -2.486   4.036   4.511
  270   HD11  ILE  33          HD11      ILE  33  -5.784   5.685   3.333
  271   HD12  ILE  33          HD12      ILE  33  -6.002   5.590   5.079
  272   HD13  ILE  33          HD13      ILE  33  -7.352   5.236   4.003
  273    H    LYS  34           HN       LYS  34  -3.264   2.254   7.200
  274    HA   LYS  34           HA       LYS  34  -0.521   2.220   6.536
  275    HB2  LYS  34           HB2      LYS  34  -1.550   1.277   9.204
  276    HB3  LYS  34           HB1      LYS  34  -0.070   2.156   8.848
  277    HG2  LYS  34           HG2      LYS  34  -1.722   4.032   8.079
  278    HG3  LYS  34           HG1      LYS  34  -2.858   3.165   9.109
  279    HD2  LYS  34           HD2      LYS  34  -0.272   4.491   9.882
  280    HD3  LYS  34           HD1      LYS  34  -1.895   4.820  10.485
  281    HE2  LYS  34           HE2      LYS  34  -0.158   2.426  11.043
  282    HE3  LYS  34           HE1      LYS  34  -0.739   3.634  12.187
  283    HZ1  LYS  34           HZ1      LYS  34  -2.467   1.724  10.712
  284    HZ2  LYS  34           HZ2      LYS  34  -2.969   2.829  11.891
  285    HZ3  LYS  34           HZ3      LYS  34  -1.962   1.540  12.316
  286    H    GLN  35           HN       GLN  35  -2.730  -0.318   7.617
  287    HA   GLN  35           HA       GLN  35  -0.795  -2.388   7.735
  288    HB2  GLN  35           HB2      GLN  35  -3.800  -2.427   7.557
  289    HB3  GLN  35           HB1      GLN  35  -2.838  -3.896   7.647
  290    HG2  GLN  35           HG2      GLN  35  -1.939  -3.195   9.791
  291    HG3  GLN  35           HG1      GLN  35  -2.861  -1.695   9.700
  292   HE21  GLN  35          HE21      GLN  35  -2.903  -3.991  11.610
  293   HE22  GLN  35          HE22      GLN  35  -4.559  -4.488  11.661
  294    H    ALA  36           HN       ALA  36  -3.229  -1.585   5.268
  295    HA   ALA  36           HA       ALA  36  -2.867  -3.630   3.512
  296    HB1  ALA  36           HB1      ALA  36  -4.579  -2.085   3.055
  297    HB2  ALA  36           HB2      ALA  36  -3.449  -1.946   1.709
  298    HB3  ALA  36           HB3      ALA  36  -3.450  -0.731   2.987
  299    H    ILE  37           HN       ILE  37  -0.819  -0.765   3.846
  300    HA   ILE  37           HA       ILE  37   0.844  -1.774   1.699
  301    HB   ILE  37           HB       ILE  37   0.309   0.643   1.904
  302   HG12  ILE  37          HG12      ILE  37   2.667   1.427   1.487
  303   HG13  ILE  37          HG11      ILE  37   3.204  -0.195   1.917
  304   HG21  ILE  37          HG21      ILE  37   1.448   2.034   3.504
  305   HG22  ILE  37          HG22      ILE  37   2.228   0.624   4.219
  306   HG23  ILE  37          HG23      ILE  37   0.480   0.823   4.344
  307   HD11  ILE  37          HD11      ILE  37   2.784   0.505  -0.577
  308   HD12  ILE  37          HD12      ILE  37   1.119   0.088  -0.174
  309   HD13  ILE  37          HD13      ILE  37   2.396  -1.114   0.000
  310    H    PHE  38           HN       PHE  38   1.272  -1.217   5.224
  311    HA   PHE  38           HA       PHE  38   3.956  -2.269   5.112
  312    HB2  PHE  38           HB2      PHE  38   4.168  -1.313   7.135
  313    HB3  PHE  38           HB1      PHE  38   2.523  -0.722   6.956
  314    HD1  PHE  38           HD1      PHE  38   4.537  -3.535   8.304
  315    HD2  PHE  38           HD2      PHE  38   0.829  -1.448   8.388
  316    HE1  PHE  38           HE1      PHE  38   3.855  -4.834  10.277
  317    HE2  PHE  38           HE2      PHE  38   0.141  -2.746  10.360
  318    HZ   PHE  38           HZ       PHE  38   1.654  -4.442  11.307
  319    H    ASN  39           HN       ASN  39   0.788  -3.494   6.026
  320    HA   ASN  39           HA       ASN  39   1.725  -6.010   6.933
  321    HB2  ASN  39           HB2      ASN  39  -0.606  -4.952   7.333
  322    HB3  ASN  39           HB1      ASN  39  -1.000  -5.566   5.734
  323   HD21  ASN  39          HD21      ASN  39  -2.107  -6.212   8.354
  324   HD22  ASN  39          HD22      ASN  39  -1.907  -7.914   8.565
  325    H    TYR  40           HN       TYR  40   1.011  -4.554   3.827
  326    HA   TYR  40           HA       TYR  40   0.914  -6.893   2.274
  327    HB2  TYR  40           HB2      TYR  40   0.399  -4.949   1.068
  328    HB3  TYR  40           HB1      TYR  40   1.750  -4.053   1.749
  329    HD1  TYR  40           HD1      TYR  40   1.002  -6.877  -0.585
  330    HD2  TYR  40           HD2      TYR  40   3.681  -3.753   0.499
  331    HE1  TYR  40           HE1      TYR  40   2.328  -7.307  -2.617
  332    HE2  TYR  40           HE2      TYR  40   5.008  -4.175  -1.522
  333    HH   TYR  40           HH       TYR  40   5.402  -5.695  -3.177
  334    H    LEU  41           HN       LEU  41   3.526  -4.890   3.478
  335    HA   LEU  41           HA       LEU  41   5.652  -6.361   2.349
  336    HB2  LEU  41           HB2      LEU  41   5.600  -4.608   4.800
  337    HB3  LEU  41           HB1      LEU  41   7.056  -5.188   4.013
  338    HG   LEU  41           HG       LEU  41   5.006  -3.375   2.723
  339   HD11  LEU  41          HD11      LEU  41   7.781  -2.648   3.614
  340   HD12  LEU  41          HD12      LEU  41   6.349  -2.373   4.603
  341   HD13  LEU  41          HD13      LEU  41   6.502  -1.582   3.035
  342   HD21  LEU  41          HD21      LEU  41   7.660  -4.435   1.782
  343   HD22  LEU  41          HD22      LEU  41   6.826  -3.074   1.034
  344   HD23  LEU  41          HD23      LEU  41   6.076  -4.669   1.044
  345    H    GLU  42           HN       GLU  42   3.984  -6.507   5.445
  346    HA   GLU  42           HA       GLU  42   5.547  -8.500   6.679
  347    HB2  GLU  42           HB2      GLU  42   3.924  -6.991   7.834
  348    HB3  GLU  42           HB1      GLU  42   2.609  -7.900   7.108
  349    HG2  GLU  42           HG2      GLU  42   3.361  -9.911   8.297
  350    HG3  GLU  42           HG1      GLU  42   4.649  -8.970   9.047
  351    H    LYS  43           HN       LYS  43   2.680  -8.689   4.619
  352    HA   LYS  43           HA       LYS  43   2.244 -11.466   4.917
  353    HB2  LYS  43           HB2      LYS  43   1.386  -9.528   2.773
  354    HB3  LYS  43           HB1      LYS  43   0.872 -11.210   2.824
  355    HG2  LYS  43           HG2      LYS  43  -0.142 -10.842   5.008
  356    HG3  LYS  43           HG1      LYS  43   0.372  -9.155   4.966
  357    HD2  LYS  43           HD2      LYS  43  -0.979  -8.832   2.927
  358    HD3  LYS  43           HD1      LYS  43  -1.540 -10.499   3.060
  359    HE2  LYS  43           HE2      LYS  43  -2.223  -8.120   4.703
  360    HE3  LYS  43           HE1      LYS  43  -3.259  -9.419   4.114
  361    HZ1  LYS  43           HZ1      LYS  43  -3.041  -9.621   6.467
  362    HZ2  LYS  43           HZ2      LYS  43  -1.351  -9.543   6.388
  363    HZ3  LYS  43           HZ3      LYS  43  -2.168 -10.890   5.766
  364    H    LEU  44           HN       LEU  44   4.112  -9.576   2.574
  365    HA   LEU  44           HA       LEU  44   4.732 -11.928   1.047
  366    HB2  LEU  44           HB2      LEU  44   6.210 -10.523  -0.269
  367    HB3  LEU  44           HB1      LEU  44   4.638  -9.779  -0.082
  368    HG   LEU  44           HG       LEU  44   5.928  -8.551   1.930
  369   HD11  LEU  44          HD11      LEU  44   8.060  -8.842  -0.172
  370   HD12  LEU  44          HD12      LEU  44   8.040  -9.790   1.314
  371   HD13  LEU  44          HD13      LEU  44   8.173  -8.034   1.390
  372   HD21  LEU  44          HD21      LEU  44   5.896  -7.821  -0.991
  373   HD22  LEU  44          HD22      LEU  44   6.333  -6.704   0.301
  374   HD23  LEU  44          HD23      LEU  44   4.709  -7.388   0.240
  375    H    GLU  45           HN       GLU  45   5.820 -10.590   3.927
  376    HA   GLU  45           HA       GLU  45   8.528 -11.537   3.856
  377    HB2  GLU  45           HB2      GLU  45   7.669  -9.626   5.242
  378    HB3  GLU  45           HB1      GLU  45   6.848 -10.801   6.255
  379    HG2  GLU  45           HG2      GLU  45   8.962 -11.790   6.886
  380    HG3  GLU  45           HG1      GLU  45   9.822 -10.681   5.817
  381    H1   MET  46           HT1      MET  46  -5.890  -1.398 -14.152
  382    H2   MET  46           HT2      MET  46  -5.774  -0.041 -15.156
  383    H3   MET  46           HT3      MET  46  -6.997  -0.128 -13.992
  384    HA   MET  46           HA       MET  46  -5.408  -0.010 -12.215
  385    HB2  MET  46           HB2      MET  46  -3.608  -1.195 -13.543
  386    HB3  MET  46           HB1      MET  46  -3.321   0.319 -14.386
  387    HG2  MET  46           HG2      MET  46  -2.840   1.352 -12.141
  388    HG3  MET  46           HG1      MET  46  -2.891  -0.277 -11.472
  389    HE1  MET  46           HE1      MET  46  -1.434  -1.903 -14.071
  390    HE2  MET  46           HE2      MET  46  -1.421  -2.221 -12.338
  391    HE3  MET  46           HE3      MET  46   0.100  -2.038 -13.211
  392    H    ALA  47           HN       ALA  47  -6.728   1.865 -11.972
  393    HA   ALA  47           HA       ALA  47  -5.661   4.270 -13.314
  394    HB1  ALA  47           HB1      ALA  47  -8.488   3.683 -12.432
  395    HB2  ALA  47           HB2      ALA  47  -7.904   3.846 -14.088
  396    HB3  ALA  47           HB3      ALA  47  -7.929   5.248 -13.020
  397    H    THR  48           HN       THR  48  -4.343   3.496 -11.155
  398    HA   THR  48           HA       THR  48  -5.392   4.326  -8.664
  399    HB   THR  48           HB       THR  48  -3.012   4.151  -7.909
  400    HG1  THR  48           HG1      THR  48  -2.391   4.646 -10.311
  401   HG21  THR  48          HG21      THR  48  -4.007   1.827  -9.565
  402   HG22  THR  48          HG22      THR  48  -4.540   2.209  -7.928
  403   HG23  THR  48          HG23      THR  48  -2.865   1.742  -8.223
  404    H    THR  49           HN       THR  49  -5.466   6.238  -7.722
  405    HA   THR  49           HA       THR  49  -4.194   8.546  -9.028
  406    HB   THR  49           HB       THR  49  -6.502   8.538  -7.069
  407    HG1  THR  49           HG1      THR  49  -7.008   7.457  -9.071
  408   HG21  THR  49          HG21      THR  49  -5.340  10.670  -7.187
  409   HG22  THR  49          HG22      THR  49  -6.912  10.798  -7.977
  410   HG23  THR  49          HG23      THR  49  -5.446  10.655  -8.946
  411    H    THR  50           HN       THR  50  -3.093  10.105  -7.716
  412    HA   THR  50           HA       THR  50  -1.580   9.021  -5.592
  413    HB   THR  50           HB       THR  50  -1.909  11.978  -6.079
  414    HG1  THR  50           HG1      THR  50  -0.942  11.774  -7.951
  415   HG21  THR  50          HG21      THR  50  -0.556  11.372  -4.161
  416   HG22  THR  50          HG22      THR  50   0.481  12.009  -5.437
  417   HG23  THR  50          HG23      THR  50   0.404  10.271  -5.149
  418    H    LEU  51           HN       LEU  51  -2.556   8.428  -3.755
  419    HA   LEU  51           HA       LEU  51  -4.195  10.424  -2.336
  420    HB2  LEU  51           HB2      LEU  51  -4.488   7.417  -2.162
  421    HB3  LEU  51           HB1      LEU  51  -5.487   8.610  -1.357
  422    HG   LEU  51           HG       LEU  51  -5.368   8.093  -4.331
  423   HD11  LEU  51          HD11      LEU  51  -6.623   6.513  -2.704
  424   HD12  LEU  51          HD12      LEU  51  -7.431   7.081  -4.163
  425   HD13  LEU  51          HD13      LEU  51  -7.791   7.830  -2.608
  426   HD21  LEU  51          HD21      LEU  51  -5.705  10.438  -4.010
  427   HD22  LEU  51          HD22      LEU  51  -6.911  10.145  -2.758
  428   HD23  LEU  51          HD23      LEU  51  -7.256   9.712  -4.432
  429    H    GLY  52           HN       GLY  52  -3.865  10.523  -0.052
  430    HA2  GLY  52           HA2      GLY  52  -1.174  10.040   0.742
  431    HA3  GLY  52           HA1      GLY  52  -2.463  10.641   1.772
  432    H    VAL  53           HN       VAL  53  -0.273   8.317   1.591
  433    HA   VAL  53           HA       VAL  53  -1.929   6.375   3.066
  434    HB   VAL  53           HB       VAL  53   0.135   5.824   0.926
  435   HG11  VAL  53          HG11      VAL  53  -0.127   3.414   1.452
  436   HG12  VAL  53          HG12      VAL  53  -0.995   3.865   2.919
  437   HG13  VAL  53          HG13      VAL  53   0.696   4.323   2.719
  438   HG21  VAL  53          HG21      VAL  53  -1.662   4.471  -0.050
  439   HG22  VAL  53          HG22      VAL  53  -2.134   6.159   0.145
  440   HG23  VAL  53          HG23      VAL  53  -2.724   4.941   1.277
  441    H    LYS  54           HN       LYS  54  -0.600   5.056   4.617
  442    HA   LYS  54           HA       LYS  54   1.499   6.749   5.755
  443    HB2  LYS  54           HB2      LYS  54  -0.037   4.440   6.951
  444    HB3  LYS  54           HB1      LYS  54   1.185   5.378   7.794
  445    HG2  LYS  54           HG2      LYS  54  -1.271   6.637   6.620
  446    HG3  LYS  54           HG1      LYS  54  -1.229   5.971   8.253
  447    HD2  LYS  54           HD2      LYS  54   0.614   7.477   8.821
  448    HD3  LYS  54           HD1      LYS  54   0.577   8.138   7.185
  449    HE2  LYS  54           HE2      LYS  54  -1.891   8.158   8.871
  450    HE3  LYS  54           HE1      LYS  54  -0.649   9.386   9.109
  451    HZ1  LYS  54           HZ1      LYS  54  -0.862  10.048   6.828
  452    HZ2  LYS  54           HZ2      LYS  54  -2.388  10.090   7.554
  453    HZ3  LYS  54           HZ3      LYS  54  -1.982   8.817   6.516
  454    H    LEU  55           HN       LEU  55   3.510   6.279   5.314
  455    HA   LEU  55           HA       LEU  55   4.374   3.476   5.166
  456    HB2  LEU  55           HB2      LEU  55   4.779   5.660   3.175
  457    HB3  LEU  55           HB1      LEU  55   6.061   4.490   3.405
  458    HG   LEU  55           HG       LEU  55   3.247   3.650   2.752
  459   HD11  LEU  55          HD11      LEU  55   5.493   4.304   0.849
  460   HD12  LEU  55          HD12      LEU  55   3.961   5.165   0.997
  461   HD13  LEU  55          HD13      LEU  55   3.985   3.502   0.410
  462   HD21  LEU  55          HD21      LEU  55   4.510   1.836   3.542
  463   HD22  LEU  55          HD22      LEU  55   5.961   2.367   2.694
  464   HD23  LEU  55          HD23      LEU  55   4.600   1.712   1.786
  465    H    ASP  56           HN       ASP  56   6.232   3.066   6.189
  466    HA   ASP  56           HA       ASP  56   7.416   5.143   7.846
  467    HB2  ASP  56           HB2      ASP  56   6.850   2.694   8.532
  468    HB3  ASP  56           HB1      ASP  56   8.302   2.264   7.644
  469    H    ASP  57           HN       ASP  57   9.883   5.205   7.909
  470    HA   ASP  57           HA       ASP  57  10.908   5.865   5.378
  471    HB2  ASP  57           HB2      ASP  57  12.014   5.627   8.097
  472    HB3  ASP  57           HB1      ASP  57  13.184   5.327   6.817
  473    HA   PRO  58           HA       PRO  58  13.191   1.578   5.423
  474    HB2  PRO  58           HB2      PRO  58  12.105  -0.330   7.062
  475    HB3  PRO  58           HB1      PRO  58  13.492   0.675   7.499
  476    HG2  PRO  58           HG2      PRO  58  10.609   1.006   8.223
  477    HG3  PRO  58           HG1      PRO  58  12.051   1.211   9.238
  478    HD2  PRO  58           HD2      PRO  58  10.753   3.314   8.194
  479    HD3  PRO  58           HD1      PRO  58  12.519   3.304   8.367
  480    H    THR  59           HN       THR  59   9.675   1.800   5.910
  481    HA   THR  59           HA       THR  59   9.139  -0.535   4.359
  482    HB   THR  59           HB       THR  59   6.823   0.121   4.274
  483    HG1  THR  59           HG1      THR  59   7.517   2.493   4.085
  484   HG21  THR  59          HG21      THR  59   8.306   0.252   6.819
  485   HG22  THR  59          HG22      THR  59   6.999  -0.820   6.320
  486   HG23  THR  59          HG23      THR  59   6.638   0.819   6.860
  487    H    ARG  60           HN       ARG  60   9.282   2.950   3.593
  488    HA   ARG  60           HA       ARG  60   8.452   2.639   0.902
  489    HB2  ARG  60           HB2      ARG  60   8.472   4.834   1.959
  490    HB3  ARG  60           HB1      ARG  60  10.222   4.757   2.139
  491    HG2  ARG  60           HG2      ARG  60  10.579   4.937  -0.185
  492    HG3  ARG  60           HG1      ARG  60   8.882   4.623  -0.546
  493    HD2  ARG  60           HD2      ARG  60   9.603   6.986   1.121
  494    HD3  ARG  60           HD1      ARG  60   9.845   7.060  -0.626
  495    HE   ARG  60           HE       ARG  60   7.315   6.956   0.795
  496   HH11  ARG  60          HH21      ARG  60   8.984   6.710  -2.262
  497   HH12  ARG  60          HH22      ARG  60   7.570   7.007  -3.215
  498   HH21  ARG  60          HH11      ARG  60   5.423   7.329  -0.450
  499   HH22  ARG  60          HH12      ARG  60   5.527   7.359  -2.177
  500    H    GLU  61           HN       GLU  61  11.599   2.601   2.472
  501    HA   GLU  61           HA       GLU  61  13.167   2.233   0.161
  502    HB2  GLU  61           HB2      GLU  61  13.588   1.452   3.052
  503    HB3  GLU  61           HB1      GLU  61  14.822   1.249   1.816
  504    HG2  GLU  61           HG2      GLU  61  14.821   3.662   1.422
  505    HG3  GLU  61           HG1      GLU  61  13.582   3.861   2.660
  506    H    ARG  62           HN       ARG  62  11.548   0.007   2.377
  507    HA   ARG  62           HA       ARG  62  12.485  -2.384   1.183
  508    HB2  ARG  62           HB2      ARG  62  11.467  -2.259   3.481
  509    HB3  ARG  62           HB1      ARG  62   9.899  -2.041   2.712
  510    HG2  ARG  62           HG2      ARG  62  10.127  -4.205   1.609
  511    HG3  ARG  62           HG1      ARG  62  11.699  -4.434   2.369
  512    HD2  ARG  62           HD2      ARG  62  10.632  -4.395   4.576
  513    HD3  ARG  62           HD1      ARG  62   9.059  -4.170   3.808
  514    HE   ARG  62           HE       ARG  62  10.244  -6.447   2.711
  515   HH11  ARG  62          HH21      ARG  62   8.901  -5.411   5.791
  516   HH12  ARG  62          HH22      ARG  62   8.485  -7.024   6.287
  517   HH21  ARG  62          HH11      ARG  62   9.671  -8.551   3.376
  518   HH22  ARG  62          HH12      ARG  62   8.923  -8.787   4.919
  519    H    LEU  63           HN       LEU  63   9.832  -0.212   0.527
  520    HA   LEU  63           HA       LEU  63   8.373  -1.855  -1.204
  521    HB2  LEU  63           HB2      LEU  63   8.516   1.017  -0.641
  522    HB3  LEU  63           HB1      LEU  63   8.136   0.671  -2.317
  523    HG   LEU  63           HG       LEU  63   6.262  -0.816  -1.470
  524   HD11  LEU  63          HD11      LEU  63   5.468  -0.550   0.754
  525   HD12  LEU  63          HD12      LEU  63   6.710   0.649   1.112
  526   HD13  LEU  63          HD13      LEU  63   7.163  -1.031   0.830
  527   HD21  LEU  63          HD21      LEU  63   4.798   1.144  -0.893
  528   HD22  LEU  63          HD22      LEU  63   5.695   1.283  -2.404
  529   HD23  LEU  63          HD23      LEU  63   6.245   2.149  -0.969
  530    H    LYS  64           HN       LYS  64  11.215   0.221  -1.719
  531    HA   LYS  64           HA       LYS  64  11.398  -0.226  -4.490
  532    HB2  LYS  64           HB2      LYS  64  12.745   1.520  -3.411
  533    HB3  LYS  64           HB1      LYS  64  13.658   0.285  -2.551
  534    HG2  LYS  64           HG2      LYS  64  14.494  -0.589  -4.677
  535    HG3  LYS  64           HG1      LYS  64  13.577   0.639  -5.546
  536    HD2  LYS  64           HD2      LYS  64  14.891   2.395  -4.516
  537    HD3  LYS  64           HD1      LYS  64  15.753   1.210  -3.534
  538    HE2  LYS  64           HE2      LYS  64  17.190   1.754  -5.340
  539    HE3  LYS  64           HE1      LYS  64  16.534   0.157  -5.690
  540    HZ1  LYS  64           HZ1      LYS  64  15.707   2.738  -6.903
  541    HZ2  LYS  64           HZ2      LYS  64  14.881   1.284  -7.143
  542    HZ3  LYS  64           HZ3      LYS  64  16.479   1.446  -7.674
  543    H    ALA  65           HN       ALA  65  12.630  -2.004  -1.745
  544    HA   ALA  65           HA       ALA  65  14.047  -3.987  -3.132
  545    HB1  ALA  65           HB1      ALA  65  14.185  -3.645  -0.685
  546    HB2  ALA  65           HB2      ALA  65  13.878  -5.326  -1.120
  547    HB3  ALA  65           HB3      ALA  65  12.562  -4.314  -0.523
  548    H    ALA  66           HN       ALA  66  10.649  -3.749  -2.171
  549    HA   ALA  66           HA       ALA  66   9.804  -6.249  -3.185
  550    HB1  ALA  66           HB1      ALA  66   8.414  -4.945  -1.648
  551    HB2  ALA  66           HB2      ALA  66   7.539  -5.286  -3.141
  552    HB3  ALA  66           HB3      ALA  66   8.229  -3.686  -2.870
  553    H    ALA  67           HN       ALA  67  10.096  -3.030  -4.541
  554    HA   ALA  67           HA       ALA  67   9.034  -3.478  -7.079
  555    HB1  ALA  67           HB1      ALA  67  10.245  -1.516  -7.773
  556    HB2  ALA  67           HB2      ALA  67  11.353  -1.670  -6.409
  557    HB3  ALA  67           HB3      ALA  67   9.664  -1.251  -6.129
  558    H    GLN  68           HN       GLN  68  12.250  -3.838  -5.808
  559    HA   GLN  68           HA       GLN  68  13.510  -4.656  -8.188
  560    HB2  GLN  68           HB2      GLN  68  14.213  -5.125  -5.287
  561    HB3  GLN  68           HB1      GLN  68  15.278  -5.525  -6.629
  562    HG2  GLN  68           HG2      GLN  68  14.224  -2.762  -6.072
  563    HG3  GLN  68           HG1      GLN  68  15.786  -3.356  -5.514
  564   HE21  GLN  68          HE21      GLN  68  13.915  -2.310  -8.236
  565   HE22  GLN  68          HE22      GLN  68  15.223  -2.198  -9.361
  566    H    SER  69           HN       SER  69  11.926  -6.466  -5.574
  567    HA   SER  69           HA       SER  69  12.578  -9.028  -6.623
  568    HB2  SER  69           HB2      SER  69  10.884  -9.889  -5.036
  569    HB3  SER  69           HB1      SER  69  12.020  -8.784  -4.269
  570    HG   SER  69           HG       SER  69   9.830  -7.495  -5.259
  571    H    ILE  70           HN       ILE  70  10.278  -6.690  -7.540
  572    HA   ILE  70           HA       ILE  70   8.774  -8.703  -9.063
  573    HB   ILE  70           HB       ILE  70   7.752  -6.958  -7.280
  574   HG12  ILE  70          HG12      ILE  70   6.587  -8.850  -8.366
  575   HG13  ILE  70          HG11      ILE  70   5.570  -7.425  -8.201
  576   HG21  ILE  70          HG21      ILE  70   7.350  -5.557  -9.902
  577   HG22  ILE  70          HG22      ILE  70   8.410  -5.006  -8.606
  578   HG23  ILE  70          HG23      ILE  70   6.670  -5.105  -8.340
  579   HD11  ILE  70          HD11      ILE  70   5.176  -8.433 -10.330
  580   HD12  ILE  70          HD12      ILE  70   6.899  -8.424 -10.706
  581   HD13  ILE  70          HD13      ILE  70   6.016  -6.903 -10.581
  582    H    ASP  71           HN       ASP  71  11.249  -6.741  -9.382
  583    HA   ASP  71           HA       ASP  71  12.405  -5.815 -11.076
  584    HB2  ASP  71           HB2      ASP  71  10.473  -7.472 -12.692
  585    HB3  ASP  71           HB1      ASP  71  11.796  -6.568 -13.419
  586    H    ARG  72           HN       ARG  72  10.575  -4.121  -9.961
  587    HA   ARG  72           HA       ARG  72   9.788  -2.485 -12.287
  588    HB2  ARG  72           HB2      ARG  72   8.194  -2.976  -9.776
  589    HB3  ARG  72           HB1      ARG  72   7.867  -1.642 -10.870
  590    HG2  ARG  72           HG2      ARG  72   7.739  -4.567 -11.554
  591    HG3  ARG  72           HG1      ARG  72   6.364  -3.501 -11.264
  592    HD2  ARG  72           HD2      ARG  72   7.398  -2.080 -13.179
  593    HD3  ARG  72           HD1      ARG  72   8.263  -3.565 -13.575
  594    HE   ARG  72           HE       ARG  72   5.584  -2.989 -14.187
  595   HH11  ARG  72          HH21      ARG  72   7.586  -5.631 -13.041
  596   HH12  ARG  72          HH22      ARG  72   6.528  -6.862 -13.648
  597   HH21  ARG  72          HH11      ARG  72   4.184  -4.623 -14.989
  598   HH22  ARG  72          HH12      ARG  72   4.600  -6.289 -14.765
  599    H    THR  73           HN       THR  73   9.524  -0.178 -11.759
  600    HA   THR  73           HA       THR  73  11.701   0.738 -10.110
  601    HB   THR  73           HB       THR  73  11.367   1.867 -12.224
  602    HG1  THR  73           HG1      THR  73  10.524   3.620 -10.148
  603   HG21  THR  73          HG21      THR  73   9.014   1.517 -12.599
  604   HG22  THR  73          HG22      THR  73   9.343   3.249 -12.637
  605   HG23  THR  73          HG23      THR  73   8.603   2.524 -11.211
  606    HA   PRO  74           HA       PRO  74   9.844   1.456  -6.154
  607    HB2  PRO  74           HB2      PRO  74  10.536   4.316  -6.700
  608    HB3  PRO  74           HB1      PRO  74  10.779   3.362  -5.232
  609    HG2  PRO  74           HG2      PRO  74  12.771   3.828  -6.980
  610    HG3  PRO  74           HG1      PRO  74  12.655   2.325  -6.052
  611    HD2  PRO  74           HD2      PRO  74  12.271   2.769  -8.924
  612    HD3  PRO  74           HD1      PRO  74  12.547   1.254  -8.049
  613    H    HIS  75           HN       HIS  75   9.135   4.214  -8.326
  614    HA   HIS  75           HA       HIS  75   6.708   4.907  -7.120
  615    HB2  HIS  75           HB2      HIS  75   7.921   6.424  -8.596
  616    HB3  HIS  75           HB1      HIS  75   7.624   5.357  -9.963
  617    HD1  HIS  75           HD1      HIS  75   5.584   5.806 -11.295
  618    HD2  HIS  75           HD2      HIS  75   5.451   7.629  -7.560
  619    HE1  HIS  75           HE1      HIS  75   3.496   7.199 -11.300
  620    HE2  HIS  75           HE2      HIS  75   3.650   8.537  -9.179
  621    H    TRP  76           HN       TRP  76   7.293   2.929 -10.025
  622    HA   TRP  76           HA       TRP  76   4.598   2.387 -10.560
  623    HB2  TRP  76           HB2      TRP  76   6.469   1.948 -12.166
  624    HB3  TRP  76           HB1      TRP  76   6.932   0.568 -11.170
  625    HD1  TRP  76           HD1      TRP  76   5.343  -1.582 -11.233
  626    HE1  TRP  76           HE1      TRP  76   3.539  -2.347 -12.896
  627    HE3  TRP  76           HE3      TRP  76   4.652   2.809 -13.763
  628    HZ2  TRP  76           HZ2      TRP  76   2.028  -1.245 -15.007
  629    HZ3  TRP  76           HZ3      TRP  76   3.007   2.866 -15.592
  630    HH2  TRP  76           HH2      TRP  76   1.723   0.880 -16.200
  631    H    LEU  77           HN       LEU  77   6.993   0.816  -8.597
  632    HA   LEU  77           HA       LEU  77   5.497  -1.420  -7.842
  633    HB2  LEU  77           HB2      LEU  77   7.902  -1.306  -7.472
  634    HB3  LEU  77           HB1      LEU  77   7.678  -0.009  -6.318
  635    HG   LEU  77           HG       LEU  77   8.137  -2.364  -5.406
  636   HD11  LEU  77          HD11      LEU  77   5.697  -0.940  -4.375
  637   HD12  LEU  77          HD12      LEU  77   7.361  -0.475  -4.035
  638   HD13  LEU  77          HD13      LEU  77   6.748  -2.028  -3.472
  639   HD21  LEU  77          HD21      LEU  77   6.523  -3.508  -6.894
  640   HD22  LEU  77          HD22      LEU  77   5.210  -2.732  -6.009
  641   HD23  LEU  77          HD23      LEU  77   6.280  -3.866  -5.185
  642    H    ILE  78           HN       ILE  78   5.709   1.801  -6.482
  643    HA   ILE  78           HA       ILE  78   4.317   1.376  -4.119
  644    HB   ILE  78           HB       ILE  78   4.316   3.793  -5.935
  645   HG12  ILE  78          HG12      ILE  78   5.648   3.366  -3.256
  646   HG13  ILE  78          HG11      ILE  78   6.451   3.091  -4.799
  647   HG21  ILE  78          HG21      ILE  78   3.450   5.031  -3.934
  648   HG22  ILE  78          HG22      ILE  78   3.081   3.465  -3.211
  649   HG23  ILE  78          HG23      ILE  78   2.289   3.954  -4.709
  650   HD11  ILE  78          HD11      ILE  78   5.565   5.659  -3.564
  651   HD12  ILE  78          HD12      ILE  78   5.792   5.531  -5.306
  652   HD13  ILE  78          HD13      ILE  78   7.140   5.212  -4.217
  653    H    LYS  79           HN       LYS  79   3.086   2.116  -7.364
  654    HA   LYS  79           HA       LYS  79   0.342   2.078  -6.697
  655    HB2  LYS  79           HB2      LYS  79   1.381   1.090  -9.346
  656    HB3  LYS  79           HB1      LYS  79  -0.107   1.961  -9.009
  657    HG2  LYS  79           HG2      LYS  79   1.539   3.863  -8.270
  658    HG3  LYS  79           HG1      LYS  79   2.669   2.990  -9.302
  659    HD2  LYS  79           HD2      LYS  79   0.060   4.281 -10.064
  660    HD3  LYS  79           HD1      LYS  79   1.674   4.628 -10.682
  661    HE2  LYS  79           HE2      LYS  79  -0.036   2.209 -11.209
  662    HE3  LYS  79           HE1      LYS  79   0.531   3.410 -12.367
  663    HZ1  LYS  79           HZ1      LYS  79   2.308   1.570 -10.866
  664    HZ2  LYS  79           HZ2      LYS  79   2.753   2.621 -12.114
  665    HZ3  LYS  79           HZ3      LYS  79   1.759   1.295 -12.441
  666    H    GLN  80           HN       GLN  80   2.576  -0.462  -7.717
  667    HA   GLN  80           HA       GLN  80   0.664  -2.556  -7.791
  668    HB2  GLN  80           HB2      GLN  80   3.668  -2.552  -7.606
  669    HB3  GLN  80           HB1      GLN  80   2.726  -4.036  -7.665
  670    HG2  GLN  80           HG2      GLN  80   1.823  -3.386  -9.831
  671    HG3  GLN  80           HG1      GLN  80   2.738  -1.880  -9.766
  672   HE21  GLN  80          HE21      GLN  80   2.804  -4.201 -11.635
  673   HE22  GLN  80          HE22      GLN  80   4.459  -4.698 -11.670
  674    H    ALA  81           HN       ALA  81   3.087  -1.672  -5.340
  675    HA   ALA  81           HA       ALA  81   2.743  -3.682  -3.539
  676    HB1  ALA  81           HB1      ALA  81   4.439  -2.111  -3.117
  677    HB2  ALA  81           HB2      ALA  81   3.308  -1.954  -1.774
  678    HB3  ALA  81           HB3      ALA  81   3.299  -0.767  -3.078
  679    H    ILE  82           HN       ILE  82   0.669  -0.844  -3.938
  680    HA   ILE  82           HA       ILE  82  -0.987  -1.822  -1.770
  681    HB   ILE  82           HB       ILE  82  -0.471   0.595  -2.023
  682   HG12  ILE  82          HG12      ILE  82  -2.841   1.363  -1.627
  683   HG13  ILE  82          HG11      ILE  82  -3.356  -0.276  -2.015
  684   HG21  ILE  82          HG21      ILE  82  -1.623   1.942  -3.653
  685   HG22  ILE  82          HG22      ILE  82  -2.390   0.509  -4.337
  686   HG23  ILE  82          HG23      ILE  82  -0.644   0.721  -4.467
  687   HD11  ILE  82          HD11      ILE  82  -2.943   0.494   0.459
  688   HD12  ILE  82          HD12      ILE  82  -1.273   0.088   0.065
  689   HD13  ILE  82          HD13      ILE  82  -2.536  -1.134  -0.076
  690    H    PHE  83           HN       PHE  83  -1.412  -1.346  -5.306
  691    HA   PHE  83           HA       PHE  83  -4.090  -2.412  -5.177
  692    HB2  PHE  83           HB2      PHE  83  -4.309  -1.502  -7.218
  693    HB3  PHE  83           HB1      PHE  83  -2.669  -0.895  -7.053
  694    HD1  PHE  83           HD1      PHE  83  -4.661  -3.753  -8.334
  695    HD2  PHE  83           HD2      PHE  83  -0.971  -1.637  -8.469
  696    HE1  PHE  83           HE1      PHE  83  -3.968  -5.094 -10.275
  697    HE2  PHE  83           HE2      PHE  83  -0.273  -2.976 -10.409
  698    HZ   PHE  83           HZ       PHE  83  -1.770  -4.707 -11.314
  699    H    ASN  84           HN       ASN  84  -0.911  -3.632  -6.057
  700    HA   ASN  84           HA       ASN  84  -1.827  -6.176  -6.912
  701    HB2  ASN  84           HB2      ASN  84   0.499  -5.104  -7.327
  702    HB3  ASN  84           HB1      ASN  84   0.893  -5.690  -5.717
  703   HD21  ASN  84          HD21      ASN  84   2.027  -6.378  -8.307
  704   HD22  ASN  84          HD22      ASN  84   1.831  -8.083  -8.494
  705    H    TYR  85           HN       TYR  85  -1.122  -4.645  -3.838
  706    HA   TYR  85           HA       TYR  85  -1.017  -6.948  -2.236
  707    HB2  TYR  85           HB2      TYR  85  -0.510  -4.973  -1.076
  708    HB3  TYR  85           HB1      TYR  85  -1.870  -4.103  -1.770
  709    HD1  TYR  85           HD1      TYR  85  -1.094  -6.871   0.620
  710    HD2  TYR  85           HD2      TYR  85  -3.795  -3.789  -0.522
  711    HE1  TYR  85           HE1      TYR  85  -2.406  -7.261   2.669
  712    HE2  TYR  85           HE2      TYR  85  -5.109  -4.170   1.515
  713    HH   TYR  85           HH       TYR  85  -5.482  -5.628   3.212
  714    H    LEU  86           HN       LEU  86  -3.638  -4.991  -3.489
  715    HA   LEU  86           HA       LEU  86  -5.758  -6.454  -2.333
  716    HB2  LEU  86           HB2      LEU  86  -5.715  -4.731  -4.806
  717    HB3  LEU  86           HB1      LEU  86  -7.169  -5.313  -4.015
  718    HG   LEU  86           HG       LEU  86  -5.136  -3.460  -2.754
  719   HD11  LEU  86          HD11      LEU  86  -7.924  -2.806  -3.660
  720   HD12  LEU  86          HD12      LEU  86  -6.494  -2.520  -4.648
  721   HD13  LEU  86          HD13      LEU  86  -6.672  -1.701  -3.098
  722   HD21  LEU  86          HD21      LEU  86  -7.772  -4.545  -1.783
  723   HD22  LEU  86          HD22      LEU  86  -6.960  -3.157  -1.062
  724   HD23  LEU  86          HD23      LEU  86  -6.183  -4.738  -1.043
  725    H    GLU  87           HN       GLU  87  -4.036  -6.678  -5.390
  726    HA   GLU  87           HA       GLU  87  -5.621  -8.678  -6.606
  727    HB2  GLU  87           HB2      GLU  87  -4.021  -7.238  -7.834
  728    HB3  GLU  87           HB1      GLU  87  -2.689  -8.049  -7.024
  729    HG2  GLU  87           HG2      GLU  87  -3.399 -10.172  -8.078
  730    HG3  GLU  87           HG1      GLU  87  -4.635  -9.277  -8.961
  731    H    LYS  88           HN       LYS  88  -2.788  -8.797  -4.520
  732    HA   LYS  88           HA       LYS  88  -2.349 -11.587  -4.744
  733    HB2  LYS  88           HB2      LYS  88  -1.454  -9.581  -2.671
  734    HB3  LYS  88           HB1      LYS  88  -0.942 -11.264  -2.681
  735    HG2  LYS  88           HG2      LYS  88   0.048 -10.957  -4.890
  736    HG3  LYS  88           HG1      LYS  88  -0.464  -9.269  -4.885
  737    HD2  LYS  88           HD2      LYS  88   0.929  -8.873  -2.899
  738    HD3  LYS  88           HD1      LYS  88   1.465 -10.554  -2.952
  739    HE2  LYS  88           HE2      LYS  88   2.176  -8.270  -4.712
  740    HE3  LYS  88           HE1      LYS  88   3.186  -9.574  -4.090
  741    HZ1  LYS  88           HZ1      LYS  88   2.913  -9.847  -6.437
  742    HZ2  LYS  88           HZ2      LYS  88   1.226  -9.750  -6.319
  743    HZ3  LYS  88           HZ3      LYS  88   2.049 -11.080  -5.667
  744    H    LEU  89           HN       LEU  89  -4.164  -9.625  -2.408
  745    HA   LEU  89           HA       LEU  89  -4.762 -11.928  -0.813
  746    HB2  LEU  89           HB2      LEU  89  -6.189 -10.483   0.489
  747    HB3  LEU  89           HB1      LEU  89  -4.641  -9.719   0.202
  748    HG   LEU  89           HG       LEU  89  -6.011  -8.590  -1.804
  749   HD11  LEU  89          HD11      LEU  89  -8.109  -8.873   0.332
  750   HD12  LEU  89          HD12      LEU  89  -8.081  -9.862  -1.127
  751   HD13  LEU  89          HD13      LEU  89  -8.263  -8.112  -1.251
  752   HD21  LEU  89          HD21      LEU  89  -5.973  -7.750   1.088
  753   HD22  LEU  89          HD22      LEU  89  -6.443  -6.695  -0.243
  754   HD23  LEU  89          HD23      LEU  89  -4.802  -7.336  -0.164
  755    H    GLU  90           HN       GLU  90  -5.940 -10.650  -3.689
  756    HA   GLU  90           HA       GLU  90  -8.640 -11.480  -3.576
  757    HB2  GLU  90           HB2      GLU  90  -7.624  -9.862  -5.221
  758    HB3  GLU  90           HB1      GLU  90  -6.888 -11.236  -6.022
  759    HG2  GLU  90           HG2      GLU  90  -9.069 -12.148  -6.558
  760    HG3  GLU  90           HG1      GLU  90  -9.858 -10.822  -5.699
  Start of MODEL    6
    1    H1   MET   1           HT1      MET   1  -3.594   0.786 -10.782
    2    H2   MET   1           HT2      MET   1  -2.110   1.596 -10.819
    3    H3   MET   1           HT3      MET   1  -2.163  -0.079 -11.043
    4    HA   MET   1           HA       MET   1  -1.814   1.040 -13.138
    5    HB2  MET   1           HB2      MET   1  -4.498  -0.281 -12.741
    6    HB3  MET   1           HB1      MET   1  -3.867   0.129 -14.331
    7    HG2  MET   1           HG2      MET   1  -1.948  -1.312 -13.963
    8    HG3  MET   1           HG1      MET   1  -2.524  -1.689 -12.341
    9    HE1  MET   1           HE1      MET   1  -2.171  -4.205 -12.976
   10    HE2  MET   1           HE2      MET   1  -1.795  -3.918 -14.675
   11    HE3  MET   1           HE3      MET   1  -3.063  -5.061 -14.234
   12    H    ALA   2           HN       ALA   2  -5.111   1.767 -11.967
   13    HA   ALA   2           HA       ALA   2  -4.989   4.338 -13.398
   14    HB1  ALA   2           HB1      ALA   2  -7.390   2.888 -12.258
   15    HB2  ALA   2           HB2      ALA   2  -6.888   2.834 -13.948
   16    HB3  ALA   2           HB3      ALA   2  -7.418   4.357 -13.234
   17    H    THR   3           HN       THR   3  -3.711   3.546 -10.918
   18    HA   THR   3           HA       THR   3  -5.032   4.523  -8.642
   19    HB   THR   3           HB       THR   3  -2.728   4.539  -7.646
   20    HG1  THR   3           HG1      THR   3  -1.705   5.003  -9.720
   21   HG21  THR   3          HG21      THR   3  -2.366   2.110  -7.801
   22   HG22  THR   3          HG22      THR   3  -3.507   2.035  -9.144
   23   HG23  THR   3          HG23      THR   3  -4.063   2.507  -7.538
   24    H    THR   4           HN       THR   4  -5.251   6.484  -7.881
   25    HA   THR   4           HA       THR   4  -3.888   8.711  -9.215
   26    HB   THR   4           HB       THR   4  -6.210   8.831  -7.273
   27    HG1  THR   4           HG1      THR   4  -6.524   7.644  -9.381
   28   HG21  THR   4          HG21      THR   4  -5.169  10.822  -9.295
   29   HG22  THR   4          HG22      THR   4  -4.982  10.933  -7.545
   30   HG23  THR   4          HG23      THR   4  -6.587  11.042  -8.269
   31    H    THR   5           HN       THR   5  -2.764  10.268  -7.918
   32    HA   THR   5           HA       THR   5  -1.411   9.116  -5.697
   33    HB   THR   5           HB       THR   5  -1.387  11.996  -6.622
   34    HG1  THR   5           HG1      THR   5  -0.723  10.647  -8.302
   35   HG21  THR   5          HG21      THR   5  -0.466  11.652  -4.361
   36   HG22  THR   5          HG22      THR   5   0.787  12.102  -5.517
   37   HG23  THR   5          HG23      THR   5   0.625  10.423  -5.002
   38    H    LEU   6           HN       LEU   6  -2.310   8.845  -3.814
   39    HA   LEU   6           HA       LEU   6  -4.009  10.963  -2.672
   40    HB2  LEU   6           HB2      LEU   6  -4.359   7.998  -2.199
   41    HB3  LEU   6           HB1      LEU   6  -5.403   9.290  -1.642
   42    HG   LEU   6           HG       LEU   6  -5.054   8.417  -4.515
   43   HD11  LEU   6          HD11      LEU   6  -7.589   8.264  -2.946
   44   HD12  LEU   6          HD12      LEU   6  -6.380   6.993  -2.784
   45   HD13  LEU   6          HD13      LEU   6  -7.088   7.340  -4.362
   46   HD21  LEU   6          HD21      LEU   6  -5.494  10.756  -4.516
   47   HD22  LEU   6          HD22      LEU   6  -6.729  10.587  -3.269
   48   HD23  LEU   6          HD23      LEU   6  -7.014   9.940  -4.885
   49    H    GLY   7           HN       GLY   7  -3.962  11.027  -0.314
   50    HA2  GLY   7           HA2      GLY   7  -1.319  10.669   0.711
   51    HA3  GLY   7           HA1      GLY   7  -2.717  11.239   1.613
   52    H    VAL   8           HN       VAL   8  -0.493   8.841   1.427
   53    HA   VAL   8           HA       VAL   8  -2.215   6.968   2.909
   54    HB   VAL   8           HB       VAL   8  -0.012   6.081   1.030
   55   HG11  VAL   8          HG11      VAL   8  -2.125   4.612   2.580
   56   HG12  VAL   8          HG12      VAL   8  -0.375   4.400   2.642
   57   HG13  VAL   8          HG13      VAL   8  -1.277   3.888   1.216
   58   HG21  VAL   8          HG21      VAL   8  -1.715   7.082  -0.331
   59   HG22  VAL   8          HG22      VAL   8  -2.980   6.218   0.541
   60   HG23  VAL   8          HG23      VAL   8  -1.844   5.328  -0.472
   61    H    LYS   9           HN       LYS   9  -0.558   5.331   4.108
   62    HA   LYS   9           HA       LYS   9   1.469   7.088   5.306
   63    HB2  LYS   9           HB2      LYS   9  -0.208   4.937   6.599
   64    HB3  LYS   9           HB1      LYS   9   1.084   5.820   7.408
   65    HG2  LYS   9           HG2      LYS   9  -0.101   7.919   7.037
   66    HG3  LYS   9           HG1      LYS   9  -1.392   7.043   6.216
   67    HD2  LYS   9           HD2      LYS   9  -1.871   5.822   8.280
   68    HD3  LYS   9           HD1      LYS   9  -0.571   6.694   9.095
   69    HE2  LYS   9           HE2      LYS   9  -3.048   7.505   9.321
   70    HE3  LYS   9           HE1      LYS   9  -1.738   8.673   9.142
   71    HZ1  LYS   9           HZ1      LYS   9  -3.345   7.658   6.864
   72    HZ2  LYS   9           HZ2      LYS   9  -2.248   8.946   6.854
   73    HZ3  LYS   9           HZ3      LYS   9  -3.705   9.085   7.700
   74    H    LEU  10           HN       LEU  10   3.500   6.459   5.341
   75    HA   LEU  10           HA       LEU  10   4.181   3.629   4.920
   76    HB2  LEU  10           HB2      LEU  10   5.019   5.993   3.283
   77    HB3  LEU  10           HB1      LEU  10   6.116   4.643   3.470
   78    HG   LEU  10           HG       LEU  10   3.324   4.218   2.447
   79   HD11  LEU  10          HD11      LEU  10   4.310   5.940   1.036
   80   HD12  LEU  10          HD12      LEU  10   4.237   4.403   0.174
   81   HD13  LEU  10          HD13      LEU  10   5.768   4.967   0.844
   82   HD21  LEU  10          HD21      LEU  10   4.538   2.346   1.279
   83   HD22  LEU  10          HD22      LEU  10   4.453   2.212   3.036
   84   HD23  LEU  10          HD23      LEU  10   5.944   2.749   2.262
   85    H    ASP  11           HN       ASP  11   6.111   2.988   5.861
   86    HA   ASP  11           HA       ASP  11   7.196   4.755   7.920
   87    HB2  ASP  11           HB2      ASP  11   7.962   1.885   7.245
   88    HB3  ASP  11           HB1      ASP  11   8.474   2.784   8.661
   89    H    ASP  12           HN       ASP  12   9.666   4.944   7.998
   90    HA   ASP  12           HA       ASP  12  10.730   5.800   5.560
   91    HB2  ASP  12           HB2      ASP  12  11.931   5.126   8.212
   92    HB3  ASP  12           HB1      ASP  12  13.019   5.277   6.839
   93    HA   PRO  13           HA       PRO  13  13.012   1.516   5.245
   94    HB2  PRO  13           HB2      PRO  13  11.907  -0.541   6.664
   95    HB3  PRO  13           HB1      PRO  13  13.261   0.437   7.241
   96    HG2  PRO  13           HG2      PRO  13  10.347   0.672   7.879
   97    HG3  PRO  13           HG1      PRO  13  11.743   0.776   8.969
   98    HD2  PRO  13           HD2      PRO  13  10.483   2.975   8.095
   99    HD3  PRO  13           HD1      PRO  13  12.243   2.945   8.326
  100    H    THR  14           HN       THR  14   9.474   1.715   5.579
  101    HA   THR  14           HA       THR  14   9.012  -0.523   3.872
  102    HB   THR  14           HB       THR  14   6.709   0.247   3.633
  103    HG1  THR  14           HG1      THR  14   6.249   2.267   3.899
  104   HG21  THR  14          HG21      THR  14   8.023  -0.174   6.197
  105   HG22  THR  14          HG22      THR  14   6.550  -0.895   5.546
  106   HG23  THR  14          HG23      THR  14   6.487   0.681   6.335
  107    H    ARG  15           HN       ARG  15   9.180   2.990   3.326
  108    HA   ARG  15           HA       ARG  15   8.530   2.887   0.596
  109    HB2  ARG  15           HB2      ARG  15   8.591   4.996   1.837
  110    HB3  ARG  15           HB1      ARG  15  10.337   4.845   2.024
  111    HG2  ARG  15           HG2      ARG  15  10.691   5.086  -0.330
  112    HG3  ARG  15           HG1      ARG  15   8.958   5.018  -0.646
  113    HD2  ARG  15           HD2      ARG  15  10.209   7.150   1.063
  114    HD3  ARG  15           HD1      ARG  15  10.041   7.313  -0.686
  115    HE   ARG  15           HE       ARG  15   7.953   7.487   1.295
  116   HH11  ARG  15          HH21      ARG  15   8.687   6.902  -2.074
  117   HH12  ARG  15          HH22      ARG  15   7.107   7.338  -2.634
  118   HH21  ARG  15          HH11      ARG  15   5.852   8.055   0.562
  119   HH22  ARG  15          HH12      ARG  15   5.486   8.000  -1.130
  120    H    GLU  16           HN       GLU  16  11.633   2.641   2.282
  121    HA   GLU  16           HA       GLU  16  13.186   2.326  -0.071
  122    HB2  GLU  16           HB2      GLU  16  13.757   1.377   2.746
  123    HB3  GLU  16           HB1      GLU  16  14.936   1.460   1.443
  124    HG2  GLU  16           HG2      GLU  16  13.477   3.793   2.669
  125    HG3  GLU  16           HG1      GLU  16  15.161   3.352   2.946
  126    H    ARG  17           HN       ARG  17  11.571   0.072   2.102
  127    HA   ARG  17           HA       ARG  17  12.483  -2.323   0.946
  128    HB2  ARG  17           HB2      ARG  17  11.362  -2.267   3.136
  129    HB3  ARG  17           HB1      ARG  17   9.863  -1.772   2.361
  130    HG2  ARG  17           HG2      ARG  17   9.803  -4.131   2.900
  131    HG3  ARG  17           HG1      ARG  17   9.791  -3.899   1.148
  132    HD2  ARG  17           HD2      ARG  17  12.213  -4.329   1.098
  133    HD3  ARG  17           HD1      ARG  17  12.189  -4.605   2.838
  134    HE   ARG  17           HE       ARG  17  11.251  -6.673   2.488
  135   HH11  ARG  17          HH21      ARG  17  11.133  -4.823  -0.490
  136   HH12  ARG  17          HH22      ARG  17  10.831  -6.206  -1.490
  137   HH21  ARG  17          HH11      ARG  17  10.884  -8.504   1.170
  138   HH22  ARG  17          HH12      ARG  17  10.686  -8.309  -0.541
  139    H    LEU  18           HN       LEU  18   9.778  -0.200   0.227
  140    HA   LEU  18           HA       LEU  18   8.511  -1.771  -1.709
  141    HB2  LEU  18           HB2      LEU  18   8.474   1.057  -0.907
  142    HB3  LEU  18           HB1      LEU  18   8.089   0.791  -2.596
  143    HG   LEU  18           HG       LEU  18   6.334  -0.876  -1.805
  144   HD11  LEU  18          HD11      LEU  18   7.266  -1.133   0.478
  145   HD12  LEU  18          HD12      LEU  18   5.545  -0.751   0.436
  146   HD13  LEU  18          HD13      LEU  18   6.717   0.504   0.835
  147   HD21  LEU  18          HD21      LEU  18   5.649   1.242  -2.640
  148   HD22  LEU  18          HD22      LEU  18   6.109   2.049  -1.141
  149   HD23  LEU  18          HD23      LEU  18   4.740   0.936  -1.160
  150    H    LYS  19           HN       LYS  19  11.271   0.434  -1.898
  151    HA   LYS  19           HA       LYS  19  11.552   0.422  -4.693
  152    HB2  LYS  19           HB2      LYS  19  12.814   1.906  -3.077
  153    HB3  LYS  19           HB1      LYS  19  13.831   0.517  -2.717
  154    HG2  LYS  19           HG2      LYS  19  14.417   0.415  -5.143
  155    HG3  LYS  19           HG1      LYS  19  13.545   1.932  -5.355
  156    HD2  LYS  19           HD2      LYS  19  15.929   1.489  -3.561
  157    HD3  LYS  19           HD1      LYS  19  15.942   2.324  -5.114
  158    HE2  LYS  19           HE2      LYS  19  14.570   3.181  -2.570
  159    HE3  LYS  19           HE1      LYS  19  15.911   3.977  -3.388
  160    HZ1  LYS  19           HZ1      LYS  19  14.293   4.232  -5.317
  161    HZ2  LYS  19           HZ2      LYS  19  14.047   5.217  -3.963
  162    HZ3  LYS  19           HZ3      LYS  19  13.076   3.854  -4.203
  163    H    ALA  20           HN       ALA  20  12.682  -1.723  -2.198
  164    HA   ALA  20           HA       ALA  20  14.160  -3.490  -3.838
  165    HB1  ALA  20           HB1      ALA  20  12.848  -3.920  -1.154
  166    HB2  ALA  20           HB2      ALA  20  14.537  -3.516  -1.466
  167    HB3  ALA  20           HB3      ALA  20  13.905  -5.094  -1.938
  168    H    ALA  21           HN       ALA  21  10.789  -3.255  -2.910
  169    HA   ALA  21           HA       ALA  21   9.969  -5.740  -4.036
  170    HB1  ALA  21           HB1      ALA  21   7.713  -4.930  -3.763
  171    HB2  ALA  21           HB2      ALA  21   8.288  -3.274  -3.577
  172    HB3  ALA  21           HB3      ALA  21   8.651  -4.477  -2.339
  173    H    ALA  22           HN       ALA  22  10.306  -2.458  -5.180
  174    HA   ALA  22           HA       ALA  22   9.043  -2.647  -7.658
  175    HB1  ALA  22           HB1      ALA  22  11.463  -0.969  -7.062
  176    HB2  ALA  22           HB2      ALA  22   9.836  -0.552  -6.528
  177    HB3  ALA  22           HB3      ALA  22  10.200  -0.652  -8.251
  178    H    GLN  23           HN       GLN  23  12.427  -3.083  -6.834
  179    HA   GLN  23           HA       GLN  23  13.225  -3.790  -9.451
  180    HB2  GLN  23           HB2      GLN  23  15.299  -4.612  -8.431
  181    HB3  GLN  23           HB1      GLN  23  14.852  -3.038  -7.843
  182    HG2  GLN  23           HG2      GLN  23  15.368  -3.915  -5.853
  183    HG3  GLN  23           HG1      GLN  23  13.717  -4.523  -5.947
  184   HE21  GLN  23          HE21      GLN  23  14.144  -6.292  -4.668
  185   HE22  GLN  23          HE22      GLN  23  15.101  -7.628  -5.206
  186    H    SER  24           HN       SER  24  12.002  -5.648  -6.735
  187    HA   SER  24           HA       SER  24  12.784  -8.094  -7.846
  188    HB2  SER  24           HB2      SER  24  11.198  -9.139  -6.201
  189    HB3  SER  24           HB1      SER  24  12.369  -8.037  -5.484
  190    HG   SER  24           HG       SER  24   9.993  -6.858  -6.245
  191    H    ILE  25           HN       ILE  25  10.123  -6.001  -8.459
  192    HA   ILE  25           HA       ILE  25   8.795  -8.099 -10.037
  193    HB   ILE  25           HB       ILE  25   7.401  -6.930  -8.324
  194   HG12  ILE  25          HG12      ILE  25   6.527  -6.416 -11.175
  195   HG13  ILE  25          HG11      ILE  25   6.398  -7.962 -10.344
  196   HG21  ILE  25          HG21      ILE  25   7.958  -4.532 -10.048
  197   HG22  ILE  25          HG22      ILE  25   8.315  -4.740  -8.334
  198   HG23  ILE  25          HG23      ILE  25   6.642  -4.611  -8.878
  199   HD11  ILE  25          HD11      ILE  25   4.852  -6.999  -8.747
  200   HD12  ILE  25          HD12      ILE  25   4.276  -6.759 -10.396
  201   HD13  ILE  25          HD13      ILE  25   5.016  -5.421  -9.517
  202    H    ASP  26           HN       ASP  26  11.030  -5.831 -10.338
  203    HA   ASP  26           HA       ASP  26  12.019  -4.702 -12.005
  204    HB2  ASP  26           HB2      ASP  26  11.622  -6.967 -13.149
  205    HB3  ASP  26           HB1      ASP  26  10.308  -6.163 -14.003
  206    H    ARG  27           HN       ARG  27  10.098  -3.304 -10.786
  207    HA   ARG  27           HA       ARG  27   8.970  -1.721 -13.007
  208    HB2  ARG  27           HB2      ARG  27   7.635  -2.302 -10.351
  209    HB3  ARG  27           HB1      ARG  27   7.029  -1.184 -11.561
  210    HG2  ARG  27           HG2      ARG  27   7.431  -4.121 -12.066
  211    HG3  ARG  27           HG1      ARG  27   5.911  -3.418 -11.514
  212    HD2  ARG  27           HD2      ARG  27   5.990  -1.929 -13.542
  213    HD3  ARG  27           HD1      ARG  27   7.351  -2.898 -14.109
  214    HE   ARG  27           HE       ARG  27   5.591  -4.812 -13.751
  215   HH11  ARG  27          HH21      ARG  27   5.121  -1.649 -15.167
  216   HH12  ARG  27          HH22      ARG  27   3.790  -2.140 -16.157
  217   HH21  ARG  27          HH11      ARG  27   3.823  -5.474 -15.059
  218   HH22  ARG  27          HH12      ARG  27   3.048  -4.324 -16.094
  219    H    THR  28           HN       THR  28   8.647   0.560 -12.459
  220    HA   THR  28           HA       THR  28  10.839   1.624 -10.948
  221    HB   THR  28           HB       THR  28  10.314   2.929 -12.838
  222    HG1  THR  28           HG1      THR  28   9.438   4.917 -11.937
  223   HG21  THR  28          HG21      THR  28   7.428   2.833 -11.976
  224   HG22  THR  28          HG22      THR  28   8.142   2.033 -13.376
  225   HG23  THR  28          HG23      THR  28   8.044   3.793 -13.320
  226    HA   PRO  29           HA       PRO  29   9.231   1.956  -6.832
  227    HB2  PRO  29           HB2      PRO  29   9.856   4.862  -7.212
  228    HB3  PRO  29           HB1      PRO  29  10.200   3.815  -5.829
  229    HG2  PRO  29           HG2      PRO  29  12.105   4.404  -7.598
  230    HG3  PRO  29           HG1      PRO  29  11.989   2.786  -6.883
  231    HD2  PRO  29           HD2      PRO  29  11.355   3.681  -9.633
  232    HD3  PRO  29           HD1      PRO  29  11.826   2.075  -9.046
  233    H    HIS  30           HN       HIS  30   8.230   4.535  -9.096
  234    HA   HIS  30           HA       HIS  30   5.912   5.216  -7.595
  235    HB2  HIS  30           HB2      HIS  30   6.862   5.880 -10.356
  236    HB3  HIS  30           HB1      HIS  30   5.218   6.287  -9.867
  237    HD1  HIS  30           HD1      HIS  30   7.925   8.185 -10.351
  238    HD2  HIS  30           HD2      HIS  30   5.862   7.321  -6.838
  239    HE1  HIS  30           HE1      HIS  30   8.470  10.064  -8.769
  240    HE2  HIS  30           HE2      HIS  30   7.332   9.454  -6.603
  241    H    TRP  31           HN       TRP  31   6.416   3.110 -10.417
  242    HA   TRP  31           HA       TRP  31   3.654   2.454 -10.629
  243    HB2  TRP  31           HB2      TRP  31   5.139   2.121 -12.565
  244    HB3  TRP  31           HB1      TRP  31   6.050   0.913 -11.660
  245    HD1  TRP  31           HD1      TRP  31   4.798  -1.438 -11.163
  246    HE1  TRP  31           HE1      TRP  31   2.885  -2.638 -12.392
  247    HE3  TRP  31           HE3      TRP  31   3.028   2.473 -13.942
  248    HZ2  TRP  31           HZ2      TRP  31   0.904  -2.024 -14.289
  249    HZ3  TRP  31           HZ3      TRP  31   1.118   2.076 -15.443
  250    HH2  TRP  31           HH2      TRP  31   0.080  -0.128 -15.612
  251    H    LEU  32           HN       LEU  32   6.426   1.176  -8.999
  252    HA   LEU  32           HA       LEU  32   5.313  -1.195  -8.039
  253    HB2  LEU  32           HB2      LEU  32   7.715  -0.716  -7.913
  254    HB3  LEU  32           HB1      LEU  32   7.401   0.544  -6.738
  255    HG   LEU  32           HG       LEU  32   8.272  -1.716  -5.884
  256   HD11  LEU  32          HD11      LEU  32   7.151  -1.491  -3.824
  257   HD12  LEU  32          HD12      LEU  32   5.739  -0.762  -4.589
  258   HD13  LEU  32          HD13      LEU  32   7.259   0.130  -4.511
  259   HD21  LEU  32          HD21      LEU  32   6.705  -3.086  -7.226
  260   HD22  LEU  32          HD22      LEU  32   5.381  -2.485  -6.228
  261   HD23  LEU  32          HD23      LEU  32   6.662  -3.454  -5.502
  262    H    ILE  33           HN       ILE  33   5.260   2.076  -6.797
  263    HA   ILE  33           HA       ILE  33   4.041   1.585  -4.341
  264    HB   ILE  33           HB       ILE  33   4.573   3.889  -5.966
  265   HG12  ILE  33          HG12      ILE  33   4.164   4.997  -3.634
  266   HG13  ILE  33          HG11      ILE  33   4.030   3.332  -3.078
  267   HG21  ILE  33          HG21      ILE  33   1.807   3.868  -4.782
  268   HG22  ILE  33          HG22      ILE  33   2.249   4.103  -6.473
  269   HG23  ILE  33          HG23      ILE  33   2.670   5.326  -5.274
  270   HD11  ILE  33          HD11      ILE  33   6.395   4.583  -4.449
  271   HD12  ILE  33          HD12      ILE  33   6.268   2.882  -4.002
  272   HD13  ILE  33          HD13      ILE  33   6.271   4.124  -2.750
  273    H    LYS  34           HN       LYS  34   2.697   2.100  -7.547
  274    HA   LYS  34           HA       LYS  34  -0.042   1.847  -6.969
  275    HB2  LYS  34           HB2      LYS  34   1.437   0.877  -9.433
  276    HB3  LYS  34           HB1      LYS  34  -0.282   1.222  -9.334
  277    HG2  LYS  34           HG2      LYS  34   0.197   3.581  -8.990
  278    HG3  LYS  34           HG1      LYS  34   1.930   3.244  -9.039
  279    HD2  LYS  34           HD2      LYS  34   1.666   2.375 -11.337
  280    HD3  LYS  34           HD1      LYS  34  -0.045   2.800 -11.281
  281    HE2  LYS  34           HE2      LYS  34   0.429   5.109 -11.192
  282    HE3  LYS  34           HE1      LYS  34   2.128   4.825 -10.818
  283    HZ1  LYS  34           HZ1      LYS  34   1.722   5.510 -13.144
  284    HZ2  LYS  34           HZ2      LYS  34   0.842   4.091 -13.393
  285    HZ3  LYS  34           HZ3      LYS  34   2.487   4.008 -13.025
  286    H    GLN  35           HN       GLN  35   2.411  -0.540  -7.843
  287    HA   GLN  35           HA       GLN  35   0.702  -2.796  -7.807
  288    HB2  GLN  35           HB2      GLN  35   3.697  -2.537  -7.633
  289    HB3  GLN  35           HB1      GLN  35   2.869  -4.084  -7.687
  290    HG2  GLN  35           HG2      GLN  35   2.710  -1.954  -9.803
  291    HG3  GLN  35           HG1      GLN  35   3.736  -3.383  -9.869
  292   HE21  GLN  35          HE21      GLN  35   1.670  -5.066  -8.629
  293   HE22  GLN  35          HE22      GLN  35   0.496  -5.356  -9.859
  294    H    ALA  36           HN       ALA  36   3.134  -1.693  -5.440
  295    HA   ALA  36           HA       ALA  36   2.942  -3.680  -3.590
  296    HB1  ALA  36           HB1      ALA  36   4.553  -1.959  -3.306
  297    HB2  ALA  36           HB2      ALA  36   3.515  -1.945  -1.880
  298    HB3  ALA  36           HB3      ALA  36   3.300  -0.729  -3.140
  299    H    ILE  37           HN       ILE  37   0.717  -0.948  -3.964
  300    HA   ILE  37           HA       ILE  37  -0.824  -1.934  -1.727
  301    HB   ILE  37           HB       ILE  37  -0.468   0.502  -2.131
  302   HG12  ILE  37          HG12      ILE  37  -2.870   1.130  -1.686
  303   HG13  ILE  37          HG11      ILE  37  -3.281  -0.560  -1.952
  304   HG21  ILE  37          HG21      ILE  37  -2.522   0.234  -4.308
  305   HG22  ILE  37          HG22      ILE  37  -0.791   0.402  -4.600
  306   HG23  ILE  37          HG23      ILE  37  -1.678   1.694  -3.791
  307   HD11  ILE  37          HD11      ILE  37  -2.773  -1.023   0.142
  308   HD12  ILE  37          HD12      ILE  37  -2.412   0.680   0.419
  309   HD13  ILE  37          HD13      ILE  37  -1.133  -0.421  -0.093
  310    H    PHE  38           HN       PHE  38  -1.392  -1.635  -5.249
  311    HA   PHE  38           HA       PHE  38  -3.984  -2.859  -5.020
  312    HB2  PHE  38           HB2      PHE  38  -4.228  -1.826  -6.989
  313    HB3  PHE  38           HB1      PHE  38  -2.513  -1.454  -7.040
  314    HD1  PHE  38           HD2      PHE  38  -4.908  -4.218  -7.806
  315    HD2  PHE  38           HD1      PHE  38  -1.220  -2.304  -8.726
  316    HE1  PHE  38           HE2      PHE  38  -4.631  -5.694  -9.755
  317    HE2  PHE  38           HE1      PHE  38  -0.941  -3.772 -10.677
  318    HZ   PHE  38           HZ       PHE  38  -2.645  -5.471 -11.193
  319    H    ASN  39           HN       ASN  39  -0.760  -3.933  -5.883
  320    HA   ASN  39           HA       ASN  39  -1.480  -6.540  -6.703
  321    HB2  ASN  39           HB2      ASN  39   0.795  -5.302  -7.014
  322    HB3  ASN  39           HB1      ASN  39   1.150  -5.887  -5.396
  323   HD21  ASN  39          HD21      ASN  39   2.694  -6.545  -7.588
  324   HD22  ASN  39          HD22      ASN  39   2.515  -8.230  -7.928
  325    H    TYR  40           HN       TYR  40  -0.901  -4.941  -3.628
  326    HA   TYR  40           HA       TYR  40  -0.734  -7.230  -2.006
  327    HB2  TYR  40           HB2      TYR  40  -0.270  -5.122  -0.969
  328    HB3  TYR  40           HB1      TYR  40  -1.816  -4.454  -1.481
  329    HD1  TYR  40           HD1      TYR  40  -0.552  -7.339   0.547
  330    HD2  TYR  40           HD2      TYR  40  -3.443  -4.245   0.144
  331    HE1  TYR  40           HE1      TYR  40  -1.536  -7.990   2.696
  332    HE2  TYR  40           HE2      TYR  40  -4.438  -4.890   2.302
  333    HH   TYR  40           HH       TYR  40  -4.548  -6.740   3.807
  334    H    LEU  41           HN       LEU  41  -3.383  -5.297  -3.203
  335    HA   LEU  41           HA       LEU  41  -5.459  -6.766  -2.006
  336    HB2  LEU  41           HB2      LEU  41  -5.487  -5.003  -4.445
  337    HB3  LEU  41           HB1      LEU  41  -6.917  -5.606  -3.628
  338    HG   LEU  41           HG       LEU  41  -4.863  -3.736  -2.435
  339   HD11  LEU  41          HD11      LEU  41  -6.346  -2.778  -4.184
  340   HD12  LEU  41          HD12      LEU  41  -6.547  -2.053  -2.590
  341   HD13  LEU  41          HD13      LEU  41  -7.729  -3.218  -3.185
  342   HD21  LEU  41          HD21      LEU  41  -5.726  -5.092  -0.682
  343   HD22  LEU  41          HD22      LEU  41  -7.371  -4.957  -1.302
  344   HD23  LEU  41          HD23      LEU  41  -6.572  -3.547  -0.607
  345    H    GLU  42           HN       GLU  42  -3.936  -6.978  -5.215
  346    HA   GLU  42           HA       GLU  42  -5.720  -8.916  -6.225
  347    HB2  GLU  42           HB2      GLU  42  -4.512  -8.851  -8.140
  348    HB3  GLU  42           HB1      GLU  42  -3.857  -7.403  -7.399
  349    HG2  GLU  42           HG2      GLU  42  -1.873  -8.292  -7.843
  350    HG3  GLU  42           HG1      GLU  42  -2.175  -9.332  -6.455
  351    H    LYS  43           HN       LYS  43  -2.764  -9.250  -4.323
  352    HA   LYS  43           HA       LYS  43  -2.480 -12.033  -4.724
  353    HB2  LYS  43           HB2      LYS  43  -1.541 -10.271  -2.466
  354    HB3  LYS  43           HB1      LYS  43  -1.186 -11.989  -2.543
  355    HG2  LYS  43           HG2      LYS  43  -0.001 -11.648  -4.656
  356    HG3  LYS  43           HG1      LYS  43  -0.356  -9.920  -4.568
  357    HD2  LYS  43           HD2      LYS  43   0.894  -9.771  -2.468
  358    HD3  LYS  43           HD1      LYS  43   1.237 -11.498  -2.547
  359    HE2  LYS  43           HE2      LYS  43   3.169 -10.323  -3.321
  360    HE3  LYS  43           HE1      LYS  43   2.408 -11.099  -4.708
  361    HZ1  LYS  43           HZ1      LYS  43   1.411  -8.471  -4.295
  362    HZ2  LYS  43           HZ2      LYS  43   2.102  -9.152  -5.677
  363    HZ3  LYS  43           HZ3      LYS  43   3.095  -8.461  -4.488
  364    H    LEU  44           HN       LEU  44  -4.270 -10.155  -2.331
  365    HA   LEU  44           HA       LEU  44  -5.115 -12.570  -0.992
  366    HB2  LEU  44           HB2      LEU  44  -6.491 -11.008   0.405
  367    HB3  LEU  44           HB1      LEU  44  -4.762 -10.754   0.465
  368    HG   LEU  44           HG       LEU  44  -5.372  -8.969  -1.438
  369   HD11  LEU  44          HD11      LEU  44  -7.782  -9.544  -1.299
  370   HD12  LEU  44          HD12      LEU  44  -7.432  -7.848  -0.963
  371   HD13  LEU  44          HD13      LEU  44  -7.781  -8.957   0.364
  372   HD21  LEU  44          HD21      LEU  44  -5.555  -8.609   1.546
  373   HD22  LEU  44          HD22      LEU  44  -5.438  -7.284   0.389
  374   HD23  LEU  44          HD23      LEU  44  -4.118  -8.445   0.537
  375    H    GLU  45           HN       GLU  45  -6.345 -10.371  -3.386
  376    HA   GLU  45           HA       GLU  45  -9.028 -11.477  -3.307
  377    HB2  GLU  45           HB2      GLU  45  -8.567  -9.034  -3.725
  378    HB3  GLU  45           HB1      GLU  45  -7.842  -9.495  -5.255
  379    HG2  GLU  45           HG2      GLU  45  -9.967 -10.382  -6.013
  380    HG3  GLU  45           HG1      GLU  45 -10.705  -9.951  -4.471
  381    H1   MET  46           HT1      MET  46   3.841   1.164  10.665
  382    H2   MET  46           HT2      MET  46   2.317   1.894  10.598
  383    H3   MET  46           HT3      MET  46   2.444   0.232  10.882
  384    HA   MET  46           HA       MET  46   1.929   1.396  12.917
  385    HB2  MET  46           HB2      MET  46   4.696   0.211  12.699
  386    HB3  MET  46           HB1      MET  46   3.963   0.636  14.242
  387    HG2  MET  46           HG2      MET  46   2.159  -0.921  13.854
  388    HG3  MET  46           HG1      MET  46   2.791  -1.296  12.253
  389    HE1  MET  46           HE1      MET  46   2.523  -3.808  12.952
  390    HE2  MET  46           HE2      MET  46   2.125  -3.509  14.644
  391    HE3  MET  46           HE3      MET  46   3.446  -4.600  14.229
  392    H    ALA  47           HN       ALA  47   5.227   2.270  11.862
  393    HA   ALA  47           HA       ALA  47   4.923   4.862  13.217
  394    HB1  ALA  47           HB1      ALA  47   7.413   3.538  12.111
  395    HB2  ALA  47           HB2      ALA  47   6.911   3.490  13.801
  396    HB3  ALA  47           HB3      ALA  47   7.350   5.027  13.055
  397    H    THR  48           HN       THR  48   3.694   3.958  10.754
  398    HA   THR  48           HA       THR  48   4.968   4.956   8.459
  399    HB   THR  48           HB       THR  48   2.669   4.826   7.456
  400    HG1  THR  48           HG1      THR  48   1.601   5.273   9.495
  401   HG21  THR  48          HG21      THR  48   2.437   2.386   7.658
  402   HG22  THR  48          HG22      THR  48   3.577   2.398   9.004
  403   HG23  THR  48          HG23      THR  48   4.111   2.868   7.390
  404    H    THR  49           HN       THR  49   5.081   6.909   7.655
  405    HA   THR  49           HA       THR  49   3.596   9.083   8.945
  406    HB   THR  49           HB       THR  49   5.927   9.287   7.020
  407    HG1  THR  49           HG1      THR  49   6.263   8.178   9.174
  408   HG21  THR  49          HG21      THR  49   4.757  11.273   8.976
  409   HG22  THR  49          HG22      THR  49   4.576  11.325   7.223
  410   HG23  THR  49          HG23      THR  49   6.167  11.543   7.952
  411    H    THR  50           HN       THR  50   2.405  10.563   7.622
  412    HA   THR  50           HA       THR  50   1.100   9.312   5.429
  413    HB   THR  50           HB       THR  50   0.966  12.215   6.266
  414    HG1  THR  50           HG1      THR  50   0.437  10.665   7.947
  415   HG21  THR  50          HG21      THR  50   0.026  11.754   4.036
  416   HG22  THR  50          HG22      THR  50  -1.231  12.181   5.196
  417   HG23  THR  50          HG23      THR  50  -0.994  10.496   4.733
  418    H    LEU  51           HN       LEU  51   2.032   9.021   3.558
  419    HA   LEU  51           HA       LEU  51   3.618  11.193   2.357
  420    HB2  LEU  51           HB2      LEU  51   4.120   8.239   1.960
  421    HB3  LEU  51           HB1      LEU  51   5.093   9.567   1.364
  422    HG   LEU  51           HG       LEU  51   4.800   8.750   4.259
  423   HD11  LEU  51          HD11      LEU  51   7.341   8.701   2.696
  424   HD12  LEU  51          HD12      LEU  51   6.201   7.366   2.551
  425   HD13  LEU  51          HD13      LEU  51   6.882   7.776   4.126
  426   HD21  LEU  51          HD21      LEU  51   5.106  11.110   4.202
  427   HD22  LEU  51          HD22      LEU  51   6.349  10.979   2.958
  428   HD23  LEU  51          HD23      LEU  51   6.669  10.389   4.589
  429    H    GLY  52           HN       GLY  52   3.549  11.231   0.015
  430    HA2  GLY  52           HA2      GLY  52   0.939  10.701  -1.009
  431    HA3  GLY  52           HA1      GLY  52   2.305  11.331  -1.919
  432    H    VAL  53           HN       VAL  53   0.216   8.821  -1.688
  433    HA   VAL  53           HA       VAL  53   2.033   7.014  -3.139
  434    HB   VAL  53           HB       VAL  53  -0.118   6.048  -1.238
  435   HG11  VAL  53          HG11      VAL  53   2.069   4.662  -2.763
  436   HG12  VAL  53          HG12      VAL  53   0.332   4.357  -2.818
  437   HG13  VAL  53          HG13      VAL  53   1.260   3.921  -1.383
  438   HG21  VAL  53          HG21      VAL  53   1.533   7.166   0.098
  439   HG22  VAL  53          HG22      VAL  53   2.839   6.347  -0.757
  440   HG23  VAL  53          HG23      VAL  53   1.748   5.424   0.276
  441    H    LYS  54           HN       LYS  54   0.464   5.268  -4.301
  442    HA   LYS  54           HA       LYS  54  -1.652   6.888  -5.538
  443    HB2  LYS  54           HB2      LYS  54   0.137   4.797  -6.779
  444    HB3  LYS  54           HB1      LYS  54  -1.189   5.605  -7.609
  445    HG2  LYS  54           HG2      LYS  54  -0.112   7.762  -7.263
  446    HG3  LYS  54           HG1      LYS  54   1.218   6.966  -6.424
  447    HD2  LYS  54           HD2      LYS  54   1.766   5.739  -8.468
  448    HD3  LYS  54           HD1      LYS  54   0.432   6.540  -9.303
  449    HE2  LYS  54           HE2      LYS  54   2.898   7.457  -9.475
  450    HE3  LYS  54           HE1      LYS  54   1.517   8.552  -9.402
  451    HZ1  LYS  54           HZ1      LYS  54   3.088   7.724  -7.022
  452    HZ2  LYS  54           HZ2      LYS  54   1.895   8.921  -7.094
  453    HZ3  LYS  54           HZ3      LYS  54   3.369   9.151  -7.889
  454    H    LEU  55           HN       LEU  55  -3.645   6.150  -5.564
  455    HA   LEU  55           HA       LEU  55  -4.178   3.300  -5.080
  456    HB2  LEU  55           HB2      LEU  55  -5.141   5.653  -3.497
  457    HB3  LEU  55           HB1      LEU  55  -6.165   4.243  -3.653
  458    HG   LEU  55           HG       LEU  55  -3.355   3.985  -2.624
  459   HD11  LEU  55          HD11      LEU  55  -4.423   5.690  -1.253
  460   HD12  LEU  55          HD12      LEU  55  -4.274   4.180  -0.354
  461   HD13  LEU  55          HD13      LEU  55  -5.832   4.652  -1.034
  462   HD21  LEU  55          HD21      LEU  55  -4.479   2.085  -1.407
  463   HD22  LEU  55          HD22      LEU  55  -4.381   1.912  -3.159
  464   HD23  LEU  55          HD23      LEU  55  -5.900   2.394  -2.402
  465    H    ASP  56           HN       ASP  56  -6.072   2.541  -6.014
  466    HA   ASP  56           HA       ASP  56  -7.239   4.216  -8.105
  467    HB2  ASP  56           HB2      ASP  56  -7.862   1.323  -7.388
  468    HB3  ASP  56           HB1      ASP  56  -8.413   2.172  -8.819
  469    H    ASP  57           HN       ASP  57  -9.713   4.285  -8.187
  470    HA   ASP  57           HA       ASP  57 -10.821   5.125  -5.767
  471    HB2  ASP  57           HB2      ASP  57 -11.942   4.401  -8.424
  472    HB3  ASP  57           HB1      ASP  57 -13.070   4.406  -7.075
  473    HA   PRO  58           HA       PRO  58 -12.892   0.735  -5.371
  474    HB2  PRO  58           HB2      PRO  58 -11.666  -1.287  -6.745
  475    HB3  PRO  58           HB1      PRO  58 -13.075  -0.401  -7.340
  476    HG2  PRO  58           HG2      PRO  58 -10.180  -0.011  -7.988
  477    HG3  PRO  58           HG1      PRO  58 -11.582  -0.007  -9.077
  478    HD2  PRO  58           HD2      PRO  58 -10.447   2.276  -8.250
  479    HD3  PRO  58           HD1      PRO  58 -12.203   2.142  -8.471
  480    H    THR  59           HN       THR  59  -9.365   1.099  -5.712
  481    HA   THR  59           HA       THR  59  -8.791  -1.067  -3.951
  482    HB   THR  59           HB       THR  59  -6.533  -0.180  -3.731
  483    HG1  THR  59           HG1      THR  59  -6.169   1.854  -4.030
  484   HG21  THR  59          HG21      THR  59  -7.825  -0.703  -6.287
  485   HG22  THR  59          HG22      THR  59  -6.319  -1.341  -5.627
  486   HG23  THR  59          HG23      THR  59  -6.332   0.223  -6.439
  487    H    ARG  60           HN       ARG  60  -9.141   2.445  -3.476
  488    HA   ARG  60           HA       ARG  60  -8.488   2.430  -0.744
  489    HB2  ARG  60           HB2      ARG  60  -8.649   4.507  -2.029
  490    HB3  ARG  60           HB1      ARG  60 -10.386   4.266  -2.212
  491    HG2  ARG  60           HG2      ARG  60 -10.762   4.553   0.126
  492    HG3  ARG  60           HG1      ARG  60  -9.030   4.548   0.459
  493    HD2  ARG  60           HD2      ARG  60 -10.342   6.605  -1.297
  494    HD3  ARG  60           HD1      ARG  60 -10.181   6.807   0.448
  495    HE   ARG  60           HE       ARG  60  -8.086   6.975  -1.536
  496   HH11  ARG  60          HH21      ARG  60  -8.839   6.546   1.852
  497   HH12  ARG  60          HH22      ARG  60  -7.284   7.066   2.402
  498   HH21  ARG  60          HH11      ARG  60  -6.014   7.654  -0.813
  499   HH22  ARG  60          HH12      ARG  60  -5.669   7.702   0.885
  500    H    GLU  61           HN       GLU  61 -11.574   1.994  -2.425
  501    HA   GLU  61           HA       GLU  61 -13.117   1.649  -0.070
  502    HB2  GLU  61           HB2      GLU  61 -13.581   0.692  -2.902
  503    HB3  GLU  61           HB1      GLU  61 -14.774   0.573  -1.614
  504    HG2  GLU  61           HG2      GLU  61 -13.626   3.080  -2.815
  505    HG3  GLU  61           HG1      GLU  61 -15.284   2.493  -2.931
  506    H    ARG  62           HN       ARG  62 -11.376  -0.567  -2.188
  507    HA   ARG  62           HA       ARG  62 -12.168  -2.979  -0.977
  508    HB2  ARG  62           HB2      ARG  62 -11.050  -2.920  -3.168
  509    HB3  ARG  62           HB1      ARG  62  -9.578  -2.329  -2.407
  510    HG2  ARG  62           HG2      ARG  62  -9.395  -4.695  -2.884
  511    HG3  ARG  62           HG1      ARG  62  -9.407  -4.423  -1.138
  512    HD2  ARG  62           HD2      ARG  62 -11.799  -4.975  -1.085
  513    HD3  ARG  62           HD1      ARG  62 -11.759  -5.280  -2.820
  514    HE   ARG  62           HE       ARG  62 -10.706  -7.291  -2.435
  515   HH11  ARG  62          HH21      ARG  62 -10.732  -5.406   0.523
  516   HH12  ARG  62          HH22      ARG  62 -10.422  -6.769   1.549
  517   HH21  ARG  62          HH11      ARG  62 -10.311  -9.096  -1.082
  518   HH22  ARG  62          HH12      ARG  62 -10.183  -8.875   0.633
  519    H    LEU  63           HN       LEU  63  -9.582  -0.701  -0.306
  520    HA   LEU  63           HA       LEU  63  -8.232  -2.163   1.660
  521    HB2  LEU  63           HB2      LEU  63  -8.341   0.647   0.801
  522    HB3  LEU  63           HB1      LEU  63  -7.944   0.434   2.495
  523    HG   LEU  63           HG       LEU  63  -6.104  -1.154   1.737
  524   HD11  LEU  63          HD11      LEU  63  -7.020  -1.507  -0.539
  525   HD12  LEU  63          HD12      LEU  63  -5.321  -1.035  -0.506
  526   HD13  LEU  63          HD13      LEU  63  -6.557   0.149  -0.931
  527   HD21  LEU  63          HD21      LEU  63  -5.530   1.014   2.528
  528   HD22  LEU  63          HD22      LEU  63  -6.029   1.764   1.012
  529   HD23  LEU  63          HD23      LEU  63  -4.605   0.724   1.054
  530    H    LYS  64           HN       LYS  64 -11.104  -0.102   1.808
  531    HA   LYS  64           HA       LYS  64 -11.387  -0.080   4.602
  532    HB2  LYS  64           HB2      LYS  64 -12.727   1.313   2.978
  533    HB3  LYS  64           HB1      LYS  64 -13.660  -0.134   2.614
  534    HG2  LYS  64           HG2      LYS  64 -14.269  -0.263   5.029
  535    HG3  LYS  64           HG1      LYS  64 -13.473   1.294   5.257
  536    HD2  LYS  64           HD2      LYS  64 -15.801   0.757   3.413
  537    HD3  LYS  64           HD1      LYS  64 -15.896   1.544   4.988
  538    HE2  LYS  64           HE2      LYS  64 -14.496   2.549   2.514
  539    HE3  LYS  64           HE1      LYS  64 -15.916   3.240   3.296
  540    HZ1  LYS  64           HZ1      LYS  64 -14.293   3.414   5.311
  541    HZ2  LYS  64           HZ2      LYS  64 -14.274   4.587   4.094
  542    HZ3  LYS  64           HZ3      LYS  64 -13.103   3.367   4.109
  543    H    ALA  65           HN       ALA  65 -12.401  -2.324   2.143
  544    HA   ALA  65           HA       ALA  65 -13.792  -4.132   3.814
  545    HB1  ALA  65           HB1      ALA  65 -12.450  -4.551   1.143
  546    HB2  ALA  65           HB2      ALA  65 -14.158  -4.228   1.443
  547    HB3  ALA  65           HB3      ALA  65 -13.448  -5.761   1.949
  548    H    ALA  66           HN       ALA  66 -10.432  -3.754   2.886
  549    HA   ALA  66           HA       ALA  66  -9.491  -6.166   4.075
  550    HB1  ALA  66           HB1      ALA  66  -7.280  -5.254   3.785
  551    HB2  ALA  66           HB2      ALA  66  -7.933  -3.632   3.561
  552    HB3  ALA  66           HB3      ALA  66  -8.235  -4.878   2.350
  553    H    ALA  67           HN       ALA  67 -10.007  -2.881   5.143
  554    HA   ALA  67           HA       ALA  67  -8.737  -2.944   7.625
  555    HB1  ALA  67           HB1      ALA  67 -11.246  -1.418   6.985
  556    HB2  ALA  67           HB2      ALA  67  -9.643  -0.923   6.444
  557    HB3  ALA  67           HB3      ALA  67 -10.005  -1.002   8.168
  558    H    GLN  68           HN       GLN  68 -12.097  -3.556   6.817
  559    HA   GLN  68           HA       GLN  68 -12.874  -4.263   9.434
  560    HB2  GLN  68           HB2      GLN  68 -14.893  -5.204   8.423
  561    HB3  GLN  68           HB1      GLN  68 -14.514  -3.636   7.775
  562    HG2  GLN  68           HG2      GLN  68 -14.965  -4.614   5.816
  563    HG3  GLN  68           HG1      GLN  68 -13.290  -5.145   5.951
  564   HE21  GLN  68          HE21      GLN  68 -13.544  -7.010   4.799
  565   HE22  GLN  68          HE22      GLN  68 -14.470  -8.360   5.364
  566    H    SER  69           HN       SER  69 -11.525  -6.114   6.771
  567    HA   SER  69           HA       SER  69 -12.190  -8.575   7.928
  568    HB2  SER  69           HB2      SER  69 -10.570  -9.579   6.307
  569    HB3  SER  69           HB1      SER  69 -11.751  -8.512   5.556
  570    HG   SER  69           HG       SER  69  -9.394  -7.301   6.355
  571    H    ILE  70           HN       ILE  70  -9.644  -6.330   8.502
  572    HA   ILE  70           HA       ILE  70  -8.218  -8.317  10.137
  573    HB   ILE  70           HB       ILE  70  -6.884  -7.130   8.389
  574   HG12  ILE  70          HG12      ILE  70  -6.032  -6.509  11.226
  575   HG13  ILE  70          HG11      ILE  70  -5.825  -8.063  10.426
  576   HG21  ILE  70          HG21      ILE  70  -7.554  -4.719  10.052
  577   HG22  ILE  70          HG22      ILE  70  -7.897  -4.987   8.343
  578   HG23  ILE  70          HG23      ILE  70  -6.233  -4.764   8.885
  579   HD11  ILE  70          HD11      ILE  70  -4.331  -7.053   8.807
  580   HD12  ILE  70          HD12      ILE  70  -3.767  -6.752  10.450
  581   HD13  ILE  70          HD13      ILE  70  -4.575  -5.471   9.547
  582    H    ASP  71           HN       ASP  71 -10.570  -6.159  10.403
  583    HA   ASP  71           HA       ASP  71 -11.595  -5.041  12.062
  584    HB2  ASP  71           HB2      ASP  71 -11.054  -7.257  13.251
  585    HB3  ASP  71           HB1      ASP  71  -9.773  -6.361  14.061
  586    HA   ARG  72           HA       ARG  72  -8.676  -1.891  12.939
  587    HB2  ARG  72           HB2      ARG  72  -7.324  -2.492  10.298
  588    HB3  ARG  72           HB1      ARG  72  -6.765  -1.312  11.471
  589    HG2  ARG  72           HG2      ARG  72  -7.027  -4.249  12.065
  590    HG3  ARG  72           HG1      ARG  72  -5.545  -3.495  11.478
  591    HD2  ARG  72           HD2      ARG  72  -5.676  -1.953  13.466
  592    HD3  ARG  72           HD1      ARG  72  -6.983  -2.970  14.073
  593    HE   ARG  72           HE       ARG  72  -5.130  -4.806  13.737
  594   HH11  ARG  72          HH21      ARG  72  -4.823  -1.599  15.099
  595   HH12  ARG  72          HH22      ARG  72  -3.457  -1.998  16.083
  596   HH21  ARG  72          HH11      ARG  72  -3.300  -5.339  15.029
  597   HH22  ARG  72          HH12      ARG  72  -2.585  -4.127  16.040
  598    H    THR  73           HN       THR  73  -8.507   0.376  12.368
  599    HA   THR  73           HA       THR  73 -10.732   1.298  10.824
  600    HB   THR  73           HB       THR  73 -10.295   2.671  12.674
  601    HG1  THR  73           HG1      THR  73  -9.764   4.662  11.796
  602   HG21  THR  73          HG21      THR  73  -7.385   2.649  11.890
  603   HG22  THR  73          HG22      THR  73  -8.112   1.852  13.285
  604   HG23  THR  73          HG23      THR  73  -8.064   3.613  13.200
  605    HA   PRO  74           HA       PRO  74  -9.139   1.623   6.697
  606    HB2  PRO  74           HB2      PRO  74  -9.927   4.497   7.013
  607    HB3  PRO  74           HB1      PRO  74 -10.209   3.402   5.654
  608    HG2  PRO  74           HG2      PRO  74 -12.144   3.925   7.415
  609    HG3  PRO  74           HG1      PRO  74 -11.945   2.306   6.723
  610    HD2  PRO  74           HD2      PRO  74 -11.374   3.265   9.462
  611    HD3  PRO  74           HD1      PRO  74 -11.737   1.626   8.890
  612    H    HIS  75           HN       HIS  75  -8.283   4.280   8.922
  613    HA   HIS  75           HA       HIS  75  -6.004   5.082   7.417
  614    HB2  HIS  75           HB2      HIS  75  -6.992   5.700  10.177
  615    HB3  HIS  75           HB1      HIS  75  -5.374   6.198   9.685
  616    HD1  HIS  75           HD1      HIS  75  -8.139   7.966  10.196
  617    HD2  HIS  75           HD2      HIS  75  -6.114   7.172   6.644
  618    HE1  HIS  75           HE1      HIS  75  -8.814   9.800   8.614
  619    HE2  HIS  75           HE2      HIS  75  -7.668   9.254   6.439
  620    H    TRP  76           HN       TRP  76  -6.401   2.990  10.266
  621    HA   TRP  76           HA       TRP  76  -3.607   2.483  10.489
  622    HB2  TRP  76           HB2      TRP  76  -5.075   2.116  12.433
  623    HB3  TRP  76           HB1      TRP  76  -5.921   0.844  11.553
  624    HD1  TRP  76           HD1      TRP  76  -4.553  -1.451  11.111
  625    HE1  TRP  76           HE1      TRP  76  -2.584  -2.525  12.368
  626    HE3  TRP  76           HE3      TRP  76  -2.984   2.608  13.797
  627    HZ2  TRP  76           HZ2      TRP  76  -0.637  -1.768  14.249
  628    HZ3  TRP  76           HZ3      TRP  76  -1.058   2.342  15.306
  629    HH2  TRP  76           HH2      TRP  76   0.089   0.199  15.527
  630    H    LEU  77           HN       LEU  77  -6.310   1.035   8.886
  631    HA   LEU  77           HA       LEU  77  -5.075  -1.294   7.973
  632    HB2  LEU  77           HB2      LEU  77  -7.500  -0.941   7.841
  633    HB3  LEU  77           HB1      LEU  77  -7.252   0.308   6.638
  634    HG   LEU  77           HG       LEU  77  -8.007  -2.010   5.834
  635   HD11  LEU  77          HD11      LEU  77  -6.896  -1.774   3.770
  636   HD12  LEU  77          HD12      LEU  77  -5.524  -0.957   4.518
  637   HD13  LEU  77          HD13      LEU  77  -7.088  -0.147   4.421
  638   HD21  LEU  77          HD21      LEU  77  -6.374  -3.271   7.204
  639   HD22  LEU  77          HD22      LEU  77  -5.080  -2.625   6.194
  640   HD23  LEU  77          HD23      LEU  77  -6.310  -3.673   5.488
  641    H    ILE  78           HN       ILE  78  -5.191   1.951   6.665
  642    HA   ILE  78           HA       ILE  78  -3.945   1.473   4.219
  643    HB   ILE  78           HB       ILE  78  -4.597   3.780   5.796
  644   HG12  ILE  78          HG12      ILE  78  -4.240   4.862   3.442
  645   HG13  ILE  78          HG11      ILE  78  -4.018   3.195   2.920
  646   HG21  ILE  78          HG21      ILE  78  -1.832   3.877   4.617
  647   HG22  ILE  78          HG22      ILE  78  -2.289   4.122   6.302
  648   HG23  ILE  78          HG23      ILE  78  -2.768   5.298   5.078
  649   HD11  ILE  78          HD11      ILE  78  -6.449   4.349   4.259
  650   HD12  ILE  78          HD12      ILE  78  -6.232   2.648   3.848
  651   HD13  ILE  78          HD13      ILE  78  -6.296   3.863   2.571
  652    H    LYS  79           HN       LYS  79  -2.637   2.128   7.412
  653    HA   LYS  79           HA       LYS  79   0.112   2.002   6.844
  654    HB2  LYS  79           HB2      LYS  79  -1.325   1.017   9.329
  655    HB3  LYS  79           HB1      LYS  79   0.376   1.440   9.226
  656    HG2  LYS  79           HG2      LYS  79  -0.212   3.765   8.820
  657    HG3  LYS  79           HG1      LYS  79  -1.927   3.349   8.877
  658    HD2  LYS  79           HD2      LYS  79  -1.636   2.568  11.199
  659    HD3  LYS  79           HD1      LYS  79   0.060   3.048  11.134
  660    HE2  LYS  79           HE2      LYS  79  -0.489   5.336  10.980
  661    HE3  LYS  79           HE1      LYS  79  -2.174   4.987  10.601
  662    HZ1  LYS  79           HZ1      LYS  79  -1.893   5.747  12.887
  663    HZ2  LYS  79           HZ2      LYS  79  -0.856   4.452  13.211
  664    HZ3  LYS  79           HZ3      LYS  79  -2.480   4.161  12.844
  665    H    GLN  80           HN       GLN  80  -2.211  -0.498   7.768
  666    HA   GLN  80           HA       GLN  80  -0.377  -2.655   7.772
  667    HB2  GLN  80           HB2      GLN  80  -3.383  -2.582   7.598
  668    HB3  GLN  80           HB1      GLN  80  -2.458  -4.071   7.710
  669    HG2  GLN  80           HG2      GLN  80  -2.424  -1.857   9.743
  670    HG3  GLN  80           HG1      GLN  80  -3.380  -3.330   9.864
  671   HE21  GLN  80          HE21      GLN  80  -1.237  -4.963   8.694
  672   HE22  GLN  80          HE22      GLN  80  -0.060  -5.154   9.940
  673    H    ALA  81           HN       ALA  81  -2.862  -1.721   5.389
  674    HA   ALA  81           HA       ALA  81  -2.578  -3.742   3.585
  675    HB1  ALA  81           HB1      ALA  81  -4.273  -2.112   3.264
  676    HB2  ALA  81           HB2      ALA  81  -3.238  -2.075   1.837
  677    HB3  ALA  81           HB3      ALA  81  -3.085  -0.824   3.071
  678    H    ILE  82           HN       ILE  82  -0.494  -0.895   3.897
  679    HA   ILE  82           HA       ILE  82   1.097  -1.851   1.681
  680    HB   ILE  82           HB       ILE  82   0.616   0.572   2.030
  681   HG12  ILE  82          HG12      ILE  82   2.984   1.313   1.574
  682   HG13  ILE  82          HG11      ILE  82   3.482  -0.347   1.880
  683   HG21  ILE  82          HG21      ILE  82   2.675   0.459   4.215
  684   HG22  ILE  82          HG22      ILE  82   0.937   0.543   4.501
  685   HG23  ILE  82          HG23      ILE  82   1.758   1.862   3.664
  686   HD11  ILE  82          HD11      ILE  82   3.003  -0.884  -0.204
  687   HD12  ILE  82          HD12      ILE  82   2.557   0.791  -0.521
  688   HD13  ILE  82          HD13      ILE  82   1.334  -0.361   0.014
  689    H    PHE  83           HN       PHE  83   1.643  -1.447   5.196
  690    HA   PHE  83           HA       PHE  83   4.294  -2.542   4.995
  691    HB2  PHE  83           HB2      PHE  83   4.480  -1.454   6.941
  692    HB3  PHE  83           HB1      PHE  83   2.748  -1.173   6.984
  693    HD1  PHE  83           HD2      PHE  83   5.284  -3.793   7.804
  694    HD2  PHE  83           HD1      PHE  83   1.502  -2.054   8.690
  695    HE1  PHE  83           HE2      PHE  83   5.084  -5.242   9.782
  696    HE2  PHE  83           HE1      PHE  83   1.300  -3.495  10.670
  697    HZ   PHE  83           HZ       PHE  83   3.089  -5.093  11.217
  698    H    ASN  84           HN       ASN  84   1.129  -3.765   5.890
  699    HA   ASN  84           HA       ASN  84   1.998  -6.312   6.758
  700    HB2  ASN  84           HB2      ASN  84  -0.338  -5.195   7.070
  701    HB3  ASN  84           HB1      ASN  84  -0.678  -5.828   5.466
  702   HD21  ASN  84          HD21      ASN  84  -2.087  -6.498   7.814
  703   HD22  ASN  84          HD22      ASN  84  -1.834  -8.176   8.136
  704    H    TYR  85           HN       TYR  85   1.330  -4.807   3.655
  705    HA   TYR  85           HA       TYR  85   1.274  -7.135   2.079
  706    HB2  TYR  85           HB2      TYR  85   0.708  -5.070   1.000
  707    HB3  TYR  85           HB1      TYR  85   2.222  -4.321   1.496
  708    HD1  TYR  85           HD1      TYR  85   1.086  -7.299  -0.469
  709    HD2  TYR  85           HD2      TYR  85   3.841  -4.076  -0.136
  710    HE1  TYR  85           HE1      TYR  85   2.095  -7.953  -2.605
  711    HE2  TYR  85           HE2      TYR  85   4.862  -4.724  -2.281
  712    HH   TYR  85           HH       TYR  85   5.058  -6.717  -3.710
  713    H    LEU  86           HN       LEU  86   3.823  -5.047   3.233
  714    HA   LEU  86           HA       LEU  86   5.971  -6.430   2.059
  715    HB2  LEU  86           HB2      LEU  86   5.909  -4.619   4.460
  716    HB3  LEU  86           HB1      LEU  86   7.369  -5.164   3.656
  717    HG   LEU  86           HG       LEU  86   5.220  -3.433   2.421
  718   HD11  LEU  86          HD11      LEU  86   6.651  -2.354   4.145
  719   HD12  LEU  86          HD12      LEU  86   6.808  -1.658   2.533
  720   HD13  LEU  86          HD13      LEU  86   8.055  -2.741   3.151
  721   HD21  LEU  86          HD21      LEU  86   6.152  -4.780   0.700
  722   HD22  LEU  86          HD22      LEU  86   7.787  -4.546   1.315
  723   HD23  LEU  86          HD23      LEU  86   6.917  -3.195   0.589
  724    H    GLU  87           HN       GLU  87   4.473  -6.658   5.280
  725    HA   GLU  87           HA       GLU  87   6.354  -8.472   6.327
  726    HB2  GLU  87           HB2      GLU  87   5.104  -8.511   8.226
  727    HB3  GLU  87           HB1      GLU  87   4.429  -7.067   7.493
  728    HG2  GLU  87           HG2      GLU  87   2.479  -8.054   7.970
  729    HG3  GLU  87           HG1      GLU  87   2.776  -8.931   6.471
  730    H    LYS  88           HN       LYS  88   3.375  -9.031   4.486
  731    HA   LYS  88           HA       LYS  88   3.264 -11.808   4.923
  732    HB2  LYS  88           HB2      LYS  88   2.260 -10.154   2.613
  733    HB3  LYS  88           HB1      LYS  88   1.986 -11.884   2.742
  734    HG2  LYS  88           HG2      LYS  88   0.770 -11.535   4.834
  735    HG3  LYS  88           HG1      LYS  88   1.041  -9.795   4.694
  736    HD2  LYS  88           HD2      LYS  88  -0.186  -9.774   2.579
  737    HD3  LYS  88           HD1      LYS  88  -0.457 -11.511   2.710
  738    HE2  LYS  88           HE2      LYS  88  -2.439 -10.372   3.433
  739    HE3  LYS  88           HE1      LYS  88  -1.665 -11.100   4.840
  740    HZ1  LYS  88           HZ1      LYS  88  -0.800  -8.418   4.311
  741    HZ2  LYS  88           HZ2      LYS  88  -1.314  -9.123   5.758
  742    HZ3  LYS  88           HZ3      LYS  88  -2.455  -8.527   4.652
  743    H    LEU  89           HN       LEU  89   4.962  -9.901   2.485
  744    HA   LEU  89           HA       LEU  89   5.955 -12.299   1.216
  745    HB2  LEU  89           HB2      LEU  89   7.255 -10.687  -0.212
  746    HB3  LEU  89           HB1      LEU  89   5.511 -10.555  -0.302
  747    HG   LEU  89           HG       LEU  89   5.969  -8.681   1.557
  748   HD11  LEU  89          HD11      LEU  89   8.414  -9.104   1.475
  749   HD12  LEU  89          HD12      LEU  89   7.961  -7.443   1.094
  750   HD13  LEU  89          HD13      LEU  89   8.407  -8.555  -0.201
  751   HD21  LEU  89          HD21      LEU  89   6.178  -8.395  -1.432
  752   HD22  LEU  89          HD22      LEU  89   5.976  -7.043  -0.319
  753   HD23  LEU  89          HD23      LEU  89   4.723  -8.278  -0.442
  754    H    GLU  90           HN       GLU  90   6.985 -10.060   3.638
  755    HA   GLU  90           HA       GLU  90   9.742 -10.995   3.566
  756    HB2  GLU  90           HB2      GLU  90   9.186  -8.574   3.892
  757    HB3  GLU  90           HB1      GLU  90   8.450  -8.995   5.429
  758    HG2  GLU  90           HG2      GLU  90  10.611  -9.779   6.252
  759    HG3  GLU  90           HG1      GLU  90  11.351  -9.366   4.709
  Start of MODEL    7
    1    H1   MET   1           HT1      MET   1   7.204  -0.981  13.015
    2    H2   MET   1           HT2      MET   1   7.652   0.545  13.591
    3    H3   MET   1           HT3      MET   1   8.237  -0.004  12.102
    4    HA   MET   1           HA       MET   1   6.339   0.420  10.991
    5    HB2  MET   1           HB2      MET   1   5.052  -1.120  12.521
    6    HB3  MET   1           HB1      MET   1   4.775   0.256  13.578
    7    HG2  MET   1           HG2      MET   1   3.579   1.399  11.777
    8    HG3  MET   1           HG1      MET   1   3.856   0.016  10.719
    9    HE1  MET   1           HE1      MET   1   1.168  -0.323  10.232
   10    HE2  MET   1           HE2      MET   1   1.082   1.213  11.093
   11    HE3  MET   1           HE3      MET   1   0.002  -0.108  11.537
   12    H    ALA   2           HN       ALA   2   7.723   2.416  11.022
   13    HA   ALA   2           HA       ALA   2   6.457   4.577  12.591
   14    HB1  ALA   2           HB1      ALA   2   8.845   4.201  13.125
   15    HB2  ALA   2           HB2      ALA   2   8.556   5.793  12.424
   16    HB3  ALA   2           HB3      ALA   2   9.250   4.508  11.436
   17    H    THR   3           HN       THR   3   5.095   3.834  10.503
   18    HA   THR   3           HA       THR   3   5.876   4.828   7.989
   19    HB   THR   3           HB       THR   3   3.533   4.444   7.347
   20    HG1  THR   3           HG1      THR   3   3.155   4.769  10.006
   21   HG21  THR   3          HG21      THR   3   3.487   2.075   7.721
   22   HG22  THR   3          HG22      THR   3   4.510   2.227   9.149
   23   HG23  THR   3          HG23      THR   3   5.176   2.554   7.549
   24    H    THR   4           HN       THR   4   5.858   6.769   7.173
   25    HA   THR   4           HA       THR   4   4.479   8.960   8.562
   26    HB   THR   4           HB       THR   4   6.607   9.106   6.406
   27    HG1  THR   4           HG1      THR   4   7.176   8.144   8.563
   28   HG21  THR   4          HG21      THR   4   5.530  11.195   8.307
   29   HG22  THR   4          HG22      THR   4   5.283  11.143   6.561
   30   HG23  THR   4          HG23      THR   4   6.897  11.422   7.216
   31    H    THR   5           HN       THR   5   3.207  10.474   7.241
   32    HA   THR   5           HA       THR   5   1.651   9.075   5.296
   33    HB   THR   5           HB       THR   5   1.546  12.038   5.852
   34    HG1  THR   5           HG1      THR   5   0.312  11.590   7.616
   35   HG21  THR   5          HG21      THR   5  -0.537  10.044   4.943
   36   HG22  THR   5          HG22      THR   5   0.237  11.267   3.937
   37   HG23  THR   5          HG23      THR   5  -0.826  11.755   5.257
   38    H    LEU   6           HN       LEU   6   2.548   8.621   3.426
   39    HA   LEU   6           HA       LEU   6   3.906  10.759   1.924
   40    HB2  LEU   6           HB2      LEU   6   4.319   7.785   1.592
   41    HB3  LEU   6           HB1      LEU   6   5.219   9.067   0.808
   42    HG   LEU   6           HG       LEU   6   5.332   8.271   3.716
   43   HD11  LEU   6          HD11      LEU   6   6.601   6.998   1.892
   44   HD12  LEU   6          HD12      LEU   6   7.512   7.568   3.290
   45   HD13  LEU   6          HD13      LEU   6   7.599   8.447   1.764
   46   HD21  LEU   6          HD21      LEU   6   6.556  10.652   2.332
   47   HD22  LEU   6          HD22      LEU   6   7.067  10.052   3.910
   48   HD23  LEU   6          HD23      LEU   6   5.427  10.661   3.688
   49    H    GLY   7           HN       GLY   7   3.595  10.618  -0.440
   50    HA2  GLY   7           HA2      GLY   7   0.828  10.178  -1.054
   51    HA3  GLY   7           HA1      GLY   7   2.066  10.735  -2.169
   52    H    VAL   8           HN       VAL   8  -0.117   8.436  -1.822
   53    HA   VAL   8           HA       VAL   8   1.443   6.454  -3.338
   54    HB   VAL   8           HB       VAL   8  -0.403   5.905  -1.008
   55   HG11  VAL   8          HG11      VAL   8   0.623   3.941  -3.049
   56   HG12  VAL   8          HG12      VAL   8  -1.059   4.324  -2.688
   57   HG13  VAL   8          HG13      VAL   8  -0.069   3.487  -1.492
   58   HG21  VAL   8          HG21      VAL   8   2.454   5.138  -1.575
   59   HG22  VAL   8          HG22      VAL   8   1.526   4.630  -0.165
   60   HG23  VAL   8          HG23      VAL   8   1.897   6.337  -0.408
   61    H    LYS   9           HN       LYS   9  -0.048   5.041  -4.696
   62    HA   LYS   9           HA       LYS   9  -2.256   6.728  -5.618
   63    HB2  LYS   9           HB2      LYS   9  -0.818   4.496  -7.040
   64    HB3  LYS   9           HB1      LYS   9  -2.103   5.483  -7.725
   65    HG2  LYS   9           HG2      LYS   9  -0.503   7.454  -7.040
   66    HG3  LYS   9           HG1      LYS   9   0.722   6.188  -7.140
   67    HD2  LYS   9           HD2      LYS   9   0.782   6.536  -9.335
   68    HD3  LYS   9           HD1      LYS   9  -0.848   5.864  -9.422
   69    HE2  LYS   9           HE2      LYS   9  -0.116   8.765  -9.042
   70    HE3  LYS   9           HE1      LYS   9  -0.769   8.033 -10.507
   71    HZ1  LYS   9           HZ1      LYS   9  -2.211   8.015  -7.921
   72    HZ2  LYS   9           HZ2      LYS   9  -2.830   7.650  -9.457
   73    HZ3  LYS   9           HZ3      LYS   9  -2.398   9.241  -9.070
   74    H    LEU  10           HN       LEU  10  -4.242   6.214  -5.199
   75    HA   LEU  10           HA       LEU  10  -5.086   3.405  -4.976
   76    HB2  LEU  10           HB2      LEU  10  -5.416   5.611  -2.978
   77    HB3  LEU  10           HB1      LEU  10  -6.669   4.398  -3.124
   78    HG   LEU  10           HG       LEU  10  -3.826   3.569  -2.661
   79   HD11  LEU  10          HD11      LEU  10  -4.375   3.572  -0.227
   80   HD12  LEU  10          HD12      LEU  10  -5.812   4.524  -0.603
   81   HD13  LEU  10          HD13      LEU  10  -4.208   5.181  -0.928
   82   HD21  LEU  10          HD21      LEU  10  -6.559   2.415  -2.182
   83   HD22  LEU  10          HD22      LEU  10  -5.113   1.757  -1.421
   84   HD23  LEU  10          HD23      LEU  10  -5.253   1.770  -3.178
   85    H    ASP  11           HN       ASP  11  -7.057   3.030  -5.981
   86    HA   ASP  11           HA       ASP  11  -8.318   5.365  -7.203
   87    HB2  ASP  11           HB2      ASP  11  -9.583   3.822  -8.620
   88    HB3  ASP  11           HB1      ASP  11  -7.861   3.603  -8.776
   89    H    ASP  12           HN       ASP  12 -10.870   4.691  -7.507
   90    HA   ASP  12           HA       ASP  12 -11.984   5.281  -4.999
   91    HB2  ASP  12           HB2      ASP  12 -13.106   4.579  -7.664
   92    HB3  ASP  12           HB1      ASP  12 -14.175   4.439  -6.274
   93    HA   PRO  13           HA       PRO  13 -13.670   0.764  -4.737
   94    HB2  PRO  13           HB2      PRO  13 -12.405  -1.106  -6.311
   95    HB3  PRO  13           HB1      PRO  13 -13.956  -0.350  -6.684
   96    HG2  PRO  13           HG2      PRO  13 -11.236   0.292  -7.715
   97    HG3  PRO  13           HG1      PRO  13 -12.793   0.303  -8.562
   98    HD2  PRO  13           HD2      PRO  13 -11.581   2.568  -7.723
   99    HD3  PRO  13           HD1      PRO  13 -13.347   2.398  -7.782
  100    H    THR  14           HN       THR  14 -10.179   1.206  -5.412
  101    HA   THR  14           HA       THR  14  -9.365  -0.914  -3.722
  102    HB   THR  14           HB       THR  14  -7.158   0.232  -3.565
  103    HG1  THR  14           HG1      THR  14  -8.203   2.400  -3.853
  104   HG21  THR  14          HG21      THR  14  -7.019  -1.152  -5.344
  105   HG22  THR  14          HG22      THR  14  -6.972   0.362  -6.245
  106   HG23  THR  14          HG23      THR  14  -8.489  -0.523  -6.086
  107    H    ARG  15           HN       ARG  15  -9.795   2.580  -3.058
  108    HA   ARG  15           HA       ARG  15  -8.910   2.367  -0.370
  109    HB2  ARG  15           HB2      ARG  15  -9.128   4.522  -1.631
  110    HB3  ARG  15           HB1      ARG  15 -10.873   4.402  -1.426
  111    HG2  ARG  15           HG2      ARG  15 -10.636   4.483   0.979
  112    HG3  ARG  15           HG1      ARG  15  -8.880   4.499   0.830
  113    HD2  ARG  15           HD2      ARG  15  -9.059   6.638  -0.412
  114    HD3  ARG  15           HD1      ARG  15 -10.796   6.628  -0.109
  115    HE   ARG  15           HE       ARG  15 -10.405   7.282   2.051
  116   HH11  ARG  15          HH21      ARG  15  -7.383   6.215   0.634
  117   HH12  ARG  15          HH22      ARG  15  -6.408   6.804   1.939
  118   HH21  ARG  15          HH11      ARG  15  -9.128   8.056   3.785
  119   HH22  ARG  15          HH12      ARG  15  -7.407   7.861   3.735
  120    H    GLU  16           HN       GLU  16 -12.091   2.099  -1.870
  121    HA   GLU  16           HA       GLU  16 -13.551   1.748   0.524
  122    HB2  GLU  16           HB2      GLU  16 -14.111   0.800  -2.296
  123    HB3  GLU  16           HB1      GLU  16 -15.267   0.688  -0.974
  124    HG2  GLU  16           HG2      GLU  16 -14.092   3.229  -2.091
  125    HG3  GLU  16           HG1      GLU  16 -15.717   2.613  -2.389
  126    H    ARG  17           HN       ARG  17 -11.908  -0.436  -1.681
  127    HA   ARG  17           HA       ARG  17 -12.607  -2.876  -0.491
  128    HB2  ARG  17           HB2      ARG  17 -11.559  -2.743  -2.712
  129    HB3  ARG  17           HB1      ARG  17 -10.078  -2.143  -1.982
  130    HG2  ARG  17           HG2      ARG  17  -9.842  -4.477  -2.527
  131    HG3  ARG  17           HG1      ARG  17  -9.822  -4.263  -0.776
  132    HD2  ARG  17           HD2      ARG  17 -12.238  -4.870  -0.739
  133    HD3  ARG  17           HD1      ARG  17 -12.130  -5.227  -2.462
  134    HE   ARG  17           HE       ARG  17 -11.027  -7.185  -1.971
  135   HH11  ARG  17          HH21      ARG  17 -11.130  -5.151   0.881
  136   HH12  ARG  17          HH22      ARG  17 -10.609  -6.410   1.953
  137   HH21  ARG  17          HH11      ARG  17 -10.310  -8.853  -0.544
  138   HH22  ARG  17          HH12      ARG  17 -10.138  -8.495   1.142
  139    H    LEU  18           HN       LEU  18 -10.083  -0.531   0.194
  140    HA   LEU  18           HA       LEU  18  -8.611  -2.033   2.039
  141    HB2  LEU  18           HB2      LEU  18  -8.894   0.818   1.367
  142    HB3  LEU  18           HB1      LEU  18  -8.429   0.517   3.030
  143    HG   LEU  18           HG       LEU  18  -6.519  -0.882   2.141
  144   HD11  LEU  18          HD11      LEU  18  -7.153   0.466  -0.468
  145   HD12  LEU  18          HD12      LEU  18  -7.517  -1.221  -0.113
  146   HD13  LEU  18          HD13      LEU  18  -5.844  -0.665  -0.127
  147   HD21  LEU  18          HD21      LEU  18  -6.722   2.060   1.569
  148   HD22  LEU  18          HD22      LEU  18  -5.219   1.156   1.393
  149   HD23  LEU  18          HD23      LEU  18  -6.004   1.260   2.968
  150    H    LYS  19           HN       LYS  19 -11.533  -0.021   2.442
  151    HA   LYS  19           HA       LYS  19 -11.672  -0.295   5.231
  152    HB2  LYS  19           HB2      LYS  19 -13.120   1.296   4.072
  153    HB3  LYS  19           HB1      LYS  19 -13.969  -0.033   3.289
  154    HG2  LYS  19           HG2      LYS  19 -14.745  -0.827   5.467
  155    HG3  LYS  19           HG1      LYS  19 -13.891   0.496   6.257
  156    HD2  LYS  19           HD2      LYS  19 -15.298   2.111   5.091
  157    HD3  LYS  19           HD1      LYS  19 -16.134   0.798   4.262
  158    HE2  LYS  19           HE2      LYS  19 -17.430   1.630   6.167
  159    HE3  LYS  19           HE1      LYS  19 -16.955  -0.051   6.389
  160    HZ1  LYS  19           HZ1      LYS  19 -16.675   1.266   8.414
  161    HZ2  LYS  19           HZ2      LYS  19 -15.586   2.284   7.617
  162    HZ3  LYS  19           HZ3      LYS  19 -15.193   0.660   7.867
  163    H    ALA  20           HN       ALA  20 -12.887  -2.312   2.656
  164    HA   ALA  20           HA       ALA  20 -14.209  -4.229   4.226
  165    HB1  ALA  20           HB1      ALA  20 -13.928  -5.727   2.249
  166    HB2  ALA  20           HB2      ALA  20 -12.921  -4.481   1.513
  167    HB3  ALA  20           HB3      ALA  20 -14.616  -4.149   1.866
  168    H    ALA  21           HN       ALA  21 -10.853  -4.045   3.074
  169    HA   ALA  21           HA       ALA  21 -10.035  -6.532   4.181
  170    HB1  ALA  21           HB1      ALA  21  -8.601  -5.703   2.533
  171    HB2  ALA  21           HB2      ALA  21  -7.707  -5.427   4.029
  172    HB3  ALA  21           HB3      ALA  21  -8.556  -4.093   3.248
  173    H    ALA  22           HN       ALA  22 -10.098  -3.218   5.324
  174    HA   ALA  22           HA       ALA  22  -8.842  -3.580   7.801
  175    HB1  ALA  22           HB1      ALA  22  -9.514  -1.409   6.611
  176    HB2  ALA  22           HB2      ALA  22  -9.670  -1.464   8.366
  177    HB3  ALA  22           HB3      ALA  22 -11.097  -1.658   7.348
  178    H    GLN  23           HN       GLN  23 -12.146  -3.917   6.771
  179    HA   GLN  23           HA       GLN  23 -13.270  -4.527   9.280
  180    HB2  GLN  23           HB2      GLN  23 -14.168  -5.194   6.474
  181    HB3  GLN  23           HB1      GLN  23 -15.130  -5.542   7.905
  182    HG2  GLN  23           HG2      GLN  23 -14.175  -2.791   7.157
  183    HG3  GLN  23           HG1      GLN  23 -15.744  -3.445   6.694
  184   HE21  GLN  23          HE21      GLN  23 -17.327  -3.718   8.270
  185   HE22  GLN  23          HE22      GLN  23 -17.202  -3.000   9.837
  186    H    SER  24           HN       SER  24 -11.867  -6.551   6.730
  187    HA   SER  24           HA       SER  24 -12.550  -9.022   7.892
  188    HB2  SER  24           HB2      SER  24 -10.979 -10.038   6.368
  189    HB3  SER  24           HB1      SER  24 -11.816  -8.742   5.522
  190    HG   SER  24           HG       SER  24  -9.731  -7.581   6.500
  191    H    ILE  25           HN       ILE  25 -10.068  -6.725   8.659
  192    HA   ILE  25           HA       ILE  25  -8.822  -8.696  10.458
  193    HB   ILE  25           HB       ILE  25  -7.331  -7.538   8.804
  194   HG12  ILE  25          HG12      ILE  25  -6.638  -6.859  11.668
  195   HG13  ILE  25          HG11      ILE  25  -6.532  -8.484  10.999
  196   HG21  ILE  25          HG21      ILE  25  -8.361  -5.370   8.751
  197   HG22  ILE  25          HG22      ILE  25  -6.685  -5.205   9.273
  198   HG23  ILE  25          HG23      ILE  25  -7.990  -5.110  10.455
  199   HD11  ILE  25          HD11      ILE  25  -4.885  -7.712   9.378
  200   HD12  ILE  25          HD12      ILE  25  -4.365  -7.388  11.032
  201   HD13  ILE  25          HD13      ILE  25  -5.001  -6.080  10.035
  202    H    ASP  26           HN       ASP  26 -11.165  -6.526  10.453
  203    HA   ASP  26           HA       ASP  26 -12.357  -5.374  11.967
  204    HB2  ASP  26           HB2      ASP  26 -11.960  -7.576  13.235
  205    HB3  ASP  26           HB1      ASP  26 -10.783  -6.669  14.179
  206    H    ARG  27           HN       ARG  27 -10.363  -3.909  10.889
  207    HA   ARG  27           HA       ARG  27  -9.648  -2.164  13.151
  208    HB2  ARG  27           HB2      ARG  27  -7.767  -2.975  10.918
  209    HB3  ARG  27           HB1      ARG  27  -7.416  -1.762  12.148
  210    HG2  ARG  27           HG2      ARG  27  -7.634  -3.461  13.890
  211    HG3  ARG  27           HG1      ARG  27  -7.993  -4.673  12.666
  212    HD2  ARG  27           HD2      ARG  27  -5.727  -4.154  11.673
  213    HD3  ARG  27           HD1      ARG  27  -5.405  -3.215  13.135
  214    HE   ARG  27           HE       ARG  27  -6.326  -5.765  13.868
  215   HH11  ARG  27          HH21      ARG  27  -3.492  -4.254  12.479
  216   HH12  ARG  27          HH22      ARG  27  -2.412  -5.498  13.014
  217   HH21  ARG  27          HH11      ARG  27  -4.892  -7.407  14.572
  218   HH22  ARG  27          HH12      ARG  27  -3.202  -7.282  14.204
  219    H    THR  28           HN       THR  28  -9.163   0.095  12.425
  220    HA   THR  28           HA       THR  28 -11.165   0.932  10.562
  221    HB   THR  28           HB       THR  28 -10.735   2.302  12.522
  222    HG1  THR  28           HG1      THR  28 -10.410   4.340  11.409
  223   HG21  THR  28          HG21      THR  28  -8.004   2.843  11.359
  224   HG22  THR  28          HG22      THR  28  -8.326   1.821  12.759
  225   HG23  THR  28          HG23      THR  28  -8.677   3.548  12.828
  226    HA   PRO  29           HA       PRO  29  -9.223   0.993   6.603
  227    HB2  PRO  29           HB2      PRO  29 -10.084   3.860   6.639
  228    HB3  PRO  29           HB1      PRO  29 -10.252   2.654   5.357
  229    HG2  PRO  29           HG2      PRO  29 -12.314   3.279   6.929
  230    HG3  PRO  29           HG1      PRO  29 -12.042   1.614   6.385
  231    HD2  PRO  29           HD2      PRO  29 -11.668   2.805   9.068
  232    HD3  PRO  29           HD1      PRO  29 -11.993   1.122   8.612
  233    H    HIS  30           HN       HIS  30  -8.651   3.973   8.512
  234    HA   HIS  30           HA       HIS  30  -6.310   4.753   7.170
  235    HB2  HIS  30           HB2      HIS  30  -7.660   6.180   8.737
  236    HB3  HIS  30           HB1      HIS  30  -6.969   5.277  10.078
  237    HD1  HIS  30           HD1      HIS  30  -5.838   7.392  11.046
  238    HD2  HIS  30           HD2      HIS  30  -4.625   6.443   7.179
  239    HE1  HIS  30           HE1      HIS  30  -3.827   8.830  10.595
  240    HE2  HIS  30           HE2      HIS  30  -3.317   8.448   8.158
  241    H    TRP  31           HN       TRP  31  -6.784   2.691   9.999
  242    HA   TRP  31           HA       TRP  31  -4.044   2.324  10.567
  243    HB2  TRP  31           HB2      TRP  31  -5.891   1.794  12.183
  244    HB3  TRP  31           HB1      TRP  31  -6.271   0.386  11.191
  245    HD1  TRP  31           HD1      TRP  31  -4.784  -1.745  11.499
  246    HE1  TRP  31           HE1      TRP  31  -2.810  -2.342  13.044
  247    HE3  TRP  31           HE3      TRP  31  -3.795   2.897  13.392
  248    HZ2  TRP  31           HZ2      TRP  31  -1.080  -1.027  14.834
  249    HZ3  TRP  31           HZ3      TRP  31  -1.965   3.142  15.017
  250    HH2  TRP  31           HH2      TRP  31  -0.636   1.220  15.723
  251    H    LEU  32           HN       LEU  32  -6.406   0.539   8.704
  252    HA   LEU  32           HA       LEU  32  -4.606  -1.478   7.928
  253    HB2  LEU  32           HB2      LEU  32  -7.040  -1.806   7.732
  254    HB3  LEU  32           HB1      LEU  32  -7.062  -0.642   6.412
  255    HG   LEU  32           HG       LEU  32  -5.102  -2.354   5.591
  256   HD11  LEU  32          HD11      LEU  32  -5.717  -3.826   7.543
  257   HD12  LEU  32          HD12      LEU  32  -5.690  -4.587   5.953
  258   HD13  LEU  32          HD13      LEU  32  -7.229  -4.152   6.696
  259   HD21  LEU  32          HD21      LEU  32  -6.628  -3.095   3.940
  260   HD22  LEU  32          HD22      LEU  32  -7.017  -1.416   4.317
  261   HD23  LEU  32          HD23      LEU  32  -8.013  -2.719   4.965
  262    H    ILE  33           HN       ILE  33  -5.191   1.708   6.699
  263    HA   ILE  33           HA       ILE  33  -4.091   1.391   4.143
  264    HB   ILE  33           HB       ILE  33  -4.031   3.784   5.994
  265   HG12  ILE  33          HG12      ILE  33  -5.593   3.337   3.445
  266   HG13  ILE  33          HG11      ILE  33  -6.229   3.006   5.053
  267   HG21  ILE  33          HG21      ILE  33  -3.020   3.550   3.174
  268   HG22  ILE  33          HG22      ILE  33  -2.149   4.103   4.605
  269   HG23  ILE  33          HG23      ILE  33  -3.441   5.090   3.923
  270   HD11  ILE  33          HD11      ILE  33  -5.387   5.566   5.337
  271   HD12  ILE  33          HD12      ILE  33  -7.027   5.086   4.904
  272   HD13  ILE  33          HD13      ILE  33  -5.881   5.546   3.644
  273    H    LYS  34           HN       LYS  34  -2.588   2.147   7.256
  274    HA   LYS  34           HA       LYS  34   0.093   2.324   6.377
  275    HB2  LYS  34           HB2      LYS  34  -0.762   1.077   8.993
  276    HB3  LYS  34           HB1      LYS  34   0.737   1.920   8.651
  277    HG2  LYS  34           HG2      LYS  34  -0.438   4.025   8.531
  278    HG3  LYS  34           HG1      LYS  34  -1.981   3.197   8.771
  279    HD2  LYS  34           HD2      LYS  34  -1.094   2.334  10.942
  280    HD3  LYS  34           HD1      LYS  34   0.323   3.359  10.711
  281    HE2  LYS  34           HE2      LYS  34  -1.681   4.191  12.151
  282    HE3  LYS  34           HE1      LYS  34  -0.858   5.299  11.055
  283    HZ1  LYS  34           HZ1      LYS  34  -3.315   3.799  10.356
  284    HZ2  LYS  34           HZ2      LYS  34  -2.581   5.025   9.456
  285    HZ3  LYS  34           HZ3      LYS  34  -3.311   5.386  10.940
  286    H    GLN  35           HN       GLN  35  -1.764  -0.380   7.653
  287    HA   GLN  35           HA       GLN  35   0.290  -2.302   7.360
  288    HB2  GLN  35           HB2      GLN  35  -2.683  -2.654   7.694
  289    HB3  GLN  35           HB1      GLN  35  -1.483  -3.933   7.858
  290    HG2  GLN  35           HG2      GLN  35  -0.420  -2.573   9.666
  291    HG3  GLN  35           HG1      GLN  35  -1.813  -1.496   9.582
  292   HE21  GLN  35          HE21      GLN  35  -3.543  -3.847   8.936
  293   HE22  GLN  35          HE22      GLN  35  -3.792  -4.641  10.447
  294    H    ALA  36           HN       ALA  36  -2.333  -1.273   5.269
  295    HA   ALA  36           HA       ALA  36  -2.395  -3.433   3.531
  296    HB1  ALA  36           HB1      ALA  36  -2.722  -0.541   2.756
  297    HB2  ALA  36           HB2      ALA  36  -3.976  -1.513   3.523
  298    HB3  ALA  36           HB3      ALA  36  -3.378  -1.949   1.922
  299    H    ILE  37           HN       ILE  37  -0.274  -0.617   3.626
  300    HA   ILE  37           HA       ILE  37   1.195  -1.645   1.355
  301    HB   ILE  37           HB       ILE  37   0.838   0.771   1.563
  302   HG12  ILE  37          HG12      ILE  37   3.106   1.502   1.080
  303   HG13  ILE  37          HG11      ILE  37   3.758   0.051   1.836
  304   HG21  ILE  37          HG21      ILE  37   2.600   0.621   3.991
  305   HG22  ILE  37          HG22      ILE  37   0.872   0.977   3.975
  306   HG23  ILE  37          HG23      ILE  37   2.010   2.096   3.224
  307   HD11  ILE  37          HD11      ILE  37   3.675   0.090  -0.679
  308   HD12  ILE  37          HD12      ILE  37   1.923  -0.051  -0.527
  309   HD13  ILE  37          HD13      ILE  37   2.970  -1.319   0.110
  310    H    PHE  38           HN       PHE  38   1.825  -1.228   4.836
  311    HA   PHE  38           HA       PHE  38   4.482  -2.270   4.644
  312    HB2  PHE  38           HB2      PHE  38   4.452  -1.021   6.529
  313    HB3  PHE  38           HB1      PHE  38   2.717  -1.195   6.732
  314    HD1  PHE  38           HD1      PHE  38   5.806  -3.289   7.068
  315    HD2  PHE  38           HD2      PHE  38   1.993  -2.216   8.626
  316    HE1  PHE  38           HE1      PHE  38   6.172  -4.782   8.989
  317    HE2  PHE  38           HE2      PHE  38   2.352  -3.707  10.547
  318    HZ   PHE  38           HZ       PHE  38   4.443  -4.993  10.730
  319    H    ASN  39           HN       ASN  39   1.342  -3.645   5.538
  320    HA   ASN  39           HA       ASN  39   2.433  -6.159   6.260
  321    HB2  ASN  39           HB2      ASN  39   0.139  -5.405   6.963
  322    HB3  ASN  39           HB1      ASN  39  -0.381  -5.639   5.299
  323   HD21  ASN  39          HD21      ASN  39  -1.925  -7.134   6.091
  324   HD22  ASN  39          HD22      ASN  39  -1.462  -8.743   6.515
  325    H    TYR  40           HN       TYR  40   1.520  -4.593   3.269
  326    HA   TYR  40           HA       TYR  40   1.421  -6.886   1.646
  327    HB2  TYR  40           HB2      TYR  40   0.771  -4.756   0.698
  328    HB3  TYR  40           HB1      TYR  40   2.354  -4.068   1.036
  329    HD1  TYR  40           HD1      TYR  40   0.856  -6.923  -0.874
  330    HD2  TYR  40           HD2      TYR  40   3.839  -3.893  -0.721
  331    HE1  TYR  40           HE1      TYR  40   1.600  -7.550  -3.132
  332    HE2  TYR  40           HE2      TYR  40   4.591  -4.513  -2.979
  333    HH   TYR  40           HH       TYR  40   4.475  -6.154  -4.575
  334    H    LEU  41           HN       LEU  41   3.986  -4.821   2.790
  335    HA   LEU  41           HA       LEU  41   6.117  -6.135   1.500
  336    HB2  LEU  41           HB2      LEU  41   6.066  -4.390   3.942
  337    HB3  LEU  41           HB1      LEU  41   7.538  -4.947   3.166
  338    HG   LEU  41           HG       LEU  41   5.439  -3.170   1.912
  339   HD11  LEU  41          HD11      LEU  41   6.814  -2.088   3.637
  340   HD12  LEU  41          HD12      LEU  41   7.116  -1.445   2.024
  341   HD13  LEU  41          HD13      LEU  41   8.264  -2.566   2.756
  342   HD21  LEU  41          HD21      LEU  41   6.332  -4.452   0.156
  343   HD22  LEU  41          HD22      LEU  41   7.959  -4.397   0.831
  344   HD23  LEU  41          HD23      LEU  41   7.244  -2.944   0.135
  345    H    GLU  42           HN       GLU  42   4.829  -6.369   4.801
  346    HA   GLU  42           HA       GLU  42   6.632  -8.321   5.734
  347    HB2  GLU  42           HB2      GLU  42   5.214  -6.915   7.203
  348    HB3  GLU  42           HB1      GLU  42   3.798  -7.801   6.653
  349    HG2  GLU  42           HG2      GLU  42   4.713  -9.857   7.601
  350    HG3  GLU  42           HG1      GLU  42   6.132  -8.971   8.151
  351    H    LYS  43           HN       LYS  43   3.483  -8.583   4.178
  352    HA   LYS  43           HA       LYS  43   3.169 -11.369   4.504
  353    HB2  LYS  43           HB2      LYS  43   1.352  -9.731   3.967
  354    HB3  LYS  43           HB1      LYS  43   1.989  -9.632   2.333
  355    HG2  LYS  43           HG2      LYS  43   1.531 -11.995   1.995
  356    HG3  LYS  43           HG1      LYS  43   0.924 -12.121   3.647
  357    HD2  LYS  43           HD2      LYS  43  -0.786 -10.388   3.061
  358    HD3  LYS  43           HD1      LYS  43  -0.246 -10.506   1.385
  359    HE2  LYS  43           HE2      LYS  43  -0.919 -12.781   1.241
  360    HE3  LYS  43           HE1      LYS  43  -1.189 -12.878   2.980
  361    HZ1  LYS  43           HZ1      LYS  43  -2.965 -12.024   0.928
  362    HZ2  LYS  43           HZ2      LYS  43  -2.796 -10.828   2.113
  363    HZ3  LYS  43           HZ3      LYS  43  -3.294 -12.385   2.550
  364    H    LEU  44           HN       LEU  44   4.541  -9.434   1.847
  365    HA   LEU  44           HA       LEU  44   5.029 -11.841   0.316
  366    HB2  LEU  44           HB2      LEU  44   5.726 -10.490  -1.462
  367    HB3  LEU  44           HB1      LEU  44   4.404  -9.618  -0.721
  368    HG   LEU  44           HG       LEU  44   6.480  -8.432   0.536
  369   HD11  LEU  44          HD11      LEU  44   8.444  -8.648  -0.480
  370   HD12  LEU  44          HD12      LEU  44   7.728  -8.292  -2.051
  371   HD13  LEU  44          HD13      LEU  44   7.745  -9.948  -1.445
  372   HD21  LEU  44          HD21      LEU  44   6.191  -6.605  -0.995
  373   HD22  LEU  44          HD22      LEU  44   4.628  -7.376  -0.723
  374   HD23  LEU  44          HD23      LEU  44   5.516  -7.683  -2.216
  375    H    GLU  45           HN       GLU  45   6.951  -9.397   1.972
  376    HA   GLU  45           HA       GLU  45   9.042  -9.264   2.713
  377    HB2  GLU  45           HB2      GLU  45   8.436 -12.148   3.132
  378    HB3  GLU  45           HB1      GLU  45  10.074 -11.568   3.426
  379    HG2  GLU  45           HG2      GLU  45   7.581 -10.447   4.698
  380    HG3  GLU  45           HG1      GLU  45   8.689 -11.586   5.460
  381    H1   MET  46           HT1      MET  46  -7.119  -1.221 -13.144
  382    H2   MET  46           HT2      MET  46  -7.598   0.277 -13.768
  383    H3   MET  46           HT3      MET  46  -8.202  -0.254 -12.279
  384    HA   MET  46           HA       MET  46  -6.322   0.217 -11.142
  385    HB2  MET  46           HB2      MET  46  -4.959  -1.244 -12.685
  386    HB3  MET  46           HB1      MET  46  -4.748   0.154 -13.727
  387    HG2  MET  46           HG2      MET  46  -3.611   1.334 -11.914
  388    HG3  MET  46           HG1      MET  46  -3.820  -0.070 -10.870
  389    HE1  MET  46           HE1      MET  46  -1.144  -0.325 -10.375
  390    HE2  MET  46           HE2      MET  46  -1.097   1.229 -11.206
  391    HE3  MET  46           HE3      MET  46   0.029  -0.049 -11.662
  392    H    ALA  47           HN       ALA  47  -7.801   2.138 -11.153
  393    HA   ALA  47           HA       ALA  47  -6.659   4.376 -12.709
  394    HB1  ALA  47           HB1      ALA  47  -9.030   3.877 -13.231
  395    HB2  ALA  47           HB2      ALA  47  -8.818   5.478 -12.523
  396    HB3  ALA  47           HB3      ALA  47  -9.438   4.154 -11.538
  397    H    THR  48           HN       THR  48  -5.258   3.670 -10.630
  398    HA   THR  48           HA       THR  48  -6.076   4.612  -8.107
  399    HB   THR  48           HB       THR  48  -3.715   4.326  -7.475
  400    HG1  THR  48           HG1      THR  48  -3.365   4.667 -10.140
  401   HG21  THR  48          HG21      THR  48  -3.572   1.963  -7.856
  402   HG22  THR  48          HG22      THR  48  -4.603   2.076  -9.282
  403   HG23  THR  48          HG23      THR  48  -5.280   2.369  -7.680
  404    H    THR  49           HN       THR  49  -6.100   6.540  -7.258
  405    HA   THR  49           HA       THR  49  -4.823   8.789  -8.654
  406    HB   THR  49           HB       THR  49  -6.993   8.826  -6.535
  407    HG1  THR  49           HG1      THR  49  -7.763   7.898  -8.466
  408   HG21  THR  49          HG21      THR  49  -5.960  10.998  -8.368
  409   HG22  THR  49          HG22      THR  49  -5.733  10.914  -6.621
  410   HG23  THR  49          HG23      THR  49  -7.348  11.147  -7.290
  411    H    THR  50           HN       THR  50  -3.591  10.327  -7.357
  412    HA   THR  50           HA       THR  50  -1.997   9.017  -5.394
  413    HB   THR  50           HB       THR  50  -2.028  11.981  -5.933
  414    HG1  THR  50           HG1      THR  50  -0.704  11.588  -7.678
  415   HG21  THR  50          HG21      THR  50   0.141  10.066  -5.054
  416   HG22  THR  50          HG22      THR  50  -0.671  11.256  -4.037
  417   HG23  THR  50          HG23      THR  50   0.364  11.788  -5.363
  418    H    LEU  51           HN       LEU  51  -2.899   8.515  -3.529
  419    HA   LEU  51           HA       LEU  51  -4.332  10.599  -2.022
  420    HB2  LEU  51           HB2      LEU  51  -4.641   7.611  -1.699
  421    HB3  LEU  51           HB1      LEU  51  -5.587   8.858  -0.913
  422    HG   LEU  51           HG       LEU  51  -5.667   8.069  -3.824
  423   HD11  LEU  51          HD11      LEU  51  -6.890   6.742  -2.006
  424   HD12  LEU  51          HD12      LEU  51  -7.818   7.281  -3.405
  425   HD13  LEU  51          HD13      LEU  51  -7.942   8.151  -1.876
  426   HD21  LEU  51          HD21      LEU  51  -6.983  10.395  -2.431
  427   HD22  LEU  51          HD22      LEU  51  -7.468   9.784  -4.013
  428   HD23  LEU  51          HD23      LEU  51  -5.853  10.454  -3.784
  429    H    GLY  52           HN       GLY  52  -4.003  10.481   0.335
  430    HA2  GLY  52           HA2      GLY  52  -1.227  10.126   0.947
  431    HA3  GLY  52           HA1      GLY  52  -2.480  10.644   2.063
  432    H    VAL  53           HN       VAL  53  -0.226   8.415   1.703
  433    HA   VAL  53           HA       VAL  53  -1.711   6.382   3.225
  434    HB   VAL  53           HB       VAL  53   0.150   5.902   0.891
  435   HG11  VAL  53          HG11      VAL  53  -0.799   3.898   2.931
  436   HG12  VAL  53          HG12      VAL  53   0.868   4.345   2.570
  437   HG13  VAL  53          HG13      VAL  53  -0.091   3.473   1.373
  438   HG21  VAL  53          HG21      VAL  53  -2.674   5.025   1.463
  439   HG22  VAL  53          HG22      VAL  53  -1.731   4.560   0.048
  440   HG23  VAL  53          HG23      VAL  53  -2.168   6.250   0.300
  441    H    LYS  54           HN       LYS  54  -0.168   5.022   4.579
  442    HA   LYS  54           HA       LYS  54   1.975   6.789   5.504
  443    HB2  LYS  54           HB2      LYS  54   0.619   4.501   6.920
  444    HB3  LYS  54           HB1      LYS  54   1.870   5.528   7.608
  445    HG2  LYS  54           HG2      LYS  54   0.199   7.445   6.926
  446    HG3  LYS  54           HG1      LYS  54  -0.979   6.136   7.034
  447    HD2  LYS  54           HD2      LYS  54  -1.033   6.457   9.232
  448    HD3  LYS  54           HD1      LYS  54   0.635   5.887   9.306
  449    HE2  LYS  54           HE2      LYS  54  -0.282   8.736   8.940
  450    HE3  LYS  54           HE1      LYS  54   0.441   8.045  10.391
  451    HZ1  LYS  54           HZ1      LYS  54   1.839   8.130   7.782
  452    HZ2  LYS  54           HZ2      LYS  54   2.506   7.800   9.306
  453    HZ3  LYS  54           HZ3      LYS  54   1.963   9.362   8.933
  454    H    LEU  55           HN       LEU  55   3.978   6.353   5.086
  455    HA   LEU  55           HA       LEU  55   4.931   3.580   4.855
  456    HB2  LEU  55           HB2      LEU  55   5.174   5.803   2.863
  457    HB3  LEU  55           HB1      LEU  55   6.473   4.639   3.004
  458    HG   LEU  55           HG       LEU  55   3.665   3.700   2.540
  459   HD11  LEU  55          HD11      LEU  55   4.211   3.738   0.104
  460   HD12  LEU  55          HD12      LEU  55   5.607   4.746   0.484
  461   HD13  LEU  55          HD13      LEU  55   3.978   5.336   0.815
  462   HD21  LEU  55          HD21      LEU  55   6.442   2.660   2.050
  463   HD22  LEU  55          HD22      LEU  55   5.022   1.948   1.287
  464   HD23  LEU  55          HD23      LEU  55   5.165   1.958   3.045
  465    H    ASP  56           HN       ASP  56   6.925   3.283   5.854
  466    HA   ASP  56           HA       ASP  56   8.092   5.673   7.067
  467    HB2  ASP  56           HB2      ASP  56   9.421   4.193   8.491
  468    HB3  ASP  56           HB1      ASP  56   7.710   3.909   8.656
  469    H    ASP  57           HN       ASP  57  10.666   5.139   7.361
  470    HA   ASP  57           HA       ASP  57  11.747   5.742   4.849
  471    HB2  ASP  57           HB2      ASP  57  12.969   5.004   7.481
  472    HB3  ASP  57           HB1      ASP  57  13.990   5.099   6.052
  473    HA   PRO  58           HA       PRO  58  13.600   1.295   4.598
  474    HB2  PRO  58           HB2      PRO  58  12.425  -0.625   6.177
  475    HB3  PRO  58           HB1      PRO  58  13.939   0.204   6.550
  476    HG2  PRO  58           HG2      PRO  58  11.190   0.719   7.577
  477    HG3  PRO  58           HG1      PRO  58  12.743   0.804   8.426
  478    HD2  PRO  58           HD2      PRO  58  11.425   3.008   7.577
  479    HD3  PRO  58           HD1      PRO  58  13.196   2.923   7.650
  480    H    THR  59           HN       THR  59  10.095   1.602   5.274
  481    HA   THR  59           HA       THR  59   9.371  -0.555   3.587
  482    HB   THR  59           HB       THR  59   7.116   0.489   3.438
  483    HG1  THR  59           HG1      THR  59   8.045   2.702   3.709
  484   HG21  THR  59          HG21      THR  59   7.046  -0.897   5.221
  485   HG22  THR  59          HG22      THR  59   6.933   0.616   6.119
  486   HG23  THR  59          HG23      THR  59   8.488  -0.200   5.956
  487    H    ARG  60           HN       ARG  60   9.645   2.956   2.929
  488    HA   ARG  60           HA       ARG  60   8.774   2.726   0.241
  489    HB2  ARG  60           HB2      ARG  60   8.928   4.882   1.512
  490    HB3  ARG  60           HB1      ARG  60  10.677   4.816   1.305
  491    HG2  ARG  60           HG2      ARG  60  10.435   4.908  -1.099
  492    HG3  ARG  60           HG1      ARG  60   8.679   4.867  -0.950
  493    HD2  ARG  60           HD2      ARG  60   8.788   7.001   0.308
  494    HD3  ARG  60           HD1      ARG  60  10.525   7.049   0.007
  495    HE   ARG  60           HE       ARG  60  10.115   7.722  -2.141
  496   HH11  ARG  60          HH21      ARG  60   7.133   6.507  -0.757
  497   HH12  ARG  60          HH22      ARG  60   6.141   7.069  -2.061
  498   HH21  ARG  60          HH11      ARG  60   8.812   8.466  -3.873
  499   HH22  ARG  60          HH12      ARG  60   7.102   8.193  -3.837
  500    H    GLU  61           HN       GLU  61  11.967   2.568   1.730
  501    HA   GLU  61           HA       GLU  61  13.427   2.262  -0.669
  502    HB2  GLU  61           HB2      GLU  61  14.043   1.338   2.146
  503    HB3  GLU  61           HB1      GLU  61  15.193   1.286   0.815
  504    HG2  GLU  61           HG2      GLU  61  13.911   3.765   1.951
  505    HG3  GLU  61           HG1      GLU  61  15.564   3.225   2.237
  506    H    ARG  62           HN       ARG  62  11.869   0.009   1.543
  507    HA   ARG  62           HA       ARG  62  12.682  -2.392   0.332
  508    HB2  ARG  62           HB2      ARG  62  11.642  -2.339   2.558
  509    HB3  ARG  62           HB1      ARG  62  10.128  -1.799   1.849
  510    HG2  ARG  62           HG2      ARG  62  10.026  -4.159   2.369
  511    HG3  ARG  62           HG1      ARG  62   9.950  -3.911   0.624
  512    HD2  ARG  62           HD2      ARG  62  12.390  -4.390   0.515
  513    HD3  ARG  62           HD1      ARG  62  12.347  -4.785   2.231
  514    HE   ARG  62           HE       ARG  62  11.390  -6.806   1.717
  515   HH11  ARG  62          HH21      ARG  62  11.132  -4.682  -1.058
  516   HH12  ARG  62          HH22      ARG  62  10.659  -5.949  -2.141
  517   HH21  ARG  62          HH11      ARG  62  10.769  -8.486   0.293
  518   HH22  ARG  62          HH12      ARG  62  10.441  -8.099  -1.378
  519    H    LEU  63           HN       LEU  63  10.067  -0.150  -0.332
  520    HA   LEU  63           HA       LEU  63   8.651  -1.688  -2.192
  521    HB2  LEU  63           HB2      LEU  63   8.836   1.167  -1.510
  522    HB3  LEU  63           HB1      LEU  63   8.382   0.853  -3.173
  523    HG   LEU  63           HG       LEU  63   6.518  -0.606  -2.294
  524   HD11  LEU  63          HD11      LEU  63   7.095   0.746   0.326
  525   HD12  LEU  63          HD12      LEU  63   7.539  -0.920  -0.040
  526   HD13  LEU  63          HD13      LEU  63   5.841  -0.443  -0.027
  527   HD21  LEU  63          HD21      LEU  63   6.625   2.337  -1.697
  528   HD22  LEU  63          HD22      LEU  63   5.152   1.384  -1.529
  529   HD23  LEU  63          HD23      LEU  63   5.934   1.527  -3.103
  530    H    LYS  64           HN       LYS  64  11.494   0.423  -2.559
  531    HA   LYS  64           HA       LYS  64  11.679   0.202  -5.347
  532    HB2  LYS  64           HB2      LYS  64  13.052   1.810  -4.108
  533    HB3  LYS  64           HB1      LYS  64  13.939   0.484  -3.365
  534    HG2  LYS  64           HG2      LYS  64  14.769  -0.197  -5.560
  535    HG3  LYS  64           HG1      LYS  64  13.878   1.128  -6.308
  536    HD2  LYS  64           HD2      LYS  64  15.205   2.742  -5.057
  537    HD3  LYS  64           HD1      LYS  64  16.075   1.429  -4.260
  538    HE2  LYS  64           HE2      LYS  64  17.393   2.352  -6.089
  539    HE3  LYS  64           HE1      LYS  64  16.935   0.685  -6.428
  540    HZ1  LYS  64           HZ1      LYS  64  16.680   2.150  -8.358
  541    HZ2  LYS  64           HZ2      LYS  64  15.549   3.079  -7.511
  542    HZ3  LYS  64           HZ3      LYS  64  15.205   1.466  -7.890
  543    H    ALA  65           HN       ALA  65  12.941  -1.805  -2.787
  544    HA   ALA  65           HA       ALA  65  14.341  -3.658  -4.369
  545    HB1  ALA  65           HB1      ALA  65  14.124  -5.177  -2.403
  546    HB2  ALA  65           HB2      ALA  65  13.065  -3.979  -1.657
  547    HB3  ALA  65           HB3      ALA  65  14.744  -3.574  -2.008
  548    H    ALA  66           HN       ALA  66  10.978  -3.588  -3.246
  549    HA   ALA  66           HA       ALA  66  10.258  -6.112  -4.347
  550    HB1  ALA  66           HB1      ALA  66   8.787  -5.344  -2.705
  551    HB2  ALA  66           HB2      ALA  66   7.890  -5.090  -4.203
  552    HB3  ALA  66           HB3      ALA  66   8.689  -3.732  -3.412
  553    H    ALA  67           HN       ALA  67  10.192  -2.795  -5.481
  554    HA   ALA  67           HA       ALA  67   8.960  -3.199  -7.962
  555    HB1  ALA  67           HB1      ALA  67   9.542  -1.008  -6.760
  556    HB2  ALA  67           HB2      ALA  67   9.701  -1.049  -8.516
  557    HB3  ALA  67           HB3      ALA  67  11.134  -1.189  -7.497
  558    H    GLN  68           HN       GLN  68  12.274  -3.406  -6.928
  559    HA   GLN  68           HA       GLN  68  13.422  -3.962  -9.441
  560    HB2  GLN  68           HB2      GLN  68  14.354  -4.625  -6.644
  561    HB3  GLN  68           HB1      GLN  68  15.325  -4.898  -8.085
  562    HG2  GLN  68           HG2      GLN  68  14.246  -2.212  -7.276
  563    HG3  GLN  68           HG1      GLN  68  15.845  -2.800  -6.834
  564   HE21  GLN  68          HE21      GLN  68  17.416  -3.028  -8.458
  565   HE22  GLN  68          HE22      GLN  68  17.256  -2.250  -9.992
  566    H    SER  69           HN       SER  69  12.093  -6.051  -6.902
  567    HA   SER  69           HA       SER  69  12.878  -8.490  -8.075
  568    HB2  SER  69           HB2      SER  69  11.359  -9.577  -6.555
  569    HB3  SER  69           HB1      SER  69  12.121  -8.238  -5.702
  570    HG   SER  69           HG       SER  69  10.015  -7.149  -6.648
  571    H    ILE  70           HN       ILE  70  10.307  -6.288  -8.824
  572    HA   ILE  70           HA       ILE  70   9.131  -8.293 -10.630
  573    HB   ILE  70           HB       ILE  70   7.599  -7.194  -8.973
  574   HG12  ILE  70          HG12      ILE  70   6.887  -6.528 -11.836
  575   HG13  ILE  70          HG11      ILE  70   6.835  -8.159 -11.173
  576   HG21  ILE  70          HG21      ILE  70   8.555  -4.991  -8.913
  577   HG22  ILE  70          HG22      ILE  70   6.874  -4.882  -9.433
  578   HG23  ILE  70          HG23      ILE  70   8.175  -4.738 -10.615
  579   HD11  ILE  70          HD11      ILE  70   5.161  -7.450  -9.553
  580   HD12  ILE  70          HD12      ILE  70   4.632  -7.138 -11.206
  581   HD13  ILE  70          HD13      ILE  70   5.221  -5.812 -10.203
  582    H    ASP  71           HN       ASP  71  11.396  -6.037 -10.622
  583    HA   ASP  71           HA       ASP  71  12.545  -4.852 -12.146
  584    HB2  ASP  71           HB2      ASP  71  12.200  -7.063 -13.415
  585    HB3  ASP  71           HB1      ASP  71  10.981  -6.194 -14.340
  586    H    ARG  72           HN       ARG  72  10.505  -3.455 -11.042
  587    HA   ARG  72           HA       ARG  72   9.727  -1.727 -13.298
  588    HB2  ARG  72           HB2      ARG  72   7.876  -2.613 -11.067
  589    HB3  ARG  72           HB1      ARG  72   7.484  -1.409 -12.293
  590    HG2  ARG  72           HG2      ARG  72   7.763  -3.086 -14.042
  591    HG3  ARG  72           HG1      ARG  72   8.165  -4.293 -12.827
  592    HD2  ARG  72           HD2      ARG  72   5.883  -3.865 -11.833
  593    HD3  ARG  72           HD1      ARG  72   5.525  -2.929 -13.289
  594    HE   ARG  72           HE       ARG  72   6.551  -5.450 -14.014
  595   HH11  ARG  72          HH21      ARG  72   3.645  -4.018 -12.695
  596   HH12  ARG  72          HH22      ARG  72   2.605  -5.270 -13.286
  597   HH21  ARG  72          HH11      ARG  72   5.178  -7.106 -14.790
  598   HH22  ARG  72          HH12      ARG  72   3.476  -7.024 -14.478
  599    H    THR  73           HN       THR  73   9.144   0.504 -12.560
  600    HA   THR  73           HA       THR  73  11.110   1.422 -10.698
  601    HB   THR  73           HB       THR  73  10.605   2.768 -12.662
  602    HG1  THR  73           HG1      THR  73  10.097   4.796 -11.488
  603   HG21  THR  73          HG21      THR  73   7.871   3.203 -11.464
  604   HG22  THR  73          HG22      THR  73   8.216   2.202 -12.874
  605   HG23  THR  73          HG23      THR  73   8.500   3.942 -12.936
  606    HA   PRO  74           HA       PRO  74   9.162   1.379  -6.738
  607    HB2  PRO  74           HB2      PRO  74   9.903   4.279  -6.742
  608    HB3  PRO  74           HB1      PRO  74  10.125   3.066  -5.476
  609    HG2  PRO  74           HG2      PRO  74  12.156   3.798  -7.039
  610    HG3  PRO  74           HG1      PRO  74  11.955   2.115  -6.522
  611    HD2  PRO  74           HD2      PRO  74  11.516   3.335  -9.184
  612    HD3  PRO  74           HD1      PRO  74  11.932   1.664  -8.760
  613    H    HIS  75           HN       HIS  75   8.478   4.352  -8.623
  614    HA   HIS  75           HA       HIS  75   6.102   5.024  -7.289
  615    HB2  HIS  75           HB2      HIS  75   7.414   6.495  -8.863
  616    HB3  HIS  75           HB1      HIS  75   6.723   5.583 -10.198
  617    HD1  HIS  75           HD1      HIS  75   5.620   7.790 -11.067
  618    HD2  HIS  75           HD2      HIS  75   4.311   6.563  -7.314
  619    HE1  HIS  75           HE1      HIS  75   3.542   9.124 -10.608
  620    HE2  HIS  75           HE2      HIS  75   2.976   8.586  -8.214
  621    H    TRP  76           HN       TRP  76   6.660   2.993 -10.130
  622    HA   TRP  76           HA       TRP  76   3.937   2.519 -10.699
  623    HB2  TRP  76           HB2      TRP  76   5.806   2.069 -12.315
  624    HB3  TRP  76           HB1      TRP  76   6.236   0.671 -11.330
  625    HD1  TRP  76           HD1      TRP  76   4.836  -1.516 -11.663
  626    HE1  TRP  76           HE1      TRP  76   2.887  -2.175 -13.216
  627    HE3  TRP  76           HE3      TRP  76   3.660   3.102 -13.507
  628    HZ2  TRP  76           HZ2      TRP  76   1.105  -0.913 -14.990
  629    HZ3  TRP  76           HZ3      TRP  76   1.821   3.290 -15.130
  630    HH2  TRP  76           HH2      TRP  76   0.571   1.323 -15.855
  631    H    LEU  77           HN       LEU  77   6.366   0.830  -8.836
  632    HA   LEU  77           HA       LEU  77   4.647  -1.261  -8.072
  633    HB2  LEU  77           HB2      LEU  77   7.092  -1.494  -7.876
  634    HB3  LEU  77           HB1      LEU  77   7.066  -0.336  -6.550
  635    HG   LEU  77           HG       LEU  77   5.172  -2.130  -5.745
  636   HD11  LEU  77          HD11      LEU  77   5.854  -3.567  -7.698
  637   HD12  LEU  77          HD12      LEU  77   5.857  -4.336  -6.112
  638   HD13  LEU  77          HD13      LEU  77   7.377  -3.832  -6.849
  639   HD21  LEU  77          HD21      LEU  77   6.721  -2.813  -4.089
  640   HD22  LEU  77          HD22      LEU  77   7.041  -1.119  -4.458
  641   HD23  LEU  77          HD23      LEU  77   8.093  -2.377  -5.106
  642    H    ILE  78           HN       ILE  78   5.107   1.939  -6.827
  643    HA   ILE  78           HA       ILE  78   4.017   1.569  -4.274
  644    HB   ILE  78           HB       ILE  78   3.860   3.964  -6.119
  645   HG12  ILE  78          HG12      ILE  78   5.440   3.570  -3.570
  646   HG13  ILE  78          HG11      ILE  78   6.088   3.273  -5.180
  647   HG21  ILE  78          HG21      ILE  78   2.860   3.677  -3.298
  648   HG22  ILE  78          HG22      ILE  78   1.967   4.202  -4.726
  649   HG23  ILE  78          HG23      ILE  78   3.219   5.237  -4.040
  650   HD11  ILE  78          HD11      ILE  78   5.144   5.797  -5.454
  651   HD12  ILE  78          HD12      ILE  78   6.802   5.383  -5.021
  652   HD13  ILE  78          HD13      ILE  78   5.638   5.790  -3.761
  653    H    LYS  79           HN       LYS  79   2.487   2.278  -7.387
  654    HA   LYS  79           HA       LYS  79  -0.200   2.343  -6.512
  655    HB2  LYS  79           HB2      LYS  79   0.710   1.145  -9.132
  656    HB3  LYS  79           HB1      LYS  79  -0.823   1.922  -8.789
  657    HG2  LYS  79           HG2      LYS  79   0.267   4.075  -8.654
  658    HG3  LYS  79           HG1      LYS  79   1.841   3.311  -8.902
  659    HD2  LYS  79           HD2      LYS  79   0.977   2.424 -11.076
  660    HD3  LYS  79           HD1      LYS  79  -0.471   3.402 -10.837
  661    HE2  LYS  79           HE2      LYS  79   1.486   4.312 -12.282
  662    HE3  LYS  79           HE1      LYS  79   0.655   5.385 -11.157
  663    HZ1  LYS  79           HZ1      LYS  79   3.146   3.930 -10.495
  664    HZ2  LYS  79           HZ2      LYS  79   2.410   5.157  -9.600
  665    HZ3  LYS  79           HZ3      LYS  79   3.120   5.510 -11.097
  666    H    GLN  80           HN       GLN  80   1.767  -0.280  -7.797
  667    HA   GLN  80           HA       GLN  80  -0.210  -2.284  -7.514
  668    HB2  GLN  80           HB2      GLN  80   2.773  -2.508  -7.858
  669    HB3  GLN  80           HB1      GLN  80   1.634  -3.842  -8.011
  670    HG2  GLN  80           HG2      GLN  80   0.498  -2.544  -9.819
  671    HG3  GLN  80           HG1      GLN  80   1.835  -1.397  -9.743
  672   HE21  GLN  80          HE21      GLN  80   3.690  -3.647  -9.101
  673   HE22  GLN  80          HE22      GLN  80   3.977  -4.426 -10.613
  674    H    ALA  81           HN       ALA  81   2.365  -1.158  -5.416
  675    HA   ALA  81           HA       ALA  81   2.516  -3.326  -3.691
  676    HB1  ALA  81           HB1      ALA  81   2.725  -0.426  -2.900
  677    HB2  ALA  81           HB2      ALA  81   4.018  -1.344  -3.670
  678    HB3  ALA  81           HB3      ALA  81   3.436  -1.811  -2.072
  679    H    ILE  82           HN       ILE  82   0.282  -0.598  -3.774
  680    HA   ILE  82           HA       ILE  82  -1.146  -1.696  -1.509
  681    HB   ILE  82           HB       ILE  82  -0.887   0.734  -1.704
  682   HG12  ILE  82          HG12      ILE  82  -3.185   1.370  -1.223
  683   HG13  ILE  82          HG11      ILE  82  -3.775  -0.103  -1.986
  684   HG21  ILE  82          HG21      ILE  82  -2.637   0.526  -4.136
  685   HG22  ILE  82          HG22      ILE  82  -0.926   0.949  -4.115
  686   HG23  ILE  82          HG23      ILE  82  -2.108   2.019  -3.361
  687   HD11  ILE  82          HD11      ILE  82  -3.697  -0.069   0.530
  688   HD12  ILE  82          HD12      ILE  82  -1.941  -0.140   0.380
  689   HD13  ILE  82          HD13      ILE  82  -2.936  -1.446  -0.264
  690    H    PHE  83           HN       PHE  83  -1.791  -1.285  -4.988
  691    HA   PHE  83           HA       PHE  83  -4.402  -2.441  -4.800
  692    HB2  PHE  83           HB2      PHE  83  -4.431  -1.177  -6.675
  693    HB3  PHE  83           HB1      PHE  83  -2.691  -1.273  -6.882
  694    HD1  PHE  83           HD1      PHE  83  -5.692  -3.488  -7.236
  695    HD2  PHE  83           HD2      PHE  83  -1.920  -2.258  -8.778
  696    HE1  PHE  83           HE1      PHE  83  -5.995  -4.982  -9.167
  697    HE2  PHE  83           HE2      PHE  83  -2.217  -3.750 -10.708
  698    HZ   PHE  83           HZ       PHE  83  -4.255  -5.115 -10.905
  699    H    ASN  84           HN       ASN  84  -1.205  -3.676  -5.699
  700    HA   ASN  84           HA       ASN  84  -2.193  -6.227  -6.445
  701    HB2  ASN  84           HB2      ASN  84   0.079  -5.372  -7.125
  702    HB3  ASN  84           HB1      ASN  84   0.594  -5.621  -5.460
  703   HD21  ASN  84          HD21      ASN  84   2.175  -7.086  -6.147
  704   HD22  ASN  84          HD22      ASN  84   1.767  -8.690  -6.647
  705    H    TYR  85           HN       TYR  85  -1.351  -4.646  -3.444
  706    HA   TYR  85           HA       TYR  85  -1.156  -6.940  -1.832
  707    HB2  TYR  85           HB2      TYR  85  -0.594  -4.787  -0.880
  708    HB3  TYR  85           HB1      TYR  85  -2.204  -4.163  -1.216
  709    HD1  TYR  85           HD1      TYR  85  -0.601  -6.965   0.690
  710    HD2  TYR  85           HD2      TYR  85  -3.684  -4.035   0.547
  711    HE1  TYR  85           HE1      TYR  85  -1.316  -7.615   2.951
  712    HE2  TYR  85           HE2      TYR  85  -4.407  -4.680   2.808
  713    HH   TYR  85           HH       TYR  85  -4.258  -6.439   4.359
  714    H    LEU  86           HN       LEU  86  -3.812  -4.979  -2.964
  715    HA   LEU  86           HA       LEU  86  -5.881  -6.393  -1.679
  716    HB2  LEU  86           HB2      LEU  86  -5.912  -4.638  -4.116
  717    HB3  LEU  86           HB1      LEU  86  -7.356  -5.262  -3.338
  718    HG   LEU  86           HG       LEU  86  -5.335  -3.403  -2.073
  719   HD11  LEU  86          HD11      LEU  86  -6.746  -2.373  -3.805
  720   HD12  LEU  86          HD12      LEU  86  -7.070  -1.741  -2.192
  721   HD13  LEU  86          HD13      LEU  86  -8.178  -2.902  -2.923
  722   HD21  LEU  86          HD21      LEU  86  -6.189  -4.729  -0.329
  723   HD22  LEU  86          HD22      LEU  86  -7.814  -4.725  -1.011
  724   HD23  LEU  86          HD23      LEU  86  -7.152  -3.252  -0.305
  725    H    GLU  87           HN       GLU  87  -4.620  -6.543  -4.997
  726    HA   GLU  87           HA       GLU  87  -6.329  -8.565  -5.947
  727    HB2  GLU  87           HB2      GLU  87  -4.964  -7.094  -7.403
  728    HB3  GLU  87           HB1      GLU  87  -3.512  -7.915  -6.849
  729    HG2  GLU  87           HG2      GLU  87  -4.326 -10.008  -7.822
  730    HG3  GLU  87           HG1      GLU  87  -5.777  -9.180  -8.379
  731    H    LYS  88           HN       LYS  88  -3.179  -8.706  -4.384
  732    HA   LYS  88           HA       LYS  88  -2.765 -11.484  -4.720
  733    HB2  LYS  88           HB2      LYS  88  -0.994  -9.793  -4.238
  734    HB3  LYS  88           HB1      LYS  88  -1.613  -9.669  -2.598
  735    HG2  LYS  88           HG2      LYS  88  -1.079 -12.016  -2.215
  736    HG3  LYS  88           HG1      LYS  88  -0.464 -12.147  -3.864
  737    HD2  LYS  88           HD2      LYS  88   1.175 -10.339  -3.308
  738    HD3  LYS  88           HD1      LYS  88   0.634 -10.443  -1.631
  739    HE2  LYS  88           HE2      LYS  88   1.376 -12.706  -1.458
  740    HE3  LYS  88           HE1      LYS  88   1.700 -12.789  -3.188
  741    HZ1  LYS  88           HZ1      LYS  88   3.368 -11.840  -1.083
  742    HZ2  LYS  88           HZ2      LYS  88   3.191 -10.675  -2.296
  743    HZ3  LYS  88           HZ3      LYS  88   3.766 -12.217  -2.684
  744    H    LEU  89           HN       LEU  89  -4.129  -9.583  -2.031
  745    HA   LEU  89           HA       LEU  89  -4.449 -11.962  -0.439
  746    HB2  LEU  89           HB2      LEU  89  -5.174 -10.617   1.316
  747    HB3  LEU  89           HB1      LEU  89  -3.951  -9.670   0.499
  748    HG   LEU  89           HG       LEU  89  -6.134  -8.668  -0.714
  749   HD11  LEU  89          HD11      LEU  89  -8.065  -8.984   0.349
  750   HD12  LEU  89          HD12      LEU  89  -7.336  -8.624   1.913
  751   HD13  LEU  89          HD13      LEU  89  -7.271 -10.264   1.267
  752   HD21  LEU  89          HD21      LEU  89  -5.962  -6.807   0.790
  753   HD22  LEU  89          HD22      LEU  89  -4.349  -7.465   0.517
  754   HD23  LEU  89          HD23      LEU  89  -5.203  -7.815   2.020
  755    H    GLU  90           HN       GLU  90  -6.591  -9.814  -2.239
  756    HA   GLU  90           HA       GLU  90  -8.846  -9.827  -2.556
  757    HB2  GLU  90           HB2      GLU  90  -7.860 -12.471  -3.536
  758    HB3  GLU  90           HB1      GLU  90  -9.554 -12.030  -3.707
  759    HG2  GLU  90           HG2      GLU  90  -7.204 -10.500  -4.808
  760    HG3  GLU  90           HG1      GLU  90  -8.302 -11.526  -5.730
  Start of MODEL    8
    1    H1   MET   1           HT1      MET   1   5.089  -1.533  13.593
    2    H2   MET   1           HT2      MET   1   5.800  -0.178  14.313
    3    H3   MET   1           HT3      MET   1   6.446  -0.812  12.887
    4    HA   MET   1           HA       MET   1   4.703  -0.063  11.582
    5    HB2  MET   1           HB2      MET   1   2.942  -0.832  13.223
    6    HB3  MET   1           HB1      MET   1   3.202   0.667  14.107
    7    HG2  MET   1           HG2      MET   1   2.616   1.897  12.002
    8    HG3  MET   1           HG1      MET   1   2.139   0.347  11.312
    9    HE1  MET   1           HE1      MET   1  -1.010  -0.656  13.156
   10    HE2  MET   1           HE2      MET   1   0.538  -1.130  13.854
   11    HE3  MET   1           HE3      MET   1   0.332  -1.111  12.104
   12    H    ALA   2           HN       ALA   2   6.415   1.393  11.131
   13    HA   ALA   2           HA       ALA   2   6.236   3.955  12.588
   14    HB1  ALA   2           HB1      ALA   2   8.382   2.870  13.006
   15    HB2  ALA   2           HB2      ALA   2   8.604   4.317  12.023
   16    HB3  ALA   2           HB3      ALA   2   8.661   2.723  11.271
   17    H    THR   3           HN       THR   3   4.501   3.429  10.600
   18    HA   THR   3           HA       THR   3   5.438   4.196   8.031
   19    HB   THR   3           HB       THR   3   3.022   4.272   7.438
   20    HG1  THR   3           HG1      THR   3   2.116   3.100   9.694
   21   HG21  THR   3          HG21      THR   3   2.614   1.900   7.706
   22   HG22  THR   3          HG22      THR   3   3.812   1.814   8.996
   23   HG23  THR   3          HG23      THR   3   4.319   2.170   7.345
   24    H    THR   4           HN       THR   4   5.531   6.108   7.094
   25    HA   THR   4           HA       THR   4   4.621   8.476   8.588
   26    HB   THR   4           HB       THR   4   6.781   8.351   6.471
   27    HG1  THR   4           HG1      THR   4   7.666   7.230   8.119
   28   HG21  THR   4          HG21      THR   4   7.460  10.514   7.398
   29   HG22  THR   4          HG22      THR   4   6.131  10.444   8.554
   30   HG23  THR   4          HG23      THR   4   5.792  10.572   6.829
   31    H    THR   5           HN       THR   5   3.579  10.162   7.396
   32    HA   THR   5           HA       THR   5   1.848   9.243   5.353
   33    HB   THR   5           HB       THR   5   2.404  12.129   6.042
   34    HG1  THR   5           HG1      THR   5   1.650  10.254   7.707
   35   HG21  THR   5          HG21      THR   5   0.047  12.430   5.419
   36   HG22  THR   5          HG22      THR   5  -0.068  10.715   5.027
   37   HG23  THR   5          HG23      THR   5   0.983  11.767   4.080
   38    H    LEU   6           HN       LEU   6   2.432   8.815   3.352
   39    HA   LEU   6           HA       LEU   6   4.216  10.670   1.919
   40    HB2  LEU   6           HB2      LEU   6   4.199   7.661   1.601
   41    HB3  LEU   6           HB1      LEU   6   5.216   8.789   0.730
   42    HG   LEU   6           HG       LEU   6   5.377   8.127   3.672
   43   HD11  LEU   6          HD11      LEU   6   7.385   7.024   3.179
   44   HD12  LEU   6          HD12      LEU   6   7.471   7.719   1.562
   45   HD13  LEU   6          HD13      LEU   6   6.260   6.493   1.930
   46   HD21  LEU   6          HD21      LEU   6   5.906  10.451   3.423
   47   HD22  LEU   6          HD22      LEU   6   6.931  10.117   2.027
   48   HD23  LEU   6          HD23      LEU   6   7.413   9.559   3.629
   49    H    GLY   7           HN       GLY   7   3.891  10.599  -0.449
   50    HA2  GLY   7           HA2      GLY   7   1.082  10.495  -1.090
   51    HA3  GLY   7           HA1      GLY   7   2.384  10.972  -2.173
   52    H    VAL   8           HN       VAL   8   0.018   8.775  -1.810
   53    HA   VAL   8           HA       VAL   8   1.487   6.740  -3.348
   54    HB   VAL   8           HB       VAL   8  -0.402   6.297  -1.039
   55   HG11  VAL   8          HG11      VAL   8  -1.109   4.716  -2.699
   56   HG12  VAL   8          HG12      VAL   8  -0.165   3.861  -1.480
   57   HG13  VAL   8          HG13      VAL   8   0.558   4.258  -3.036
   58   HG21  VAL   8          HG21      VAL   8   1.912   6.652  -0.431
   59   HG22  VAL   8          HG22      VAL   8   2.426   5.404  -1.565
   60   HG23  VAL   8          HG23      VAL   8   1.467   4.969  -0.151
   61    H    LYS   9           HN       LYS   9   0.007   5.363  -4.669
   62    HA   LYS   9           HA       LYS   9  -2.286   6.949  -5.601
   63    HB2  LYS   9           HB2      LYS   9  -0.260   5.290  -7.061
   64    HB3  LYS   9           HB1      LYS   9  -1.855   5.515  -7.754
   65    HG2  LYS   9           HG2      LYS   9  -0.424   7.138  -8.719
   66    HG3  LYS   9           HG1      LYS   9  -1.498   7.978  -7.604
   67    HD2  LYS   9           HD2      LYS   9   0.705   8.871  -7.328
   68    HD3  LYS   9           HD1      LYS   9   0.327   7.907  -5.902
   69    HE2  LYS   9           HE2      LYS   9   1.650   6.411  -8.043
   70    HE3  LYS   9           HE1      LYS   9   2.619   7.723  -7.380
   71    HZ1  LYS   9           HZ1      LYS   9   1.426   5.458  -5.886
   72    HZ2  LYS   9           HZ2      LYS   9   2.163   6.789  -5.147
   73    HZ3  LYS   9           HZ3      LYS   9   3.069   5.764  -6.139
   74    H    LEU  10           HN       LEU  10  -4.209   6.063  -5.261
   75    HA   LEU  10           HA       LEU  10  -4.458   3.133  -5.023
   76    HB2  LEU  10           HB2      LEU  10  -5.057   5.239  -3.061
   77    HB3  LEU  10           HB1      LEU  10  -6.345   4.074  -3.293
   78    HG   LEU  10           HG       LEU  10  -3.542   3.179  -2.716
   79   HD11  LEU  10          HD11      LEU  10  -4.201   3.055  -0.339
   80   HD12  LEU  10          HD12      LEU  10  -5.673   3.947  -0.724
   81   HD13  LEU  10          HD13      LEU  10  -4.098   4.713  -0.931
   82   HD21  LEU  10          HD21      LEU  10  -6.292   1.996  -2.431
   83   HD22  LEU  10          HD22      LEU  10  -4.842   1.265  -1.748
   84   HD23  LEU  10          HD23      LEU  10  -4.990   1.463  -3.494
   85    H    ASP  11           HN       ASP  11  -6.354   2.256  -5.835
   86    HA   ASP  11           HA       ASP  11  -7.904   3.919  -7.615
   87    HB2  ASP  11           HB2      ASP  11  -8.648   1.086  -6.919
   88    HB3  ASP  11           HB1      ASP  11  -8.869   1.938  -8.438
   89    H    ASP  12           HN       ASP  12 -10.272   4.005  -7.544
   90    HA   ASP  12           HA       ASP  12 -11.258   4.691  -4.971
   91    HB2  ASP  12           HB2      ASP  12 -12.399   4.617  -7.722
   92    HB3  ASP  12           HB1      ASP  12 -13.534   4.620  -6.378
   93    HA   PRO  13           HA       PRO  13 -14.053   0.707  -5.381
   94    HB2  PRO  13           HB2      PRO  13 -13.037  -1.233  -7.055
   95    HB3  PRO  13           HB1      PRO  13 -14.318  -0.102  -7.502
   96    HG2  PRO  13           HG2      PRO  13 -11.390   0.020  -8.095
   97    HG3  PRO  13           HG1      PRO  13 -12.765   0.410  -9.147
   98    HD2  PRO  13           HD2      PRO  13 -11.327   2.331  -7.950
   99    HD3  PRO  13           HD1      PRO  13 -13.082   2.489  -8.172
  100    H    THR  14           HN       THR  14 -10.554   0.518  -5.797
  101    HA   THR  14           HA       THR  14 -10.304  -1.755  -4.085
  102    HB   THR  14           HB       THR  14  -8.612  -0.719  -5.904
  103    HG1  THR  14           HG1      THR  14  -6.985  -1.966  -4.410
  104   HG21  THR  14          HG21      THR  14  -8.089   1.250  -4.492
  105   HG22  THR  14          HG22      THR  14  -6.674   0.254  -4.832
  106   HG23  THR  14          HG23      THR  14  -7.461   0.160  -3.257
  107    H    ARG  15           HN       ARG  15 -10.447   1.693  -3.656
  108    HA   ARG  15           HA       ARG  15  -9.263   1.928  -1.120
  109    HB2  ARG  15           HB2      ARG  15  -9.814   3.846  -2.557
  110    HB3  ARG  15           HB1      ARG  15 -11.527   3.525  -2.343
  111    HG2  ARG  15           HG2      ARG  15 -10.952   5.346  -0.938
  112    HG3  ARG  15           HG1      ARG  15 -11.221   3.944   0.099
  113    HD2  ARG  15           HD2      ARG  15  -8.809   3.580   0.239
  114    HD3  ARG  15           HD1      ARG  15  -8.531   4.963  -0.819
  115    HE   ARG  15           HE       ARG  15  -8.993   6.386   0.936
  116   HH11  ARG  15          HH21      ARG  15  -9.708   3.085   1.853
  117   HH12  ARG  15          HH22      ARG  15  -9.893   3.456   3.533
  118   HH21  ARG  15          HH11      ARG  15  -9.246   6.892   3.147
  119   HH22  ARG  15          HH12      ARG  15  -9.637   5.638   4.274
  120    H    GLU  16           HN       GLU  16 -12.651   1.375  -2.088
  121    HA   GLU  16           HA       GLU  16 -13.602   1.098   0.574
  122    HB2  GLU  16           HB2      GLU  16 -15.591   0.016  -0.427
  123    HB3  GLU  16           HB1      GLU  16 -15.180   1.527  -1.220
  124    HG2  GLU  16           HG2      GLU  16 -14.135   0.279  -3.041
  125    HG3  GLU  16           HG1      GLU  16 -14.551  -1.231  -2.240
  126    H    ARG  17           HN       ARG  17 -12.251  -1.149  -1.770
  127    HA   ARG  17           HA       ARG  17 -12.666  -3.545  -0.359
  128    HB2  ARG  17           HB2      ARG  17 -11.789  -3.159  -2.781
  129    HB3  ARG  17           HB1      ARG  17 -10.207  -3.056  -2.026
  130    HG2  ARG  17           HG2      ARG  17 -11.989  -5.423  -1.556
  131    HG3  ARG  17           HG1      ARG  17 -10.971  -5.314  -2.992
  132    HD2  ARG  17           HD2      ARG  17  -9.007  -4.998  -1.505
  133    HD3  ARG  17           HD1      ARG  17 -10.059  -5.255  -0.118
  134    HE   ARG  17           HE       ARG  17  -9.811  -7.344  -2.175
  135   HH11  ARG  17          HH21      ARG  17  -9.359  -6.270   1.124
  136   HH12  ARG  17          HH22      ARG  17  -8.927  -7.840   1.712
  137   HH21  ARG  17          HH11      ARG  17  -9.210  -9.429  -1.410
  138   HH22  ARG  17          HH12      ARG  17  -8.845  -9.624   0.281
  139    H    LEU  18           HN       LEU  18 -10.218  -1.034  -0.097
  140    HA   LEU  18           HA       LEU  18  -8.404  -2.349   1.587
  141    HB2  LEU  18           HB2      LEU  18  -9.004   0.443   0.892
  142    HB3  LEU  18           HB1      LEU  18  -8.355   0.244   2.507
  143    HG   LEU  18           HG       LEU  18  -6.487  -1.131   1.313
  144   HD11  LEU  18          HD11      LEU  18  -6.037  -0.570  -0.933
  145   HD12  LEU  18          HD12      LEU  18  -7.314   0.645  -0.960
  146   HD13  LEU  18          HD13      LEU  18  -7.728  -1.067  -0.875
  147   HD21  LEU  18          HD21      LEU  18  -5.249   0.996   0.877
  148   HD22  LEU  18          HD22      LEU  18  -6.009   0.897   2.465
  149   HD23  LEU  18          HD23      LEU  18  -6.752   1.864   1.191
  150    H    LYS  19           HN       LYS  19 -11.360  -0.502   2.276
  151    HA   LYS  19           HA       LYS  19 -11.165  -0.661   5.076
  152    HB2  LYS  19           HB2      LYS  19 -12.801   0.808   3.959
  153    HB3  LYS  19           HB1      LYS  19 -13.712  -0.611   3.455
  154    HG2  LYS  19           HG2      LYS  19 -14.118  -1.187   5.800
  155    HG3  LYS  19           HG1      LYS  19 -13.202   0.232   6.307
  156    HD2  LYS  19           HD2      LYS  19 -14.817   1.688   5.221
  157    HD3  LYS  19           HD1      LYS  19 -15.711   0.285   4.635
  158    HE2  LYS  19           HE2      LYS  19 -16.859   1.118   6.551
  159    HE3  LYS  19           HE1      LYS  19 -16.069  -0.384   7.018
  160    HZ1  LYS  19           HZ1      LYS  19 -14.318   0.896   8.069
  161    HZ2  LYS  19           HZ2      LYS  19 -15.821   1.338   8.702
  162    HZ3  LYS  19           HZ3      LYS  19 -15.046   2.346   7.588
  163    H    ALA  20           HN       ALA  20 -12.498  -2.877   2.732
  164    HA   ALA  20           HA       ALA  20 -13.584  -4.773   4.481
  165    HB1  ALA  20           HB1      ALA  20 -12.306  -5.291   1.794
  166    HB2  ALA  20           HB2      ALA  20 -13.973  -4.773   2.046
  167    HB3  ALA  20           HB3      ALA  20 -13.441  -6.348   2.635
  168    H    ALA  21           HN       ALA  21 -10.306  -4.355   3.222
  169    HA   ALA  21           HA       ALA  21  -9.186  -6.673   4.420
  170    HB1  ALA  21           HB1      ALA  21  -8.062  -5.480   2.595
  171    HB2  ALA  21           HB2      ALA  21  -7.018  -5.605   4.011
  172    HB3  ALA  21           HB3      ALA  21  -7.832  -4.084   3.647
  173    H    ALA  22           HN       ALA  22  -9.666  -3.353   5.413
  174    HA   ALA  22           HA       ALA  22  -8.331  -3.417   7.889
  175    HB1  ALA  22           HB1      ALA  22  -9.159  -1.359   6.711
  176    HB2  ALA  22           HB2      ALA  22  -9.550  -1.430   8.428
  177    HB3  ALA  22           HB3      ALA  22 -10.786  -1.802   7.226
  178    H    GLN  23           HN       GLN  23 -11.531  -4.289   6.887
  179    HA   GLN  23           HA       GLN  23 -12.602  -4.765   9.456
  180    HB2  GLN  23           HB2      GLN  23 -13.398  -5.746   6.716
  181    HB3  GLN  23           HB1      GLN  23 -14.326  -6.093   8.170
  182    HG2  GLN  23           HG2      GLN  23 -13.678  -3.330   7.170
  183    HG3  GLN  23           HG1      GLN  23 -15.195  -4.173   6.873
  184   HE21  GLN  23          HE21      GLN  23 -13.287  -2.427   9.149
  185   HE22  GLN  23          HE22      GLN  23 -14.463  -2.357  10.413
  186    H    SER  24           HN       SER  24 -10.966  -6.895   7.105
  187    HA   SER  24           HA       SER  24 -11.335  -9.232   8.697
  188    HB2  SER  24           HB2      SER  24  -9.530 -10.218   7.244
  189    HB3  SER  24           HB1      SER  24 -10.902  -9.563   6.358
  190    HG   SER  24           HG       SER  24  -8.273  -8.657   6.514
  191    H    ILE  25           HN       ILE  25  -9.262  -6.550   8.849
  192    HA   ILE  25           HA       ILE  25  -7.354  -7.909  10.597
  193    HB   ILE  25           HB       ILE  25  -7.316  -5.430   8.941
  194   HG12  ILE  25          HG12      ILE  25  -5.153  -7.440   9.565
  195   HG13  ILE  25          HG11      ILE  25  -6.314  -7.619   8.255
  196   HG21  ILE  25          HG21      ILE  25  -6.774  -4.461  11.067
  197   HG22  ILE  25          HG22      ILE  25  -5.311  -4.573  10.088
  198   HG23  ILE  25          HG23      ILE  25  -5.593  -5.730  11.389
  199   HD11  ILE  25          HD11      ILE  25  -4.032  -6.714   7.655
  200   HD12  ILE  25          HD12      ILE  25  -4.513  -5.232   8.482
  201   HD13  ILE  25          HD13      ILE  25  -5.422  -5.795   7.080
  202    H    ASP  26           HN       ASP  26 -10.196  -6.336  10.713
  203    HA   ASP  26           HA       ASP  26 -11.502  -5.399  12.261
  204    HB2  ASP  26           HB2      ASP  26 -10.649  -7.467  13.524
  205    HB3  ASP  26           HB1      ASP  26  -9.616  -6.346  14.405
  206    H    ARG  27           HN       ARG  27  -9.722  -3.683  11.067
  207    HA   ARG  27           HA       ARG  27  -9.404  -1.730  13.254
  208    HB2  ARG  27           HB2      ARG  27  -7.333  -2.329  11.139
  209    HB3  ARG  27           HB1      ARG  27  -7.290  -0.921  12.189
  210    HG2  ARG  27           HG2      ARG  27  -7.141  -2.377  14.143
  211    HG3  ARG  27           HG1      ARG  27  -7.186  -3.792  13.090
  212    HD2  ARG  27           HD2      ARG  27  -5.142  -2.829  11.948
  213    HD3  ARG  27           HD1      ARG  27  -5.049  -1.689  13.289
  214    HE   ARG  27           HE       ARG  27  -5.032  -3.869  14.685
  215   HH11  ARG  27          HH21      ARG  27  -3.555  -3.428  11.561
  216   HH12  ARG  27          HH22      ARG  27  -2.262  -4.539  11.855
  217   HH21  ARG  27          HH11      ARG  27  -3.336  -5.374  15.090
  218   HH22  ARG  27          HH12      ARG  27  -2.147  -5.661  13.862
  219    H    THR  28           HN       THR  28  -9.060   0.510  12.358
  220    HA   THR  28           HA       THR  28 -11.114   1.017  10.419
  221    HB   THR  28           HB       THR  28 -10.224   2.385  12.607
  222    HG1  THR  28           HG1      THR  28 -12.074   3.235  12.087
  223   HG21  THR  28          HG21      THR  28  -9.166   4.404  12.009
  224   HG22  THR  28          HG22      THR  28  -9.352   4.084  10.286
  225   HG23  THR  28          HG23      THR  28  -8.215   3.133  11.241
  226    HA   PRO  29           HA       PRO  29  -8.947   1.308   6.591
  227    HB2  PRO  29           HB2      PRO  29  -9.727   4.188   6.493
  228    HB3  PRO  29           HB1      PRO  29  -9.888   2.934   5.258
  229    HG2  PRO  29           HG2      PRO  29 -11.998   3.694   6.672
  230    HG3  PRO  29           HG1      PRO  29 -11.744   1.983   6.278
  231    HD2  PRO  29           HD2      PRO  29 -11.347   3.412   8.865
  232    HD3  PRO  29           HD1      PRO  29 -11.889   1.749   8.564
  233    H    HIS  30           HN       HIS  30  -8.341   4.028   8.797
  234    HA   HIS  30           HA       HIS  30  -6.049   5.031   7.540
  235    HB2  HIS  30           HB2      HIS  30  -7.219   6.228   9.331
  236    HB3  HIS  30           HB1      HIS  30  -6.749   4.992  10.489
  237    HD1  HIS  30           HD1      HIS  30  -4.654   5.430  11.750
  238    HD2  HIS  30           HD2      HIS  30  -4.899   7.712   8.289
  239    HE1  HIS  30           HE1      HIS  30  -2.678   6.980  11.828
  240    HE2  HIS  30           HE2      HIS  30  -3.035   8.542   9.885
  241    H    TRP  31           HN       TRP  31  -6.356   2.626  10.133
  242    HA   TRP  31           HA       TRP  31  -3.597   2.102  10.397
  243    HB2  TRP  31           HB2      TRP  31  -5.961   0.333  11.031
  244    HB3  TRP  31           HB1      TRP  31  -4.311   0.040  11.562
  245    HD1  TRP  31           HD1      TRP  31  -7.450   1.686  12.609
  246    HE1  TRP  31           HE1      TRP  31  -7.071   3.074  14.744
  247    HE3  TRP  31           HE3      TRP  31  -2.337   1.673  12.681
  248    HZ2  TRP  31           HZ2      TRP  31  -4.890   4.039  16.251
  249    HZ3  TRP  31           HZ3      TRP  31  -1.182   2.853  14.506
  250    HH2  TRP  31           HH2      TRP  31  -2.434   4.011  16.253
  251    H    LEU  32           HN       LEU  32  -6.196   0.623   8.626
  252    HA   LEU  32           HA       LEU  32  -4.794  -1.536   7.570
  253    HB2  LEU  32           HB2      LEU  32  -7.244  -1.359   7.553
  254    HB3  LEU  32           HB1      LEU  32  -7.128  -0.094   6.347
  255    HG   LEU  32           HG       LEU  32  -7.720  -2.483   5.577
  256   HD11  LEU  32          HD11      LEU  32  -7.103  -0.569   4.104
  257   HD12  LEU  32          HD12      LEU  32  -6.682  -2.155   3.460
  258   HD13  LEU  32          HD13      LEU  32  -5.434  -1.130   4.167
  259   HD21  LEU  32          HD21      LEU  32  -4.737  -2.787   5.872
  260   HD22  LEU  32          HD22      LEU  32  -5.828  -3.930   5.091
  261   HD23  LEU  32          HD23      LEU  32  -5.959  -3.629   6.824
  262    H    ILE  33           HN       ILE  33  -5.197   1.723   6.323
  263    HA   ILE  33           HA       ILE  33  -4.090   1.223   3.797
  264    HB   ILE  33           HB       ILE  33  -4.065   3.744   5.463
  265   HG12  ILE  33          HG12      ILE  33  -5.681   3.061   3.002
  266   HG13  ILE  33          HG11      ILE  33  -6.266   2.814   4.644
  267   HG21  ILE  33          HG21      ILE  33  -2.220   3.897   3.949
  268   HG22  ILE  33          HG22      ILE  33  -3.526   4.912   3.339
  269   HG23  ILE  33          HG23      ILE  33  -3.214   3.339   2.604
  270   HD11  ILE  33          HD11      ILE  33  -5.474   5.456   3.440
  271   HD12  ILE  33          HD12      ILE  33  -6.088   5.203   5.074
  272   HD13  ILE  33          HD13      ILE  33  -7.123   4.878   3.683
  273    H    LYS  34           HN       LYS  34  -2.559   2.339   6.812
  274    HA   LYS  34           HA       LYS  34   0.090   2.385   5.796
  275    HB2  LYS  34           HB2      LYS  34  -0.225   1.631   8.638
  276    HB3  LYS  34           HB1      LYS  34   0.735   2.913   7.920
  277    HG2  LYS  34           HG2      LYS  34  -1.409   4.183   7.592
  278    HG3  LYS  34           HG1      LYS  34  -2.193   2.952   8.577
  279    HD2  LYS  34           HD2      LYS  34   0.096   4.723   9.439
  280    HD3  LYS  34           HD1      LYS  34  -1.591   4.895   9.924
  281    HE2  LYS  34           HE2      LYS  34  -1.523   2.766  11.060
  282    HE3  LYS  34           HE1      LYS  34   0.116   2.475  10.486
  283    HZ1  LYS  34           HZ1      LYS  34   0.283   3.224  12.703
  284    HZ2  LYS  34           HZ2      LYS  34  -0.771   4.515  12.448
  285    HZ3  LYS  34           HZ3      LYS  34   0.763   4.532  11.745
  286    H    GLN  35           HN       GLN  35  -1.786  -0.065   7.499
  287    HA   GLN  35           HA       GLN  35   0.286  -1.978   7.620
  288    HB2  GLN  35           HB2      GLN  35  -2.699  -2.181   7.921
  289    HB3  GLN  35           HB1      GLN  35  -1.638  -3.577   8.074
  290    HG2  GLN  35           HG2      GLN  35  -0.931  -1.191   9.665
  291    HG3  GLN  35           HG1      GLN  35  -2.383  -2.067  10.146
  292   HE21  GLN  35          HE21      GLN  35   0.154  -3.827   8.626
  293   HE22  GLN  35          HE22      GLN  35   0.745  -4.620  10.042
  294    H    ALA  36           HN       ALA  36  -2.472  -1.653   5.388
  295    HA   ALA  36           HA       ALA  36  -2.180  -3.959   3.949
  296    HB1  ALA  36           HB1      ALA  36  -3.017  -1.228   3.028
  297    HB2  ALA  36           HB2      ALA  36  -4.038  -2.601   3.460
  298    HB3  ALA  36           HB3      ALA  36  -3.075  -2.647   1.983
  299    H    ILE  37           HN       ILE  37  -0.368  -0.921   3.466
  300    HA   ILE  37           HA       ILE  37   1.041  -2.111   1.270
  301    HB   ILE  37           HB       ILE  37   0.710   0.278   1.260
  302   HG12  ILE  37          HG12      ILE  37   3.002   1.042   0.809
  303   HG13  ILE  37          HG11      ILE  37   3.637  -0.389   1.613
  304   HG21  ILE  37          HG21      ILE  37   1.796   1.778   2.826
  305   HG22  ILE  37          HG22      ILE  37   2.451   0.400   3.710
  306   HG23  ILE  37          HG23      ILE  37   0.710   0.672   3.666
  307   HD11  ILE  37          HD11      ILE  37   1.887  -0.462  -0.828
  308   HD12  ILE  37          HD12      ILE  37   2.758  -1.807  -0.089
  309   HD13  ILE  37          HD13      ILE  37   3.649  -0.497  -0.863
  310    H    PHE  38           HN       PHE  38   2.092  -1.335   4.624
  311    HA   PHE  38           HA       PHE  38   4.653  -2.551   4.125
  312    HB2  PHE  38           HB2      PHE  38   5.289  -1.485   5.996
  313    HB3  PHE  38           HB1      PHE  38   3.694  -0.757   6.017
  314    HD1  PHE  38           HD1      PHE  38   5.558  -3.739   7.264
  315    HD2  PHE  38           HD2      PHE  38   2.347  -1.012   7.873
  316    HE1  PHE  38           HE1      PHE  38   5.158  -4.714   9.486
  317    HE2  PHE  38           HE2      PHE  38   1.940  -1.987  10.093
  318    HZ   PHE  38           HZ       PHE  38   3.344  -3.840  10.903
  319    H    ASN  39           HN       ASN  39   1.659  -3.542   5.652
  320    HA   ASN  39           HA       ASN  39   2.683  -6.008   6.592
  321    HB2  ASN  39           HB2      ASN  39   0.584  -4.984   7.478
  322    HB3  ASN  39           HB1      ASN  39  -0.187  -5.361   5.942
  323   HD21  ASN  39          HD21      ASN  39   1.703  -6.971   8.502
  324   HD22  ASN  39          HD22      ASN  39   0.751  -8.417   8.501
  325    H    TYR  40           HN       TYR  40   1.531  -4.809   3.509
  326    HA   TYR  40           HA       TYR  40   1.073  -7.314   2.296
  327    HB2  TYR  40           HB2      TYR  40   0.467  -5.470   0.940
  328    HB3  TYR  40           HB1      TYR  40   1.989  -4.641   1.239
  329    HD1  TYR  40           HD1      TYR  40   1.143  -8.051  -0.077
  330    HD2  TYR  40           HD2      TYR  40   3.153  -4.358  -0.718
  331    HE1  TYR  40           HE1      TYR  40   2.046  -8.917  -2.192
  332    HE2  TYR  40           HE2      TYR  40   4.065  -5.215  -2.833
  333    HH   TYR  40           HH       TYR  40   4.474  -7.184  -4.000
  334    H    LEU  41           HN       LEU  41   3.865  -5.286   2.775
  335    HA   LEU  41           HA       LEU  41   5.730  -7.014   1.540
  336    HB2  LEU  41           HB2      LEU  41   6.155  -4.775   3.486
  337    HB3  LEU  41           HB1      LEU  41   7.425  -5.563   2.568
  338    HG   LEU  41           HG       LEU  41   5.133  -3.978   1.407
  339   HD11  LEU  41          HD11      LEU  41   6.543  -2.369   2.223
  340   HD12  LEU  41          HD12      LEU  41   7.201  -2.619   0.605
  341   HD13  LEU  41          HD13      LEU  41   7.982  -3.361   2.000
  342   HD21  LEU  41          HD21      LEU  41   7.395  -5.477   0.109
  343   HD22  LEU  41          HD22      LEU  41   6.465  -4.225  -0.713
  344   HD23  LEU  41          HD23      LEU  41   5.663  -5.689  -0.146
  345    H    GLU  42           HN       GLU  42   4.738  -6.509   4.874
  346    HA   GLU  42           HA       GLU  42   6.630  -8.259   6.054
  347    HB2  GLU  42           HB2      GLU  42   5.353  -6.479   7.257
  348    HB3  GLU  42           HB1      GLU  42   3.909  -7.469   7.102
  349    HG2  GLU  42           HG2      GLU  42   5.039  -9.245   8.403
  350    HG3  GLU  42           HG1      GLU  42   6.402  -8.150   8.641
  351    H    LYS  43           HN       LYS  43   3.327  -8.699   4.886
  352    HA   LYS  43           HA       LYS  43   3.008 -11.354   5.847
  353    HB2  LYS  43           HB2      LYS  43   1.138  -9.799   5.217
  354    HB3  LYS  43           HB1      LYS  43   1.564 -10.060   3.532
  355    HG2  LYS  43           HG2      LYS  43   1.163 -12.501   3.900
  356    HG3  LYS  43           HG1      LYS  43   0.534 -12.091   5.497
  357    HD2  LYS  43           HD2      LYS  43  -0.534 -10.955   2.915
  358    HD3  LYS  43           HD1      LYS  43  -1.216 -12.364   3.729
  359    HE2  LYS  43           HE2      LYS  43  -2.558 -10.702   4.567
  360    HE3  LYS  43           HE1      LYS  43  -1.290 -10.741   5.790
  361    HZ1  LYS  43           HZ1      LYS  43  -2.030  -8.633   4.024
  362    HZ2  LYS  43           HZ2      LYS  43  -0.381  -8.990   3.896
  363    HZ3  LYS  43           HZ3      LYS  43  -1.042  -8.588   5.400
  364    H    LEU  44           HN       LEU  44   3.930 -10.009   2.682
  365    HA   LEU  44           HA       LEU  44   4.171 -12.585   1.481
  366    HB2  LEU  44           HB2      LEU  44   4.785 -11.515  -0.466
  367    HB3  LEU  44           HB1      LEU  44   3.825 -10.285   0.327
  368    HG   LEU  44           HG       LEU  44   6.272  -9.567   1.207
  369   HD11  LEU  44          HD11      LEU  44   7.969 -10.385   0.027
  370   HD12  LEU  44          HD12      LEU  44   7.183  -9.946  -1.489
  371   HD13  LEU  44          HD13      LEU  44   6.845 -11.506  -0.741
  372   HD21  LEU  44          HD21      LEU  44   6.254  -7.872  -0.529
  373   HD22  LEU  44          HD22      LEU  44   4.620  -8.142   0.078
  374   HD23  LEU  44          HD23      LEU  44   5.108  -8.823  -1.474
  375    H    GLU  45           HN       GLU  45   6.193 -10.515   3.330
  376    HA   GLU  45           HA       GLU  45   8.191 -10.734   4.303
  377    HB2  GLU  45           HB2      GLU  45   7.776 -13.620   3.553
  378    HB3  GLU  45           HB1      GLU  45   9.202 -13.079   4.432
  379    HG2  GLU  45           HG2      GLU  45   7.760 -12.208   6.220
  380    HG3  GLU  45           HG1      GLU  45   6.339 -12.758   5.335
  381    H1   MET  46           HT1      MET  46  -5.095  -1.628 -13.770
  382    H2   MET  46           HT2      MET  46  -5.792  -0.323 -14.589
  383    H3   MET  46           HT3      MET  46  -6.473  -0.874 -13.144
  384    HA   MET  46           HA       MET  46  -4.705  -0.089 -11.854
  385    HB2  MET  46           HB2      MET  46  -2.939  -0.788 -13.523
  386    HB3  MET  46           HB1      MET  46  -3.282   0.691 -14.409
  387    HG2  MET  46           HG2      MET  46  -2.725   1.954 -12.312
  388    HG3  MET  46           HG1      MET  46  -2.162   0.431 -11.630
  389    HE1  MET  46           HE1      MET  46   1.017  -0.410 -13.473
  390    HE2  MET  46           HE2      MET  46  -0.496  -0.971 -14.181
  391    HE3  MET  46           HE3      MET  46  -0.306  -0.931 -12.429
  392    H    ALA  47           HN       ALA  47  -6.465   1.283 -11.378
  393    HA   ALA  47           HA       ALA  47  -6.425   3.848 -12.843
  394    HB1  ALA  47           HB1      ALA  47  -8.520   2.670 -13.259
  395    HB2  ALA  47           HB2      ALA  47  -8.807   4.095 -12.260
  396    HB3  ALA  47           HB3      ALA  47  -8.784   2.493 -11.524
  397    H    THR  48           HN       THR  48  -4.670   3.359 -10.848
  398    HA   THR  48           HA       THR  48  -5.614   4.071  -8.274
  399    HB   THR  48           HB       THR  48  -3.203   4.253  -7.697
  400    HG1  THR  48           HG1      THR  48  -2.158   3.178  -9.888
  401   HG21  THR  48          HG21      THR  48  -2.674   1.913  -8.013
  402   HG22  THR  48          HG22      THR  48  -3.871   1.789  -9.301
  403   HG23  THR  48          HG23      THR  48  -4.389   2.085  -7.642
  404    H    THR  49           HN       THR  49  -5.779   5.964  -7.305
  405    HA   THR  49           HA       THR  49  -4.986   8.394  -8.769
  406    HB   THR  49           HB       THR  49  -7.158   8.134  -6.675
  407    HG1  THR  49           HG1      THR  49  -8.016   7.041  -8.340
  408   HG21  THR  49          HG21      THR  49  -7.916  10.291  -7.549
  409   HG22  THR  49          HG22      THR  49  -6.578  10.306  -8.697
  410   HG23  THR  49          HG23      THR  49  -6.255  10.402  -6.966
  411    H    THR  50           HN       THR  50  -4.015  10.101  -7.552
  412    HA   THR  50           HA       THR  50  -2.260   9.245  -5.510
  413    HB   THR  50           HB       THR  50  -2.959  12.117  -6.091
  414    HG1  THR  50           HG1      THR  50  -1.996  10.239  -7.783
  415   HG21  THR  50          HG21      THR  50  -0.582  12.477  -5.558
  416   HG22  THR  50          HG22      THR  50  -0.401  10.753  -5.233
  417   HG23  THR  50          HG23      THR  50  -1.446  11.738  -4.209
  418    H    LEU  51           HN       LEU  51  -2.838   8.743  -3.524
  419    HA   LEU  51           HA       LEU  51  -4.711  10.483  -2.062
  420    HB2  LEU  51           HB2      LEU  51  -4.548   7.474  -1.801
  421    HB3  LEU  51           HB1      LEU  51  -5.619   8.534  -0.911
  422    HG   LEU  51           HG       LEU  51  -5.747   7.919  -3.864
  423   HD11  LEU  51          HD11      LEU  51  -7.703   6.716  -3.394
  424   HD12  LEU  51          HD12      LEU  51  -7.822   7.378  -1.765
  425   HD13  LEU  51          HD13      LEU  51  -6.555   6.215  -2.153
  426   HD21  LEU  51          HD21      LEU  51  -6.383  10.211  -3.576
  427   HD22  LEU  51          HD22      LEU  51  -7.394   9.806  -2.189
  428   HD23  LEU  51          HD23      LEU  51  -7.847   9.253  -3.801
  429    H    GLY  52           HN       GLY  52  -4.385  10.377   0.310
  430    HA2  GLY  52           HA2      GLY  52  -1.571  10.408   0.941
  431    HA3  GLY  52           HA1      GLY  52  -2.891  10.799   2.035
  432    H    VAL  53           HN       VAL  53  -0.420   8.729   1.625
  433    HA   VAL  53           HA       VAL  53  -1.783   6.598   3.132
  434    HB   VAL  53           HB       VAL  53   0.119   6.285   0.812
  435   HG11  VAL  53          HG11      VAL  53   0.902   4.712   2.444
  436   HG12  VAL  53          HG12      VAL  53  -0.004   3.834   1.212
  437   HG13  VAL  53          HG13      VAL  53  -0.741   4.171   2.776
  438   HG21  VAL  53          HG21      VAL  53  -2.211   6.543   0.213
  439   HG22  VAL  53          HG22      VAL  53  -2.663   5.250   1.324
  440   HG23  VAL  53          HG23      VAL  53  -1.687   4.888  -0.098
  441    H    LYS  54           HN       LYS  54  -0.243   5.279   4.434
  442    HA   LYS  54           HA       LYS  54   1.980   6.953   5.381
  443    HB2  LYS  54           HB2      LYS  54   0.041   5.179   6.823
  444    HB3  LYS  54           HB1      LYS  54   1.626   5.471   7.513
  445    HG2  LYS  54           HG2      LYS  54   0.125   7.009   8.507
  446    HG3  LYS  54           HG1      LYS  54   1.149   7.916   7.396
  447    HD2  LYS  54           HD2      LYS  54  -1.099   8.700   7.148
  448    HD3  LYS  54           HD1      LYS  54  -0.681   7.779   5.705
  449    HE2  LYS  54           HE2      LYS  54  -1.913   6.189   7.833
  450    HE3  LYS  54           HE1      LYS  54  -2.952   7.455   7.186
  451    HZ1  LYS  54           HZ1      LYS  54  -1.659   5.255   5.681
  452    HZ2  LYS  54           HZ2      LYS  54  -2.431   6.563   4.939
  453    HZ3  LYS  54           HZ3      LYS  54  -3.313   5.505   5.917
  454    H    LEU  55           HN       LEU  55   3.943   6.162   5.041
  455    HA   LEU  55           HA       LEU  55   4.323   3.252   4.747
  456    HB2  LEU  55           HB2      LEU  55   4.825   5.417   2.825
  457    HB3  LEU  55           HB1      LEU  55   6.165   4.309   3.035
  458    HG   LEU  55           HG       LEU  55   3.405   3.297   2.443
  459   HD11  LEU  55          HD11      LEU  55   4.068   3.244   0.064
  460   HD12  LEU  55          HD12      LEU  55   5.497   4.197   0.465
  461   HD13  LEU  55          HD13      LEU  55   3.888   4.885   0.685
  462   HD21  LEU  55          HD21      LEU  55   6.206   2.247   2.138
  463   HD22  LEU  55          HD22      LEU  55   4.791   1.462   1.443
  464   HD23  LEU  55          HD23      LEU  55   4.931   1.636   3.191
  465    H    ASP  56           HN       ASP  56   6.253   2.443   5.547
  466    HA   ASP  56           HA       ASP  56   7.732   4.136   7.357
  467    HB2  ASP  56           HB2      ASP  56   8.602   1.357   6.592
  468    HB3  ASP  56           HB1      ASP  56   8.804   2.185   8.126
  469    H    ASP  57           HN       ASP  57  10.090   4.342   7.276
  470    HA   ASP  57           HA       ASP  57  11.028   5.098   4.704
  471    HB2  ASP  57           HB2      ASP  57  12.162   5.087   7.452
  472    HB3  ASP  57           HB1      ASP  57  13.308   5.129   6.116
  473    HA   PRO  58           HA       PRO  58  14.007   1.250   5.062
  474    HB2  PRO  58           HB2      PRO  58  13.090  -0.757   6.713
  475    HB3  PRO  58           HB1      PRO  58  14.316   0.428   7.172
  476    HG2  PRO  58           HG2      PRO  58  11.388   0.401   7.775
  477    HG3  PRO  58           HG1      PRO  58  12.746   0.843   8.827
  478    HD2  PRO  58           HD2      PRO  58  11.212   2.708   7.659
  479    HD3  PRO  58           HD1      PRO  58  12.957   2.948   7.881
  480    H    THR  59           HN       THR  59  10.521   0.919   5.459
  481    HA   THR  59           HA       THR  59  10.369  -1.352   3.728
  482    HB   THR  59           HB       THR  59   8.639  -0.418   5.563
  483    HG1  THR  59           HG1      THR  59   7.053  -1.713   4.089
  484   HG21  THR  59          HG21      THR  59   8.031   1.552   4.190
  485   HG22  THR  59          HG22      THR  59   6.659   0.492   4.513
  486   HG23  THR  59          HG23      THR  59   7.446   0.460   2.935
  487    H    ARG  60           HN       ARG  60  10.343   2.107   3.351
  488    HA   ARG  60           HA       ARG  60   9.166   2.325   0.814
  489    HB2  ARG  60           HB2      ARG  60   9.620   4.244   2.283
  490    HB3  ARG  60           HB1      ARG  60  11.347   4.008   2.071
  491    HG2  ARG  60           HG2      ARG  60  10.689   5.822   0.694
  492    HG3  ARG  60           HG1      ARG  60  11.027   4.452  -0.365
  493    HD2  ARG  60           HD2      ARG  60   8.639   3.976  -0.527
  494    HD3  ARG  60           HD1      ARG  60   8.288   5.321   0.559
  495    HE   ARG  60           HE       ARG  60   8.671   6.798  -1.165
  496   HH11  ARG  60          HH21      ARG  60   9.615   3.574  -2.143
  497   HH12  ARG  60          HH22      ARG  60   9.817   4.000  -3.807
  498   HH21  ARG  60          HH11      ARG  60   8.938   7.374  -3.355
  499   HH22  ARG  60          HH12      ARG  60   9.433   6.176  -4.501
  500    H    GLU  61           HN       GLU  61  12.568   1.903   1.788
  501    HA   GLU  61           HA       GLU  61  13.550   1.718  -0.870
  502    HB2  GLU  61           HB2      GLU  61  15.580   0.719   0.127
  503    HB3  GLU  61           HB1      GLU  61  15.079   2.180   0.968
  504    HG2  GLU  61           HG2      GLU  61  14.076   0.823   2.727
  505    HG3  GLU  61           HG1      GLU  61  14.574  -0.639   1.882
  506    H    ARG  62           HN       ARG  62  12.281  -0.628   1.427
  507    HA   ARG  62           HA       ARG  62  12.814  -2.977  -0.025
  508    HB2  ARG  62           HB2      ARG  62  11.903  -2.671   2.400
  509    HB3  ARG  62           HB1      ARG  62  10.324  -2.636   1.632
  510    HG2  ARG  62           HG2      ARG  62  12.229  -4.903   1.153
  511    HG3  ARG  62           HG1      ARG  62  11.184  -4.864   2.572
  512    HD2  ARG  62           HD2      ARG  62   9.232  -4.623   1.043
  513    HD3  ARG  62           HD1      ARG  62  10.326  -4.838  -0.319
  514    HE   ARG  62           HE       ARG  62  10.156  -6.929   1.740
  515   HH11  ARG  62          HH21      ARG  62   9.613  -5.889  -1.561
  516   HH12  ARG  62          HH22      ARG  62   9.272  -7.485  -2.143
  517   HH21  ARG  62          HH11      ARG  62   9.692  -9.048   0.988
  518   HH22  ARG  62          HH12      ARG  62   9.322  -9.275  -0.699
  519    H    LEU  63           HN       LEU  63  10.258  -0.573  -0.251
  520    HA   LEU  63           HA       LEU  63   8.512  -1.932  -1.968
  521    HB2  LEU  63           HB2      LEU  63   8.987   0.868  -1.215
  522    HB3  LEU  63           HB1      LEU  63   8.350   0.674  -2.834
  523    HG   LEU  63           HG       LEU  63   6.544  -0.807  -1.667
  524   HD11  LEU  63          HD11      LEU  63   6.065  -0.303   0.586
  525   HD12  LEU  63          HD12      LEU  63   7.284   0.970   0.635
  526   HD13  LEU  63          HD13      LEU  63   7.778  -0.719   0.525
  527   HD21  LEU  63          HD21      LEU  63   5.210   1.255  -1.200
  528   HD22  LEU  63          HD22      LEU  63   5.975   1.214  -2.789
  529   HD23  LEU  63          HD23      LEU  63   6.673   2.195  -1.500
  530    H    LYS  64           HN       LYS  64  11.381   0.066  -2.616
  531    HA   LYS  64           HA       LYS  64  11.197  -0.058  -5.419
  532    HB2  LYS  64           HB2      LYS  64  12.755   1.477  -4.293
  533    HB3  LYS  64           HB1      LYS  64  13.727   0.104  -3.778
  534    HG2  LYS  64           HG2      LYS  64  14.195  -0.448  -6.116
  535    HG3  LYS  64           HG1      LYS  64  13.217   0.924  -6.636
  536    HD2  LYS  64           HD2      LYS  64  14.742   2.449  -5.488
  537    HD3  LYS  64           HD1      LYS  64  15.714   1.079  -4.950
  538    HE2  LYS  64           HE2      LYS  64  16.834   1.953  -6.831
  539    HE3  LYS  64           HE1      LYS  64  16.011   0.504  -7.401
  540    HZ1  LYS  64           HZ1      LYS  64  14.419   1.769  -8.520
  541    HZ2  LYS  64           HZ2      LYS  64  15.869   2.582  -8.829
  542    HZ3  LYS  64           HZ3      LYS  64  14.795   3.185  -7.673
  543    H    ALA  65           HN       ALA  65  12.630  -2.250  -3.112
  544    HA   ALA  65           HA       ALA  65  13.802  -4.064  -4.893
  545    HB1  ALA  65           HB1      ALA  65  12.552  -4.683  -2.214
  546    HB2  ALA  65           HB2      ALA  65  14.195  -4.091  -2.460
  547    HB3  ALA  65           HB3      ALA  65  13.728  -5.677  -3.075
  548    H    ALA  66           HN       ALA  66  10.509  -3.817  -3.624
  549    HA   ALA  66           HA       ALA  66   9.497  -6.159  -4.870
  550    HB1  ALA  66           HB1      ALA  66   8.325  -5.060  -3.015
  551    HB2  ALA  66           HB2      ALA  66   7.283  -5.208  -4.430
  552    HB3  ALA  66           HB3      ALA  66   8.022  -3.656  -4.037
  553    H    ALA  67           HN       ALA  67   9.850  -2.808  -5.800
  554    HA   ALA  67           HA       ALA  67   8.496  -2.876  -8.268
  555    HB1  ALA  67           HB1      ALA  67   9.242  -0.807  -7.060
  556    HB2  ALA  67           HB2      ALA  67   9.637  -0.833  -8.779
  557    HB3  ALA  67           HB3      ALA  67  10.886  -1.176  -7.582
  558    H    GLN  68           HN       GLN  68  11.737  -3.628  -7.301
  559    HA   GLN  68           HA       GLN  68  12.808  -4.024  -9.886
  560    HB2  GLN  68           HB2      GLN  68  13.669  -5.007  -7.165
  561    HB3  GLN  68           HB1      GLN  68  14.602  -5.282  -8.633
  562    HG2  GLN  68           HG2      GLN  68  13.820  -2.571  -7.591
  563    HG3  GLN  68           HG1      GLN  68  15.377  -3.340  -7.299
  564   HE21  GLN  68          HE21      GLN  68  13.361  -1.715  -9.588
  565   HE22  GLN  68          HE22      GLN  68  14.540  -1.553 -10.842
  566    H    SER  69           HN       SER  69  11.295  -6.240  -7.542
  567    HA   SER  69           HA       SER  69  11.737  -8.551  -9.146
  568    HB2  SER  69           HB2      SER  69  10.023  -9.628  -7.673
  569    HB3  SER  69           HB1      SER  69  11.335  -8.860  -6.785
  570    HG   SER  69           HG       SER  69   8.860  -8.486  -6.335
  571    H    ILE  70           HN       ILE  70   9.550  -5.953  -9.268
  572    HA   ILE  70           HA       ILE  70   7.697  -7.376 -11.028
  573    HB   ILE  70           HB       ILE  70   7.549  -4.927  -9.335
  574   HG12  ILE  70          HG12      ILE  70   5.475  -7.016  -9.996
  575   HG13  ILE  70          HG11      ILE  70   6.644  -7.169  -8.690
  576   HG21  ILE  70          HG21      ILE  70   6.966  -3.943 -11.442
  577   HG22  ILE  70          HG22      ILE  70   5.508  -4.138 -10.469
  578   HG23  ILE  70          HG23      ILE  70   5.843  -5.257 -11.791
  579   HD11  ILE  70          HD11      ILE  70   4.327  -6.374  -8.072
  580   HD12  ILE  70          HD12      ILE  70   4.741  -4.858  -8.874
  581   HD13  ILE  70          HD13      ILE  70   5.677  -5.405  -7.483
  582    H    ASP  71           HN       ASP  71  10.465  -5.687 -11.126
  583    HA   ASP  71           HA       ASP  71  11.735  -4.691 -12.670
  584    HB2  ASP  71           HB2      ASP  71  10.881  -6.774 -13.948
  585    HB3  ASP  71           HB1      ASP  71   9.882  -5.629 -14.839
  586    H    ARG  72           HN       ARG  72   9.879  -3.050 -11.449
  587    HA   ARG  72           HA       ARG  72   9.499  -1.078 -13.609
  588    HB2  ARG  72           HB2      ARG  72   7.439  -1.782 -11.514
  589    HB3  ARG  72           HB1      ARG  72   7.341  -0.377 -12.566
  590    HG2  ARG  72           HG2      ARG  72   7.277  -1.839 -14.521
  591    HG3  ARG  72           HG1      ARG  72   7.379  -3.251 -13.468
  592    HD2  ARG  72           HD2      ARG  72   5.276  -2.408 -12.353
  593    HD3  ARG  72           HD1      ARG  72   5.146  -1.248 -13.674
  594    HE   ARG  72           HE       ARG  72   5.266  -3.416 -15.102
  595   HH11  ARG  72          HH21      ARG  72   3.664  -3.038 -12.030
  596   HH12  ARG  72          HH22      ARG  72   2.422  -4.194 -12.373
  597   HH21  ARG  72          HH11      ARG  72   3.650  -4.988 -15.565
  598   HH22  ARG  72          HH12      ARG  72   2.427  -5.324 -14.385
  599    H    THR  73           HN       THR  73   9.048   1.138 -12.688
  600    HA   THR  73           HA       THR  73  11.071   1.730 -10.740
  601    HB   THR  73           HB       THR  73  10.060   3.080 -12.901
  602    HG1  THR  73           HG1      THR  73  11.640   4.441 -12.401
  603   HG21  THR  73          HG21      THR  73   8.921   5.034 -12.248
  604   HG22  THR  73          HG22      THR  73   9.184   4.713 -10.535
  605   HG23  THR  73          HG23      THR  73   8.059   3.715 -11.456
  606    HA   PRO  74           HA       PRO  74   8.889   1.816  -6.901
  607    HB2  PRO  74           HB2      PRO  74   9.538   4.727  -6.742
  608    HB3  PRO  74           HB1      PRO  74   9.746   3.457  -5.529
  609    HG2  PRO  74           HG2      PRO  74  11.829   4.335  -6.915
  610    HG3  PRO  74           HG1      PRO  74  11.648   2.609  -6.550
  611    HD2  PRO  74           HD2      PRO  74  11.218   4.057  -9.120
  612    HD3  PRO  74           HD1      PRO  74  11.812   2.410  -8.836
  613    H    HIS  75           HN       HIS  75   8.162   4.532  -9.063
  614    HA   HIS  75           HA       HIS  75   5.835   5.433  -7.791
  615    HB2  HIS  75           HB2      HIS  75   6.967   6.699  -9.559
  616    HB3  HIS  75           HB1      HIS  75   6.548   5.464 -10.736
  617    HD1  HIS  75           HD1      HIS  75   4.489   5.903 -12.042
  618    HD2  HIS  75           HD2      HIS  75   4.560   8.043  -8.483
  619    HE1  HIS  75           HE1      HIS  75   2.453   7.375 -12.103
  620    HE2  HIS  75           HE2      HIS  75   2.716   8.877 -10.098
  621    H    TRP  76           HN       TRP  76   6.244   3.082 -10.417
  622    HA   TRP  76           HA       TRP  76   3.509   2.443 -10.681
  623    HB2  TRP  76           HB2      TRP  76   5.941   0.791 -11.367
  624    HB3  TRP  76           HB1      TRP  76   4.301   0.451 -11.906
  625    HD1  TRP  76           HD1      TRP  76   7.365   2.325 -12.854
  626    HE1  TRP  76           HE1      TRP  76   6.926   3.758 -14.948
  627    HE3  TRP  76           HE3      TRP  76   2.272   1.939 -13.031
  628    HZ2  TRP  76           HZ2      TRP  76   4.704   4.603 -16.473
  629    HZ3  TRP  76           HZ3      TRP  76   1.064   3.089 -14.840
  630    HH2  TRP  76           HH2      TRP  76   2.257   4.393 -16.525
  631    H    LEU  77           HN       LEU  77   6.178   1.050  -8.946
  632    HA   LEU  77           HA       LEU  77   4.880  -1.188  -7.926
  633    HB2  LEU  77           HB2      LEU  77   7.319  -0.894  -7.900
  634    HB3  LEU  77           HB1      LEU  77   7.141   0.342  -6.672
  635    HG   LEU  77           HG       LEU  77   7.843  -2.031  -5.944
  636   HD11  LEU  77          HD11      LEU  77   7.136  -0.175  -4.438
  637   HD12  LEU  77          HD12      LEU  77   6.790  -1.790  -3.824
  638   HD13  LEU  77          HD13      LEU  77   5.494  -0.813  -4.513
  639   HD21  LEU  77          HD21      LEU  77   4.877  -2.469  -6.250
  640   HD22  LEU  77          HD22      LEU  77   6.020  -3.574  -5.488
  641   HD23  LEU  77          HD23      LEU  77   6.138  -3.236  -7.215
  642    H    ILE  78           HN       ILE  78   5.132   2.063  -6.616
  643    HA   ILE  78           HA       ILE  78   4.039   1.469  -4.105
  644    HB   ILE  78           HB       ILE  78   3.900   4.016  -5.726
  645   HG12  ILE  78          HG12      ILE  78   5.537   3.364  -3.271
  646   HG13  ILE  78          HG11      ILE  78   6.138   3.167  -4.914
  647   HG21  ILE  78          HG21      ILE  78   2.045   4.049  -4.213
  648   HG22  ILE  78          HG22      ILE  78   3.298   5.119  -3.586
  649   HG23  ILE  78          HG23      ILE  78   3.066   3.522  -2.875
  650   HD11  ILE  78          HD11      ILE  78   5.231   5.753  -3.672
  651   HD12  ILE  78          HD12      ILE  78   5.857   5.552  -5.308
  652   HD13  ILE  78          HD13      ILE  78   6.903   5.249  -3.920
  653    H    LYS  79           HN       LYS  79   2.463   2.561  -7.106
  654    HA   LYS  79           HA       LYS  79  -0.187   2.473  -6.092
  655    HB2  LYS  79           HB2      LYS  79   0.166   1.773  -8.943
  656    HB3  LYS  79           HB1      LYS  79  -0.855   2.998  -8.209
  657    HG2  LYS  79           HG2      LYS  79   1.224   4.367  -7.865
  658    HG3  LYS  79           HG1      LYS  79   2.068   3.186  -8.861
  659    HD2  LYS  79           HD2      LYS  79  -0.309   4.841  -9.710
  660    HD3  LYS  79           HD1      LYS  79   1.368   5.115 -10.184
  661    HE2  LYS  79           HE2      LYS  79   1.428   3.010 -11.355
  662    HE3  LYS  79           HE1      LYS  79  -0.183   2.599 -10.775
  663    HZ1  LYS  79           HZ1      LYS  79  -0.390   3.365 -12.991
  664    HZ2  LYS  79           HZ2      LYS  79   0.540   4.743 -12.693
  665    HZ3  LYS  79           HZ3      LYS  79  -0.994   4.597 -12.000
  666    H    GLN  80           HN       GLN  80   1.803   0.141  -7.825
  667    HA   GLN  80           HA       GLN  80  -0.179  -1.863  -7.982
  668    HB2  GLN  80           HB2      GLN  80   2.810  -1.916  -8.288
  669    HB3  GLN  80           HB1      GLN  80   1.822  -3.363  -8.455
  670    HG2  GLN  80           HG2      GLN  80   0.999  -0.993 -10.017
  671    HG3  GLN  80           HG1      GLN  80   2.483  -1.805 -10.514
  672   HE21  GLN  80          HE21      GLN  80   0.006  -3.660  -8.995
  673   HE22  GLN  80          HE22      GLN  80  -0.553  -4.471 -10.413
  674    H    ALA  81           HN       ALA  81   2.556  -1.444  -5.739
  675    HA   ALA  81           HA       ALA  81   2.374  -3.788  -4.343
  676    HB1  ALA  81           HB1      ALA  81   3.082  -1.038  -3.372
  677    HB2  ALA  81           HB2      ALA  81   4.166  -2.354  -3.825
  678    HB3  ALA  81           HB3      ALA  81   3.204  -2.471  -2.352
  679    H    ILE  82           HN       ILE  82   0.423  -0.847  -3.810
  680    HA   ILE  82           HA       ILE  82  -0.931  -2.139  -1.636
  681    HB   ILE  82           HB       ILE  82  -0.712   0.263  -1.585
  682   HG12  ILE  82          HG12      ILE  82  -3.035   0.911  -1.121
  683   HG13  ILE  82          HG11      ILE  82  -3.606  -0.530  -1.955
  684   HG21  ILE  82          HG21      ILE  82  -1.866   1.736  -3.128
  685   HG22  ILE  82          HG22      ILE  82  -2.454   0.344  -4.036
  686   HG23  ILE  82          HG23      ILE  82  -0.727   0.696  -3.983
  687   HD11  ILE  82          HD11      ILE  82  -1.858  -0.575   0.488
  688   HD12  ILE  82          HD12      ILE  82  -2.665  -1.942  -0.281
  689   HD13  ILE  82          HD13      ILE  82  -3.617  -0.690   0.517
  690    H    PHE  83           HN       PHE  83  -2.018  -1.357  -4.977
  691    HA   PHE  83           HA       PHE  83  -4.517  -2.703  -4.501
  692    HB2  PHE  83           HB2      PHE  83  -5.203  -1.635  -6.353
  693    HB3  PHE  83           HB1      PHE  83  -3.643  -0.835  -6.363
  694    HD1  PHE  83           HD1      PHE  83  -5.355  -3.893  -7.650
  695    HD2  PHE  83           HD2      PHE  83  -2.305  -0.981  -8.234
  696    HE1  PHE  83           HE1      PHE  83  -4.914  -4.811  -9.889
  697    HE2  PHE  83           HE2      PHE  83  -1.857  -1.898 -10.471
  698    HZ   PHE  83           HZ       PHE  83  -3.161  -3.814 -11.302
  699    H    ASN  84           HN       ASN  84  -1.478  -3.525  -6.038
  700    HA   ASN  84           HA       ASN  84  -2.381  -6.021  -7.021
  701    HB2  ASN  84           HB2      ASN  84  -0.320  -4.884  -7.873
  702    HB3  ASN  84           HB1      ASN  84   0.456  -5.265  -6.340
  703   HD21  ASN  84          HD21      ASN  84  -1.405  -6.920  -8.896
  704   HD22  ASN  84          HD22      ASN  84  -0.383  -8.316  -8.942
  705    H    TYR  85           HN       TYR  85  -1.292  -4.819  -3.917
  706    HA   TYR  85           HA       TYR  85  -0.723  -7.319  -2.744
  707    HB2  TYR  85           HB2      TYR  85  -0.198  -5.471  -1.360
  708    HB3  TYR  85           HB1      TYR  85  -1.758  -4.709  -1.644
  709    HD1  TYR  85           HD1      TYR  85  -0.758  -8.098  -0.388
  710    HD2  TYR  85           HD2      TYR  85  -2.922  -4.506   0.323
  711    HE1  TYR  85           HE1      TYR  85  -1.614  -9.038   1.714
  712    HE2  TYR  85           HE2      TYR  85  -3.787  -5.437   2.425
  713    HH   TYR  85           HH       TYR  85  -4.133  -7.483   3.527
  714    H    LEU  86           HN       LEU  86  -3.609  -5.418  -3.198
  715    HA   LEU  86           HA       LEU  86  -5.387  -7.251  -1.978
  716    HB2  LEU  86           HB2      LEU  86  -5.924  -5.015  -3.907
  717    HB3  LEU  86           HB1      LEU  86  -7.152  -5.871  -2.989
  718    HG   LEU  86           HG       LEU  86  -4.929  -4.193  -1.820
  719   HD11  LEU  86          HD11      LEU  86  -6.399  -2.631  -2.610
  720   HD12  LEU  86          HD12      LEU  86  -7.063  -2.937  -1.004
  721   HD13  LEU  86          HD13      LEU  86  -7.797  -3.688  -2.420
  722   HD21  LEU  86          HD21      LEU  86  -7.125  -5.797  -0.533
  723   HD22  LEU  86          HD22      LEU  86  -6.250  -4.513   0.299
  724   HD23  LEU  86          HD23      LEU  86  -5.385  -5.936  -0.280
  725    H    GLU  87           HN       GLU  87  -4.453  -6.642  -5.316
  726    HA   GLU  87           HA       GLU  87  -6.235  -8.486  -6.508
  727    HB2  GLU  87           HB2      GLU  87  -5.062  -6.630  -7.700
  728    HB3  GLU  87           HB1      GLU  87  -3.564  -7.535  -7.553
  729    HG2  GLU  87           HG2      GLU  87  -4.666  -9.386  -8.834
  730    HG3  GLU  87           HG1      GLU  87  -6.006  -8.280  -9.135
  731    H    LYS  88           HN       LYS  88  -2.911  -8.767  -5.341
  732    HA   LYS  88           HA       LYS  88  -2.469 -11.397  -6.325
  733    HB2  LYS  88           HB2      LYS  88  -0.671  -9.761  -5.702
  734    HB3  LYS  88           HB1      LYS  88  -1.071 -10.047  -4.016
  735    HG2  LYS  88           HG2      LYS  88  -0.559 -12.467  -4.397
  736    HG3  LYS  88           HG1      LYS  88   0.042 -12.019  -5.993
  737    HD2  LYS  88           HD2      LYS  88   1.072 -10.864  -3.403
  738    HD3  LYS  88           HD1      LYS  88   1.818 -12.219  -4.252
  739    HE2  LYS  88           HE2      LYS  88   3.065 -10.471  -5.063
  740    HE3  LYS  88           HE1      LYS  88   1.792 -10.555  -6.279
  741    HZ1  LYS  88           HZ1      LYS  88   2.425  -8.449  -4.462
  742    HZ2  LYS  88           HZ2      LYS  88   0.794  -8.889  -4.364
  743    HZ3  LYS  88           HZ3      LYS  88   1.452  -8.421  -5.849
  744    H    LEU  89           HN       LEU  89  -3.487 -10.127  -3.158
  745    HA   LEU  89           HA       LEU  89  -3.544 -12.715  -1.958
  746    HB2  LEU  89           HB2      LEU  89  -4.220 -11.686  -0.007
  747    HB3  LEU  89           HB1      LEU  89  -3.341 -10.404  -0.808
  748    HG   LEU  89           HG       LEU  89  -5.825  -9.826  -1.671
  749   HD11  LEU  89          HD11      LEU  89  -7.479 -10.714  -0.482
  750   HD12  LEU  89          HD12      LEU  89  -6.687 -10.304   1.042
  751   HD13  LEU  89          HD13      LEU  89  -6.301 -11.819   0.225
  752   HD21  LEU  89          HD21      LEU  89  -5.889  -8.134   0.071
  753   HD22  LEU  89          HD22      LEU  89  -4.246  -8.316  -0.539
  754   HD23  LEU  89          HD23      LEU  89  -4.695  -9.026   1.013
  755    H    GLU  90           HN       GLU  90  -5.756 -10.772  -3.756
  756    HA   GLU  90           HA       GLU  90  -7.748 -11.130  -4.714
  757    HB2  GLU  90           HB2      GLU  90  -7.076 -14.017  -4.116
  758    HB3  GLU  90           HB1      GLU  90  -8.482 -13.522  -5.053
  759    HG2  GLU  90           HG2      GLU  90  -7.019 -12.438  -6.686
  760    HG3  GLU  90           HG1      GLU  90  -5.612 -12.929  -5.750
  Start of MODEL    9
    1    H1   MET   1           HT1      MET   1   6.876  -0.051  13.699
    2    H2   MET   1           HT2      MET   1   5.726  -1.289  13.794
    3    H3   MET   1           HT3      MET   1   5.619   0.046  14.827
    4    HA   MET   1           HA       MET   1   5.372   0.166  11.885
    5    HB2  MET   1           HB2      MET   1   3.489  -1.031  13.034
    6    HB3  MET   1           HB1      MET   1   3.190   0.428  13.968
    7    HG2  MET   1           HG2      MET   1   2.781   1.647  11.861
    8    HG3  MET   1           HG1      MET   1   2.981   0.135  10.980
    9    HE1  MET   1           HE1      MET   1  -0.563   1.281  13.682
   10    HE2  MET   1           HE2      MET   1   0.621   2.403  13.012
   11    HE3  MET   1           HE3      MET   1   1.094   1.277  14.284
   12    H    ALA   2           HN       ALA   2   6.651   1.976  11.664
   13    HA   ALA   2           HA       ALA   2   5.796   4.388  13.141
   14    HB1  ALA   2           HB1      ALA   2   8.111   3.874  13.594
   15    HB2  ALA   2           HB2      ALA   2   8.040   5.294  12.549
   16    HB3  ALA   2           HB3      ALA   2   8.452   3.719  11.870
   17    H    THR   3           HN       THR   3   4.087   3.984  11.366
   18    HA   THR   3           HA       THR   3   4.715   4.558   8.678
   19    HB   THR   3           HB       THR   3   2.282   4.804   8.369
   20    HG1  THR   3           HG1      THR   3   1.955   4.242  11.126
   21   HG21  THR   3          HG21      THR   3   1.688   2.523   9.488
   22   HG22  THR   3          HG22      THR   3   3.401   2.498   9.909
   23   HG23  THR   3          HG23      THR   3   2.909   2.580   8.218
   24    H    THR   4           HN       THR   4   5.097   6.392   7.709
   25    HA   THR   4           HA       THR   4   4.377   8.912   9.051
   26    HB   THR   4           HB       THR   4   6.192   9.913   7.589
   27    HG1  THR   4           HG1      THR   4   6.717   7.141   7.143
   28   HG22  THR   4          HG22      THR   4   6.980   7.814   9.612
   29   HG23  THR   4          HG23      THR   4   6.600   9.504   9.940
   30    H    THR   5           HN       THR   5   3.877  10.729   7.465
   31    HA   THR   5           HA       THR   5   1.859   9.780   5.655
   32    HB   THR   5           HB       THR   5   2.869  12.613   5.960
   33    HG1  THR   5           HG1      THR   5   2.071  11.359   7.921
   34   HG21  THR   5          HG21      THR   5   0.186  11.526   5.091
   35   HG22  THR   5          HG22      THR   5   1.414  12.187   4.012
   36   HG23  THR   5          HG23      THR   5   0.633  13.228   5.204
   37    H    LEU   6           HN       LEU   6   2.422   8.918   3.755
   38    HA   LEU   6           HA       LEU   6   4.387  10.363   2.122
   39    HB2  LEU   6           HB2      LEU   6   4.245   7.369   2.503
   40    HB3  LEU   6           HB1      LEU   6   5.275   8.185   1.340
   41    HG   LEU   6           HG       LEU   6   5.456   8.623   4.323
   42   HD11  LEU   6          HD11      LEU   6   6.047   6.354   3.959
   43   HD12  LEU   6          HD12      LEU   6   7.544   7.267   4.143
   44   HD13  LEU   6          HD13      LEU   6   7.008   6.766   2.539
   45   HD21  LEU   6          HD21      LEU   6   7.228   9.402   2.017
   46   HD22  LEU   6          HD22      LEU   6   7.686   9.535   3.715
   47   HD23  LEU   6          HD23      LEU   6   6.331  10.476   3.091
   48    H    GLY   7           HN       GLY   7   4.024  10.282  -0.123
   49    HA2  GLY   7           HA2      GLY   7   1.250   9.995  -0.827
   50    HA3  GLY   7           HA1      GLY   7   2.545  10.528  -1.885
   51    H    VAL   8           HN       VAL   8   0.249   8.393  -1.839
   52    HA   VAL   8           HA       VAL   8   1.811   6.358  -3.261
   53    HB   VAL   8           HB       VAL   8  -0.281   5.796  -1.140
   54   HG11  VAL   8          HG11      VAL   8   0.050   3.400  -1.678
   55   HG12  VAL   8          HG12      VAL   8   0.977   3.881  -3.098
   56   HG13  VAL   8          HG13      VAL   8  -0.730   4.306  -2.974
   57   HG21  VAL   8          HG21      VAL   8   1.502   4.477  -0.091
   58   HG22  VAL   8          HG22      VAL   8   1.960   6.172  -0.270
   59   HG23  VAL   8          HG23      VAL   8   2.607   4.962  -1.377
   60    H    LYS   9           HN       LYS   9   0.381   5.140  -4.814
   61    HA   LYS   9           HA       LYS   9  -1.959   6.781  -5.500
   62    HB2  LYS   9           HB2      LYS   9  -0.101   5.474  -7.487
   63    HB3  LYS   9           HB1      LYS   9  -1.457   6.532  -7.849
   64    HG2  LYS   9           HG2      LYS   9  -0.262   8.340  -6.587
   65    HG3  LYS   9           HG1      LYS   9   1.135   7.267  -6.513
   66    HD2  LYS   9           HD2      LYS   9   1.615   8.525  -8.386
   67    HD3  LYS   9           HD1      LYS   9   0.809   7.126  -9.098
   68    HE2  LYS   9           HE2      LYS   9  -0.912   9.403  -8.311
   69    HE3  LYS   9           HE1      LYS   9   0.154   9.655  -9.691
   70    HZ1  LYS   9           HZ1      LYS   9  -2.294   8.365  -9.672
   71    HZ2  LYS   9           HZ2      LYS   9  -1.148   7.150  -9.908
   72    HZ3  LYS   9           HZ3      LYS   9  -1.206   8.476 -10.959
   73    H    LEU  10           HN       LEU  10  -3.799   5.686  -5.411
   74    HA   LEU  10           HA       LEU  10  -3.863   2.984  -6.479
   75    HB2  LEU  10           HB2      LEU  10  -5.299   2.170  -4.626
   76    HB3  LEU  10           HB1      LEU  10  -3.628   2.425  -4.199
   77    HG   LEU  10           HG       LEU  10  -4.676   4.787  -3.403
   78   HD11  LEU  10          HD11      LEU  10  -6.952   4.160  -4.005
   79   HD12  LEU  10          HD12      LEU  10  -6.795   4.309  -2.255
   80   HD13  LEU  10          HD13      LEU  10  -6.832   2.713  -3.004
   81   HD21  LEU  10          HD21      LEU  10  -3.267   3.318  -2.079
   82   HD22  LEU  10          HD22      LEU  10  -4.621   2.211  -1.847
   83   HD23  LEU  10          HD23      LEU  10  -4.676   3.830  -1.149
   84    H    ASP  11           HN       ASP  11  -6.319   2.237  -6.276
   85    HA   ASP  11           HA       ASP  11  -7.764   4.353  -7.708
   86    HB2  ASP  11           HB2      ASP  11  -8.674   1.487  -7.643
   87    HB3  ASP  11           HB1      ASP  11  -8.979   2.706  -8.862
   88    H    ASP  12           HN       ASP  12  -9.873   4.910  -7.121
   89    HA   ASP  12           HA       ASP  12 -10.624   4.851  -4.467
   90    HB2  ASP  12           HB2      ASP  12 -11.889   5.571  -6.974
   91    HB3  ASP  12           HB1      ASP  12 -13.049   4.867  -5.854
   92    HA   PRO  13           HA       PRO  13 -13.376   0.829  -5.722
   93    HB2  PRO  13           HB2      PRO  13 -11.191  -0.186  -7.490
   94    HB3  PRO  13           HB1      PRO  13 -12.931  -0.476  -7.578
   95    HG2  PRO  13           HG2      PRO  13 -11.680   1.267  -9.205
   96    HG3  PRO  13           HG1      PRO  13 -13.344   1.509  -8.648
   97    HD2  PRO  13           HD2      PRO  13 -10.898   2.967  -7.907
   98    HD3  PRO  13           HD1      PRO  13 -12.593   3.449  -7.749
   99    H    THR  14           HN       THR  14  -9.772   0.801  -5.746
  100    HA   THR  14           HA       THR  14  -9.631  -1.539  -4.127
  101    HB   THR  14           HB       THR  14  -7.367  -1.438  -4.244
  102    HG1  THR  14           HG1      THR  14  -6.156   0.382  -3.855
  103   HG21  THR  14          HG21      THR  14  -7.677   0.754  -6.251
  104   HG22  THR  14          HG22      THR  14  -8.359  -0.844  -6.549
  105   HG23  THR  14          HG23      THR  14  -6.623  -0.657  -6.298
  106    H    ARG  15           HN       ARG  15  -9.660   1.911  -3.502
  107    HA   ARG  15           HA       ARG  15  -9.001   1.882  -0.787
  108    HB2  ARG  15           HB2      ARG  15  -9.584   3.809  -2.589
  109    HB3  ARG  15           HB1      ARG  15 -11.098   3.785  -1.688
  110    HG2  ARG  15           HG2      ARG  15  -8.419   4.092  -0.354
  111    HG3  ARG  15           HG1      ARG  15  -9.354   5.462  -0.947
  112    HD2  ARG  15           HD2      ARG  15  -9.968   5.362   1.282
  113    HD3  ARG  15           HD1      ARG  15 -11.264   4.463   0.494
  114    HE   ARG  15           HE       ARG  15  -9.261   2.659   1.212
  115   HH11  ARG  15          HH21      ARG  15 -11.515   4.794   2.805
  116   HH12  ARG  15          HH22      ARG  15 -11.725   3.762   4.177
  117   HH21  ARG  15          HH11      ARG  15  -9.565   1.258   2.967
  118   HH22  ARG  15          HH12      ARG  15 -10.638   1.697   4.249
  119    H    GLU  16           HN       GLU  16 -12.155   1.539  -2.414
  120    HA   GLU  16           HA       GLU  16 -13.714   1.229  -0.085
  121    HB2  GLU  16           HB2      GLU  16 -14.105   0.059  -2.854
  122    HB3  GLU  16           HB1      GLU  16 -15.331   0.072  -1.596
  123    HG2  GLU  16           HG2      GLU  16 -15.334   2.511  -1.613
  124    HG3  GLU  16           HG1      GLU  16 -14.094   2.504  -2.868
  125    H    ARG  17           HN       ARG  17 -11.945  -1.037  -2.112
  126    HA   ARG  17           HA       ARG  17 -12.658  -3.435  -0.831
  127    HB2  ARG  17           HB2      ARG  17 -11.207  -2.840  -3.029
  128    HB3  ARG  17           HB1      ARG  17  -9.899  -3.178  -1.909
  129    HG2  ARG  17           HG2      ARG  17 -12.155  -5.066  -2.563
  130    HG3  ARG  17           HG1      ARG  17 -10.538  -5.130  -3.259
  131    HD2  ARG  17           HD2      ARG  17 -11.420  -5.729  -0.459
  132    HD3  ARG  17           HD1      ARG  17 -10.477  -6.726  -1.563
  133    HE   ARG  17           HE       ARG  17  -9.050  -4.373  -0.948
  134   HH11  ARG  17          HH21      ARG  17  -9.984  -7.449   0.404
  135   HH12  ARG  17          HH22      ARG  17  -8.737  -7.453   1.605
  136   HH21  ARG  17          HH11      ARG  17  -7.422  -4.336   0.661
  137   HH22  ARG  17          HH12      ARG  17  -7.269  -5.675   1.747
  138    H    LEU  18           HN       LEU  18 -10.087  -1.084  -0.217
  139    HA   LEU  18           HA       LEU  18  -8.712  -2.522   1.756
  140    HB2  LEU  18           HB2      LEU  18  -8.915   0.347   1.013
  141    HB3  LEU  18           HB1      LEU  18  -8.329  -0.004   2.623
  142    HG   LEU  18           HG       LEU  18  -6.559  -1.479   1.523
  143   HD11  LEU  18          HD11      LEU  18  -7.377   0.033  -0.936
  144   HD12  LEU  18          HD12      LEU  18  -7.658  -1.685  -0.657
  145   HD13  LEU  18          HD13      LEU  18  -6.009  -1.068  -0.768
  146   HD21  LEU  18          HD21      LEU  18  -5.251   0.585   0.776
  147   HD22  LEU  18          HD22      LEU  18  -5.842   0.547   2.437
  148   HD23  LEU  18          HD23      LEU  18  -6.691   1.500   1.220
  149    H    LYS  19           HN       LYS  19 -11.624  -0.544   1.886
  150    HA   LYS  19           HA       LYS  19 -11.851  -0.414   4.687
  151    HB2  LYS  19           HB2      LYS  19 -13.243   0.920   3.097
  152    HB3  LYS  19           HB1      LYS  19 -14.128  -0.551   2.710
  153    HG2  LYS  19           HG2      LYS  19 -14.706  -0.721   5.151
  154    HG3  LYS  19           HG1      LYS  19 -14.021   0.893   5.345
  155    HD2  LYS  19           HD2      LYS  19 -16.276   0.196   3.467
  156    HD3  LYS  19           HD1      LYS  19 -16.484   0.892   5.074
  157    HE2  LYS  19           HE2      LYS  19 -14.956   2.166   2.807
  158    HE3  LYS  19           HE1      LYS  19 -16.602   2.581   3.282
  159    HZ1  LYS  19           HZ1      LYS  19 -14.087   3.067   4.740
  160    HZ2  LYS  19           HZ2      LYS  19 -15.559   3.016   5.567
  161    HZ3  LYS  19           HZ3      LYS  19 -15.315   4.162   4.345
  162    H    ALA  20           HN       ALA  20 -12.864  -2.773   2.327
  163    HA   ALA  20           HA       ALA  20 -14.258  -4.507   4.047
  164    HB1  ALA  20           HB1      ALA  20 -14.091  -6.166   2.342
  165    HB2  ALA  20           HB2      ALA  20 -12.693  -5.368   1.620
  166    HB3  ALA  20           HB3      ALA  20 -14.282  -4.606   1.543
  167    H    ALA  21           HN       ALA  21 -10.833  -4.316   3.200
  168    HA   ALA  21           HA       ALA  21 -10.071  -6.607   4.712
  169    HB1  ALA  21           HB1      ALA  21  -8.555  -5.967   3.047
  170    HB2  ALA  21           HB2      ALA  21  -7.763  -5.535   4.564
  171    HB3  ALA  21           HB3      ALA  21  -8.540  -4.289   3.586
  172    H    ALA  22           HN       ALA  22 -10.379  -3.180   5.387
  173    HA   ALA  22           HA       ALA  22  -9.123  -3.072   7.889
  174    HB1  ALA  22           HB1      ALA  22 -11.482  -1.436   7.005
  175    HB2  ALA  22           HB2      ALA  22  -9.819  -1.114   6.514
  176    HB3  ALA  22           HB3      ALA  22 -10.274  -1.000   8.215
  177    H    GLN  23           HN       GLN  23 -12.521  -3.568   7.104
  178    HA   GLN  23           HA       GLN  23 -13.330  -3.969   9.790
  179    HB2  GLN  23           HB2      GLN  23 -15.379  -4.957   8.861
  180    HB3  GLN  23           HB1      GLN  23 -14.964  -3.462   8.080
  181    HG2  GLN  23           HG2      GLN  23 -15.456  -4.611   6.223
  182    HG3  GLN  23           HG1      GLN  23 -13.780  -5.131   6.389
  183   HE21  GLN  23          HE21      GLN  23 -14.081  -7.083   5.385
  184   HE22  GLN  23          HE22      GLN  23 -14.985  -8.375   6.098
  185    H    SER  24           HN       SER  24 -12.052  -6.019   7.308
  186    HA   SER  24           HA       SER  24 -12.684  -8.442   8.540
  187    HB2  SER  24           HB2      SER  24 -12.059  -8.132   6.109
  188    HB3  SER  24           HB1      SER  24 -10.387  -7.951   6.633
  189    HG   SER  24           HG       SER  24 -10.505 -10.063   7.495
  190    H    ILE  25           HN       ILE  25 -10.146  -6.141   8.917
  191    HA   ILE  25           HA       ILE  25  -8.606  -7.920  10.656
  192    HB   ILE  25           HB       ILE  25  -7.765  -6.253   8.686
  193   HG12  ILE  25          HG12      ILE  25  -6.388  -7.978   9.673
  194   HG13  ILE  25          HG11      ILE  25  -5.491  -6.466   9.631
  195   HG21  ILE  25          HG21      ILE  25  -7.381  -4.682  11.216
  196   HG22  ILE  25          HG22      ILE  25  -8.410  -4.239   9.854
  197   HG23  ILE  25          HG23      ILE  25  -6.660  -4.317   9.649
  198   HD11  ILE  25          HD11      ILE  25  -6.026  -6.143  12.022
  199   HD12  ILE  25          HD12      ILE  25  -5.065  -7.587  11.699
  200   HD13  ILE  25          HD13      ILE  25  -6.792  -7.732  12.027
  201    H    ASP  26           HN       ASP  26 -11.113  -5.953  10.829
  202    HA   ASP  26           HA       ASP  26 -12.270  -4.887  12.418
  203    HB2  ASP  26           HB2      ASP  26 -11.644  -7.003  13.690
  204    HB3  ASP  26           HB1      ASP  26 -10.402  -6.038  14.481
  205    H    ARG  27           HN       ARG  27 -10.347  -3.366  11.153
  206    HA   ARG  27           HA       ARG  27  -9.814  -1.448  13.317
  207    HB2  ARG  27           HB2      ARG  27  -7.815  -2.297  11.221
  208    HB3  ARG  27           HB1      ARG  27  -7.639  -0.850  12.204
  209    HG2  ARG  27           HG2      ARG  27  -7.678  -2.266  14.229
  210    HG3  ARG  27           HG1      ARG  27  -7.735  -3.692  13.192
  211    HD2  ARG  27           HD2      ARG  27  -5.533  -1.636  13.321
  212    HD3  ARG  27           HD1      ARG  27  -5.464  -3.294  13.914
  213    HE   ARG  27           HE       ARG  27  -5.824  -2.672  11.059
  214   HH11  ARG  27          HH21      ARG  27  -4.160  -4.369  13.626
  215   HH12  ARG  27          HH22      ARG  27  -3.185  -5.318  12.552
  216   HH21  ARG  27          HH11      ARG  27  -4.536  -3.903   9.628
  217   HH22  ARG  27          HH12      ARG  27  -3.399  -5.043  10.264
  218    H    THR  28           HN       THR  28  -9.497   0.751  12.543
  219    HA   THR  28           HA       THR  28 -11.431   1.440  10.574
  220    HB   THR  28           HB       THR  28  -9.344   3.337  11.623
  221    HG1  THR  28           HG1      THR  28 -11.568   2.249  13.042
  222   HG21  THR  28          HG21      THR  28 -12.286   3.594  10.991
  223   HG22  THR  28          HG22      THR  28 -10.942   4.280  10.078
  224   HG23  THR  28          HG23      THR  28 -11.303   4.875  11.699
  225    HA   PRO  29           HA       PRO  29  -9.294   1.192   6.682
  226    HB2  PRO  29           HB2      PRO  29 -10.228   4.045   6.623
  227    HB3  PRO  29           HB1      PRO  29 -10.218   2.852   5.319
  228    HG2  PRO  29           HG2      PRO  29 -12.449   3.316   6.681
  229    HG3  PRO  29           HG1      PRO  29 -12.005   1.663   6.216
  230    HD2  PRO  29           HD2      PRO  29 -11.986   2.933   8.885
  231    HD3  PRO  29           HD1      PRO  29 -12.095   1.215   8.450
  232    H    HIS  30           HN       HIS  30  -8.759   4.121   8.634
  233    HA   HIS  30           HA       HIS  30  -6.461   5.049   7.354
  234    HB2  HIS  30           HB2      HIS  30  -7.866   6.197   9.152
  235    HB3  HIS  30           HB1      HIS  30  -6.955   5.255  10.325
  236    HD1  HIS  30           HD1      HIS  30  -5.597   7.045  11.425
  237    HD2  HIS  30           HD2      HIS  30  -5.401   7.243   7.275
  238    HE1  HIS  30           HE1      HIS  30  -3.850   8.783  10.912
  239    HE2  HIS  30           HE2      HIS  30  -3.955   9.063   8.409
  240    H    TRP  31           HN       TRP  31  -6.803   2.807  10.074
  241    HA   TRP  31           HA       TRP  31  -4.062   2.380  10.554
  242    HB2  TRP  31           HB2      TRP  31  -6.413   0.555  11.059
  243    HB3  TRP  31           HB1      TRP  31  -4.797   0.314  11.710
  244    HD1  TRP  31           HD1      TRP  31  -8.035   1.849  12.535
  245    HE1  TRP  31           HE1      TRP  31  -7.831   3.328  14.633
  246    HE3  TRP  31           HE3      TRP  31  -2.942   2.096  12.843
  247    HZ2  TRP  31           HZ2      TRP  31  -5.775   4.449  16.204
  248    HZ3  TRP  31           HZ3      TRP  31  -1.933   3.394  14.675
  249    HH2  TRP  31           HH2      TRP  31  -3.323   4.546  16.320
  250    H    LEU  32           HN       LEU  32  -6.465   0.596   8.742
  251    HA   LEU  32           HA       LEU  32  -4.669  -1.369   7.866
  252    HB2  LEU  32           HB2      LEU  32  -7.118  -1.721   7.854
  253    HB3  LEU  32           HB1      LEU  32  -7.216  -0.636   6.471
  254    HG   LEU  32           HG       LEU  32  -5.244  -2.443   5.747
  255   HD11  LEU  32          HD11      LEU  32  -7.512  -3.959   7.009
  256   HD12  LEU  32          HD12      LEU  32  -5.859  -3.881   7.619
  257   HD13  LEU  32          HD13      LEU  32  -6.190  -4.641   6.062
  258   HD21  LEU  32          HD21      LEU  32  -6.998  -1.432   4.344
  259   HD22  LEU  32          HD22      LEU  32  -8.158  -2.571   5.029
  260   HD23  LEU  32          HD23      LEU  32  -6.795  -3.163   4.078
  261    H    ILE  33           HN       ILE  33  -5.438   1.768   6.530
  262    HA   ILE  33           HA       ILE  33  -4.379   1.272   3.966
  263    HB   ILE  33           HB       ILE  33  -4.479   3.826   5.574
  264   HG12  ILE  33          HG12      ILE  33  -5.993   3.024   3.086
  265   HG13  ILE  33          HG11      ILE  33  -6.608   2.789   4.719
  266   HG21  ILE  33          HG21      ILE  33  -4.006   4.933   3.331
  267   HG22  ILE  33          HG22      ILE  33  -3.393   3.360   2.816
  268   HG23  ILE  33          HG23      ILE  33  -2.641   4.199   4.174
  269   HD11  ILE  33          HD11      ILE  33  -6.525   5.203   5.089
  270   HD12  ILE  33          HD12      ILE  33  -7.543   4.785   3.710
  271   HD13  ILE  33          HD13      ILE  33  -5.923   5.430   3.447
  272    H    LYS  34           HN       LYS  34  -2.847   2.578   6.892
  273    HA   LYS  34           HA       LYS  34  -0.217   2.733   5.856
  274    HB2  LYS  34           HB2      LYS  34  -0.465   1.966   8.703
  275    HB3  LYS  34           HB1      LYS  34   0.435   3.284   7.975
  276    HG2  LYS  34           HG2      LYS  34  -1.614   4.594   7.807
  277    HG3  LYS  34           HG1      LYS  34  -2.518   3.261   8.535
  278    HD2  LYS  34           HD2      LYS  34  -0.982   3.414  10.508
  279    HD3  LYS  34           HD1      LYS  34  -0.313   4.882   9.797
  280    HE2  LYS  34           HE2      LYS  34  -2.502   5.939   9.893
  281    HE3  LYS  34           HE1      LYS  34  -3.201   4.460  10.551
  282    HZ1  LYS  34           HZ1      LYS  34  -1.238   6.266  11.851
  283    HZ2  LYS  34           HZ2      LYS  34  -1.576   4.718  12.432
  284    HZ3  LYS  34           HZ3      LYS  34  -2.799   5.881  12.373
  285    H    GLN  35           HN       GLN  35  -1.860   0.310   7.783
  286    HA   GLN  35           HA       GLN  35   0.310  -1.497   7.730
  287    HB2  GLN  35           HB2      GLN  35  -2.574  -1.840   8.524
  288    HB3  GLN  35           HB1      GLN  35  -1.360  -3.109   8.675
  289    HG2  GLN  35           HG2      GLN  35  -0.028  -1.684  10.125
  290    HG3  GLN  35           HG1      GLN  35  -1.214  -0.394   9.961
  291   HE21  GLN  35          HE21      GLN  35  -0.440  -3.404  11.447
  292   HE22  GLN  35          HE22      GLN  35  -1.759  -3.430  12.560
  293    H    ALA  36           HN       ALA  36  -2.268  -0.882   5.476
  294    HA   ALA  36           HA       ALA  36  -2.385  -3.428   4.291
  295    HB1  ALA  36           HB1      ALA  36  -3.146  -2.284   2.231
  296    HB2  ALA  36           HB2      ALA  36  -2.757  -0.736   2.981
  297    HB3  ALA  36           HB3      ALA  36  -4.017  -1.758   3.672
  298    H    ILE  37           HN       ILE  37  -0.370  -0.608   3.543
  299    HA   ILE  37           HA       ILE  37   1.086  -2.034   1.548
  300    HB   ILE  37           HB       ILE  37   0.992   0.385   1.478
  301   HG12  ILE  37          HG12      ILE  37   3.344   0.888   1.075
  302   HG13  ILE  37          HG11      ILE  37   3.825  -0.520   2.018
  303   HG21  ILE  37          HG21      ILE  37   0.902   0.824   3.873
  304   HG22  ILE  37          HG22      ILE  37   2.113   1.815   3.060
  305   HG23  ILE  37          HG23      ILE  37   2.612   0.413   4.007
  306   HD11  ILE  37          HD11      ILE  37   2.921  -2.001   0.395
  307   HD12  ILE  37          HD12      ILE  37   3.927  -0.823  -0.448
  308   HD13  ILE  37          HD13      ILE  37   2.171  -0.669  -0.482
  309    H    PHE  38           HN       PHE  38   1.696  -1.445   4.987
  310    HA   PHE  38           HA       PHE  38   4.268  -2.721   4.963
  311    HB2  PHE  38           HB2      PHE  38   4.131  -1.223   6.710
  312    HB3  PHE  38           HB1      PHE  38   2.423  -1.524   6.980
  313    HD1  PHE  38           HD1      PHE  38   1.694  -3.357   8.394
  314    HD2  PHE  38           HD2      PHE  38   5.824  -2.482   7.858
  315    HE1  PHE  38           HE1      PHE  38   2.229  -4.704  10.378
  316    HE2  PHE  38           HE2      PHE  38   6.369  -3.836   9.840
  317    HZ   PHE  38           HZ       PHE  38   4.569  -4.949  11.102
  318    H    ASN  39           HN       ASN  39   0.992  -3.727   5.773
  319    HA   ASN  39           HA       ASN  39   1.708  -6.314   6.679
  320    HB2  ASN  39           HB2      ASN  39  -0.583  -4.978   6.937
  321    HB3  ASN  39           HB1      ASN  39  -0.978  -5.854   5.465
  322   HD21  ASN  39          HD21      ASN  39   0.851  -8.072   6.538
  323   HD22  ASN  39          HD22      ASN  39  -0.122  -8.889   7.709
  324    H    TYR  40           HN       TYR  40   1.137  -4.813   3.598
  325    HA   TYR  40           HA       TYR  40   0.759  -7.132   2.053
  326    HB2  TYR  40           HB2      TYR  40   0.439  -5.003   0.974
  327    HB3  TYR  40           HB1      TYR  40   2.062  -4.477   1.401
  328    HD1  TYR  40           HD2      TYR  40   1.010  -7.722  -0.107
  329    HD2  TYR  40           HD1      TYR  40   3.056  -4.035  -0.664
  330    HE1  TYR  40           HE2      TYR  40   1.840  -8.521  -2.275
  331    HE2  TYR  40           HE1      TYR  40   3.897  -4.826  -2.834
  332    HH   TYR  40           HH       TYR  40   4.256  -6.776  -4.067
  333    H    LEU  41           HN       LEU  41   3.528  -5.350   3.174
  334    HA   LEU  41           HA       LEU  41   5.516  -6.956   2.046
  335    HB2  LEU  41           HB2      LEU  41   5.624  -5.312   4.565
  336    HB3  LEU  41           HB1      LEU  41   7.016  -5.961   3.719
  337    HG   LEU  41           HG       LEU  41   5.309  -3.620   3.032
  338   HD11  LEU  41          HD11      LEU  41   7.539  -3.405   4.032
  339   HD12  LEU  41          HD12      LEU  41   7.427  -2.658   2.440
  340   HD13  LEU  41          HD13      LEU  41   8.226  -4.219   2.627
  341   HD21  LEU  41          HD21      LEU  41   5.999  -3.698   0.691
  342   HD22  LEU  41          HD22      LEU  41   4.929  -5.036   1.106
  343   HD23  LEU  41          HD23      LEU  41   6.664  -5.311   0.944
  344    H    GLU  42           HN       GLU  42   3.918  -7.022   5.183
  345    HA   GLU  42           HA       GLU  42   5.267  -9.189   6.334
  346    HB2  GLU  42           HB2      GLU  42   3.900  -7.641   7.628
  347    HB3  GLU  42           HB1      GLU  42   2.454  -8.194   6.803
  348    HG2  GLU  42           HG2      GLU  42   2.801 -10.437   7.781
  349    HG3  GLU  42           HG1      GLU  42   4.181  -9.799   8.673
  350    H    LYS  43           HN       LYS  43   2.369  -9.110   4.292
  351    HA   LYS  43           HA       LYS  43   1.680 -11.828   4.596
  352    HB2  LYS  43           HB2      LYS  43   0.848  -9.612   2.912
  353    HB3  LYS  43           HB1      LYS  43   0.854 -11.132   2.031
  354    HG2  LYS  43           HG2      LYS  43  -1.298 -11.013   2.874
  355    HG3  LYS  43           HG1      LYS  43  -0.472 -12.051   4.036
  356    HD2  LYS  43           HD2      LYS  43  -0.170 -10.168   5.538
  357    HD3  LYS  43           HD1      LYS  43  -0.923  -9.087   4.364
  358    HE2  LYS  43           HE2      LYS  43  -2.961 -10.609   4.524
  359    HE3  LYS  43           HE1      LYS  43  -2.190 -11.303   5.949
  360    HZ1  LYS  43           HZ1      LYS  43  -3.040  -8.487   5.558
  361    HZ2  LYS  43           HZ2      LYS  43  -2.091  -9.001   6.862
  362    HZ3  LYS  43           HZ3      LYS  43  -3.660  -9.605   6.671
  363    H    LEU  44           HN       LEU  44   3.661 -10.158   2.172
  364    HA   LEU  44           HA       LEU  44   4.283 -12.648   0.855
  365    HB2  LEU  44           HB2      LEU  44   5.497 -11.376  -0.726
  366    HB3  LEU  44           HB1      LEU  44   4.049 -10.468  -0.350
  367    HG   LEU  44           HG       LEU  44   5.824  -9.362   1.397
  368   HD11  LEU  44          HD11      LEU  44   7.923  -9.027   0.357
  369   HD12  LEU  44          HD12      LEU  44   7.385  -9.791  -1.139
  370   HD13  LEU  44          HD13      LEU  44   7.623 -10.765   0.312
  371   HD21  LEU  44          HD21      LEU  44   5.962  -7.511  -0.247
  372   HD22  LEU  44          HD22      LEU  44   4.321  -8.106   0.001
  373   HD23  LEU  44          HD23      LEU  44   5.217  -8.567  -1.447
  374    H    GLU  45           HN       GLU  45   5.534 -10.951   3.520
  375    HA   GLU  45           HA       GLU  45   7.635 -12.848   3.887
  376    HB2  GLU  45           HB2      GLU  45   8.739 -11.363   2.297
  377    HB3  GLU  45           HB1      GLU  45   8.353  -9.980   3.305
  378    HG2  GLU  45           HG2      GLU  45  10.660 -10.549   3.586
  379    HG3  GLU  45           HG1      GLU  45   9.795 -10.905   5.079
  380    H1   MET  46           HT1      MET  46  -6.800  -0.311 -13.793
  381    H2   MET  46           HT2      MET  46  -5.686  -1.582 -13.758
  382    H3   MET  46           HT3      MET  46  -5.485  -0.315 -14.856
  383    HA   MET  46           HA       MET  46  -5.340  -0.082 -11.912
  384    HB2  MET  46           HB2      MET  46  -3.423  -1.286 -12.994
  385    HB3  MET  46           HB1      MET  46  -3.118   0.155 -13.955
  386    HG2  MET  46           HG2      MET  46  -2.766   1.424 -11.863
  387    HG3  MET  46           HG1      MET  46  -2.964  -0.073 -10.957
  388    HE1  MET  46           HE1      MET  46   0.604   1.023 -13.657
  389    HE2  MET  46           HE2      MET  46  -0.590   2.164 -13.040
  390    HE3  MET  46           HE3      MET  46  -1.050   0.983 -14.267
  391    H    ALA  47           HN       ALA  47  -6.567   1.737 -11.679
  392    HA   ALA  47           HA       ALA  47  -5.733   4.126 -13.210
  393    HB1  ALA  47           HB1      ALA  47  -8.042   3.595 -13.667
  394    HB2  ALA  47           HB2      ALA  47  -7.984   5.031 -12.643
  395    HB3  ALA  47           HB3      ALA  47  -8.393   3.464 -11.944
  396    H    THR  48           HN       THR  48  -4.032   3.759 -11.411
  397    HA   THR  48           HA       THR  48  -4.683   4.381  -8.741
  398    HB   THR  48           HB       THR  48  -2.254   4.649  -8.417
  399    HG1  THR  48           HG1      THR  48  -1.940   4.074 -11.179
  400   HG21  THR  48          HG21      THR  48  -1.637   2.354  -9.501
  401   HG22  THR  48          HG22      THR  48  -3.350   2.310  -9.920
  402   HG23  THR  48          HG23      THR  48  -2.858   2.424  -8.231
  403    H    THR  49           HN       THR  49  -5.065   6.229  -7.796
  404    HA   THR  49           HA       THR  49  -4.366   8.732  -9.182
  405    HB   THR  49           HB       THR  49  -6.183   9.740  -7.725
  406    HG1  THR  49           HG1      THR  49  -6.738   6.971  -7.277
  407   HG21  THR  49          HG21      THR  49  -8.031   8.884  -9.135
  408   HG22  THR  49          HG22      THR  49  -6.963   7.607  -9.718
  409   HG23  THR  49          HG23      THR  49  -6.594   9.296 -10.071
  410    H    THR  50           HN       THR  50  -3.912  10.583  -7.598
  411    HA   THR  50           HA       THR  50  -1.866   9.675  -5.789
  412    HB   THR  50           HB       THR  50  -2.896  12.495  -6.137
  413    HG1  THR  50           HG1      THR  50  -2.134  11.269  -8.094
  414   HG21  THR  50          HG21      THR  50  -0.200  11.443  -5.264
  415   HG22  THR  50          HG22      THR  50  -1.429  12.107  -4.187
  416   HG23  THR  50          HG23      THR  50  -0.665  13.139  -5.396
  417    H    LEU  51           HN       LEU  51  -2.423   8.837  -3.877
  418    HA   LEU  51           HA       LEU  51  -4.389  10.302  -2.262
  419    HB2  LEU  51           HB2      LEU  51  -4.225   7.303  -2.586
  420    HB3  LEU  51           HB1      LEU  51  -5.262   8.135  -1.439
  421    HG   LEU  51           HG       LEU  51  -5.443   8.514  -4.430
  422   HD11  LEU  51          HD11      LEU  51  -6.018   6.248  -4.029
  423   HD12  LEU  51          HD12      LEU  51  -7.522   7.147  -4.227
  424   HD13  LEU  51          HD13      LEU  51  -6.981   6.678  -2.616
  425   HD21  LEU  51          HD21      LEU  51  -7.223   9.323  -2.142
  426   HD22  LEU  51          HD22      LEU  51  -7.681   9.421  -3.843
  427   HD23  LEU  51          HD23      LEU  51  -6.333  10.384  -3.236
  428    H    GLY  52           HN       GLY  52  -4.042  10.220  -0.002
  429    HA2  GLY  52           HA2      GLY  52  -1.253   9.992   0.689
  430    HA3  GLY  52           HA1      GLY  52  -2.547  10.542   1.739
  431    H    VAL  53           HN       VAL  53  -0.238   8.409   1.705
  432    HA   VAL  53           HA       VAL  53  -1.784   6.395   3.179
  433    HB   VAL  53           HB       VAL  53   0.315   5.811   1.069
  434   HG11  VAL  53          HG11      VAL  53  -0.003   3.421   1.648
  435   HG12  VAL  53          HG12      VAL  53  -0.933   3.922   3.060
  436   HG13  VAL  53          HG13      VAL  53   0.772   4.353   2.929
  437   HG21  VAL  53          HG21      VAL  53  -1.460   4.465   0.042
  438   HG22  VAL  53          HG22      VAL  53  -1.928   6.159   0.192
  439   HG23  VAL  53          HG23      VAL  53  -2.569   4.964   1.319
  440    H    LYS  54           HN       LYS  54  -0.327   5.204   4.742
  441    HA   LYS  54           HA       LYS  54   1.991   6.885   5.407
  442    HB2  LYS  54           HB2      LYS  54   0.150   5.599   7.423
  443    HB3  LYS  54           HB1      LYS  54   1.487   6.690   7.757
  444    HG2  LYS  54           HG2      LYS  54   0.253   8.443   6.452
  445    HG3  LYS  54           HG1      LYS  54  -1.123   7.342   6.414
  446    HD2  LYS  54           HD2      LYS  54  -1.592   8.684   8.248
  447    HD3  LYS  54           HD1      LYS  54  -0.832   7.273   8.984
  448    HE2  LYS  54           HE2      LYS  54   0.996   9.446   8.192
  449    HE3  LYS  54           HE1      LYS  54  -0.113   9.824   9.508
  450    HZ1  LYS  54           HZ1      LYS  54   2.264   8.473   9.712
  451    HZ2  LYS  54           HZ2      LYS  54   1.095   7.263   9.854
  452    HZ3  LYS  54           HZ3      LYS  54   1.070   8.592  10.903
  453    H    LEU  55           HN       LEU  55   3.836   5.795   5.330
  454    HA   LEU  55           HA       LEU  55   3.914   3.115   6.452
  455    HB2  LEU  55           HB2      LEU  55   5.355   2.278   4.611
  456    HB3  LEU  55           HB1      LEU  55   3.681   2.515   4.183
  457    HG   LEU  55           HG       LEU  55   4.712   4.871   3.347
  458   HD11  LEU  55          HD11      LEU  55   6.994   4.271   3.955
  459   HD12  LEU  55          HD12      LEU  55   6.832   4.389   2.202
  460   HD13  LEU  55          HD13      LEU  55   6.883   2.806   2.979
  461   HD21  LEU  55          HD21      LEU  55   3.312   3.372   2.047
  462   HD22  LEU  55          HD22      LEU  55   4.672   2.270   1.832
  463   HD23  LEU  55          HD23      LEU  55   4.717   3.878   1.109
  464    H    ASP  56           HN       ASP  56   6.379   2.376   6.249
  465    HA   ASP  56           HA       ASP  56   7.813   4.521   7.646
  466    HB2  ASP  56           HB2      ASP  56   8.754   1.665   7.624
  467    HB3  ASP  56           HB1      ASP  56   9.041   2.905   8.825
  468    H    ASP  57           HN       ASP  57   9.914   5.087   7.042
  469    HA   ASP  57           HA       ASP  57  10.658   4.994   4.389
  470    HB2  ASP  57           HB2      ASP  57  11.903   5.801   6.866
  471    HB3  ASP  57           HB1      ASP  57  13.084   5.032   5.812
  472    HA   PRO  58           HA       PRO  58  13.447   1.011   5.696
  473    HB2  PRO  58           HB2      PRO  58  11.269   0.009   7.481
  474    HB3  PRO  58           HB1      PRO  58  13.011  -0.268   7.573
  475    HG2  PRO  58           HG2      PRO  58  11.744   1.493   9.171
  476    HG3  PRO  58           HG1      PRO  58  13.410   1.731   8.619
  477    HD2  PRO  58           HD2      PRO  58  10.969   3.178   7.852
  478    HD3  PRO  58           HD1      PRO  58  12.665   3.652   7.681
  479    H    THR  59           HN       THR  59   9.843   0.951   5.738
  480    HA   THR  59           HA       THR  59   9.708  -1.413   4.157
  481    HB   THR  59           HB       THR  59   7.440  -1.313   4.262
  482    HG1  THR  59           HG1      THR  59   6.242   0.457   3.786
  483   HG21  THR  59          HG21      THR  59   7.746   0.882   6.265
  484   HG22  THR  59          HG22      THR  59   8.446  -0.708   6.565
  485   HG23  THR  59          HG23      THR  59   6.707  -0.541   6.320
  486    H    ARG  60           HN       ARG  60   9.701   2.028   3.474
  487    HA   ARG  60           HA       ARG  60   9.042   1.954   0.763
  488    HB2  ARG  60           HB2      ARG  60   9.627   3.913   2.532
  489    HB3  ARG  60           HB1      ARG  60  11.137   3.877   1.625
  490    HG2  ARG  60           HG2      ARG  60   8.461   4.146   0.281
  491    HG3  ARG  60           HG1      ARG  60   9.365   5.536   0.875
  492    HD2  ARG  60           HD2      ARG  60   9.979   5.421  -1.362
  493    HD3  ARG  60           HD1      ARG  60  11.305   4.594  -0.546
  494    HE   ARG  60           HE       ARG  60   9.401   2.685  -1.231
  495   HH11  ARG  60          HH21      ARG  60  11.519   4.915  -2.895
  496   HH12  ARG  60          HH22      ARG  60  11.777   3.856  -4.239
  497   HH21  ARG  60          HH11      ARG  60   9.764   1.269  -2.955
  498   HH22  ARG  60          HH12      ARG  60  10.798   1.738  -4.258
  499    H    GLU  61           HN       GLU  61  12.200   1.649   2.386
  500    HA   GLU  61           HA       GLU  61  13.744   1.318   0.047
  501    HB2  GLU  61           HB2      GLU  61  14.203   0.167   2.812
  502    HB3  GLU  61           HB1      GLU  61  15.415   0.286   1.542
  503    HG2  GLU  61           HG2      GLU  61  15.245   2.721   1.604
  504    HG3  GLU  61           HG1      GLU  61  14.030   2.601   2.876
  505    H    ARG  62           HN       ARG  62  12.013  -0.925   2.130
  506    HA   ARG  62           HA       ARG  62  12.754  -3.339   0.894
  507    HB2  ARG  62           HB2      ARG  62  11.298  -2.721   3.084
  508    HB3  ARG  62           HB1      ARG  62   9.994  -3.097   1.971
  509    HG2  ARG  62           HG2      ARG  62  12.274  -4.945   2.653
  510    HG3  ARG  62           HG1      ARG  62  10.662  -5.015   3.359
  511    HD2  ARG  62           HD2      ARG  62  11.536  -5.653   0.565
  512    HD3  ARG  62           HD1      ARG  62  10.610  -6.642   1.691
  513    HE   ARG  62           HE       ARG  62   9.153  -4.318   1.047
  514   HH11  ARG  62          HH21      ARG  62  10.112  -7.402  -0.270
  515   HH12  ARG  62          HH22      ARG  62   8.858  -7.435  -1.463
  516   HH21  ARG  62          HH11      ARG  62   7.519  -4.319  -0.553
  517   HH22  ARG  62          HH12      ARG  62   7.373  -5.673  -1.622
  518    H    LEU  63           HN       LEU  63  10.155  -1.027   0.250
  519    HA   LEU  63           HA       LEU  63   8.795  -2.493  -1.710
  520    HB2  LEU  63           HB2      LEU  63   8.984   0.387  -1.006
  521    HB3  LEU  63           HB1      LEU  63   8.404   0.011  -2.614
  522    HG   LEU  63           HG       LEU  63   6.642  -1.462  -1.494
  523   HD11  LEU  63          HD11      LEU  63   7.447   0.094   0.942
  524   HD12  LEU  63          HD12      LEU  63   7.743  -1.626   0.687
  525   HD13  LEU  63          HD13      LEU  63   6.089  -1.022   0.791
  526   HD21  LEU  63          HD21      LEU  63   5.313   0.600  -0.780
  527   HD22  LEU  63          HD22      LEU  63   5.909   0.547  -2.439
  528   HD23  LEU  63          HD23      LEU  63   6.746   1.523  -1.232
  529    H    LYS  64           HN       LYS  64  11.705  -0.500  -1.871
  530    HA   LYS  64           HA       LYS  64  11.941  -0.420  -4.673
  531    HB2  LYS  64           HB2      LYS  64  13.341   0.940  -3.113
  532    HB3  LYS  64           HB1      LYS  64  14.217  -0.526  -2.692
  533    HG2  LYS  64           HG2      LYS  64  14.783  -0.751  -5.138
  534    HG3  LYS  64           HG1      LYS  64  14.134   0.875  -5.348
  535    HD2  LYS  64           HD2      LYS  64  16.378   0.134  -3.475
  536    HD3  LYS  64           HD1      LYS  64  16.590   0.840  -5.077
  537    HE2  LYS  64           HE2      LYS  64  15.045   2.134  -2.834
  538    HE3  LYS  64           HE1      LYS  64  16.732   2.482  -3.208
  539    HZ1  LYS  64           HZ1      LYS  64  14.352   3.031  -4.874
  540    HZ2  LYS  64           HZ2      LYS  64  15.925   3.068  -5.502
  541    HZ3  LYS  64           HZ3      LYS  64  15.480   4.134  -4.262
  542    H    ALA  65           HN       ALA  65  12.953  -2.734  -2.272
  543    HA   ALA  65           HA       ALA  65  14.352  -4.499  -3.953
  544    HB1  ALA  65           HB1      ALA  65  14.184  -6.121  -2.213
  545    HB2  ALA  65           HB2      ALA  65  12.782  -5.311  -1.513
  546    HB3  ALA  65           HB3      ALA  65  14.368  -4.541  -1.447
  547    H    ALA  66           HN       ALA  66  10.927  -4.304  -3.107
  548    HA   ALA  66           HA       ALA  66  10.170  -6.620  -4.579
  549    HB1  ALA  66           HB1      ALA  66   8.651  -5.950  -2.928
  550    HB2  ALA  66           HB2      ALA  66   7.860  -5.550  -4.454
  551    HB3  ALA  66           HB3      ALA  66   8.634  -4.283  -3.501
  552    H    ALA  67           HN       ALA  67  10.439  -3.195  -5.317
  553    HA   ALA  67           HA       ALA  67   9.209  -3.150  -7.829
  554    HB1  ALA  67           HB1      ALA  67  11.551  -1.473  -6.975
  555    HB2  ALA  67           HB2      ALA  67   9.885  -1.157  -6.491
  556    HB3  ALA  67           HB3      ALA  67  10.339  -1.075  -8.194
  557    H    GLN  68           HN       GLN  68  12.605  -3.625  -7.019
  558    HA   GLN  68           HA       GLN  68  13.420  -4.063  -9.702
  559    HB2  GLN  68           HB2      GLN  68  15.473  -5.021  -8.760
  560    HB3  GLN  68           HB1      GLN  68  15.051  -3.519  -7.996
  561    HG2  GLN  68           HG2      GLN  68  15.552  -4.639  -6.126
  562    HG3  GLN  68           HG1      GLN  68  13.882  -5.178  -6.281
  563   HE21  GLN  68          HE21      GLN  68  14.305  -7.085  -5.177
  564   HE22  GLN  68          HE22      GLN  68  15.199  -8.385  -5.888
  565    H    SER  69           HN       SER  69  12.170  -6.068  -7.167
  566    HA   SER  69           HA       SER  69  12.795  -8.508  -8.363
  567    HB2  SER  69           HB2      SER  69  12.209  -8.260  -5.953
  568    HB3  SER  69           HB1      SER  69  10.543  -7.932  -6.423
  569    HG   SER  69           HG       SER  69  11.007 -10.109  -7.637
  570    H    ILE  70           HN       ILE  70  10.245  -6.223  -8.780
  571    HA   ILE  70           HA       ILE  70   8.707  -8.057 -10.461
  572    HB   ILE  70           HB       ILE  70   7.863  -6.336  -8.543
  573   HG12  ILE  70          HG12      ILE  70   6.494  -8.095  -9.491
  574   HG13  ILE  70          HG11      ILE  70   5.591  -6.586  -9.472
  575   HG21  ILE  70          HG21      ILE  70   7.483  -4.835 -11.115
  576   HG22  ILE  70          HG22      ILE  70   8.506  -4.354  -9.761
  577   HG23  ILE  70          HG23      ILE  70   6.755  -4.428  -9.561
  578   HD11  ILE  70          HD11      ILE  70   6.108  -6.305 -11.871
  579   HD12  ILE  70          HD12      ILE  70   5.159  -7.749 -11.516
  580   HD13  ILE  70          HD13      ILE  70   6.886  -7.888 -11.852
  581    H    ASP  71           HN       ASP  71  11.203  -6.059 -10.710
  582    HA   ASP  71           HA       ASP  71  12.350  -5.100 -12.383
  583    HB2  ASP  71           HB2      ASP  71  11.580  -7.244 -13.558
  584    HB3  ASP  71           HB1      ASP  71  10.369  -6.240 -14.347
  585    H    ARG  72           HN       ARG  72  10.446  -3.517 -11.090
  586    HA   ARG  72           HA       ARG  72   9.923  -1.626 -13.281
  587    HB2  ARG  72           HB2      ARG  72   7.910  -2.439 -11.185
  588    HB3  ARG  72           HB1      ARG  72   7.743  -1.007 -12.192
  589    HG2  ARG  72           HG2      ARG  72   7.791  -2.451 -14.194
  590    HG3  ARG  72           HG1      ARG  72   7.849  -3.863 -13.138
  591    HD2  ARG  72           HD2      ARG  72   5.641  -1.820 -13.319
  592    HD3  ARG  72           HD1      ARG  72   5.583  -3.495 -13.862
  593    HE   ARG  72           HE       ARG  72   5.935  -2.789 -11.026
  594   HH11  ARG  72          HH21      ARG  72   4.292  -4.565 -13.550
  595   HH12  ARG  72          HH22      ARG  72   3.318  -5.483 -12.451
  596   HH21  ARG  72          HH11      ARG  72   4.646  -3.981  -9.563
  597   HH22  ARG  72          HH12      ARG  72   3.513  -5.142 -10.170
  598    H    THR  73           HN       THR  73   9.551   0.585 -12.527
  599    HA   THR  73           HA       THR  73  11.488   1.332 -10.573
  600    HB   THR  73           HB       THR  73   9.385   3.192 -11.660
  601    HG1  THR  73           HG1      THR  73  11.566   2.010 -13.052
  602   HG21  THR  73          HG21      THR  73  12.320   3.497 -11.017
  603   HG22  THR  73          HG22      THR  73  10.962   4.169 -10.114
  604   HG23  THR  73          HG23      THR  73  11.318   4.757 -11.739
  605    HA   PRO  74           HA       PRO  74   9.332   1.129  -6.685
  606    HB2  PRO  74           HB2      PRO  74  10.257   3.986  -6.667
  607    HB3  PRO  74           HB1      PRO  74  10.246   2.813  -5.345
  608    HG2  PRO  74           HG2      PRO  74  12.479   3.268  -6.710
  609    HG3  PRO  74           HG1      PRO  74  12.045   1.622  -6.211
  610    HD2  PRO  74           HD2      PRO  74  12.032   2.831  -8.907
  611    HD3  PRO  74           HD1      PRO  74  12.138   1.124  -8.434
  612    H    HIS  75           HN       HIS  75   8.801   4.029  -8.687
  613    HA   HIS  75           HA       HIS  75   6.496   4.973  -7.438
  614    HB2  HIS  75           HB2      HIS  75   7.906   6.060  -9.288
  615    HB3  HIS  75           HB1      HIS  75   6.948   5.110 -10.416
  616    HD1  HIS  75           HD1      HIS  75   5.657   6.970 -11.517
  617    HD2  HIS  75           HD2      HIS  75   5.458   7.121  -7.368
  618    HE1  HIS  75           HE1      HIS  75   3.955   8.745 -10.987
  619    HE2  HIS  75           HE2      HIS  75   4.130   9.031  -8.489
  620    H    TRP  76           HN       TRP  76   6.843   2.668 -10.105
  621    HA   TRP  76           HA       TRP  76   4.102   2.226 -10.568
  622    HB2  TRP  76           HB2      TRP  76   6.455   0.398 -11.050
  623    HB3  TRP  76           HB1      TRP  76   4.838   0.149 -11.696
  624    HD1  TRP  76           HD1      TRP  76   8.075   1.691 -12.531
  625    HE1  TRP  76           HE1      TRP  76   7.868   3.143 -14.644
  626    HE3  TRP  76           HE3      TRP  76   2.982   1.890 -12.866
  627    HZ2  TRP  76           HZ2      TRP  76   5.812   4.228 -16.241
  628    HZ3  TRP  76           HZ3      TRP  76   1.971   3.157 -14.718
  629    HH2  TRP  76           HH2      TRP  76   3.359   4.302 -16.371
  630    H    LEU  77           HN       LEU  77   6.519   0.481  -8.737
  631    HA   LEU  77           HA       LEU  77   4.738  -1.473  -7.817
  632    HB2  LEU  77           HB2      LEU  77   7.189  -1.809  -7.804
  633    HB3  LEU  77           HB1      LEU  77   7.282  -0.700  -6.441
  634    HG   LEU  77           HG       LEU  77   5.324  -2.508  -5.683
  635   HD11  LEU  77          HD11      LEU  77   7.603  -4.029  -6.919
  636   HD12  LEU  77          HD12      LEU  77   5.950  -3.973  -7.531
  637   HD13  LEU  77          HD13      LEU  77   6.285  -4.703  -5.961
  638   HD21  LEU  77          HD21      LEU  77   7.071  -1.458  -4.301
  639   HD22  LEU  77          HD22      LEU  77   8.239  -2.600  -4.966
  640   HD23  LEU  77          HD23      LEU  77   6.882  -3.185  -4.003
  641    H    ILE  78           HN       ILE  78   5.488   1.693  -6.541
  642    HA   ILE  78           HA       ILE  78   4.434   1.233  -3.968
  643    HB   ILE  78           HB       ILE  78   4.517   3.761  -5.615
  644   HG12  ILE  78          HG12      ILE  78   6.044   3.008  -3.120
  645   HG13  ILE  78          HG11      ILE  78   6.652   2.746  -4.751
  646   HG21  ILE  78          HG21      ILE  78   4.044   4.899  -3.388
  647   HG22  ILE  78          HG22      ILE  78   3.442   3.332  -2.846
  648   HG23  ILE  78          HG23      ILE  78   2.681   4.146  -4.214
  649   HD11  ILE  78          HD11      ILE  78   6.559   5.152  -5.166
  650   HD12  ILE  78          HD12      ILE  78   7.583   4.764  -3.783
  651   HD13  ILE  78          HD13      ILE  78   5.961   5.407  -3.527
  652    H    LYS  79           HN       LYS  79   2.897   2.488  -6.913
  653    HA   LYS  79           HA       LYS  79   0.265   2.640  -5.878
  654    HB2  LYS  79           HB2      LYS  79   0.517   1.836  -8.714
  655    HB3  LYS  79           HB1      LYS  79  -0.390   3.158  -8.002
  656    HG2  LYS  79           HG2      LYS  79   1.643   4.486  -7.857
  657    HG3  LYS  79           HG1      LYS  79   2.566   3.148  -8.551
  658    HD2  LYS  79           HD2      LYS  79   1.040   3.246 -10.536
  659    HD3  LYS  79           HD1      LYS  79   0.358   4.726  -9.862
  660    HE2  LYS  79           HE2      LYS  79   2.531   5.801  -9.973
  661    HE3  LYS  79           HE1      LYS  79   3.260   4.308 -10.566
  662    HZ1  LYS  79           HZ1      LYS  79   1.257   5.999 -11.961
  663    HZ2  LYS  79           HZ2      LYS  79   1.722   4.467 -12.499
  664    HZ3  LYS  79           HZ3      LYS  79   2.859   5.715 -12.425
  665    H    GLN  80           HN       GLN  80   1.927   0.197  -7.766
  666    HA   GLN  80           HA       GLN  80  -0.235  -1.618  -7.683
  667    HB2  GLN  80           HB2      GLN  80   2.650  -1.975  -8.473
  668    HB3  GLN  80           HB1      GLN  80   1.429  -3.238  -8.614
  669    HG2  GLN  80           HG2      GLN  80   0.109  -1.826 -10.083
  670    HG3  GLN  80           HG1      GLN  80   1.293  -0.534  -9.923
  671   HE21  GLN  80          HE21      GLN  80   0.511  -3.534 -11.414
  672   HE22  GLN  80          HE22      GLN  80   1.840  -3.568 -12.515
  673    H    ALA  81           HN       ALA  81   2.343  -0.955  -5.442
  674    HA   ALA  81           HA       ALA  81   2.475  -3.482  -4.214
  675    HB1  ALA  81           HB1      ALA  81   3.224  -2.300  -2.174
  676    HB2  ALA  81           HB2      ALA  81   2.826  -0.766  -2.949
  677    HB3  ALA  81           HB3      ALA  81   4.095  -1.791  -3.621
  678    H    ILE  82           HN       ILE  82   0.439  -0.660  -3.514
  679    HA   ILE  82           HA       ILE  82  -1.005  -2.063  -1.497
  680    HB   ILE  82           HB       ILE  82  -0.930   0.356  -1.467
  681   HG12  ILE  82          HG12      ILE  82  -3.284   0.850  -1.069
  682   HG13  ILE  82          HG11      ILE  82  -3.758  -0.575  -1.988
  683   HG21  ILE  82          HG21      ILE  82  -0.843   0.752  -3.868
  684   HG22  ILE  82          HG22      ILE  82  -2.058   1.752  -3.072
  685   HG23  ILE  82          HG23      ILE  82  -2.551   0.331  -3.994
  686   HD11  ILE  82          HD11      ILE  82  -2.842  -2.024  -0.341
  687   HD12  ILE  82          HD12      ILE  82  -3.857  -0.840   0.482
  688   HD13  ILE  82          HD13      ILE  82  -2.101  -0.672   0.514
  689    H    PHE  83           HN       PHE  83  -1.621  -1.537  -4.943
  690    HA   PHE  83           HA       PHE  83  -4.185  -2.827  -4.900
  691    HB2  PHE  83           HB2      PHE  83  -4.051  -1.357  -6.673
  692    HB3  PHE  83           HB1      PHE  83  -2.342  -1.659  -6.936
  693    HD1  PHE  83           HD1      PHE  83  -1.607  -3.511  -8.318
  694    HD2  PHE  83           HD2      PHE  83  -5.740  -2.642  -7.795
  695    HE1  PHE  83           HE1      PHE  83  -2.137  -4.891 -10.281
  696    HE2  PHE  83           HE2      PHE  83  -6.281  -4.029  -9.755
  697    HZ   PHE  83           HZ       PHE  83  -4.477  -5.155 -11.001
  698    H    ASN  84           HN       ASN  84  -0.902  -3.826  -5.689
  699    HA   ASN  84           HA       ASN  84  -1.599  -6.435  -6.548
  700    HB2  ASN  84           HB2      ASN  84   0.675  -5.097  -6.850
  701    HB3  ASN  84           HB1      ASN  84   1.085  -5.912  -5.347
  702   HD21  ASN  84          HD21      ASN  84  -0.719  -8.193  -6.334
  703   HD22  ASN  84          HD22      ASN  84   0.266  -9.041  -7.470
  704    H    TYR  85           HN       TYR  85  -1.019  -4.874  -3.494
  705    HA   TYR  85           HA       TYR  85  -0.646  -7.161  -1.908
  706    HB2  TYR  85           HB2      TYR  85  -0.336  -5.013  -0.865
  707    HB3  TYR  85           HB1      TYR  85  -1.962  -4.501  -1.300
  708    HD1  TYR  85           HD2      TYR  85  -0.889  -7.718   0.261
  709    HD2  TYR  85           HD1      TYR  85  -2.965  -4.037   0.756
  710    HE1  TYR  85           HE2      TYR  85  -1.720  -8.490   2.439
  711    HE2  TYR  85           HE1      TYR  85  -3.806  -4.803   2.935
  712    HH   TYR  85           HH       TYR  85  -4.138  -6.709   4.213
  713    H    LEU  86           HN       LEU  86  -3.423  -5.420  -3.070
  714    HA   LEU  86           HA       LEU  86  -5.397  -7.022  -1.913
  715    HB2  LEU  86           HB2      LEU  86  -5.515  -5.427  -4.460
  716    HB3  LEU  86           HB1      LEU  86  -6.903  -6.072  -3.606
  717    HG   LEU  86           HG       LEU  86  -5.218  -3.702  -2.959
  718   HD11  LEU  86          HD11      LEU  86  -7.453  -3.531  -3.978
  719   HD12  LEU  86          HD12      LEU  86  -7.343  -2.735  -2.409
  720   HD13  LEU  86          HD13      LEU  86  -8.135  -4.304  -2.548
  721   HD21  LEU  86          HD21      LEU  86  -5.923  -3.741  -0.622
  722   HD22  LEU  86          HD22      LEU  86  -4.843  -5.081  -1.007
  723   HD23  LEU  86          HD23      LEU  86  -6.577  -5.362  -0.851
  724    H    GLU  87           HN       GLU  87  -3.804  -7.131  -5.065
  725    HA   GLU  87           HA       GLU  87  -5.139  -9.331  -6.162
  726    HB2  GLU  87           HB2      GLU  87  -3.747  -7.786  -7.469
  727    HB3  GLU  87           HB1      GLU  87  -2.313  -8.388  -6.657
  728    HG2  GLU  87           HG2      GLU  87  -2.723 -10.614  -7.638
  729    HG3  GLU  87           HG1      GLU  87  -4.108  -9.950  -8.502
  730    H    LYS  88           HN       LYS  88  -2.250  -9.200  -4.104
  731    HA   LYS  88           HA       LYS  88  -1.550 -11.923  -4.357
  732    HB2  LYS  88           HB2      LYS  88  -0.729  -9.677  -2.703
  733    HB3  LYS  88           HB1      LYS  88  -0.727 -11.189  -1.807
  734    HG2  LYS  88           HG2      LYS  88   1.426 -11.056  -2.655
  735    HG3  LYS  88           HG1      LYS  88   0.606 -12.126  -3.794
  736    HD2  LYS  88           HD2      LYS  88   0.289 -10.286  -5.338
  737    HD3  LYS  88           HD1      LYS  88   1.016  -9.164  -4.187
  738    HE2  LYS  88           HE2      LYS  88   3.074 -10.684  -4.300
  739    HE3  LYS  88           HE1      LYS  88   2.326 -11.373  -5.740
  740    HZ1  LYS  88           HZ1      LYS  88   3.106  -8.539  -5.321
  741    HZ2  LYS  88           HZ2      LYS  88   2.238  -9.096  -6.664
  742    HZ3  LYS  88           HZ3      LYS  88   3.815  -9.644  -6.391
  743    H    LEU  89           HN       LEU  89  -3.547 -10.221  -1.979
  744    HA   LEU  89           HA       LEU  89  -4.149 -12.682  -0.598
  745    HB2  LEU  89           HB2      LEU  89  -5.358 -11.379   0.962
  746    HB3  LEU  89           HB1      LEU  89  -3.916 -10.471   0.562
  747    HG   LEU  89           HG       LEU  89  -5.703  -9.415  -1.205
  748   HD11  LEU  89          HD11      LEU  89  -7.797  -9.060  -0.164
  749   HD12  LEU  89          HD12      LEU  89  -7.253  -9.794   1.344
  750   HD13  LEU  89          HD13      LEU  89  -7.494 -10.796  -0.088
  751   HD21  LEU  89          HD21      LEU  89  -5.850  -7.528   0.394
  752   HD22  LEU  89          HD22      LEU  89  -4.206  -8.120   0.154
  753   HD23  LEU  89          HD23      LEU  89  -5.094  -8.552   1.615
  754    H    GLU  90           HN       GLU  90  -5.427 -11.009  -3.279
  755    HA   GLU  90           HA       GLU  90  -7.490 -12.929  -3.687
  756    HB2  GLU  90           HB2      GLU  90  -8.633 -11.536  -2.018
  757    HB3  GLU  90           HB1      GLU  90  -8.317 -10.103  -2.983
  758    HG2  GLU  90           HG2      GLU  90 -10.574 -10.692  -3.339
  759    HG3  GLU  90           HG1      GLU  90  -9.694 -11.123  -4.801
  Start of MODEL   10
    1    H1   MET   1           HT1      MET   1   4.360   0.355  15.735
    2    H2   MET   1           HT2      MET   1   2.853   0.114  15.006
    3    H3   MET   1           HT3      MET   1   3.260   1.634  15.627
    4    HA   MET   1           HA       MET   1   5.092   0.595  13.655
    5    HB2  MET   1           HB2      MET   1   2.461   0.219  13.038
    6    HB3  MET   1           HB1      MET   1   2.701   1.863  12.461
    7    HG2  MET   1           HG2      MET   1   3.200   0.627  10.591
    8    HG3  MET   1           HG1      MET   1   4.798   0.873  11.297
    9    HE1  MET   1           HE1      MET   1   1.720  -1.526  11.264
   10    HE2  MET   1           HE2      MET   1   2.508  -3.042  10.830
   11    HE3  MET   1           HE3      MET   1   2.538  -1.681   9.709
   12    H    ALA   2           HN       ALA   2   6.129   2.346  12.625
   13    HA   ALA   2           HA       ALA   2   5.435   5.002  13.714
   14    HB1  ALA   2           HB1      ALA   2   8.202   3.936  13.131
   15    HB2  ALA   2           HB2      ALA   2   7.493   4.123  14.735
   16    HB3  ALA   2           HB3      ALA   2   7.814   5.545  13.742
   17    H    THR   3           HN       THR   3   4.143   4.581  11.601
   18    HA   THR   3           HA       THR   3   5.562   4.877   9.131
   19    HB   THR   3           HB       THR   3   3.372   4.918   8.101
   20    HG1  THR   3           HG1      THR   3   2.673   5.979  10.429
   21   HG21  THR   3          HG21      THR   3   2.506   2.784   8.871
   22   HG22  THR   3          HG22      THR   3   3.389   2.942  10.389
   23   HG23  THR   3          HG23      THR   3   4.269   2.736   8.875
   24    H    THR   4           HN       THR   4   5.435   6.556   7.695
   25    HA   THR   4           HA       THR   4   4.730   9.198   8.794
   26    HB   THR   4           HB       THR   4   6.415  10.035   7.050
   27    HG1  THR   4           HG1      THR   4   6.566   7.357   6.632
   28   HG21  THR   4          HG21      THR   4   7.335   8.408   9.421
   29   HG22  THR   4          HG22      THR   4   6.962  10.131   9.388
   30   HG23  THR   4          HG23      THR   4   8.370   9.517   8.522
   31    H    THR   5           HN       THR   5   3.895  10.747   7.145
   32    HA   THR   5           HA       THR   5   2.045   9.405   5.378
   33    HB   THR   5           HB       THR   5   2.496  12.380   5.666
   34    HG1  THR   5           HG1      THR   5   0.528  12.110   7.037
   35   HG21  THR   5          HG21      THR   5   0.267  12.602   4.770
   36   HG22  THR   5          HG22      THR   5   0.061  10.851   4.742
   37   HG23  THR   5          HG23      THR   5   1.228  11.619   3.665
   38    H    LEU   6           HN       LEU   6   2.588   8.791   3.406
   39    HA   LEU   6           HA       LEU   6   4.372  10.523   1.841
   40    HB2  LEU   6           HB2      LEU   6   4.418   7.505   1.964
   41    HB3  LEU   6           HB1      LEU   6   5.343   8.474   0.831
   42    HG   LEU   6           HG       LEU   6   5.648   8.658   3.830
   43   HD11  LEU   6          HD11      LEU   6   7.154   7.046   1.795
   44   HD12  LEU   6          HD12      LEU   6   6.359   6.486   3.267
   45   HD13  LEU   6          HD13      LEU   6   7.820   7.467   3.372
   46   HD21  LEU   6          HD21      LEU   6   6.371  10.670   2.786
   47   HD22  LEU   6          HD22      LEU   6   7.211   9.783   1.516
   48   HD23  LEU   6          HD23      LEU   6   7.815   9.735   3.172
   49    H    GLY   7           HN       GLY   7   3.897  10.688  -0.346
   50    HA2  GLY   7           HA2      GLY   7   1.151  10.299  -1.024
   51    HA3  GLY   7           HA1      GLY   7   2.404  10.929  -2.081
   52    H    VAL   8           HN       VAL   8   0.418   8.305  -1.354
   53    HA   VAL   8           HA       VAL   8   1.944   6.512  -3.124
   54    HB   VAL   8           HB       VAL   8  -0.041   5.928  -0.928
   55   HG11  VAL   8          HG11      VAL   8   0.141   3.535  -1.531
   56   HG12  VAL   8          HG12      VAL   8   0.980   4.001  -3.010
   57   HG13  VAL   8          HG13      VAL   8  -0.694   4.492  -2.755
   58   HG21  VAL   8          HG21      VAL   8   2.282   6.219  -0.259
   59   HG22  VAL   8          HG22      VAL   8   2.782   4.996  -1.428
   60   HG23  VAL   8          HG23      VAL   8   1.776   4.542  -0.053
   61    H    LYS   9           HN       LYS   9   0.826   5.479  -4.837
   62    HA   LYS   9           HA       LYS   9  -1.659   6.860  -5.553
   63    HB2  LYS   9           HB2      LYS   9   0.516   5.696  -7.274
   64    HB3  LYS   9           HB1      LYS   9  -1.054   6.158  -7.915
   65    HG2  LYS   9           HG2      LYS   9  -0.685   8.455  -7.177
   66    HG3  LYS   9           HG1      LYS   9   0.890   7.993  -6.528
   67    HD2  LYS   9           HD2      LYS   9   1.669   7.404  -8.740
   68    HD3  LYS   9           HD1      LYS   9   0.073   7.724  -9.421
   69    HE2  LYS   9           HE2      LYS   9   1.557   9.866  -7.944
   70    HE3  LYS   9           HE1      LYS   9   1.936   9.519  -9.630
   71    HZ1  LYS   9           HZ1      LYS   9  -0.615  10.494  -8.488
   72    HZ2  LYS   9           HZ2      LYS   9  -0.534   9.809 -10.036
   73    HZ3  LYS   9           HZ3      LYS   9   0.345  11.209  -9.688
   74    H    LEU  10           HN       LEU  10  -3.430   5.753  -5.415
   75    HA   LEU  10           HA       LEU  10  -3.495   2.994  -6.341
   76    HB2  LEU  10           HB2      LEU  10  -5.037   2.352  -4.490
   77    HB3  LEU  10           HB1      LEU  10  -3.376   2.578  -4.019
   78    HG   LEU  10           HG       LEU  10  -4.291   5.005  -3.379
   79   HD11  LEU  10          HD11      LEU  10  -6.552   4.609  -4.144
   80   HD12  LEU  10          HD12      LEU  10  -6.535   4.765  -2.386
   81   HD13  LEU  10          HD13      LEU  10  -6.671   3.172  -3.129
   82   HD21  LEU  10          HD21      LEU  10  -3.157   3.523  -1.855
   83   HD22  LEU  10          HD22      LEU  10  -4.580   2.487  -1.753
   84   HD23  LEU  10          HD23      LEU  10  -4.631   4.122  -1.093
   85    H    ASP  11           HN       ASP  11  -5.993   2.354  -6.275
   86    HA   ASP  11           HA       ASP  11  -7.173   4.365  -8.040
   87    HB2  ASP  11           HB2      ASP  11  -8.182   1.579  -7.426
   88    HB3  ASP  11           HB1      ASP  11  -8.714   2.626  -8.734
   89    H    ASP  12           HN       ASP  12  -9.254   5.266  -7.701
   90    HA   ASP  12           HA       ASP  12 -10.033   5.897  -5.128
   91    HB2  ASP  12           HB2      ASP  12 -11.408   5.979  -7.762
   92    HB3  ASP  12           HB1      ASP  12 -12.436   6.075  -6.338
   93    HA   PRO  13           HA       PRO  13 -13.237   2.193  -5.201
   94    HB2  PRO  13           HB2      PRO  13 -12.504   0.135  -6.887
   95    HB3  PRO  13           HB1      PRO  13 -13.731   1.347  -7.268
   96    HG2  PRO  13           HG2      PRO  13 -10.860   1.229  -8.095
   97    HG3  PRO  13           HG1      PRO  13 -12.283   1.700  -9.044
   98    HD2  PRO  13           HD2      PRO  13 -10.611   3.531  -8.028
   99    HD3  PRO  13           HD1      PRO  13 -12.361   3.819  -8.107
  100    H    THR  14           HN       THR  14  -9.823   1.738  -5.900
  101    HA   THR  14           HA       THR  14  -9.411  -0.558  -4.315
  102    HB   THR  14           HB       THR  14  -7.533   1.613  -5.259
  103    HG1  THR  14           HG1      THR  14  -7.135   0.216  -6.870
  104   HG21  THR  14          HG21      THR  14  -5.731  -0.104  -4.615
  105   HG22  THR  14          HG22      THR  14  -6.957  -0.785  -3.546
  106   HG23  THR  14          HG23      THR  14  -6.426   0.881  -3.329
  107    H    ARG  15           HN       ARG  15  -9.335   2.904  -3.661
  108    HA   ARG  15           HA       ARG  15  -8.412   2.822  -1.011
  109    HB2  ARG  15           HB2      ARG  15  -8.939   4.789  -2.698
  110    HB3  ARG  15           HB1      ARG  15 -10.509   4.782  -1.895
  111    HG2  ARG  15           HG2      ARG  15  -7.865   5.141  -0.489
  112    HG3  ARG  15           HG1      ARG  15  -8.928   6.454  -0.985
  113    HD2  ARG  15           HD2      ARG  15  -9.699   6.260   1.126
  114    HD3  ARG  15           HD1      ARG  15 -10.661   4.955   0.431
  115    HE   ARG  15           HE       ARG  15  -8.232   3.859   1.221
  116   HH11  ARG  15          HH21      ARG  15 -10.971   5.417   2.729
  117   HH12  ARG  15          HH22      ARG  15 -10.823   4.536   4.212
  118   HH21  ARG  15          HH11      ARG  15  -8.022   2.686   3.169
  119   HH22  ARG  15          HH12      ARG  15  -9.136   2.967   4.460
  120    H    GLU  16           HN       GLU  16 -11.655   2.576  -2.420
  121    HA   GLU  16           HA       GLU  16 -13.090   2.288  -0.006
  122    HB2  GLU  16           HB2      GLU  16 -13.702   1.246  -2.784
  123    HB3  GLU  16           HB1      GLU  16 -14.847   1.257  -1.449
  124    HG2  GLU  16           HG2      GLU  16 -14.731   3.694  -1.365
  125    HG3  GLU  16           HG1      GLU  16 -13.579   3.685  -2.699
  126    H    ARG  17           HN       ARG  17 -11.523   0.006  -2.187
  127    HA   ARG  17           HA       ARG  17 -12.292  -2.390  -0.947
  128    HB2  ARG  17           HB2      ARG  17 -11.026  -1.974  -3.202
  129    HB3  ARG  17           HB1      ARG  17  -9.581  -2.055  -2.209
  130    HG2  ARG  17           HG2      ARG  17 -11.649  -4.245  -2.366
  131    HG3  ARG  17           HG1      ARG  17 -10.177  -4.194  -3.335
  132    HD2  ARG  17           HD2      ARG  17  -8.893  -4.087  -1.175
  133    HD3  ARG  17           HD1      ARG  17 -10.406  -4.409  -0.341
  134    HE   ARG  17           HE       ARG  17  -9.646  -6.340  -2.375
  135   HH11  ARG  17          HH21      ARG  17  -9.694  -5.479   1.015
  136   HH12  ARG  17          HH22      ARG  17  -9.358  -7.086   1.570
  137   HH21  ARG  17          HH11      ARG  17  -9.192  -8.500  -1.646
  138   HH22  ARG  17          HH12      ARG  17  -9.080  -8.792   0.059
  139    H    LEU  18           HN       LEU  18  -9.683  -0.111  -0.298
  140    HA   LEU  18           HA       LEU  18  -8.290  -1.622   1.608
  141    HB2  LEU  18           HB2      LEU  18  -8.474   1.240   0.909
  142    HB3  LEU  18           HB1      LEU  18  -8.009   0.916   2.566
  143    HG   LEU  18           HG       LEU  18  -6.175  -0.578   1.613
  144   HD11  LEU  18          HD11      LEU  18  -6.783   0.963  -0.899
  145   HD12  LEU  18          HD12      LEU  18  -7.148  -0.744  -0.653
  146   HD13  LEU  18          HD13      LEU  18  -5.473  -0.191  -0.647
  147   HD21  LEU  18          HD21      LEU  18  -4.859   1.553   0.865
  148   HD22  LEU  18          HD22      LEU  18  -5.382   1.364   2.537
  149   HD23  LEU  18          HD23      LEU  18  -6.300   2.394   1.439
  150    H    LYS  19           HN       LYS  19 -11.141   0.482   1.882
  151    HA   LYS  19           HA       LYS  19 -11.348   0.318   4.690
  152    HB2  LYS  19           HB2      LYS  19 -12.656   1.939   3.326
  153    HB3  LYS  19           HB1      LYS  19 -13.638   0.601   2.741
  154    HG2  LYS  19           HG2      LYS  19 -14.375   0.136   5.026
  155    HG3  LYS  19           HG1      LYS  19 -13.391   1.476   5.616
  156    HD2  LYS  19           HD2      LYS  19 -14.713   3.025   4.231
  157    HD3  LYS  19           HD1      LYS  19 -15.715   1.674   3.701
  158    HE2  LYS  19           HE2      LYS  19 -16.912   2.753   5.438
  159    HE3  LYS  19           HE1      LYS  19 -16.258   1.271   6.132
  160    HZ1  LYS  19           HZ1      LYS  19 -15.038   3.966   6.435
  161    HZ2  LYS  19           HZ2      LYS  19 -14.515   2.538   7.179
  162    HZ3  LYS  19           HZ3      LYS  19 -16.009   3.210   7.597
  163    H    ALA  20           HN       ALA  20 -12.545  -1.686   2.108
  164    HA   ALA  20           HA       ALA  20 -14.025  -3.521   3.638
  165    HB1  ALA  20           HB1      ALA  20 -13.826  -5.028   1.715
  166    HB2  ALA  20           HB2      ALA  20 -12.581  -3.987   1.024
  167    HB3  ALA  20           HB3      ALA  20 -14.231  -3.389   1.203
  168    H    ALA  21           HN       ALA  21 -10.630  -3.374   2.696
  169    HA   ALA  21           HA       ALA  21  -9.823  -5.850   3.803
  170    HB1  ALA  21           HB1      ALA  21  -8.471  -4.491   2.203
  171    HB2  ALA  21           HB2      ALA  21  -7.570  -5.013   3.626
  172    HB3  ALA  21           HB3      ALA  21  -8.150  -3.352   3.510
  173    H    ALA  22           HN       ALA  22 -10.065  -2.574   5.051
  174    HA   ALA  22           HA       ALA  22  -8.997  -2.977   7.604
  175    HB1  ALA  22           HB1      ALA  22  -9.984  -0.924   8.207
  176    HB2  ALA  22           HB2      ALA  22 -11.293  -1.123   7.043
  177    HB3  ALA  22           HB3      ALA  22  -9.660  -0.771   6.480
  178    H    GLN  23           HN       GLN  23 -12.185  -3.336   6.306
  179    HA   GLN  23           HA       GLN  23 -13.509  -4.032   8.701
  180    HB2  GLN  23           HB2      GLN  23 -14.208  -4.545   5.808
  181    HB3  GLN  23           HB1      GLN  23 -15.289  -4.878   7.154
  182    HG2  GLN  23           HG2      GLN  23 -14.148  -2.166   6.541
  183    HG3  GLN  23           HG1      GLN  23 -15.721  -2.724   5.980
  184   HE21  GLN  23          HE21      GLN  23 -14.018  -1.234   8.471
  185   HE22  GLN  23          HE22      GLN  23 -15.267  -1.223   9.662
  186    H    SER  24           HN       SER  24 -11.886  -5.944   6.197
  187    HA   SER  24           HA       SER  24 -12.751  -8.453   7.185
  188    HB2  SER  24           HB2      SER  24 -11.059  -9.439   5.734
  189    HB3  SER  24           HB1      SER  24 -11.909  -8.155   4.882
  190    HG   SER  24           HG       SER  24  -9.730  -7.188   6.160
  191    H    ILE  25           HN       ILE  25 -10.267  -6.266   8.201
  192    HA   ILE  25           HA       ILE  25  -9.179  -8.355   9.967
  193    HB   ILE  25           HB       ILE  25  -7.536  -7.296   8.430
  194   HG12  ILE  25          HG12      ILE  25  -6.987  -6.597  11.321
  195   HG13  ILE  25          HG11      ILE  25  -6.902  -8.231  10.674
  196   HG21  ILE  25          HG21      ILE  25  -8.182  -4.795   9.975
  197   HG22  ILE  25          HG22      ILE  25  -8.446  -5.085   8.255
  198   HG23  ILE  25          HG23      ILE  25  -6.804  -4.981   8.890
  199   HD11  ILE  25          HD11      ILE  25  -5.084  -7.638   9.246
  200   HD12  ILE  25          HD12      ILE  25  -4.710  -7.092  10.881
  201   HD13  ILE  25          HD13      ILE  25  -5.248  -5.933   9.665
  202    H    ASP  26           HN       ASP  26 -11.409  -6.075   9.953
  203    HA   ASP  26           HA       ASP  26 -12.522  -4.830  11.459
  204    HB2  ASP  26           HB2      ASP  26 -11.244  -6.859  13.274
  205    HB3  ASP  26           HB1      ASP  26 -12.339  -5.624  13.887
  206    H    ARG  27           HN       ARG  27 -10.364  -3.531  10.577
  207    HA   ARG  27           HA       ARG  27  -9.397  -2.141  12.997
  208    HB2  ARG  27           HB2      ARG  27  -7.843  -2.659  10.453
  209    HB3  ARG  27           HB1      ARG  27  -7.289  -1.659  11.788
  210    HG2  ARG  27           HG2      ARG  27  -7.991  -4.556  12.139
  211    HG3  ARG  27           HG1      ARG  27  -6.381  -4.021  11.655
  212    HD2  ARG  27           HD2      ARG  27  -6.226  -2.672  13.699
  213    HD3  ARG  27           HD1      ARG  27  -7.830  -3.223  14.179
  214    HE   ARG  27           HE       ARG  27  -6.904  -5.179  14.902
  215   HH11  ARG  27          HH21      ARG  27  -4.634  -3.590  12.792
  216   HH12  ARG  27          HH22      ARG  27  -3.350  -4.722  13.077
  217   HH21  ARG  27          HH11      ARG  27  -5.203  -6.675  15.323
  218   HH22  ARG  27          HH12      ARG  27  -3.673  -6.469  14.538
  219    H    THR  28           HN       THR  28  -8.850   0.116  12.643
  220    HA   THR  28           HA       THR  28 -10.847   1.479  11.159
  221    HB   THR  28           HB       THR  28  -8.337   2.679  12.351
  222    HG1  THR  28           HG1      THR  28  -9.708   2.905  14.267
  223   HG21  THR  28          HG21      THR  28  -9.724   4.655  12.691
  224   HG22  THR  28          HG22      THR  28 -11.113   3.819  11.997
  225   HG23  THR  28          HG23      THR  28  -9.716   4.194  10.988
  226    HA   PRO  29           HA       PRO  29  -9.130   1.708   7.050
  227    HB2  PRO  29           HB2      PRO  29  -9.885   4.587   7.398
  228    HB3  PRO  29           HB1      PRO  29 -10.154   3.517   6.017
  229    HG2  PRO  29           HG2      PRO  29 -12.119   4.042   7.743
  230    HG3  PRO  29           HG1      PRO  29 -11.927   2.429   7.032
  231    HD2  PRO  29           HD2      PRO  29 -11.392   3.347   9.794
  232    HD3  PRO  29           HD1      PRO  29 -11.784   1.723   9.198
  233    H    HIS  30           HN       HIS  30  -8.336   4.389   9.268
  234    HA   HIS  30           HA       HIS  30  -6.017   5.262   7.948
  235    HB2  HIS  30           HB2      HIS  30  -7.334   6.395   9.834
  236    HB3  HIS  30           HB1      HIS  30  -6.427   5.368  10.936
  237    HD1  HIS  30           HD1      HIS  30  -5.802   8.039   8.311
  238    HD2  HIS  30           HD2      HIS  30  -4.025   6.383  11.682
  239    HE1  HIS  30           HE1      HIS  30  -3.790   9.466   8.780
  240    HE2  HIS  30           HE2      HIS  30  -2.919   8.613  10.989
  241    H    TRP  31           HN       TRP  31  -6.437   2.943  10.609
  242    HA   TRP  31           HA       TRP  31  -3.680   2.317  10.838
  243    HB2  TRP  31           HB2      TRP  31  -5.339   1.893  12.661
  244    HB3  TRP  31           HB1      TRP  31  -6.030   0.607  11.674
  245    HD1  TRP  31           HD1      TRP  31  -4.862  -1.719  11.751
  246    HE1  TRP  31           HE1      TRP  31  -2.800  -2.664  12.975
  247    HE3  TRP  31           HE3      TRP  31  -2.918   2.642  13.574
  248    HZ2  TRP  31           HZ2      TRP  31  -0.652  -1.697  14.512
  249    HZ3  TRP  31           HZ3      TRP  31  -0.858   2.544  14.914
  250    HH2  TRP  31           HH2      TRP  31   0.251   0.418  15.374
  251    H    LEU  32           HN       LEU  32  -6.390   0.991   9.124
  252    HA   LEU  32           HA       LEU  32  -5.151  -1.278   8.073
  253    HB2  LEU  32           HB2      LEU  32  -7.570  -0.973   7.998
  254    HB3  LEU  32           HB1      LEU  32  -7.374   0.367   6.889
  255    HG   LEU  32           HG       LEU  32  -8.105  -1.912   5.939
  256   HD11  LEU  32          HD11      LEU  32  -7.359   0.059   4.615
  257   HD12  LEU  32          HD12      LEU  32  -7.040  -1.499   3.855
  258   HD13  LEU  32          HD13      LEU  32  -5.728  -0.614   4.633
  259   HD21  LEU  32          HD21      LEU  32  -6.385  -3.233   7.126
  260   HD22  LEU  32          HD22      LEU  32  -5.149  -2.457   6.136
  261   HD23  LEU  32          HD23      LEU  32  -6.371  -3.479   5.380
  262    H    ILE  33           HN       ILE  33  -5.296   2.022   6.866
  263    HA   ILE  33           HA       ILE  33  -4.156   1.545   4.364
  264    HB   ILE  33           HB       ILE  33  -4.010   3.976   6.141
  265   HG12  ILE  33          HG12      ILE  33  -5.483   3.521   3.541
  266   HG13  ILE  33          HG11      ILE  33  -6.202   3.272   5.128
  267   HG21  ILE  33          HG21      ILE  33  -2.046   4.125   4.824
  268   HG22  ILE  33          HG22      ILE  33  -3.241   5.189   4.081
  269   HG23  ILE  33          HG23      ILE  33  -2.902   3.611   3.370
  270   HD11  ILE  33          HD11      ILE  33  -6.061   5.576   5.645
  271   HD12  ILE  33          HD12      ILE  33  -6.732   5.452   4.018
  272   HD13  ILE  33          HD13      ILE  33  -5.040   5.895   4.244
  273    H    LYS  34           HN       LYS  34  -2.599   2.349   7.454
  274    HA   LYS  34           HA       LYS  34   0.064   2.209   6.554
  275    HB2  LYS  34           HB2      LYS  34  -1.144   1.560   9.251
  276    HB3  LYS  34           HB1      LYS  34   0.586   1.620   8.957
  277    HG2  LYS  34           HG2      LYS  34   0.365   3.977   8.301
  278    HG3  LYS  34           HG1      LYS  34  -1.355   3.900   8.693
  279    HD2  LYS  34           HD2      LYS  34   0.855   3.278  10.645
  280    HD3  LYS  34           HD1      LYS  34   0.085   4.858  10.500
  281    HE2  LYS  34           HE2      LYS  34  -1.348   2.288  11.140
  282    HE3  LYS  34           HE1      LYS  34  -0.837   3.484  12.329
  283    HZ1  LYS  34           HZ1      LYS  34  -3.098   3.877  11.843
  284    HZ2  LYS  34           HZ2      LYS  34  -2.832   3.834  10.169
  285    HZ3  LYS  34           HZ3      LYS  34  -2.218   5.113  11.094
  286    H    GLN  35           HN       GLN  35  -2.047  -0.237   7.973
  287    HA   GLN  35           HA       GLN  35  -0.172  -2.330   7.827
  288    HB2  GLN  35           HB2      GLN  35  -3.145  -2.280   8.171
  289    HB3  GLN  35           HB1      GLN  35  -2.267  -3.795   8.012
  290    HG2  GLN  35           HG2      GLN  35  -0.821  -2.978   9.927
  291    HG3  GLN  35           HG1      GLN  35  -2.046  -1.731  10.170
  292   HE21  GLN  35          HE21      GLN  35  -4.232  -3.445   9.349
  293   HE22  GLN  35          HE22      GLN  35  -4.487  -4.570  10.636
  294    H    ALA  36           HN       ALA  36  -2.670  -1.252   5.582
  295    HA   ALA  36           HA       ALA  36  -2.791  -3.447   3.910
  296    HB1  ALA  36           HB1      ALA  36  -3.267  -1.646   2.107
  297    HB2  ALA  36           HB2      ALA  36  -3.194  -0.522   3.464
  298    HB3  ALA  36           HB3      ALA  36  -4.374  -1.832   3.465
  299    H    ILE  37           HN       ILE  37  -0.669  -0.598   3.533
  300    HA   ILE  37           HA       ILE  37   0.699  -1.713   1.311
  301    HB   ILE  37           HB       ILE  37   0.702   0.688   1.737
  302   HG12  ILE  37          HG12      ILE  37   3.112   1.150   1.425
  303   HG13  ILE  37          HG11      ILE  37   3.472  -0.508   1.898
  304   HG21  ILE  37          HG21      ILE  37   1.862   1.732   3.532
  305   HG22  ILE  37          HG22      ILE  37   2.477   0.182   4.106
  306   HG23  ILE  37          HG23      ILE  37   0.753   0.540   4.208
  307   HD11  ILE  37          HD11      ILE  37   1.695   0.148  -0.424
  308   HD12  ILE  37          HD12      ILE  37   2.487  -1.381  -0.041
  309   HD13  ILE  37          HD13      ILE  37   3.445   0.000  -0.573
  310    H    PHE  38           HN       PHE  38   1.351  -1.689   4.761
  311    HA   PHE  38           HA       PHE  38   3.851  -3.036   4.628
  312    HB2  PHE  38           HB2      PHE  38   3.688  -1.995   6.655
  313    HB3  PHE  38           HB1      PHE  38   1.938  -2.123   6.695
  314    HD1  PHE  38           HD1      PHE  38   0.881  -4.230   7.504
  315    HD2  PHE  38           HD2      PHE  38   5.067  -3.518   7.809
  316    HE1  PHE  38           HE1      PHE  38   1.049  -5.986   9.216
  317    HE2  PHE  38           HE2      PHE  38   5.242  -5.278   9.519
  318    HZ   PHE  38           HZ       PHE  38   3.232  -6.514  10.224
  319    H    ASN  39           HN       ASN  39   0.545  -4.017   4.649
  320    HA   ASN  39           HA       ASN  39   0.901  -6.709   5.382
  321    HB2  ASN  39           HB2      ASN  39  -1.276  -5.216   3.975
  322    HB3  ASN  39           HB1      ASN  39  -1.285  -6.971   3.987
  323   HD21  ASN  39          HD21      ASN  39  -3.171  -5.099   5.152
  324   HD22  ASN  39          HD22      ASN  39  -3.224  -5.452   6.843
  325    H    TYR  40           HN       TYR  40   0.906  -4.957   2.313
  326    HA   TYR  40           HA       TYR  40   1.064  -7.193   0.652
  327    HB2  TYR  40           HB2      TYR  40   0.867  -5.185  -0.549
  328    HB3  TYR  40           HB1      TYR  40   2.094  -4.377   0.421
  329    HD1  TYR  40           HD1      TYR  40   2.016  -7.467  -1.711
  330    HD2  TYR  40           HD2      TYR  40   3.944  -3.784  -0.813
  331    HE1  TYR  40           HE1      TYR  40   3.701  -7.932  -3.441
  332    HE2  TYR  40           HE2      TYR  40   5.631  -4.240  -2.542
  333    HH   TYR  40           HH       TYR  40   5.279  -6.634  -4.877
  334    H    LEU  41           HN       LEU  41   3.388  -5.406   2.512
  335    HA   LEU  41           HA       LEU  41   5.626  -6.966   1.672
  336    HB2  LEU  41           HB2      LEU  41   5.346  -5.120   4.021
  337    HB3  LEU  41           HB1      LEU  41   6.856  -5.742   3.374
  338    HG   LEU  41           HG       LEU  41   4.935  -3.883   1.976
  339   HD11  LEU  41          HD11      LEU  41   7.780  -3.420   2.816
  340   HD12  LEU  41          HD12      LEU  41   6.376  -2.918   3.756
  341   HD13  LEU  41          HD13      LEU  41   6.646  -2.248   2.148
  342   HD21  LEU  41          HD21      LEU  41   7.347  -5.359   0.991
  343   HD22  LEU  41          HD22      LEU  41   6.871  -3.815   0.286
  344   HD23  LEU  41          HD23      LEU  41   5.762  -5.185   0.238
  345    H    GLU  42           HN       GLU  42   3.653  -6.928   4.612
  346    HA   GLU  42           HA       GLU  42   5.102  -8.917   6.020
  347    HB2  GLU  42           HB2      GLU  42   3.762  -7.296   7.194
  348    HB3  GLU  42           HB1      GLU  42   2.308  -7.835   6.371
  349    HG2  GLU  42           HG2      GLU  42   3.740  -9.896   7.914
  350    HG3  GLU  42           HG1      GLU  42   3.014  -8.595   8.854
  351    H    LYS  43           HN       LYS  43   2.177  -9.109   4.012
  352    HA   LYS  43           HA       LYS  43   1.420 -11.700   4.752
  353    HB2  LYS  43           HB2      LYS  43   0.959 -10.169   2.193
  354    HB3  LYS  43           HB1      LYS  43   0.232 -11.736   2.519
  355    HG2  LYS  43           HG2      LYS  43  -0.154  -9.279   4.220
  356    HG3  LYS  43           HG1      LYS  43  -1.276  -9.835   2.978
  357    HD2  LYS  43           HD2      LYS  43  -1.586 -11.932   4.197
  358    HD3  LYS  43           HD1      LYS  43  -0.454 -11.384   5.434
  359    HE2  LYS  43           HE2      LYS  43  -3.027  -9.984   4.721
  360    HE3  LYS  43           HE1      LYS  43  -2.835 -11.103   6.070
  361    HZ1  LYS  43           HZ1      LYS  43  -2.460  -9.142   7.128
  362    HZ2  LYS  43           HZ2      LYS  43  -1.825  -8.375   5.768
  363    HZ3  LYS  43           HZ3      LYS  43  -0.866  -9.462   6.643
  364    H    LEU  44           HN       LEU  44   3.413 -10.648   1.979
  365    HA   LEU  44           HA       LEU  44   4.034 -13.418   1.409
  366    HB2  LEU  44           HB2      LEU  44   5.383 -12.564  -0.440
  367    HB3  LEU  44           HB1      LEU  44   3.745 -11.950  -0.482
  368    HG   LEU  44           HG       LEU  44   4.890  -9.886   0.765
  369   HD11  LEU  44          HD11      LEU  44   7.100 -11.042  -0.936
  370   HD12  LEU  44          HD12      LEU  44   7.116 -10.906   0.823
  371   HD13  LEU  44          HD13      LEU  44   7.101  -9.451  -0.174
  372   HD21  LEU  44          HD21      LEU  44   5.067  -8.829  -1.430
  373   HD22  LEU  44          HD22      LEU  44   3.610  -9.815  -1.307
  374   HD23  LEU  44          HD23      LEU  44   5.007 -10.415  -2.199
  375    H    GLU  45           HN       GLU  45   5.374 -10.740   3.057
  376    HA   GLU  45           HA       GLU  45   7.221 -10.313   4.235
  377    HB2  GLU  45           HB2      GLU  45   6.248 -12.254   5.518
  378    HB3  GLU  45           HB1      GLU  45   7.415 -13.286   4.698
  379    HG2  GLU  45           HG2      GLU  45   9.250 -12.122   5.671
  380    HG3  GLU  45           HG1      GLU  45   8.193 -10.868   6.306
  381    H1   MET  46           HT1      MET  46  -3.909   0.554 -15.718
  382    H2   MET  46           HT2      MET  46  -2.475   0.212 -14.891
  383    H3   MET  46           HT3      MET  46  -2.770   1.778 -15.460
  384    HA   MET  46           HA       MET  46  -4.764   0.675 -13.663
  385    HB2  MET  46           HB2      MET  46  -2.191   0.281 -12.883
  386    HB3  MET  46           HB1      MET  46  -2.442   1.922 -12.303
  387    HG2  MET  46           HG2      MET  46  -3.054   0.663 -10.479
  388    HG3  MET  46           HG1      MET  46  -4.608   0.958 -11.260
  389    HE1  MET  46           HE1      MET  46  -1.591  -1.535 -11.126
  390    HE2  MET  46           HE2      MET  46  -2.449  -3.022 -10.720
  391    HE3  MET  46           HE3      MET  46  -2.480  -1.655  -9.606
  392    H    ALA  47           HN       ALA  47  -5.807   2.428 -12.535
  393    HA   ALA  47           HA       ALA  47  -5.137   5.082 -13.643
  394    HB1  ALA  47           HB1      ALA  47  -7.896   4.015 -13.029
  395    HB2  ALA  47           HB2      ALA  47  -7.198   4.178 -14.640
  396    HB3  ALA  47           HB3      ALA  47  -7.513   5.615 -13.666
  397    H    THR  48           HN       THR  48  -3.853   4.573 -11.498
  398    HA   THR  48           HA       THR  48  -5.265   4.950  -9.045
  399    HB   THR  48           HB       THR  48  -3.080   4.947  -8.007
  400    HG1  THR  48           HG1      THR  48  -2.342   6.007 -10.307
  401   HG21  THR  48          HG21      THR  48  -2.251   2.793  -8.766
  402   HG22  THR  48          HG22      THR  48  -3.127   2.961 -10.287
  403   HG23  THR  48          HG23      THR  48  -4.014   2.779  -8.774
  404    H    THR  49           HN       THR  49  -5.064   6.632  -7.608
  405    HA   THR  49           HA       THR  49  -4.319   9.255  -8.727
  406    HB   THR  49           HB       THR  49  -5.981  10.109  -6.948
  407    HG1  THR  49           HG1      THR  49  -6.098   7.573  -6.356
  408   HG21  THR  49          HG21      THR  49  -6.935   8.567  -9.364
  409   HG22  THR  49          HG22      THR  49  -6.498  10.275  -9.296
  410   HG23  THR  49          HG23      THR  49  -7.933   9.697  -8.448
  411    H    THR  50           HN       THR  50  -3.436  10.785  -7.100
  412    HA   THR  50           HA       THR  50  -1.613   9.422  -5.325
  413    HB   THR  50           HB       THR  50  -2.001  12.405  -5.613
  414    HG1  THR  50           HG1      THR  50  -0.194  12.203  -7.096
  415   HG21  THR  50          HG21      THR  50   0.260  12.565  -4.775
  416   HG22  THR  50          HG22      THR  50   0.412  10.808  -4.747
  417   HG23  THR  50          HG23      THR  50  -0.706  11.614  -3.646
  418    H    LEU  51           HN       LEU  51  -2.178   8.827  -3.349
  419    HA   LEU  51           HA       LEU  51  -3.905  10.622  -1.790
  420    HB2  LEU  51           HB2      LEU  51  -4.038   7.606  -1.887
  421    HB3  LEU  51           HB1      LEU  51  -4.932   8.611  -0.761
  422    HG   LEU  51           HG       LEU  51  -5.237   8.780  -3.761
  423   HD11  LEU  51          HD11      LEU  51  -6.782   7.221  -1.714
  424   HD12  LEU  51          HD12      LEU  51  -6.004   6.630  -3.182
  425   HD13  LEU  51          HD13      LEU  51  -7.439   7.650  -3.293
  426   HD21  LEU  51          HD21      LEU  51  -5.903  10.818  -2.727
  427   HD22  LEU  51          HD22      LEU  51  -6.768   9.960  -1.453
  428   HD23  LEU  51          HD23      LEU  51  -7.372   9.920  -3.109
  429    H    GLY  52           HN       GLY  52  -3.430  10.771   0.401
  430    HA2  GLY  52           HA2      GLY  52  -0.692  10.324   1.078
  431    HA3  GLY  52           HA1      GLY  52  -1.929  10.993   2.131
  432    H    VAL  53           HN       VAL  53  -0.016   8.312   1.417
  433    HA   VAL  53           HA       VAL  53  -1.590   6.572   3.196
  434    HB   VAL  53           HB       VAL  53   0.378   5.923   1.003
  435   HG11  VAL  53          HG11      VAL  53   0.131   3.539   1.618
  436   HG12  VAL  53          HG12      VAL  53  -0.695   4.034   3.096
  437   HG13  VAL  53          HG13      VAL  53   0.992   4.478   2.838
  438   HG21  VAL  53          HG21      VAL  53  -1.938   6.274   0.336
  439   HG22  VAL  53          HG22      VAL  53  -2.470   5.071   1.510
  440   HG23  VAL  53          HG23      VAL  53  -1.478   4.583   0.136
  441    H    LYS  54           HN       LYS  54  -0.495   5.506   4.910
  442    HA   LYS  54           HA       LYS  54   2.021   6.832   5.623
  443    HB2  LYS  54           HB2      LYS  54  -0.182   5.729   7.348
  444    HB3  LYS  54           HB1      LYS  54   1.399   6.157   7.987
  445    HG2  LYS  54           HG2      LYS  54   1.088   8.455   7.238
  446    HG3  LYS  54           HG1      LYS  54  -0.495   8.030   6.582
  447    HD2  LYS  54           HD2      LYS  54  -1.326   7.514   8.773
  448    HD3  LYS  54           HD1      LYS  54   0.279   7.711   9.479
  449    HE2  LYS  54           HE2      LYS  54  -1.096   9.952   8.030
  450    HE3  LYS  54           HE1      LYS  54  -1.394   9.636   9.739
  451    HZ1  LYS  54           HZ1      LYS  54   1.124  10.465   8.429
  452    HZ2  LYS  54           HZ2      LYS  54   1.130   9.745   9.964
  453    HZ3  LYS  54           HZ3      LYS  54   0.309  11.203   9.718
  454    H    LEU  55           HN       LEU  55   3.763   5.684   5.496
  455    HA   LEU  55           HA       LEU  55   3.761   2.931   6.436
  456    HB2  LEU  55           HB2      LEU  55   5.287   2.240   4.588
  457    HB3  LEU  55           HB1      LEU  55   3.631   2.502   4.120
  458    HG   LEU  55           HG       LEU  55   4.601   4.903   3.464
  459   HD11  LEU  55          HD11      LEU  55   6.854   4.456   4.223
  460   HD12  LEU  55          HD12      LEU  55   6.834   4.604   2.465
  461   HD13  LEU  55          HD13      LEU  55   6.935   3.012   3.215
  462   HD21  LEU  55          HD21      LEU  55   3.426   3.444   1.950
  463   HD22  LEU  55          HD22      LEU  55   4.822   2.371   1.851
  464   HD23  LEU  55          HD23      LEU  55   4.913   4.000   1.181
  465    H    ASP  56           HN       ASP  56   6.244   2.226   6.369
  466    HA   ASP  56           HA       ASP  56   7.480   4.211   8.126
  467    HB2  ASP  56           HB2      ASP  56   8.395   1.392   7.509
  468    HB3  ASP  56           HB1      ASP  56   9.006   2.431   8.788
  469    H    ASP  57           HN       ASP  57   9.580   5.058   7.783
  470    HA   ASP  57           HA       ASP  57  10.367   5.658   5.202
  471    HB2  ASP  57           HB2      ASP  57  11.792   5.689   7.824
  472    HB3  ASP  57           HB1      ASP  57  12.764   5.846   6.367
  473    HA   PRO  58           HA       PRO  58  13.481   1.881   5.304
  474    HB2  PRO  58           HB2      PRO  58  12.700  -0.146   7.005
  475    HB3  PRO  58           HB1      PRO  58  13.955   1.039   7.378
  476    HG2  PRO  58           HG2      PRO  58  11.082   0.995   8.203
  477    HG3  PRO  58           HG1      PRO  58  12.515   1.437   9.151
  478    HD2  PRO  58           HD2      PRO  58  10.891   3.304   8.123
  479    HD3  PRO  58           HD1      PRO  58  12.648   3.547   8.198
  480    H    THR  59           HN       THR  59  10.055   1.530   5.992
  481    HA   THR  59           HA       THR  59   9.588  -0.777   4.429
  482    HB   THR  59           HB       THR  59   7.756   1.445   5.350
  483    HG1  THR  59           HG1      THR  59   7.247   0.023   6.939
  484   HG21  THR  59          HG21      THR  59   5.919  -0.242   4.729
  485   HG22  THR  59          HG22      THR  59   7.131  -0.963   3.670
  486   HG23  THR  59          HG23      THR  59   6.635   0.711   3.430
  487    H    ARG  60           HN       ARG  60   9.597   2.679   3.756
  488    HA   ARG  60           HA       ARG  60   8.665   2.605   1.109
  489    HB2  ARG  60           HB2      ARG  60   9.239   4.570   2.780
  490    HB3  ARG  60           HB1      ARG  60  10.810   4.520   1.980
  491    HG2  ARG  60           HG2      ARG  60   8.177   4.930   0.568
  492    HG3  ARG  60           HG1      ARG  60   9.272   6.222   1.054
  493    HD2  ARG  60           HD2      ARG  60  10.046   5.992  -1.051
  494    HD3  ARG  60           HD1      ARG  60  10.966   4.661  -0.350
  495    HE   ARG  60           HE       ARG  60   8.507   3.635  -1.139
  496   HH11  ARG  60          HH21      ARG  60  11.288   5.111  -2.651
  497   HH12  ARG  60          HH22      ARG  60  11.114   4.233  -4.132
  498   HH21  ARG  60          HH11      ARG  60   8.268   2.459  -3.084
  499   HH22  ARG  60          HH12      ARG  60   9.389   2.710  -4.377
  500    H    GLU  61           HN       GLU  61  11.901   2.268   2.515
  501    HA   GLU  61           HA       GLU  61  13.324   1.936   0.094
  502    HB2  GLU  61           HB2      GLU  61  13.907   0.878   2.873
  503    HB3  GLU  61           HB1      GLU  61  15.044   0.840   1.534
  504    HG2  GLU  61           HG2      GLU  61  15.030   3.277   1.447
  505    HG3  GLU  61           HG1      GLU  61  13.888   3.318   2.790
  506    H    ARG  62           HN       ARG  62  11.695  -0.281   2.293
  507    HA   ARG  62           HA       ARG  62  12.395  -2.709   1.074
  508    HB2  ARG  62           HB2      ARG  62  11.142  -2.230   3.327
  509    HB3  ARG  62           HB1      ARG  62   9.695  -2.291   2.335
  510    HG2  ARG  62           HG2      ARG  62  11.714  -4.524   2.516
  511    HG3  ARG  62           HG1      ARG  62  10.244  -4.429   3.486
  512    HD2  ARG  62           HD2      ARG  62   8.960  -4.319   1.328
  513    HD3  ARG  62           HD1      ARG  62  10.466  -4.679   0.494
  514    HE   ARG  62           HE       ARG  62   9.690  -6.578   2.547
  515   HH11  ARG  62          HH21      ARG  62   9.695  -5.736  -0.846
  516   HH12  ARG  62          HH22      ARG  62   9.308  -7.335  -1.386
  517   HH21  ARG  62          HH11      ARG  62   9.170  -8.731   1.838
  518   HH22  ARG  62          HH12      ARG  62   9.013  -9.027   0.138
  519    H    LEU  63           HN       LEU  63   9.858  -0.358   0.403
  520    HA   LEU  63           HA       LEU  63   8.424  -1.844  -1.493
  521    HB2  LEU  63           HB2      LEU  63   8.682   1.017  -0.812
  522    HB3  LEU  63           HB1      LEU  63   8.202   0.692  -2.464
  523    HG   LEU  63           HG       LEU  63   6.335  -0.747  -1.495
  524   HD11  LEU  63          HD11      LEU  63   6.991   0.789   1.008
  525   HD12  LEU  63          HD12      LEU  63   7.306  -0.929   0.771
  526   HD13  LEU  63          HD13      LEU  63   5.648  -0.327   0.765
  527   HD21  LEU  63          HD21      LEU  63   5.077   1.420  -0.755
  528   HD22  LEU  63          HD22      LEU  63   5.592   1.210  -2.428
  529   HD23  LEU  63          HD23      LEU  63   6.538   2.220  -1.335
  530    H    LYS  64           HN       LYS  64  11.329   0.181  -1.773
  531    HA   LYS  64           HA       LYS  64  11.531   0.000  -4.582
  532    HB2  LYS  64           HB2      LYS  64  12.882   1.598  -3.232
  533    HB3  LYS  64           HB1      LYS  64  13.826   0.239  -2.631
  534    HG2  LYS  64           HG2      LYS  64  14.561  -0.265  -4.911
  535    HG3  LYS  64           HG1      LYS  64  13.615   1.095  -5.515
  536    HD2  LYS  64           HD2      LYS  64  14.973   2.635  -4.192
  537    HD3  LYS  64           HD1      LYS  64  15.907   1.279  -3.559
  538    HE2  LYS  64           HE2      LYS  64  17.216   2.203  -5.290
  539    HE3  LYS  64           HE1      LYS  64  16.503   0.741  -5.964
  540    HZ1  LYS  64           HZ1      LYS  64  15.437   3.482  -6.397
  541    HZ2  LYS  64           HZ2      LYS  64  14.899   2.061  -7.139
  542    HZ3  LYS  64           HZ3      LYS  64  16.442   2.664  -7.485
  543    H    ALA  65           HN       ALA  65  12.677  -2.021  -1.988
  544    HA   ALA  65           HA       ALA  65  14.109  -3.902  -3.508
  545    HB1  ALA  65           HB1      ALA  65  13.871  -5.394  -1.578
  546    HB2  ALA  65           HB2      ALA  65  12.653  -4.318  -0.893
  547    HB3  ALA  65           HB3      ALA  65  14.318  -3.764  -1.073
  548    H    ALA  66           HN       ALA  66  10.719  -3.666  -2.568
  549    HA   ALA  66           HA       ALA  66   9.852  -6.126  -3.661
  550    HB1  ALA  66           HB1      ALA  66   8.531  -4.726  -2.073
  551    HB2  ALA  66           HB2      ALA  66   7.621  -5.233  -3.495
  552    HB3  ALA  66           HB3      ALA  66   8.242  -3.586  -3.387
  553    H    ALA  67           HN       ALA  67  10.178  -2.866  -4.930
  554    HA   ALA  67           HA       ALA  67   9.101  -3.260  -7.483
  555    HB1  ALA  67           HB1      ALA  67  10.131  -1.233  -8.096
  556    HB2  ALA  67           HB2      ALA  67  11.436  -1.453  -6.932
  557    HB3  ALA  67           HB3      ALA  67   9.812  -1.062  -6.369
  558    H    GLN  68           HN       GLN  68  12.278  -3.692  -6.179
  559    HA   GLN  68           HA       GLN  68  13.584  -4.420  -8.575
  560    HB2  GLN  68           HB2      GLN  68  14.269  -4.956  -5.682
  561    HB3  GLN  68           HB1      GLN  68  15.341  -5.319  -7.028
  562    HG2  GLN  68           HG2      GLN  68  14.276  -2.570  -6.437
  563    HG3  GLN  68           HG1      GLN  68  15.814  -3.174  -5.828
  564   HE21  GLN  68          HE21      GLN  68  14.143  -1.819  -8.479
  565   HE22  GLN  68          HE22      GLN  68  15.461  -1.789  -9.596
  566    H    SER  69           HN       SER  69  11.948  -6.285  -6.043
  567    HA   SER  69           HA       SER  69  12.709  -8.823  -7.030
  568    HB2  SER  69           HB2      SER  69  11.038  -9.749  -5.544
  569    HB3  SER  69           HB1      SER  69  11.872  -8.435  -4.720
  570    HG   SER  69           HG       SER  69   9.831  -7.312  -5.893
  571    H    ILE  70           HN       ILE  70  10.299  -6.565  -8.064
  572    HA   ILE  70           HA       ILE  70   9.135  -8.641  -9.793
  573    HB   ILE  70           HB       ILE  70   7.528  -7.518  -8.267
  574   HG12  ILE  70          HG12      ILE  70   6.990  -6.834 -11.163
  575   HG13  ILE  70          HG11      ILE  70   6.864  -8.460 -10.501
  576   HG21  ILE  70          HG21      ILE  70   8.243  -5.056  -9.840
  577   HG22  ILE  70          HG22      ILE  70   8.500  -5.333  -8.118
  578   HG23  ILE  70          HG23      ILE  70   6.861  -5.190  -8.753
  579   HD11  ILE  70          HD11      ILE  70   5.064  -7.806  -9.075
  580   HD12  ILE  70          HD12      ILE  70   4.703  -7.265 -10.714
  581   HD13  ILE  70          HD13      ILE  70   5.273  -6.110  -9.509
  582    H    ASP  71           HN       ASP  71  11.433  -6.411  -9.834
  583    HA   ASP  71           HA       ASP  71  12.581  -5.267 -11.399
  584    HB2  ASP  71           HB2      ASP  71  11.106  -7.186 -13.195
  585    HB3  ASP  71           HB1      ASP  71  12.319  -6.062 -13.798
  586    H    ARG  72           HN       ARG  72  10.453  -3.877 -10.463
  587    HA   ARG  72           HA       ARG  72   9.522  -2.451 -12.875
  588    HB2  ARG  72           HB2      ARG  72   7.964  -2.908 -10.324
  589    HB3  ARG  72           HB1      ARG  72   7.435  -1.904 -11.666
  590    HG2  ARG  72           HG2      ARG  72   8.050  -4.824 -11.988
  591    HG3  ARG  72           HG1      ARG  72   6.457  -4.235 -11.514
  592    HD2  ARG  72           HD2      ARG  72   6.326  -2.924 -13.572
  593    HD3  ARG  72           HD1      ARG  72   7.932  -3.485 -14.038
  594    HE   ARG  72           HE       ARG  72   7.019  -5.475 -14.708
  595   HH11  ARG  72          HH21      ARG  72   4.680  -3.750 -12.783
  596   HH12  ARG  72          HH22      ARG  72   3.385  -4.857 -13.106
  597   HH21  ARG  72          HH11      ARG  72   5.309  -6.943 -15.171
  598   HH22  ARG  72          HH12      ARG  72   3.740  -6.662 -14.489
  599    H    THR  73           HN       THR  73   9.046  -0.184 -12.529
  600    HA   THR  73           HA       THR  73  11.081   1.128 -11.050
  601    HB   THR  73           HB       THR  73   8.607   2.368 -12.280
  602    HG1  THR  73           HG1      THR  73  10.087   2.594 -14.148
  603   HG21  THR  73          HG21      THR  73  10.009   4.334 -12.586
  604   HG22  THR  73          HG22      THR  73  11.383   3.489 -11.874
  605   HG23  THR  73          HG23      THR  73   9.974   3.871 -10.884
  606    HA   PRO  74           HA       PRO  74   9.363   1.431  -6.948
  607    HB2  PRO  74           HB2      PRO  74  10.189   4.289  -7.306
  608    HB3  PRO  74           HB1      PRO  74  10.431   3.217  -5.921
  609    HG2  PRO  74           HG2      PRO  74  12.411   3.687  -7.641
  610    HG3  PRO  74           HG1      PRO  74  12.173   2.078  -6.936
  611    HD2  PRO  74           HD2      PRO  74  11.655   3.024  -9.694
  612    HD3  PRO  74           HD1      PRO  74  12.024   1.391  -9.110
  613    H    HIS  75           HN       HIS  75   8.632   4.119  -9.180
  614    HA   HIS  75           HA       HIS  75   6.338   5.054  -7.851
  615    HB2  HIS  75           HB2      HIS  75   7.694   6.148  -9.740
  616    HB3  HIS  75           HB1      HIS  75   6.739   5.162 -10.839
  617    HD1  HIS  75           HD1      HIS  75   6.229   7.848  -8.193
  618    HD2  HIS  75           HD2      HIS  75   4.381   6.277 -11.569
  619    HE1  HIS  75           HE1      HIS  75   4.281   9.357  -8.657
  620    HE2  HIS  75           HE2      HIS  75   3.393   8.563 -10.877
  621    H    TRP  76           HN       TRP  76   6.699   2.720 -10.511
  622    HA   TRP  76           HA       TRP  76   3.926   2.168 -10.739
  623    HB2  TRP  76           HB2      TRP  76   5.570   1.688 -12.561
  624    HB3  TRP  76           HB1      TRP  76   6.231   0.391 -11.568
  625    HD1  TRP  76           HD1      TRP  76   5.002  -1.906 -11.626
  626    HE1  TRP  76           HE1      TRP  76   2.914  -2.805 -12.842
  627    HE3  TRP  76           HE3      TRP  76   3.170   2.491 -13.478
  628    HZ2  TRP  76           HZ2      TRP  76   0.791  -1.793 -14.383
  629    HZ3  TRP  76           HZ3      TRP  76   1.106   2.438 -14.815
  630    HH2  TRP  76           HH2      TRP  76  -0.058   0.339 -15.259
  631    H    LEU  77           HN       LEU  77   6.597   0.778  -9.014
  632    HA   LEU  77           HA       LEU  77   5.297  -1.453  -7.957
  633    HB2  LEU  77           HB2      LEU  77   7.723  -1.214  -7.881
  634    HB3  LEU  77           HB1      LEU  77   7.561   0.136  -6.779
  635    HG   LEU  77           HG       LEU  77   8.231  -2.157  -5.816
  636   HD11  LEU  77          HD11      LEU  77   7.536  -0.159  -4.503
  637   HD12  LEU  77          HD12      LEU  77   7.176  -1.705  -3.735
  638   HD13  LEU  77          HD13      LEU  77   5.889  -0.789  -4.519
  639   HD21  LEU  77          HD21      LEU  77   6.475  -3.437  -6.998
  640   HD22  LEU  77          HD22      LEU  77   5.260  -2.623  -6.012
  641   HD23  LEU  77          HD23      LEU  77   6.454  -3.674  -5.250
  642    H    ILE  78           HN       ILE  78   5.529   1.847  -6.766
  643    HA   ILE  78           HA       ILE  78   4.375   1.412  -4.263
  644    HB   ILE  78           HB       ILE  78   4.293   3.838  -6.050
  645   HG12  ILE  78          HG12      ILE  78   5.754   3.355  -3.449
  646   HG13  ILE  78          HG11      ILE  78   6.465   3.082  -5.035
  647   HG21  ILE  78          HG21      ILE  78   2.334   4.043  -4.733
  648   HG22  ILE  78          HG22      ILE  78   3.555   5.079  -3.995
  649   HG23  ILE  78          HG23      ILE  78   3.176   3.513  -3.278
  650   HD11  ILE  78          HD11      ILE  78   6.385   5.386  -5.561
  651   HD12  ILE  78          HD12      ILE  78   7.052   5.252  -3.934
  652   HD13  ILE  78          HD13      ILE  78   5.371   5.738  -4.162
  653    H    LYS  79           HN       LYS  79   2.844   2.245  -7.358
  654    HA   LYS  79           HA       LYS  79   0.177   2.174  -6.462
  655    HB2  LYS  79           HB2      LYS  79   1.371   1.481  -9.155
  656    HB3  LYS  79           HB1      LYS  79  -0.357   1.592  -8.863
  657    HG2  LYS  79           HG2      LYS  79  -0.068   3.945  -8.215
  658    HG3  LYS  79           HG1      LYS  79   1.649   3.817  -8.607
  659    HD2  LYS  79           HD2      LYS  79  -0.580   3.261 -10.557
  660    HD3  LYS  79           HD1      LYS  79   0.243   4.814 -10.416
  661    HE2  LYS  79           HE2      LYS  79   1.591   2.197 -11.050
  662    HE3  LYS  79           HE1      LYS  79   1.110   3.398 -12.246
  663    HZ1  LYS  79           HZ1      LYS  79   3.382   3.735 -11.784
  664    HZ2  LYS  79           HZ2      LYS  79   3.135   3.695 -10.106
  665    HZ3  LYS  79           HZ3      LYS  79   2.548   4.993 -11.020
  666    H    GLN  80           HN       GLN  80   2.221  -0.336  -7.877
  667    HA   GLN  80           HA       GLN  80   0.294  -2.379  -7.717
  668    HB2  GLN  80           HB2      GLN  80   3.264  -2.397  -8.077
  669    HB3  GLN  80           HB1      GLN  80   2.366  -3.896  -7.879
  670    HG2  GLN  80           HG2      GLN  80   0.916  -3.108  -9.800
  671    HG3  GLN  80           HG1      GLN  80   2.142  -1.870 -10.075
  672   HE21  GLN  80          HE21      GLN  80   4.328  -3.582  -9.242
  673   HE22  GLN  80          HE22      GLN  80   4.572  -4.723 -10.515
  674    H    ALA  81           HN       ALA  81   2.816  -1.355  -5.474
  675    HA   ALA  81           HA       ALA  81   2.879  -3.544  -3.789
  676    HB1  ALA  81           HB1      ALA  81   3.403  -1.746  -1.995
  677    HB2  ALA  81           HB2      ALA  81   3.362  -0.629  -3.360
  678    HB3  ALA  81           HB3      ALA  81   4.505  -1.971  -3.352
  679    H    ILE  82           HN       ILE  82   0.837  -0.635  -3.421
  680    HA   ILE  82           HA       ILE  82  -0.559  -1.700  -1.193
  681    HB   ILE  82           HB       ILE  82  -0.500   0.697  -1.634
  682   HG12  ILE  82          HG12      ILE  82  -2.897   1.224  -1.322
  683   HG13  ILE  82          HG11      ILE  82  -3.301  -0.426  -1.787
  684   HG21  ILE  82          HG21      ILE  82  -1.634   1.761  -3.433
  685   HG22  ILE  82          HG22      ILE  82  -2.291   0.225  -3.997
  686   HG23  ILE  82          HG23      ILE  82  -0.558   0.536  -4.105
  687   HD11  ILE  82          HD11      ILE  82  -1.506   0.194   0.532
  688   HD12  ILE  82          HD12      ILE  82  -2.338  -1.315   0.157
  689   HD13  ILE  82          HD13      ILE  82  -3.259   0.093   0.682
  690    H    PHE  83           HN       PHE  83  -1.215  -1.679  -4.641
  691    HA   PHE  83           HA       PHE  83  -3.747  -2.961  -4.499
  692    HB2  PHE  83           HB2      PHE  83  -3.561  -1.935  -6.531
  693    HB3  PHE  83           HB1      PHE  83  -1.814  -2.105  -6.572
  694    HD1  PHE  83           HD1      PHE  83  -0.809  -4.243  -7.370
  695    HD2  PHE  83           HD2      PHE  83  -4.976  -3.428  -7.679
  696    HE1  PHE  83           HE1      PHE  83  -1.021  -6.002  -9.074
  697    HE2  PHE  83           HE2      PHE  83  -5.195  -5.191  -9.381
  698    HZ   PHE  83           HZ       PHE  83  -3.217  -6.480 -10.081
  699    H    ASN  84           HN       ASN  84  -0.468  -4.025  -4.509
  700    HA   ASN  84           HA       ASN  84  -0.893  -6.711  -5.234
  701    HB2  ASN  84           HB2      ASN  84   1.322  -5.264  -3.841
  702    HB3  ASN  84           HB1      ASN  84   1.288  -7.018  -3.836
  703   HD21  ASN  84          HD21      ASN  84   3.214  -5.197  -5.021
  704   HD22  ASN  84          HD22      ASN  84   3.259  -5.567  -6.707
  705    H    TYR  85           HN       TYR  85  -0.854  -4.945  -2.173
  706    HA   TYR  85           HA       TYR  85  -1.068  -7.170  -0.501
  707    HB2  TYR  85           HB2      TYR  85  -0.816  -5.167   0.694
  708    HB3  TYR  85           HB1      TYR  85  -2.017  -4.326  -0.281
  709    HD1  TYR  85           HD1      TYR  85  -2.029  -7.406   1.868
  710    HD2  TYR  85           HD2      TYR  85  -3.854  -3.678   0.942
  711    HE1  TYR  85           HE1      TYR  85  -3.730  -7.813   3.597
  712    HE2  TYR  85           HE2      TYR  85  -5.556  -4.076   2.670
  713    HH   TYR  85           HH       TYR  85  -5.276  -6.489   5.014
  714    H    LEU  86           HN       LEU  86  -3.343  -5.328  -2.365
  715    HA   LEU  86           HA       LEU  86  -5.623  -6.819  -1.513
  716    HB2  LEU  86           HB2      LEU  86  -5.292  -4.994  -3.872
  717    HB3  LEU  86           HB1      LEU  86  -6.819  -5.573  -3.226
  718    HG   LEU  86           HG       LEU  86  -4.853  -3.758  -1.833
  719   HD11  LEU  86          HD11      LEU  86  -7.686  -3.226  -2.676
  720   HD12  LEU  86          HD12      LEU  86  -6.270  -2.769  -3.622
  721   HD13  LEU  86          HD13      LEU  86  -6.519  -2.080  -2.018
  722   HD21  LEU  86          HD21      LEU  86  -7.303  -5.169  -0.845
  723   HD22  LEU  86          HD22      LEU  86  -6.789  -3.634  -0.145
  724   HD23  LEU  86          HD23      LEU  86  -5.715  -5.033  -0.091
  725    H    GLU  87           HN       GLU  87  -3.652  -6.848  -4.451
  726    HA   GLU  87           HA       GLU  87  -5.157  -8.800  -5.851
  727    HB2  GLU  87           HB2      GLU  87  -3.795  -7.218  -7.040
  728    HB3  GLU  87           HB1      GLU  87  -2.347  -7.770  -6.216
  729    HG2  GLU  87           HG2      GLU  87  -3.767  -9.860  -7.699
  730    HG3  GLU  87           HG1      GLU  87  -3.137  -8.551  -8.695
  731    H    LYS  88           HN       LYS  88  -2.245  -9.065  -3.839
  732    HA   LYS  88           HA       LYS  88  -1.549 -11.676  -4.577
  733    HB2  LYS  88           HB2      LYS  88  -1.058 -10.144  -2.026
  734    HB3  LYS  88           HB1      LYS  88  -0.382 -11.738  -2.329
  735    HG2  LYS  88           HG2      LYS  88   0.101  -9.311  -4.048
  736    HG3  LYS  88           HG1      LYS  88   1.194  -9.899  -2.794
  737    HD2  LYS  88           HD2      LYS  88   1.443 -12.011  -3.995
  738    HD3  LYS  88           HD1      LYS  88   0.332 -11.439  -5.241
  739    HE2  LYS  88           HE2      LYS  88   2.953 -10.131  -4.531
  740    HE3  LYS  88           HE1      LYS  88   2.708 -11.230  -5.888
  741    HZ1  LYS  88           HZ1      LYS  88   2.405  -9.246  -6.923
  742    HZ2  LYS  88           HZ2      LYS  88   1.802  -8.470  -5.553
  743    HZ3  LYS  88           HZ3      LYS  88   0.803  -9.513  -6.436
  744    H    LEU  89           HN       LEU  89  -3.504 -10.563  -1.806
  745    HA   LEU  89           HA       LEU  89  -4.203 -13.310  -1.227
  746    HB2  LEU  89           HB2      LEU  89  -5.530 -12.413   0.617
  747    HB3  LEU  89           HB1      LEU  89  -3.877 -11.842   0.659
  748    HG   LEU  89           HG       LEU  89  -4.970  -9.755  -0.597
  749   HD11  LEU  89          HD11      LEU  89  -7.203 -10.847   1.115
  750   HD12  LEU  89          HD12      LEU  89  -7.221 -10.720  -0.644
  751   HD13  LEU  89          HD13      LEU  89  -7.166  -9.260   0.344
  752   HD21  LEU  89          HD21      LEU  89  -5.114  -8.685   1.593
  753   HD22  LEU  89          HD22      LEU  89  -3.683  -9.709   1.472
  754   HD23  LEU  89          HD23      LEU  89  -5.094 -10.269   2.369
  755    H    GLU  90           HN       GLU  90  -5.461 -10.599  -2.885
  756    HA   GLU  90           HA       GLU  90  -7.283 -10.139  -4.092
  757    HB2  GLU  90           HB2      GLU  90  -6.341 -12.094  -5.348
  758    HB3  GLU  90           HB1      GLU  90  -7.498 -13.119  -4.508
  759    HG2  GLU  90           HG2      GLU  90  -9.342 -11.988  -5.507
  760    HG3  GLU  90           HG1      GLU  90  -8.289 -10.745  -6.174
  Start of MODEL   11
    1    H1   MET   1           HT1      MET   1   2.530   1.407  11.824
    2    H2   MET   1           HT2      MET   1   2.356   1.908  13.431
    3    H3   MET   1           HT3      MET   1   2.153   0.276  13.027
    4    HA   MET   1           HA       MET   1   4.254   0.572  14.070
    5    HB2  MET   1           HB2      MET   1   4.632   0.200  11.088
    6    HB3  MET   1           HB1      MET   1   5.679  -0.408  12.363
    7    HG2  MET   1           HG2      MET   1   2.937  -1.325  11.593
    8    HG3  MET   1           HG1      MET   1   4.429  -2.257  11.702
    9    HE1  MET   1           HE1      MET   1   1.143  -2.217  13.221
   10    HE2  MET   1           HE2      MET   1   1.603  -3.320  14.519
   11    HE3  MET   1           HE3      MET   1   2.094  -3.657  12.859
   12    H    ALA   2           HN       ALA   2   6.215   1.398  11.608
   13    HA   ALA   2           HA       ALA   2   6.545   4.107  12.694
   14    HB1  ALA   2           HB1      ALA   2   8.817   3.984  11.787
   15    HB2  ALA   2           HB2      ALA   2   8.468   2.392  11.113
   16    HB3  ALA   2           HB3      ALA   2   8.490   2.624  12.861
   17    H    THR   3           HN       THR   3   4.587   3.204  10.695
   18    HA   THR   3           HA       THR   3   5.303   4.016   8.107
   19    HB   THR   3           HB       THR   3   2.879   4.036   7.668
   20    HG1  THR   3           HG1      THR   3   2.812   4.465  10.347
   21   HG21  THR   3          HG21      THR   3   2.443   1.740   8.073
   22   HG22  THR   3          HG22      THR   3   3.497   1.716   9.486
   23   HG23  THR   3          HG23      THR   3   4.190   1.873   7.872
   24    H    THR   4           HN       THR   4   5.445   5.953   7.212
   25    HA   THR   4           HA       THR   4   4.496   8.311   8.697
   26    HB   THR   4           HB       THR   4   6.664   8.196   6.586
   27    HG1  THR   4           HG1      THR   4   7.687   7.200   8.181
   28   HG21  THR   4          HG21      THR   4   5.918  10.314   8.615
   29   HG22  THR   4          HG22      THR   4   5.686  10.410   6.869
   30   HG23  THR   4          HG23      THR   4   7.316  10.382   7.541
   31    H    THR   5           HN       THR   5   3.256   9.849   7.580
   32    HA   THR   5           HA       THR   5   1.688   8.903   5.439
   33    HB   THR   5           HB       THR   5   2.006  11.803   6.204
   34    HG1  THR   5           HG1      THR   5   0.233  11.260   7.696
   35   HG21  THR   5          HG21      THR   5  -0.304  11.985   5.506
   36   HG22  THR   5          HG22      THR   5  -0.383  10.250   5.202
   37   HG23  THR   5          HG23      THR   5   0.649  11.275   4.204
   38    H    LEU   6           HN       LEU   6   2.537   8.494   3.513
   39    HA   LEU   6           HA       LEU   6   4.129  10.576   2.170
   40    HB2  LEU   6           HB2      LEU   6   4.449   7.592   1.799
   41    HB3  LEU   6           HB1      LEU   6   5.399   8.847   1.033
   42    HG   LEU   6           HG       LEU   6   5.421   8.135   3.968
   43   HD11  LEU   6          HD11      LEU   6   6.560   6.598   2.308
   44   HD12  LEU   6          HD12      LEU   6   7.564   7.242   3.606
   45   HD13  LEU   6          HD13      LEU   6   7.667   7.932   1.987
   46   HD21  LEU   6          HD21      LEU   6   6.905  10.275   2.452
   47   HD22  LEU   6          HD22      LEU   6   7.310   9.745   4.084
   48   HD23  LEU   6          HD23      LEU   6   5.749  10.501   3.765
   49    H    GLY   7           HN       GLY   7   3.941  10.450  -0.232
   50    HA2  GLY   7           HA2      GLY   7   1.187  10.159  -0.987
   51    HA3  GLY   7           HA1      GLY   7   2.509  10.649  -2.037
   52    H    VAL   8           HN       VAL   8   0.201   8.460  -1.848
   53    HA   VAL   8           HA       VAL   8   1.767   6.400  -3.244
   54    HB   VAL   8           HB       VAL   8  -0.154   5.974  -0.961
   55   HG11  VAL   8          HG11      VAL   8  -0.945   4.420  -2.569
   56   HG12  VAL   8          HG12      VAL   8   0.049   3.519  -1.424
   57   HG13  VAL   8          HG13      VAL   8   0.693   3.943  -3.010
   58   HG21  VAL   8          HG21      VAL   8   2.642   4.991  -1.494
   59   HG22  VAL   8          HG22      VAL   8   1.664   4.571  -0.088
   60   HG23  VAL   8          HG23      VAL   8   2.163   6.242  -0.347
   61    H    LYS   9           HN       LYS   9   0.386   5.059  -4.697
   62    HA   LYS   9           HA       LYS   9  -1.852   6.673  -5.687
   63    HB2  LYS   9           HB2      LYS   9  -0.380   4.424  -7.061
   64    HB3  LYS   9           HB1      LYS   9  -1.596   5.466  -7.784
   65    HG2  LYS   9           HG2      LYS   9  -0.073   7.404  -7.324
   66    HG3  LYS   9           HG1      LYS   9   1.161   6.227  -6.871
   67    HD2  LYS   9           HD2      LYS   9   1.729   6.229  -9.035
   68    HD3  LYS   9           HD1      LYS   9   0.267   5.276  -9.289
   69    HE2  LYS   9           HE2      LYS   9   0.440   8.285  -9.436
   70    HE3  LYS   9           HE1      LYS   9   0.415   7.198 -10.822
   71    HZ1  LYS   9           HZ1      LYS   9  -1.769   7.951 -10.570
   72    HZ2  LYS   9           HZ2      LYS   9  -1.757   7.745  -8.892
   73    HZ3  LYS   9           HZ3      LYS   9  -1.788   6.395  -9.907
   74    H    LEU  10           HN       LEU  10  -3.831   6.068  -5.231
   75    HA   LEU  10           HA       LEU  10  -4.484   3.211  -4.914
   76    HB2  LEU  10           HB2      LEU  10  -4.957   5.496  -3.090
   77    HB3  LEU  10           HB1      LEU  10  -6.307   4.404  -3.318
   78    HG   LEU  10           HG       LEU  10  -3.610   3.356  -2.534
   79   HD11  LEU  10          HD11      LEU  10  -4.136   5.058  -0.898
   80   HD12  LEU  10          HD12      LEU  10  -4.377   3.459  -0.196
   81   HD13  LEU  10          HD13      LEU  10  -5.767   4.415  -0.712
   82   HD21  LEU  10          HD21      LEU  10  -5.120   1.635  -1.477
   83   HD22  LEU  10          HD22      LEU  10  -5.122   1.681  -3.240
   84   HD23  LEU  10          HD23      LEU  10  -6.454   2.402  -2.338
   85    H    ASP  11           HN       ASP  11  -6.219   2.578  -6.129
   86    HA   ASP  11           HA       ASP  11  -7.502   4.491  -7.850
   87    HB2  ASP  11           HB2      ASP  11  -8.659   1.755  -7.438
   88    HB3  ASP  11           HB1      ASP  11  -8.535   2.697  -8.916
   89    H    ASP  12           HN       ASP  12  -9.796   5.023  -7.805
   90    HA   ASP  12           HA       ASP  12 -10.802   5.710  -5.313
   91    HB2  ASP  12           HB2      ASP  12 -11.961   5.547  -8.036
   92    HB3  ASP  12           HB1      ASP  12 -13.117   5.551  -6.710
   93    HA   PRO  13           HA       PRO  13 -13.628   1.790  -5.290
   94    HB2  PRO  13           HB2      PRO  13 -13.012  -0.223  -7.027
   95    HB3  PRO  13           HB1      PRO  13 -14.198   1.039  -7.379
   96    HG2  PRO  13           HG2      PRO  13 -11.345   0.822  -8.251
   97    HG3  PRO  13           HG1      PRO  13 -12.768   1.330  -9.182
   98    HD2  PRO  13           HD2      PRO  13 -11.010   3.099  -8.154
   99    HD3  PRO  13           HD1      PRO  13 -12.741   3.459  -8.301
  100    H    THR  14           HN       THR  14 -10.221   1.608  -5.965
  101    HA   THR  14           HA       THR  14  -9.693  -0.828  -4.597
  102    HB   THR  14           HB       THR  14  -7.901   1.481  -5.348
  103    HG1  THR  14           HG1      THR  14  -7.270   0.032  -6.983
  104   HG21  THR  14          HG21      THR  14  -7.013  -1.232  -4.385
  105   HG22  THR  14          HG22      THR  14  -6.991   0.223  -3.393
  106   HG23  THR  14          HG23      THR  14  -5.993   0.131  -4.843
  107    H    ARG  15           HN       ARG  15  -9.592   2.599  -3.658
  108    HA   ARG  15           HA       ARG  15  -8.681   2.153  -1.027
  109    HB2  ARG  15           HB2      ARG  15  -8.781   4.385  -2.180
  110    HB3  ARG  15           HB1      ARG  15 -10.522   4.378  -1.921
  111    HG2  ARG  15           HG2      ARG  15 -10.178   4.297   0.489
  112    HG3  ARG  15           HG1      ARG  15  -8.431   4.281   0.247
  113    HD2  ARG  15           HD2      ARG  15  -8.611   6.469  -0.888
  114    HD3  ARG  15           HD1      ARG  15 -10.336   6.485  -0.529
  115    HE   ARG  15           HE       ARG  15  -9.865   6.958   1.676
  116   HH11  ARG  15          HH21      ARG  15  -6.904   6.201  -0.034
  117   HH12  ARG  15          HH22      ARG  15  -5.868   6.830   1.205
  118   HH21  ARG  15          HH11      ARG  15  -8.509   7.799   3.317
  119   HH22  ARG  15          HH12      ARG  15  -6.789   7.750   3.115
  120    H    GLU  16           HN       GLU  16 -11.882   2.249  -2.483
  121    HA   GLU  16           HA       GLU  16 -13.408   1.848  -0.141
  122    HB2  GLU  16           HB2      GLU  16 -13.946   1.101  -3.019
  123    HB3  GLU  16           HB1      GLU  16 -15.143   0.999  -1.734
  124    HG2  GLU  16           HG2      GLU  16 -14.960   3.399  -1.364
  125    HG3  GLU  16           HG1      GLU  16 -13.753   3.507  -2.647
  126    H    ARG  17           HN       ARG  17 -11.919  -0.324  -2.466
  127    HA   ARG  17           HA       ARG  17 -12.846  -2.760  -1.449
  128    HB2  ARG  17           HB2      ARG  17 -11.480  -2.199  -3.620
  129    HB3  ARG  17           HB1      ARG  17 -10.081  -2.471  -2.593
  130    HG2  ARG  17           HG2      ARG  17 -12.280  -4.491  -2.919
  131    HG3  ARG  17           HG1      ARG  17 -10.873  -4.426  -3.980
  132    HD2  ARG  17           HD2      ARG  17  -9.478  -4.569  -1.849
  133    HD3  ARG  17           HD1      ARG  17 -10.976  -5.015  -1.035
  134    HE   ARG  17           HE       ARG  17 -10.333  -6.575  -3.380
  135   HH11  ARG  17          HH21      ARG  17 -10.107  -6.335   0.116
  136   HH12  ARG  17          HH22      ARG  17  -9.811  -8.029   0.335
  137   HH21  ARG  17          HH11      ARG  17  -9.929  -8.793  -3.089
  138   HH22  ARG  17          HH12      ARG  17  -9.714  -9.449  -1.493
  139    H    LEU  18           HN       LEU  18 -10.130  -0.691  -0.600
  140    HA   LEU  18           HA       LEU  18  -8.909  -2.369   1.276
  141    HB2  LEU  18           HB2      LEU  18  -8.823   0.496   0.637
  142    HB3  LEU  18           HB1      LEU  18  -8.474   0.125   2.315
  143    HG   LEU  18           HG       LEU  18  -6.735  -1.514   1.474
  144   HD11  LEU  18          HD11      LEU  18  -7.655  -1.649  -0.829
  145   HD12  LEU  18          HD12      LEU  18  -5.925  -1.314  -0.755
  146   HD13  LEU  18          HD13      LEU  18  -7.062  -0.012  -1.110
  147   HD21  LEU  18          HD21      LEU  18  -6.403   1.418   0.855
  148   HD22  LEU  18          HD22      LEU  18  -5.086   0.256   1.025
  149   HD23  LEU  18          HD23      LEU  18  -6.117   0.628   2.406
  150    H    LYS  19           HN       LYS  19 -11.677  -0.181   1.533
  151    HA   LYS  19           HA       LYS  19 -11.952  -0.288   4.318
  152    HB2  LYS  19           HB2      LYS  19 -13.247   1.311   3.065
  153    HB3  LYS  19           HB1      LYS  19 -14.047   0.030   2.168
  154    HG2  LYS  19           HG2      LYS  19 -15.595   0.848   3.761
  155    HG3  LYS  19           HG1      LYS  19 -15.057  -0.729   4.332
  156    HD2  LYS  19           HD2      LYS  19 -13.595   0.292   5.946
  157    HD3  LYS  19           HD1      LYS  19 -13.929   1.898   5.294
  158    HE2  LYS  19           HE2      LYS  19 -16.302   1.619   5.933
  159    HE3  LYS  19           HE1      LYS  19 -15.901   0.065   6.659
  160    HZ1  LYS  19           HZ1      LYS  19 -14.945   2.743   7.514
  161    HZ2  LYS  19           HZ2      LYS  19 -14.341   1.290   8.136
  162    HZ3  LYS  19           HZ3      LYS  19 -15.965   1.698   8.369
  163    H    ALA  20           HN       ALA  20 -13.170  -2.385   1.800
  164    HA   ALA  20           HA       ALA  20 -14.613  -4.168   3.414
  165    HB1  ALA  20           HB1      ALA  20 -14.498  -5.724   1.560
  166    HB2  ALA  20           HB2      ALA  20 -13.177  -4.809   0.834
  167    HB3  ALA  20           HB3      ALA  20 -14.786  -4.094   0.953
  168    H    ALA  21           HN       ALA  21 -11.237  -4.259   2.309
  169    HA   ALA  21           HA       ALA  21 -10.550  -6.650   3.666
  170    HB1  ALA  21           HB1      ALA  21  -8.876  -4.382   2.607
  171    HB2  ALA  21           HB2      ALA  21  -9.127  -5.977   1.897
  172    HB3  ALA  21           HB3      ALA  21  -8.180  -5.808   3.376
  173    H    ALA  22           HN       ALA  22 -10.537  -3.265   4.547
  174    HA   ALA  22           HA       ALA  22  -9.227  -3.445   7.034
  175    HB1  ALA  22           HB1      ALA  22  -9.769  -1.332   5.757
  176    HB2  ALA  22           HB2      ALA  22 -10.081  -1.283   7.492
  177    HB3  ALA  22           HB3      ALA  22 -11.418  -1.498   6.362
  178    H    GLN  23           HN       GLN  23 -12.497  -3.928   6.033
  179    HA   GLN  23           HA       GLN  23 -13.651  -4.211   8.590
  180    HB2  GLN  23           HB2      GLN  23 -14.457  -5.327   5.894
  181    HB3  GLN  23           HB1      GLN  23 -15.441  -5.486   7.347
  182    HG2  GLN  23           HG2      GLN  23 -14.545  -2.849   6.203
  183    HG3  GLN  23           HG1      GLN  23 -16.089  -3.609   5.822
  184   HE21  GLN  23          HE21      GLN  23 -14.197  -1.987   8.238
  185   HE22  GLN  23          HE22      GLN  23 -15.484  -1.705   9.357
  186    H    SER  24           HN       SER  24 -12.055  -6.428   6.373
  187    HA   SER  24           HA       SER  24 -12.451  -8.784   7.903
  188    HB2  SER  24           HB2      SER  24 -10.158  -8.266   6.001
  189    HB3  SER  24           HB1      SER  24 -10.901  -9.815   6.407
  190    HG   SER  24           HG       SER  24 -12.854  -8.939   5.419
  191    H    ILE  25           HN       ILE  25 -10.275  -6.117   8.120
  192    HA   ILE  25           HA       ILE  25  -8.521  -7.528   9.994
  193    HB   ILE  25           HB       ILE  25  -7.906  -5.788   7.968
  194   HG12  ILE  25          HG12      ILE  25  -6.368  -7.345   9.080
  195   HG13  ILE  25          HG11      ILE  25  -5.644  -5.757   8.870
  196   HG21  ILE  25          HG21      ILE  25  -8.839  -3.876   9.174
  197   HG22  ILE  25          HG22      ILE  25  -7.107  -3.707   8.889
  198   HG23  ILE  25          HG23      ILE  25  -7.698  -4.160  10.489
  199   HD11  ILE  25          HD11      ILE  25  -5.031  -6.528  11.013
  200   HD12  ILE  25          HD12      ILE  25  -6.688  -6.989  11.399
  201   HD13  ILE  25          HD13      ILE  25  -6.257  -5.284  11.259
  202    H    ASP  26           HN       ASP  26 -11.305  -5.989   9.999
  203    HA   ASP  26           HA       ASP  26 -12.672  -5.022  11.479
  204    HB2  ASP  26           HB2      ASP  26 -10.622  -6.064  13.430
  205    HB3  ASP  26           HB1      ASP  26 -12.151  -5.345  13.919
  206    H    ARG  27           HN       ARG  27 -10.803  -3.289  10.215
  207    HA   ARG  27           HA       ARG  27 -10.812  -1.163  12.250
  208    HB2  ARG  27           HB2      ARG  27  -8.370  -1.853  10.593
  209    HB3  ARG  27           HB1      ARG  27  -8.532  -0.446  11.640
  210    HG2  ARG  27           HG2      ARG  27  -8.778  -1.895  13.575
  211    HG3  ARG  27           HG1      ARG  27  -8.635  -3.314  12.543
  212    HD2  ARG  27           HD2      ARG  27  -6.370  -2.528  11.881
  213    HD3  ARG  27           HD1      ARG  27  -6.523  -1.227  13.060
  214    HE   ARG  27           HE       ARG  27  -5.997  -4.010  13.587
  215   HH11  ARG  27          HH21      ARG  27  -7.233  -1.024  14.941
  216   HH12  ARG  27          HH22      ARG  27  -6.911  -1.481  16.581
  217   HH21  ARG  27          HH11      ARG  27  -5.573  -4.619  15.764
  218   HH22  ARG  27          HH12      ARG  27  -5.970  -3.525  17.050
  219    H    THR  28           HN       THR  28 -10.228   1.007  11.183
  220    HA   THR  28           HA       THR  28 -11.892   1.329   8.862
  221    HB   THR  28           HB       THR  28 -11.377   2.947  10.977
  222    HG1  THR  28           HG1      THR  28 -12.499   4.515   9.791
  223   HG21  THR  28          HG21      THR  28 -10.056   4.825  10.379
  224   HG22  THR  28          HG22      THR  28  -9.834   4.227   8.736
  225   HG23  THR  28          HG23      THR  28  -9.071   3.391  10.089
  226    HA   PRO  29           HA       PRO  29  -9.079   1.193   5.459
  227    HB2  PRO  29           HB2      PRO  29  -9.621   4.089   4.979
  228    HB3  PRO  29           HB1      PRO  29  -9.655   2.731   3.847
  229    HG2  PRO  29           HG2      PRO  29 -11.917   3.747   4.789
  230    HG3  PRO  29           HG1      PRO  29 -11.724   1.996   4.584
  231    HD2  PRO  29           HD2      PRO  29 -11.684   3.629   7.079
  232    HD3  PRO  29           HD1      PRO  29 -12.286   1.980   6.816
  233    H    HIS  30           HN       HIS  30  -8.697   4.160   7.414
  234    HA   HIS  30           HA       HIS  30  -6.102   4.802   6.558
  235    HB2  HIS  30           HB2      HIS  30  -7.523   6.337   7.861
  236    HB3  HIS  30           HB1      HIS  30  -7.346   5.303   9.273
  237    HD1  HIS  30           HD1      HIS  30  -5.204   7.452   6.987
  238    HD2  HIS  30           HD2      HIS  30  -5.227   5.941  10.858
  239    HE1  HIS  30           HE1      HIS  30  -3.231   8.499   8.131
  240    HE2  HIS  30           HE2      HIS  30  -3.458   7.792  10.537
  241    H    TRP  31           HN       TRP  31  -7.225   2.654   9.118
  242    HA   TRP  31           HA       TRP  31  -4.650   2.118  10.177
  243    HB2  TRP  31           HB2      TRP  31  -7.255   0.611  10.384
  244    HB3  TRP  31           HB1      TRP  31  -5.789   0.131  11.232
  245    HD1  TRP  31           HD1      TRP  31  -8.834   2.066  11.745
  246    HE1  TRP  31           HE1      TRP  31  -8.619   3.626  13.782
  247    HE3  TRP  31           HE3      TRP  31  -3.771   1.832  12.419
  248    HZ2  TRP  31           HZ2      TRP  31  -6.575   4.624  15.447
  249    HZ3  TRP  31           HZ3      TRP  31  -2.767   3.121  14.256
  250    HH2  TRP  31           HH2      TRP  31  -4.140   4.488  15.737
  251    H    LEU  32           HN       LEU  32  -6.780   0.522   7.917
  252    HA   LEU  32           HA       LEU  32  -5.058  -1.648   7.429
  253    HB2  LEU  32           HB2      LEU  32  -7.409  -1.833   6.816
  254    HB3  LEU  32           HB1      LEU  32  -7.198  -0.568   5.611
  255    HG   LEU  32           HG       LEU  32  -5.456  -2.051   4.524
  256   HD11  LEU  32          HD11      LEU  32  -5.709  -4.488   5.021
  257   HD12  LEU  32          HD12      LEU  32  -6.605  -4.028   6.469
  258   HD13  LEU  32          HD13      LEU  32  -4.921  -3.540   6.282
  259   HD21  LEU  32          HD21      LEU  32  -7.753  -1.783   3.677
  260   HD22  LEU  32          HD22      LEU  32  -8.226  -3.201   4.614
  261   HD23  LEU  32          HD23      LEU  32  -7.041  -3.355   3.317
  262    H    ILE  33           HN       ILE  33  -5.434   1.474   5.906
  263    HA   ILE  33           HA       ILE  33  -3.874   1.127   3.663
  264    HB   ILE  33           HB       ILE  33  -4.304   3.520   5.429
  265   HG12  ILE  33          HG12      ILE  33  -5.005   3.125   2.523
  266   HG13  ILE  33          HG11      ILE  33  -6.057   2.582   3.826
  267   HG21  ILE  33          HG21      ILE  33  -2.056   3.792   4.567
  268   HG22  ILE  33          HG22      ILE  33  -3.160   4.919   3.778
  269   HG23  ILE  33          HG23      ILE  33  -2.627   3.467   2.930
  270   HD11  ILE  33          HD11      ILE  33  -6.550   4.834   2.766
  271   HD12  ILE  33          HD12      ILE  33  -5.127   5.422   3.628
  272   HD13  ILE  33          HD13      ILE  33  -6.496   4.764   4.526
  273    H    LYS  34           HN       LYS  34  -2.711   2.204   6.890
  274    HA   LYS  34           HA       LYS  34   0.024   2.122   6.103
  275    HB2  LYS  34           HB2      LYS  34   0.569   2.606   8.336
  276    HB3  LYS  34           HB1      LYS  34  -0.999   3.362   8.104
  277    HG2  LYS  34           HG2      LYS  34  -2.057   1.422   9.206
  278    HG3  LYS  34           HG1      LYS  34  -0.454   0.753   9.508
  279    HD2  LYS  34           HD2      LYS  34   0.051   2.963  10.690
  280    HD3  LYS  34           HD1      LYS  34  -1.690   3.246  10.644
  281    HE2  LYS  34           HE2      LYS  34  -0.161   1.114  12.094
  282    HE3  LYS  34           HE1      LYS  34  -1.332   2.266  12.731
  283    HZ1  LYS  34           HZ1      LYS  34  -2.905   0.975  11.088
  284    HZ2  LYS  34           HZ2      LYS  34  -2.610   0.408  12.654
  285    HZ3  LYS  34           HZ3      LYS  34  -1.785  -0.266  11.344
  286    H    GLN  35           HN       GLN  35  -2.107  -0.211   7.648
  287    HA   GLN  35           HA       GLN  35  -0.072  -2.103   8.234
  288    HB2  GLN  35           HB2      GLN  35  -3.070  -2.353   8.066
  289    HB3  GLN  35           HB1      GLN  35  -2.013  -3.671   8.558
  290    HG2  GLN  35           HG2      GLN  35  -1.188  -2.319  10.410
  291    HG3  GLN  35           HG1      GLN  35  -2.248  -1.003   9.918
  292   HE21  GLN  35          HE21      GLN  35  -4.086  -3.483   9.214
  293   HE22  GLN  35          HE22      GLN  35  -4.890  -3.754  10.717
  294    H    ALA  36           HN       ALA  36  -2.363  -1.741   5.592
  295    HA   ALA  36           HA       ALA  36  -1.950  -4.201   4.344
  296    HB1  ALA  36           HB1      ALA  36  -2.799  -3.022   2.294
  297    HB2  ALA  36           HB2      ALA  36  -2.845  -1.546   3.259
  298    HB3  ALA  36           HB3      ALA  36  -3.839  -2.929   3.714
  299    H    ILE  37           HN       ILE  37  -0.268  -1.093   3.930
  300    HA   ILE  37           HA       ILE  37   1.254  -2.118   1.762
  301    HB   ILE  37           HB       ILE  37   0.887   0.301   2.104
  302   HG12  ILE  37          HG12      ILE  37   3.277   0.974   1.606
  303   HG13  ILE  37          HG11      ILE  37   3.723  -0.700   1.913
  304   HG21  ILE  37          HG21      ILE  37   1.182   0.410   4.520
  305   HG22  ILE  37          HG22      ILE  37   2.240   1.551   3.692
  306   HG23  ILE  37          HG23      ILE  37   2.897   0.044   4.331
  307   HD11  ILE  37          HD11      ILE  37   1.542  -0.632   0.078
  308   HD12  ILE  37          HD12      ILE  37   3.177  -1.251  -0.151
  309   HD13  ILE  37          HD13      ILE  37   2.822   0.444  -0.483
  310    H    PHE  38           HN       PHE  38   2.047  -1.739   5.267
  311    HA   PHE  38           HA       PHE  38   4.596  -2.998   4.806
  312    HB2  PHE  38           HB2      PHE  38   5.126  -2.427   6.933
  313    HB3  PHE  38           HB1      PHE  38   3.696  -1.415   6.826
  314    HD1  PHE  38           HD1      PHE  38   4.960  -4.674   8.038
  315    HD2  PHE  38           HD2      PHE  38   1.869  -1.760   8.250
  316    HE1  PHE  38           HE1      PHE  38   4.027  -5.816  10.004
  317    HE2  PHE  38           HE2      PHE  38   0.925  -2.902  10.214
  318    HZ   PHE  38           HZ       PHE  38   2.005  -4.932  11.092
  319    H    ASN  39           HN       ASN  39   1.387  -4.055   5.699
  320    HA   ASN  39           HA       ASN  39   2.125  -6.696   6.429
  321    HB2  ASN  39           HB2      ASN  39  -0.492  -5.505   5.565
  322    HB3  ASN  39           HB1      ASN  39  -0.296  -7.241   5.716
  323   HD21  ASN  39          HD21      ASN  39  -2.129  -5.766   7.180
  324   HD22  ASN  39          HD22      ASN  39  -1.685  -5.819   8.850
  325    H    TYR  40           HN       TYR  40   1.440  -5.037   3.445
  326    HA   TYR  40           HA       TYR  40   1.186  -7.256   1.767
  327    HB2  TYR  40           HB2      TYR  40   0.724  -5.099   0.832
  328    HB3  TYR  40           HB1      TYR  40   2.301  -4.481   1.300
  329    HD1  TYR  40           HD1      TYR  40   0.730  -7.045  -0.901
  330    HD2  TYR  40           HD2      TYR  40   4.003  -4.398  -0.282
  331    HE1  TYR  40           HE1      TYR  40   1.586  -7.578  -3.148
  332    HE2  TYR  40           HE2      TYR  40   4.868  -4.925  -2.516
  333    HH   TYR  40           HH       TYR  40   4.708  -6.504  -4.233
  334    H    LEU  41           HN       LEU  41   3.882  -5.507   3.086
  335    HA   LEU  41           HA       LEU  41   5.910  -6.955   1.748
  336    HB2  LEU  41           HB2      LEU  41   6.045  -5.512   4.385
  337    HB3  LEU  41           HB1      LEU  41   7.427  -6.105   3.484
  338    HG   LEU  41           HG       LEU  41   5.531  -3.923   2.633
  339   HD11  LEU  41          HD11      LEU  41   8.437  -3.929   3.410
  340   HD12  LEU  41          HD12      LEU  41   7.101  -3.204   4.300
  341   HD13  LEU  41          HD13      LEU  41   7.574  -2.548   2.732
  342   HD21  LEU  41          HD21      LEU  41   7.702  -5.369   1.155
  343   HD22  LEU  41          HD22      LEU  41   7.248  -3.716   0.743
  344   HD23  LEU  41          HD23      LEU  41   6.057  -5.013   0.637
  345    H    GLU  42           HN       GLU  42   4.249  -7.351   4.798
  346    HA   GLU  42           HA       GLU  42   5.714  -9.555   5.767
  347    HB2  GLU  42           HB2      GLU  42   4.176  -8.050   7.088
  348    HB3  GLU  42           HB1      GLU  42   2.824  -8.894   6.351
  349    HG2  GLU  42           HG2      GLU  42   3.095  -9.893   8.444
  350    HG3  GLU  42           HG1      GLU  42   3.830 -11.017   7.302
  351    H    LYS  43           HN       LYS  43   2.832  -9.299   3.743
  352    HA   LYS  43           HA       LYS  43   2.109 -12.022   3.753
  353    HB2  LYS  43           HB2      LYS  43   1.378  -9.626   2.200
  354    HB3  LYS  43           HB1      LYS  43   1.164 -11.150   1.352
  355    HG2  LYS  43           HG2      LYS  43  -0.892 -10.597   2.410
  356    HG3  LYS  43           HG1      LYS  43  -0.187 -11.964   3.271
  357    HD2  LYS  43           HD2      LYS  43   0.656 -10.423   4.994
  358    HD3  LYS  43           HD1      LYS  43  -0.088  -9.073   4.135
  359    HE2  LYS  43           HE2      LYS  43  -2.275  -9.927   4.524
  360    HE3  LYS  43           HE1      LYS  43  -1.639 -11.455   5.130
  361    HZ1  LYS  43           HZ1      LYS  43  -1.550  -8.801   6.436
  362    HZ2  LYS  43           HZ2      LYS  43  -0.584 -10.090   6.950
  363    HZ3  LYS  43           HZ3      LYS  43  -2.271 -10.221   7.006
  364    H    LEU  44           HN       LEU  44   4.115 -10.172   1.470
  365    HA   LEU  44           HA       LEU  44   4.643 -12.572  -0.064
  366    HB2  LEU  44           HB2      LEU  44   6.042 -11.157  -1.479
  367    HB3  LEU  44           HB1      LEU  44   4.450 -10.463  -1.256
  368    HG   LEU  44           HG       LEU  44   5.834  -9.204   0.721
  369   HD11  LEU  44          HD11      LEU  44   7.952  -8.472  -0.189
  370   HD12  LEU  44          HD12      LEU  44   7.735  -9.517  -1.595
  371   HD13  LEU  44          HD13      LEU  44   7.938 -10.223   0.009
  372   HD21  LEU  44          HD21      LEU  44   5.855  -7.284  -0.772
  373   HD22  LEU  44          HD22      LEU  44   4.343  -8.181  -0.904
  374   HD23  LEU  44          HD23      LEU  44   5.576  -8.345  -2.155
  375    H    GLU  45           HN       GLU  45   6.100 -10.658   2.362
  376    HA   GLU  45           HA       GLU  45   8.099 -10.550   3.387
  377    HB2  GLU  45           HB2      GLU  45   8.548 -12.698   4.661
  378    HB3  GLU  45           HB1      GLU  45   6.970 -11.966   4.855
  379    HG2  GLU  45           HG2      GLU  45   6.026 -13.600   3.321
  380    HG3  GLU  45           HG1      GLU  45   7.612 -14.337   3.123
  381    H1   MET  46           HT1      MET  46  -2.531   1.384 -12.047
  382    H2   MET  46           HT2      MET  46  -2.427   1.915 -13.650
  383    H3   MET  46           HT3      MET  46  -2.218   0.273 -13.288
  384    HA   MET  46           HA       MET  46  -4.356   0.574 -14.218
  385    HB2  MET  46           HB2      MET  46  -4.626   0.244 -11.218
  386    HB3  MET  46           HB1      MET  46  -5.715  -0.379 -12.451
  387    HG2  MET  46           HG2      MET  46  -2.980  -1.312 -11.705
  388    HG3  MET  46           HG1      MET  46  -4.473  -2.238 -11.862
  389    HE1  MET  46           HE1      MET  46  -1.159  -2.214 -13.324
  390    HE2  MET  46           HE2      MET  46  -1.621  -3.285 -14.646
  391    HE3  MET  46           HE3      MET  46  -2.146  -3.639 -13.000
  392    H    ALA  47           HN       ALA  47  -6.246   1.438 -11.742
  393    HA   ALA  47           HA       ALA  47  -6.548   4.157 -12.816
  394    HB1  ALA  47           HB1      ALA  47  -8.813   4.060 -11.885
  395    HB2  ALA  47           HB2      ALA  47  -8.476   2.459 -11.226
  396    HB3  ALA  47           HB3      ALA  47  -8.513   2.703 -12.972
  397    H    THR  48           HN       THR  48  -4.572   3.255 -10.839
  398    HA   THR  48           HA       THR  48  -5.273   4.049  -8.239
  399    HB   THR  48           HB       THR  48  -2.842   4.065  -7.820
  400    HG1  THR  48           HG1      THR  48  -2.792   4.528 -10.483
  401   HG21  THR  48          HG21      THR  48  -2.424   1.766  -8.225
  402   HG22  THR  48          HG22      THR  48  -3.480   1.749  -9.636
  403   HG23  THR  48          HG23      THR  48  -4.171   1.906  -8.021
  404    H    THR  49           HN       THR  49  -5.426   5.986  -7.342
  405    HA   THR  49           HA       THR  49  -4.458   8.347  -8.807
  406    HB   THR  49           HB       THR  49  -6.641   8.224  -6.714
  407    HG1  THR  49           HG1      THR  49  -7.835   7.443  -8.271
  408   HG21  THR  49          HG21      THR  49  -5.865  10.368  -8.704
  409   HG22  THR  49          HG22      THR  49  -5.651  10.435  -6.954
  410   HG23  THR  49          HG23      THR  49  -7.274  10.426  -7.643
  411    H    THR  50           HN       THR  50  -3.217   9.877  -7.683
  412    HA   THR  50           HA       THR  50  -1.659   8.911  -5.543
  413    HB   THR  50           HB       THR  50  -1.944  11.814  -6.322
  414    HG1  THR  50           HG1      THR  50  -0.221  11.301  -7.822
  415   HG21  THR  50          HG21      THR  50   0.344  11.998  -5.579
  416   HG22  THR  50          HG22      THR  50   0.425  10.262  -5.277
  417   HG23  THR  50          HG23      THR  50  -0.626  11.281  -4.293
  418    H    LEU  51           HN       LEU  51  -2.497   8.508  -3.619
  419    HA   LEU  51           HA       LEU  51  -4.082  10.587  -2.260
  420    HB2  LEU  51           HB2      LEU  51  -4.421   7.601  -1.906
  421    HB3  LEU  51           HB1      LEU  51  -5.368   8.859  -1.140
  422    HG   LEU  51           HG       LEU  51  -5.385   8.157  -4.078
  423   HD11  LEU  51          HD11      LEU  51  -6.525   6.612  -2.425
  424   HD12  LEU  51          HD12      LEU  51  -7.526   7.258  -3.724
  425   HD13  LEU  51          HD13      LEU  51  -7.634   7.944  -2.102
  426   HD21  LEU  51          HD21      LEU  51  -6.873  10.287  -2.553
  427   HD22  LEU  51          HD22      LEU  51  -7.276   9.766  -4.189
  428   HD23  LEU  51          HD23      LEU  51  -5.716  10.522  -3.864
  429    H    GLY  52           HN       GLY  52  -3.869  10.494   0.120
  430    HA2  GLY  52           HA2      GLY  52  -1.137  10.156   0.894
  431    HA3  GLY  52           HA1      GLY  52  -2.463  10.637   1.943
  432    H    VAL  53           HN       VAL  53  -0.158   8.456   1.763
  433    HA   VAL  53           HA       VAL  53  -1.730   6.383   3.128
  434    HB   VAL  53           HB       VAL  53   0.193   5.966   0.843
  435   HG11  VAL  53          HG11      VAL  53   0.979   4.403   2.443
  436   HG12  VAL  53          HG12      VAL  53  -0.016   3.508   1.294
  437   HG13  VAL  53          HG13      VAL  53  -0.660   3.927   2.881
  438   HG21  VAL  53          HG21      VAL  53  -2.606   4.985   1.365
  439   HG22  VAL  53          HG22      VAL  53  -1.626   4.568  -0.040
  440   HG23  VAL  53          HG23      VAL  53  -2.123   6.239   0.224
  441    H    LYS  54           HN       LYS  54  -0.350   5.038   4.578
  442    HA   LYS  54           HA       LYS  54   1.893   6.646   5.561
  443    HB2  LYS  54           HB2      LYS  54   0.420   4.399   6.939
  444    HB3  LYS  54           HB1      LYS  54   1.636   5.444   7.660
  445    HG2  LYS  54           HG2      LYS  54   0.126   7.378   7.216
  446    HG3  LYS  54           HG1      LYS  54  -1.111   6.219   6.725
  447    HD2  LYS  54           HD2      LYS  54  -1.714   6.199   8.877
  448    HD3  LYS  54           HD1      LYS  54  -0.269   5.222   9.142
  449    HE2  LYS  54           HE2      LYS  54  -0.395   8.231   9.321
  450    HE3  LYS  54           HE1      LYS  54  -0.433   7.132  10.697
  451    HZ1  LYS  54           HZ1      LYS  54   1.772   7.797  10.543
  452    HZ2  LYS  54           HZ2      LYS  54   1.803   7.693   8.856
  453    HZ3  LYS  54           HZ3      LYS  54   1.775   6.283   9.785
  454    H    LEU  55           HN       LEU  55   3.869   6.041   5.116
  455    HA   LEU  55           HA       LEU  55   4.518   3.186   4.780
  456    HB2  LEU  55           HB2      LEU  55   4.997   5.480   2.971
  457    HB3  LEU  55           HB1      LEU  55   6.343   4.381   3.192
  458    HG   LEU  55           HG       LEU  55   3.641   3.351   2.401
  459   HD11  LEU  55          HD11      LEU  55   4.171   5.064   0.779
  460   HD12  LEU  55          HD12      LEU  55   4.408   3.470   0.063
  461   HD13  LEU  55          HD13      LEU  55   5.800   4.418   0.587
  462   HD21  LEU  55          HD21      LEU  55   5.140   1.633   1.328
  463   HD22  LEU  55          HD22      LEU  55   5.148   1.664   3.091
  464   HD23  LEU  55          HD23      LEU  55   6.481   2.387   2.190
  465    H    ASP  56           HN       ASP  56   6.253   2.543   5.994
  466    HA   ASP  56           HA       ASP  56   7.547   4.451   7.716
  467    HB2  ASP  56           HB2      ASP  56   8.700   1.713   7.297
  468    HB3  ASP  56           HB1      ASP  56   8.590   2.649   8.771
  469    H    ASP  57           HN       ASP  57   9.846   4.965   7.648
  470    HA   ASP  57           HA       ASP  57  10.818   5.632   5.135
  471    HB2  ASP  57           HB2      ASP  57  12.032   5.494   7.844
  472    HB3  ASP  57           HB1      ASP  57  13.137   5.586   6.476
  473    HA   PRO  58           HA       PRO  58  13.685   1.737   5.137
  474    HB2  PRO  58           HB2      PRO  58  13.038  -0.277   6.872
  475    HB3  PRO  58           HB1      PRO  58  14.242   0.968   7.225
  476    HG2  PRO  58           HG2      PRO  58  11.387   0.788   8.098
  477    HG3  PRO  58           HG1      PRO  58  12.816   1.286   9.025
  478    HD2  PRO  58           HD2      PRO  58  11.074   3.068   7.997
  479    HD3  PRO  58           HD1      PRO  58  12.810   3.410   8.133
  480    H    THR  59           HN       THR  59  10.274   1.579   5.801
  481    HA   THR  59           HA       THR  59   9.739  -0.860   4.437
  482    HB   THR  59           HB       THR  59   7.942   1.440   5.215
  483    HG1  THR  59           HG1      THR  59   7.276  -0.113   6.779
  484   HG21  THR  59          HG21      THR  59   7.044  -1.252   4.221
  485   HG22  THR  59          HG22      THR  59   7.037   0.210   3.237
  486   HG23  THR  59          HG23      THR  59   6.036   0.118   4.687
  487    H    ARG  60           HN       ARG  60   9.646   2.567   3.498
  488    HA   ARG  60           HA       ARG  60   8.719   2.116   0.866
  489    HB2  ARG  60           HB2      ARG  60   8.801   4.353   2.025
  490    HB3  ARG  60           HB1      ARG  60  10.543   4.351   1.768
  491    HG2  ARG  60           HG2      ARG  60  10.211   4.276  -0.640
  492    HG3  ARG  60           HG1      ARG  60   8.461   4.268  -0.415
  493    HD2  ARG  60           HD2      ARG  60   8.647   6.449   0.734
  494    HD3  ARG  60           HD1      ARG  60  10.375   6.462   0.384
  495    HE   ARG  60           HE       ARG  60   9.907   6.913  -1.844
  496   HH11  ARG  60          HH21      ARG  60   6.945   6.276  -0.080
  497   HH12  ARG  60          HH22      ARG  60   5.916   6.953  -1.298
  498   HH21  ARG  60          HH11      ARG  60   8.559   7.796  -3.459
  499   HH22  ARG  60          HH12      ARG  60   6.844   7.835  -3.224
  500    H    GLU  61           HN       GLU  61  11.918   2.226   2.316
  501    HA   GLU  61           HA       GLU  61  13.420   1.837  -0.043
  502    HB2  GLU  61           HB2      GLU  61  14.011   1.098   2.830
  503    HB3  GLU  61           HB1      GLU  61  15.194   1.011   1.529
  504    HG2  GLU  61           HG2      GLU  61  14.965   3.418   1.170
  505    HG3  GLU  61           HG1      GLU  61  13.777   3.488   2.470
  506    H    ARG  62           HN       ARG  62  11.962  -0.329   2.299
  507    HA   ARG  62           HA       ARG  62  12.891  -2.763   1.279
  508    HB2  ARG  62           HB2      ARG  62  11.572  -2.228   3.467
  509    HB3  ARG  62           HB1      ARG  62  10.142  -2.444   2.471
  510    HG2  ARG  62           HG2      ARG  62  12.289  -4.525   2.714
  511    HG3  ARG  62           HG1      ARG  62  10.896  -4.446   3.794
  512    HD2  ARG  62           HD2      ARG  62   9.445  -4.537   1.751
  513    HD3  ARG  62           HD1      ARG  62  10.900  -4.868   0.817
  514    HE   ARG  62           HE       ARG  62  10.452  -6.634   3.050
  515   HH11  ARG  62          HH21      ARG  62   9.994  -6.073  -0.379
  516   HH12  ARG  62          HH22      ARG  62   9.704  -7.744  -0.738
  517   HH21  ARG  62          HH11      ARG  62  10.052  -8.824   2.582
  518   HH22  ARG  62          HH12      ARG  62   9.751  -9.317   0.952
  519    H    LEU  63           HN       LEU  63  10.167  -0.698   0.434
  520    HA   LEU  63           HA       LEU  63   8.936  -2.391  -1.427
  521    HB2  LEU  63           HB2      LEU  63   8.849   0.475  -0.796
  522    HB3  LEU  63           HB1      LEU  63   8.495   0.103  -2.472
  523    HG   LEU  63           HG       LEU  63   6.755  -1.533  -1.620
  524   HD11  LEU  63          HD11      LEU  63   7.678  -1.667   0.679
  525   HD12  LEU  63          HD12      LEU  63   5.950  -1.324   0.607
  526   HD13  LEU  63          HD13      LEU  63   7.093  -0.027   0.958
  527   HD21  LEU  63          HD21      LEU  63   6.429   1.399  -1.005
  528   HD22  LEU  63          HD22      LEU  63   5.111   0.239  -1.175
  529   HD23  LEU  63          HD23      LEU  63   6.143   0.609  -2.556
  530    H    LYS  64           HN       LYS  64  11.699  -0.199  -1.704
  531    HA   LYS  64           HA       LYS  64  11.960  -0.308  -4.492
  532    HB2  LYS  64           HB2      LYS  64  13.267   1.295  -3.260
  533    HB3  LYS  64           HB1      LYS  64  14.058   0.021  -2.346
  534    HG2  LYS  64           HG2      LYS  64  15.619   0.810  -3.937
  535    HG3  LYS  64           HG1      LYS  64  15.070  -0.765  -4.502
  536    HD2  LYS  64           HD2      LYS  64  13.624   0.261  -6.129
  537    HD3  LYS  64           HD1      LYS  64  13.972   1.867  -5.485
  538    HE2  LYS  64           HE2      LYS  64  16.332   1.588  -6.123
  539    HE3  LYS  64           HE1      LYS  64  15.952   0.008  -6.802
  540    HZ1  LYS  64           HZ1      LYS  64  14.885   2.618  -7.743
  541    HZ2  LYS  64           HZ2      LYS  64  14.458   1.111  -8.379
  542    HZ3  LYS  64           HZ3      LYS  64  16.047   1.672  -8.530
  543    H    ALA  65           HN       ALA  65  13.197  -2.406  -1.980
  544    HA   ALA  65           HA       ALA  65  14.627  -4.191  -3.606
  545    HB1  ALA  65           HB1      ALA  65  14.524  -5.748  -1.752
  546    HB2  ALA  65           HB2      ALA  65  13.207  -4.833  -1.019
  547    HB3  ALA  65           HB3      ALA  65  14.815  -4.117  -1.147
  548    H    ALA  66           HN       ALA  66  11.251  -4.255  -2.502
  549    HA   ALA  66           HA       ALA  66  10.553  -6.655  -3.843
  550    HB1  ALA  66           HB1      ALA  66   8.894  -4.374  -2.788
  551    HB2  ALA  66           HB2      ALA  66   9.127  -5.973  -2.081
  552    HB3  ALA  66           HB3      ALA  66   8.185  -5.791  -3.562
  553    H    ALA  67           HN       ALA  67  10.542  -3.269  -4.725
  554    HA   ALA  67           HA       ALA  67   9.239  -3.444  -7.213
  555    HB1  ALA  67           HB1      ALA  67   9.786  -1.336  -5.933
  556    HB2  ALA  67           HB2      ALA  67  10.095  -1.285  -7.668
  557    HB3  ALA  67           HB3      ALA  67  11.434  -1.503  -6.541
  558    H    GLN  68           HN       GLN  68  12.519  -3.917  -6.227
  559    HA   GLN  68           HA       GLN  68  13.667  -4.199  -8.781
  560    HB2  GLN  68           HB2      GLN  68  14.460  -5.341  -6.090
  561    HB3  GLN  68           HB1      GLN  68  15.441  -5.511  -7.541
  562    HG2  GLN  68           HG2      GLN  68  14.585  -2.858  -6.421
  563    HG3  GLN  68           HG1      GLN  68  16.106  -3.643  -6.002
  564   HE21  GLN  68          HE21      GLN  68  14.295  -2.006  -8.473
  565   HE22  GLN  68          HE22      GLN  68  15.611  -1.759  -9.567
  566    H    SER  69           HN       SER  69  12.091  -6.431  -6.571
  567    HA   SER  69           HA       SER  69  12.466  -8.780  -8.113
  568    HB2  SER  69           HB2      SER  69  10.238  -8.221  -6.141
  569    HB3  SER  69           HB1      SER  69  10.876  -9.796  -6.613
  570    HG   SER  69           HG       SER  69  12.947  -8.507  -5.769
  571    H    ILE  70           HN       ILE  70  10.288  -6.115  -8.305
  572    HA   ILE  70           HA       ILE  70   8.520  -7.522 -10.171
  573    HB   ILE  70           HB       ILE  70   7.915  -5.785  -8.141
  574   HG12  ILE  70          HG12      ILE  70   6.369  -7.334  -9.251
  575   HG13  ILE  70          HG11      ILE  70   5.651  -5.744  -9.036
  576   HG21  ILE  70          HG21      ILE  70   8.849  -3.871  -9.345
  577   HG22  ILE  70          HG22      ILE  70   7.118  -3.699  -9.054
  578   HG23  ILE  70          HG23      ILE  70   7.703  -4.149 -10.656
  579   HD11  ILE  70          HD11      ILE  70   5.028  -6.511 -11.178
  580   HD12  ILE  70          HD12      ILE  70   6.683  -6.974 -11.572
  581   HD13  ILE  70          HD13      ILE  70   6.256  -5.269 -11.427
  582    H    ASP  71           HN       ASP  71  11.309  -5.997 -10.190
  583    HA   ASP  71           HA       ASP  71  12.680  -5.047 -11.683
  584    HB2  ASP  71           HB2      ASP  71  10.589  -6.092 -13.592
  585    HB3  ASP  71           HB1      ASP  71  12.064  -5.306 -14.138
  586    H    ARG  72           HN       ARG  72  10.791  -3.307 -10.405
  587    HA   ARG  72           HA       ARG  72  10.821  -1.161 -12.423
  588    HB2  ARG  72           HB2      ARG  72   8.392  -1.855 -10.759
  589    HB3  ARG  72           HB1      ARG  72   8.546  -0.443 -11.795
  590    HG2  ARG  72           HG2      ARG  72   8.767  -1.883 -13.746
  591    HG3  ARG  72           HG1      ARG  72   8.623  -3.308 -12.718
  592    HD2  ARG  72           HD2      ARG  72   6.378  -2.493 -12.017
  593    HD3  ARG  72           HD1      ARG  72   6.532  -1.190 -13.196
  594    HE   ARG  72           HE       ARG  72   5.934  -3.956 -13.720
  595   HH11  ARG  72          HH21      ARG  72   7.282  -1.031 -15.093
  596   HH12  ARG  72          HH22      ARG  72   6.878  -1.453 -16.722
  597   HH21  ARG  72          HH11      ARG  72   5.392  -4.518 -15.879
  598   HH22  ARG  72          HH12      ARG  72   5.794  -3.436 -17.168
  599    H    THR  73           HN       THR  73  10.222   1.009 -11.341
  600    HA   THR  73           HA       THR  73  11.901   1.309  -9.019
  601    HB   THR  73           HB       THR  73  11.424   2.965 -11.115
  602    HG1  THR  73           HG1      THR  73  12.390   4.599  -9.762
  603   HG21  THR  73          HG21      THR  73  10.072   4.821 -10.534
  604   HG22  THR  73          HG22      THR  73   9.843   4.230  -8.889
  605   HG23  THR  73          HG23      THR  73   9.089   3.386 -10.241
  606    HA   PRO  74           HA       PRO  74   9.085   1.188  -5.624
  607    HB2  PRO  74           HB2      PRO  74   9.644   4.080  -5.138
  608    HB3  PRO  74           HB1      PRO  74   9.674   2.719  -4.010
  609    HG2  PRO  74           HG2      PRO  74  11.938   3.723  -4.955
  610    HG3  PRO  74           HG1      PRO  74  11.736   1.971  -4.758
  611    HD2  PRO  74           HD2      PRO  74  11.690   3.618  -7.243
  612    HD3  PRO  74           HD1      PRO  74  12.291   1.968  -6.991
  613    H    HIS  75           HN       HIS  75   8.707   4.159  -7.578
  614    HA   HIS  75           HA       HIS  75   6.114   4.808  -6.711
  615    HB2  HIS  75           HB2      HIS  75   7.550   6.332  -8.020
  616    HB3  HIS  75           HB1      HIS  75   7.339   5.309  -9.434
  617    HD1  HIS  75           HD1      HIS  75   5.228   7.424  -7.085
  618    HD2  HIS  75           HD2      HIS  75   5.232   6.033 -10.996
  619    HE1  HIS  75           HE1      HIS  75   3.295   8.564  -8.204
  620    HE2  HIS  75           HE2      HIS  75   3.548   7.963 -10.631
  621    H    TRP  76           HN       TRP  76   7.235   2.668  -9.278
  622    HA   TRP  76           HA       TRP  76   4.663   2.130 -10.335
  623    HB2  TRP  76           HB2      TRP  76   7.265   0.625 -10.541
  624    HB3  TRP  76           HB1      TRP  76   5.801   0.149 -11.395
  625    HD1  TRP  76           HD1      TRP  76   8.849   2.080 -11.903
  626    HE1  TRP  76           HE1      TRP  76   8.635   3.652 -13.932
  627    HE3  TRP  76           HE3      TRP  76   3.784   1.861 -12.568
  628    HZ2  TRP  76           HZ2      TRP  76   6.589   4.662 -15.587
  629    HZ3  TRP  76           HZ3      TRP  76   2.779   3.162 -14.395
  630    HH2  TRP  76           HH2      TRP  76   4.153   4.533 -15.872
  631    H    LEU  77           HN       LEU  77   6.791   0.527  -8.079
  632    HA   LEU  77           HA       LEU  77   5.064  -1.640  -7.590
  633    HB2  LEU  77           HB2      LEU  77   7.417  -1.826  -6.977
  634    HB3  LEU  77           HB1      LEU  77   7.206  -0.563  -5.770
  635    HG   LEU  77           HG       LEU  77   5.463  -2.049  -4.689
  636   HD11  LEU  77          HD11      LEU  77   5.718  -4.484  -5.192
  637   HD12  LEU  77          HD12      LEU  77   6.614  -4.020  -6.638
  638   HD13  LEU  77          HD13      LEU  77   4.929  -3.533  -6.451
  639   HD21  LEU  77          HD21      LEU  77   7.763  -1.784  -3.841
  640   HD22  LEU  77          HD22      LEU  77   8.233  -3.199  -4.783
  641   HD23  LEU  77          HD23      LEU  77   7.050  -3.355  -3.483
  642    H    ILE  78           HN       ILE  78   5.447   1.481  -6.059
  643    HA   ILE  78           HA       ILE  78   3.887   1.130  -3.815
  644    HB   ILE  78           HB       ILE  78   4.321   3.531  -5.571
  645   HG12  ILE  78          HG12      ILE  78   5.029   3.115  -2.669
  646   HG13  ILE  78          HG11      ILE  78   6.077   2.582  -3.979
  647   HG21  ILE  78          HG21      ILE  78   2.075   3.798  -4.702
  648   HG22  ILE  78          HG22      ILE  78   3.182   4.923  -3.915
  649   HG23  ILE  78          HG23      ILE  78   2.652   3.470  -3.068
  650   HD11  ILE  78          HD11      ILE  78   6.575   4.825  -2.901
  651   HD12  ILE  78          HD12      ILE  78   5.151   5.421  -3.755
  652   HD13  ILE  78          HD13      ILE  78   6.515   4.769  -4.662
  653    H    LYS  79           HN       LYS  79   2.728   2.227  -7.036
  654    HA   LYS  79           HA       LYS  79  -0.007   2.146  -6.255
  655    HB2  LYS  79           HB2      LYS  79  -0.547   2.625  -8.491
  656    HB3  LYS  79           HB1      LYS  79   1.024   3.374  -8.263
  657    HG2  LYS  79           HG2      LYS  79   2.072   1.420  -9.355
  658    HG3  LYS  79           HG1      LYS  79   0.464   0.762  -9.655
  659    HD2  LYS  79           HD2      LYS  79  -0.018   2.977 -10.847
  660    HD3  LYS  79           HD1      LYS  79   1.727   3.232 -10.809
  661    HE2  LYS  79           HE2      LYS  79   0.172   1.081 -12.213
  662    HE3  LYS  79           HE1      LYS  79   1.304   2.246 -12.897
  663    HZ1  LYS  79           HZ1      LYS  79   2.926   0.984 -11.250
  664    HZ2  LYS  79           HZ2      LYS  79   2.645   0.443 -12.827
  665    HZ3  LYS  79           HZ3      LYS  79   1.834  -0.276 -11.532
  666    H    GLN  80           HN       GLN  80   2.122  -0.198  -7.793
  667    HA   GLN  80           HA       GLN  80   0.076  -2.082  -8.373
  668    HB2  GLN  80           HB2      GLN  80   3.073  -2.356  -8.215
  669    HB3  GLN  80           HB1      GLN  80   2.001  -3.667  -8.697
  670    HG2  GLN  80           HG2      GLN  80   1.186  -2.321 -10.559
  671    HG3  GLN  80           HG1      GLN  80   2.250  -1.006 -10.070
  672   HE21  GLN  80          HE21      GLN  80   4.100  -3.464  -9.353
  673   HE22  GLN  80          HE22      GLN  80   4.889  -3.763 -10.858
  674    H    ALA  81           HN       ALA  81   2.391  -1.750  -5.741
  675    HA   ALA  81           HA       ALA  81   1.958  -4.204  -4.494
  676    HB1  ALA  81           HB1      ALA  81   2.814  -3.037  -2.440
  677    HB2  ALA  81           HB2      ALA  81   2.867  -1.557  -3.398
  678    HB3  ALA  81           HB3      ALA  81   3.854  -2.943  -3.860
  679    H    ILE  82           HN       ILE  82   0.287  -1.088  -4.074
  680    HA   ILE  82           HA       ILE  82  -1.239  -2.113  -1.909
  681    HB   ILE  82           HB       ILE  82  -0.864   0.306  -2.247
  682   HG12  ILE  82          HG12      ILE  82  -3.248   0.987  -1.740
  683   HG13  ILE  82          HG11      ILE  82  -3.705  -0.684  -2.050
  684   HG21  ILE  82          HG21      ILE  82  -1.166   0.424  -4.662
  685   HG22  ILE  82          HG22      ILE  82  -2.220   1.565  -3.826
  686   HG23  ILE  82          HG23      ILE  82  -2.881   0.061  -4.469
  687   HD11  ILE  82          HD11      ILE  82  -1.517  -0.627  -0.221
  688   HD12  ILE  82          HD12      ILE  82  -3.153  -1.246   0.009
  689   HD13  ILE  82          HD13      ILE  82  -2.795   0.448   0.347
  690    H    PHE  83           HN       PHE  83  -2.042  -1.720  -5.412
  691    HA   PHE  83           HA       PHE  83  -4.591  -2.976  -4.945
  692    HB2  PHE  83           HB2      PHE  83  -5.124  -2.406  -7.073
  693    HB3  PHE  83           HB1      PHE  83  -3.696  -1.392  -6.965
  694    HD1  PHE  83           HD1      PHE  83  -4.960  -4.647  -8.183
  695    HD2  PHE  83           HD2      PHE  83  -1.868  -1.734  -8.391
  696    HE1  PHE  83           HE1      PHE  83  -4.027  -5.788 -10.150
  697    HE2  PHE  83           HE2      PHE  83  -0.925  -2.874 -10.356
  698    HZ   PHE  83           HZ       PHE  83  -2.004  -4.903 -11.237
  699    H    ASN  84           HN       ASN  84  -1.387  -4.039  -5.842
  700    HA   ASN  84           HA       ASN  84  -2.130  -6.674  -6.582
  701    HB2  ASN  84           HB2      ASN  84   0.487  -5.484  -5.716
  702    HB3  ASN  84           HB1      ASN  84   0.292  -7.221  -5.870
  703   HD21  ASN  84          HD21      ASN  84   2.110  -5.718  -7.344
  704   HD22  ASN  84          HD22      ASN  84   1.656  -5.774  -9.010
  705    H    TYR  85           HN       TYR  85  -1.440  -5.033  -3.588
  706    HA   TYR  85           HA       TYR  85  -1.193  -7.257  -1.917
  707    HB2  TYR  85           HB2      TYR  85  -0.719  -5.092  -0.997
  708    HB3  TYR  85           HB1      TYR  85  -2.302  -4.480  -1.453
  709    HD1  TYR  85           HD1      TYR  85  -0.731  -7.062   0.745
  710    HD2  TYR  85           HD2      TYR  85  -3.959  -4.356   0.156
  711    HE1  TYR  85           HE1      TYR  85  -1.560  -7.563   3.006
  712    HE2  TYR  85           HE2      TYR  85  -4.801  -4.854   2.409
  713    HH   TYR  85           HH       TYR  85  -4.649  -6.449   4.131
  714    H    LEU  86           HN       LEU  86  -3.887  -5.496  -3.234
  715    HA   LEU  86           HA       LEU  86  -5.920  -6.949  -1.899
  716    HB2  LEU  86           HB2      LEU  86  -6.052  -5.493  -4.535
  717    HB3  LEU  86           HB1      LEU  86  -7.436  -6.080  -3.630
  718    HG   LEU  86           HG       LEU  86  -5.518  -3.915  -2.781
  719   HD11  LEU  86          HD11      LEU  86  -8.438  -3.887  -3.513
  720   HD12  LEU  86          HD12      LEU  86  -7.109  -3.202  -4.445
  721   HD13  LEU  86          HD13      LEU  86  -7.532  -2.515  -2.877
  722   HD21  LEU  86          HD21      LEU  86  -7.694  -5.349  -1.291
  723   HD22  LEU  86          HD22      LEU  86  -7.225  -3.700  -0.880
  724   HD23  LEU  86          HD23      LEU  86  -6.042  -5.003  -0.781
  725    H    GLU  87           HN       GLU  87  -4.264  -7.333  -4.957
  726    HA   GLU  87           HA       GLU  87  -5.732  -9.534  -5.937
  727    HB2  GLU  87           HB2      GLU  87  -4.201  -8.033  -7.256
  728    HB3  GLU  87           HB1      GLU  87  -2.837  -8.849  -6.506
  729    HG2  GLU  87           HG2      GLU  87  -3.026  -9.925  -8.532
  730    HG3  GLU  87           HG1      GLU  87  -3.900 -11.001  -7.444
  731    H    LYS  88           HN       LYS  88  -2.849  -9.292  -3.925
  732    HA   LYS  88           HA       LYS  88  -2.132 -12.016  -3.937
  733    HB2  LYS  88           HB2      LYS  88  -1.388  -9.617  -2.393
  734    HB3  LYS  88           HB1      LYS  88  -1.177 -11.140  -1.542
  735    HG2  LYS  88           HG2      LYS  88   0.880 -10.610  -2.600
  736    HG3  LYS  88           HG1      LYS  88   0.162 -11.960  -3.476
  737    HD2  LYS  88           HD2      LYS  88  -0.666 -10.395  -5.180
  738    HD3  LYS  88           HD1      LYS  88   0.089  -9.059  -4.308
  739    HE2  LYS  88           HE2      LYS  88   2.265  -9.903  -4.727
  740    HE3  LYS  88           HE1      LYS  88   1.630 -11.446  -5.293
  741    HZ1  LYS  88           HZ1      LYS  88   1.643  -8.841  -6.669
  742    HZ2  LYS  88           HZ2      LYS  88   0.508 -10.021  -7.093
  743    HZ3  LYS  88           HZ3      LYS  88   2.161 -10.350  -7.237
  744    H    LEU  89           HN       LEU  89  -4.076 -10.146  -1.606
  745    HA   LEU  89           HA       LEU  89  -4.599 -12.536  -0.067
  746    HB2  LEU  89           HB2      LEU  89  -5.926 -11.110   1.383
  747    HB3  LEU  89           HB1      LEU  89  -4.344 -10.415   1.099
  748    HG   LEU  89           HG       LEU  89  -5.781  -9.147  -0.825
  749   HD11  LEU  89          HD11      LEU  89  -7.897  -8.438   0.120
  750   HD12  LEU  89          HD12      LEU  89  -7.650  -9.486   1.516
  751   HD13  LEU  89          HD13      LEU  89  -7.879 -10.189  -0.086
  752   HD21  LEU  89          HD21      LEU  89  -5.800  -7.234   0.679
  753   HD22  LEU  89          HD22      LEU  89  -4.278  -8.118   0.800
  754   HD23  LEU  89          HD23      LEU  89  -5.507  -8.301   2.052
  755    H    GLU  90           HN       GLU  90  -6.121 -10.620  -2.483
  756    HA   GLU  90           HA       GLU  90  -8.223 -10.534  -3.348
  757    HB2  GLU  90           HB2      GLU  90  -8.744 -12.720  -4.537
  758    HB3  GLU  90           HB1      GLU  90  -7.287 -11.845  -4.964
  759    HG2  GLU  90           HG2      GLU  90  -5.994 -13.381  -3.496
  760    HG3  GLU  90           HG1      GLU  90  -7.473 -14.314  -3.253
  Start of MODEL   12
    1    H1   MET   1           HT1      MET   1   3.223   0.547  14.634
    2    H2   MET   1           HT2      MET   1   4.822   0.444  15.166
    3    H3   MET   1           HT3      MET   1   4.129  -0.849  14.323
    4    HA   MET   1           HA       MET   1   5.665   0.491  12.972
    5    HB2  MET   1           HB2      MET   1   2.756   0.407  12.167
    6    HB3  MET   1           HB1      MET   1   4.037   0.884  11.062
    7    HG2  MET   1           HG2      MET   1   5.104  -1.350  11.524
    8    HG3  MET   1           HG1      MET   1   3.617  -1.792  12.362
    9    HE1  MET   1           HE1      MET   1   1.084  -2.507  10.100
   10    HE2  MET   1           HE2      MET   1   1.096  -0.773   9.782
   11    HE3  MET   1           HE3      MET   1   1.397  -1.372  11.413
   12    H    ALA   2           HN       ALA   2   6.364   2.446  12.316
   13    HA   ALA   2           HA       ALA   2   4.879   4.782  13.326
   14    HB1  ALA   2           HB1      ALA   2   7.062   4.427  14.396
   15    HB2  ALA   2           HB2      ALA   2   7.024   5.927  13.469
   16    HB3  ALA   2           HB3      ALA   2   7.842   4.507  12.816
   17    H    THR   3           HN       THR   3   3.959   3.900  11.035
   18    HA   THR   3           HA       THR   3   5.251   4.775   8.686
   19    HB   THR   3           HB       THR   3   2.810   4.600   7.789
   20    HG1  THR   3           HG1      THR   3   2.243   2.933   9.887
   21   HG21  THR   3          HG21      THR   3   4.594   2.891   7.488
   22   HG22  THR   3          HG22      THR   3   2.981   2.195   7.645
   23   HG23  THR   3          HG23      THR   3   4.095   2.156   9.012
   24    H    THR   4           HN       THR   4   5.278   6.696   7.697
   25    HA   THR   4           HA       THR   4   3.785   8.913   8.913
   26    HB   THR   4           HB       THR   4   5.404  10.293   7.459
   27    HG1  THR   4           HG1      THR   4   7.285   8.313   7.536
   28   HG21  THR   4          HG21      THR   4   5.635  10.122   9.882
   29   HG22  THR   4          HG22      THR   4   7.221  10.073   9.113
   30   HG23  THR   4          HG23      THR   4   6.484   8.586   9.708
   31    H    THR   5           HN       THR   5   2.941  10.590   7.331
   32    HA   THR   5           HA       THR   5   1.386   9.235   5.332
   33    HB   THR   5           HB       THR   5   1.532  12.213   5.816
   34    HG1  THR   5           HG1      THR   5  -0.580  10.916   6.949
   35   HG21  THR   5          HG21      THR   5   0.372  11.606   3.770
   36   HG22  THR   5          HG22      THR   5  -0.800  12.144   4.974
   37   HG23  THR   5          HG23      THR   5  -0.604  10.423   4.642
   38    H    LEU   6           HN       LEU   6   2.390   8.622   3.554
   39    HA   LEU   6           HA       LEU   6   4.080  10.562   2.112
   40    HB2  LEU   6           HB2      LEU   6   4.187   7.552   1.874
   41    HB3  LEU   6           HB1      LEU   6   5.297   8.708   1.167
   42    HG   LEU   6           HG       LEU   6   5.023   8.027   4.096
   43   HD11  LEU   6          HD11      LEU   6   6.251   6.479   2.466
   44   HD12  LEU   6          HD12      LEU   6   7.100   6.990   3.924
   45   HD13  LEU   6          HD13      LEU   6   7.463   7.758   2.379
   46   HD21  LEU   6          HD21      LEU   6   6.725  10.110   2.738
   47   HD22  LEU   6          HD22      LEU   6   6.966   9.550   4.392
   48   HD23  LEU   6          HD23      LEU   6   5.472  10.377   3.950
   49    H    GLY   7           HN       GLY   7   3.892  10.515  -0.232
   50    HA2  GLY   7           HA2      GLY   7   1.169  10.211  -1.088
   51    HA3  GLY   7           HA1      GLY   7   2.522  10.725  -2.086
   52    H    VAL   8           HN       VAL   8   0.227   8.501  -1.977
   53    HA   VAL   8           HA       VAL   8   1.878   6.466  -3.314
   54    HB   VAL   8           HB       VAL   8  -0.156   6.036  -1.134
   55   HG11  VAL   8          HG11      VAL   8   0.807   3.980  -3.115
   56   HG12  VAL   8          HG12      VAL   8  -0.854   4.506  -2.844
   57   HG13  VAL   8          HG13      VAL   8  -0.001   3.599  -1.595
   58   HG21  VAL   8          HG21      VAL   8   1.616   4.638  -0.175
   59   HG22  VAL   8          HG22      VAL   8   2.151   6.297  -0.441
   60   HG23  VAL   8          HG23      VAL   8   2.649   5.021  -1.552
   61    H    LYS   9           HN       LYS   9   0.688   5.211  -4.918
   62    HA   LYS   9           HA       LYS   9  -1.534   6.758  -6.027
   63    HB2  LYS   9           HB2      LYS   9   0.132   4.561  -7.272
   64    HB3  LYS   9           HB1      LYS   9  -1.106   5.498  -8.098
   65    HG2  LYS   9           HG2      LYS   9   0.200   7.536  -7.748
   66    HG3  LYS   9           HG1      LYS   9   1.441   6.591  -6.925
   67    HD2  LYS   9           HD2      LYS   9   2.287   6.783  -9.078
   68    HD3  LYS   9           HD1      LYS   9   1.502   5.204  -9.107
   69    HE2  LYS   9           HE2      LYS   9  -0.114   7.572  -9.887
   70    HE3  LYS   9           HE1      LYS   9   1.121   7.017 -11.014
   71    HZ1  LYS   9           HZ1      LYS   9  -1.302   5.626 -10.083
   72    HZ2  LYS   9           HZ2      LYS   9   0.024   4.731 -10.626
   73    HZ3  LYS   9           HZ3      LYS   9  -0.725   5.839 -11.659
   74    H    LEU  10           HN       LEU  10  -3.555   6.081  -5.756
   75    HA   LEU  10           HA       LEU  10  -4.100   3.204  -5.436
   76    HB2  LEU  10           HB2      LEU  10  -4.555   5.376  -3.517
   77    HB3  LEU  10           HB1      LEU  10  -5.967   4.382  -3.812
   78    HG   LEU  10           HG       LEU  10  -3.336   3.138  -3.084
   79   HD11  LEU  10          HD11      LEU  10  -5.432   4.242  -1.222
   80   HD12  LEU  10          HD12      LEU  10  -3.743   4.739  -1.338
   81   HD13  LEU  10          HD13      LEU  10  -4.151   3.130  -0.741
   82   HD21  LEU  10          HD21      LEU  10  -6.215   2.301  -2.774
   83   HD22  LEU  10          HD22      LEU  10  -4.816   1.370  -2.241
   84   HD23  LEU  10          HD23      LEU  10  -5.067   1.677  -3.959
   85    H    ASP  11           HN       ASP  11  -6.079   2.504  -6.241
   86    HA   ASP  11           HA       ASP  11  -7.417   4.260  -8.116
   87    HB2  ASP  11           HB2      ASP  11  -7.870   1.375  -7.311
   88    HB3  ASP  11           HB1      ASP  11  -8.923   2.213  -8.438
   89    H    ASP  12           HN       ASP  12  -9.461   5.177  -7.820
   90    HA   ASP  12           HA       ASP  12 -10.368   5.762  -5.275
   91    HB2  ASP  12           HB2      ASP  12 -11.609   5.919  -7.973
   92    HB3  ASP  12           HB1      ASP  12 -12.679   6.066  -6.584
   93    HA   PRO  13           HA       PRO  13 -13.776   2.286  -5.610
   94    HB2  PRO  13           HB2      PRO  13 -13.076   0.204  -7.286
   95    HB3  PRO  13           HB1      PRO  13 -14.208   1.494  -7.705
   96    HG2  PRO  13           HG2      PRO  13 -11.317   1.206  -8.401
   97    HG3  PRO  13           HG1      PRO  13 -12.658   1.800  -9.397
   98    HD2  PRO  13           HD2      PRO  13 -10.904   3.477  -8.251
   99    HD3  PRO  13           HD1      PRO  13 -12.622   3.897  -8.416
  100    H    THR  14           HN       THR  14 -10.419   1.332  -6.262
  101    HA   THR  14           HA       THR  14 -10.512  -0.893  -4.504
  102    HB   THR  14           HB       THR  14  -8.772  -0.066  -6.465
  103    HG1  THR  14           HG1      THR  14  -7.889  -2.020  -4.686
  104   HG21  THR  14          HG21      THR  14  -6.554   0.016  -5.437
  105   HG22  THR  14          HG22      THR  14  -7.288   0.010  -3.833
  106   HG23  THR  14          HG23      THR  14  -7.541   1.381  -4.914
  107    H    ARG  15           HN       ARG  15  -9.887   2.502  -4.076
  108    HA   ARG  15           HA       ARG  15  -8.570   2.427  -1.586
  109    HB2  ARG  15           HB2      ARG  15  -9.234   4.419  -3.240
  110    HB3  ARG  15           HB1      ARG  15 -10.617   4.538  -2.167
  111    HG2  ARG  15           HG2      ARG  15  -7.769   4.635  -1.208
  112    HG3  ARG  15           HG1      ARG  15  -8.698   6.065  -1.654
  113    HD2  ARG  15           HD2      ARG  15  -9.198   6.075   0.545
  114    HD3  ARG  15           HD1      ARG  15 -10.423   4.907   0.050
  115    HE   ARG  15           HE       ARG  15  -8.286   3.350   0.570
  116   HH11  ARG  15          HH21      ARG  15  -9.946   5.827   2.390
  117   HH12  ARG  15          HH22      ARG  15  -9.519   5.162   3.930
  118   HH21  ARG  15          HH11      ARG  15  -7.727   2.452   2.587
  119   HH22  ARG  15          HH12      ARG  15  -8.248   3.225   4.043
  120    H    GLU  16           HN       GLU  16 -11.958   2.461  -2.547
  121    HA   GLU  16           HA       GLU  16 -13.099   2.371   0.021
  122    HB2  GLU  16           HB2      GLU  16 -14.108   1.371  -2.646
  123    HB3  GLU  16           HB1      GLU  16 -15.081   1.357  -1.182
  124    HG2  GLU  16           HG2      GLU  16 -14.846   3.797  -1.021
  125    HG3  GLU  16           HG1      GLU  16 -13.917   3.790  -2.520
  126    H    ARG  17           HN       ARG  17 -11.872  -0.120  -2.142
  127    HA   ARG  17           HA       ARG  17 -12.767  -2.381  -0.745
  128    HB2  ARG  17           HB2      ARG  17 -11.608  -2.286  -3.055
  129    HB3  ARG  17           HB1      ARG  17 -10.102  -2.317  -2.149
  130    HG2  ARG  17           HG2      ARG  17 -12.175  -4.394  -1.604
  131    HG3  ARG  17           HG1      ARG  17 -11.169  -4.531  -3.044
  132    HD2  ARG  17           HD2      ARG  17  -9.462  -5.305  -1.840
  133    HD3  ARG  17           HD1      ARG  17  -9.541  -3.918  -0.753
  134    HE   ARG  17           HE       ARG  17 -11.588  -5.529   0.057
  135   HH11  ARG  17          HH21      ARG  17  -8.151  -5.998  -0.374
  136   HH12  ARG  17          HH22      ARG  17  -8.022  -7.186   0.878
  137   HH21  ARG  17          HH11      ARG  17 -11.423  -7.094   1.725
  138   HH22  ARG  17          HH12      ARG  17  -9.887  -7.813   2.072
  139    H    LEU  18           HN       LEU  18  -9.955  -0.289  -0.298
  140    HA   LEU  18           HA       LEU  18  -8.656  -1.842   1.648
  141    HB2  LEU  18           HB2      LEU  18  -8.654   1.050   0.942
  142    HB3  LEU  18           HB1      LEU  18  -8.057   0.619   2.531
  143    HG   LEU  18           HG       LEU  18  -6.434  -0.943   1.403
  144   HD11  LEU  18          HD11      LEU  18  -7.404   0.500  -1.054
  145   HD12  LEU  18          HD12      LEU  18  -7.533  -1.227  -0.720
  146   HD13  LEU  18          HD13      LEU  18  -5.949  -0.493  -0.970
  147   HD21  LEU  18          HD21      LEU  18  -6.365   2.026   0.982
  148   HD22  LEU  18          HD22      LEU  18  -5.013   0.990   0.530
  149   HD23  LEU  18          HD23      LEU  18  -5.542   1.063   2.211
  150    H    LYS  19           HN       LYS  19 -11.267   0.560   1.867
  151    HA   LYS  19           HA       LYS  19 -11.480   0.522   4.671
  152    HB2  LYS  19           HB2      LYS  19 -12.677   2.181   3.343
  153    HB3  LYS  19           HB1      LYS  19 -13.661   0.915   2.618
  154    HG2  LYS  19           HG2      LYS  19 -14.634   0.413   4.798
  155    HG3  LYS  19           HG1      LYS  19 -13.641   1.671   5.535
  156    HD2  LYS  19           HD2      LYS  19 -15.902   2.479   5.138
  157    HD3  LYS  19           HD1      LYS  19 -14.745   3.351   4.133
  158    HE2  LYS  19           HE2      LYS  19 -16.884   2.659   2.990
  159    HE3  LYS  19           HE1      LYS  19 -15.395   2.164   2.189
  160    HZ1  LYS  19           HZ1      LYS  19 -17.095   0.399   2.269
  161    HZ2  LYS  19           HZ2      LYS  19 -17.015   0.410   3.959
  162    HZ3  LYS  19           HZ3      LYS  19 -15.663  -0.045   3.053
  163    H    ALA  20           HN       ALA  20 -12.860  -1.527   2.209
  164    HA   ALA  20           HA       ALA  20 -14.447  -3.156   3.878
  165    HB1  ALA  20           HB1      ALA  20 -13.150  -3.911   1.258
  166    HB2  ALA  20           HB2      ALA  20 -14.685  -3.058   1.418
  167    HB3  ALA  20           HB3      ALA  20 -14.526  -4.709   2.019
  168    H    ALA  21           HN       ALA  21 -11.087  -3.354   2.798
  169    HA   ALA  21           HA       ALA  21 -10.474  -5.848   3.981
  170    HB1  ALA  21           HB1      ALA  21  -8.370  -3.751   3.789
  171    HB2  ALA  21           HB2      ALA  21  -9.127  -4.305   2.296
  172    HB3  ALA  21           HB3      ALA  21  -8.307  -5.458   3.349
  173    H    ALA  22           HN       ALA  22 -10.337  -2.522   5.101
  174    HA   ALA  22           HA       ALA  22  -9.191  -2.930   7.626
  175    HB1  ALA  22           HB1      ALA  22  -9.985  -0.758   8.173
  176    HB2  ALA  22           HB2      ALA  22 -11.272  -0.858   6.971
  177    HB3  ALA  22           HB3      ALA  22  -9.591  -0.726   6.454
  178    H    GLN  23           HN       GLN  23 -12.464  -3.022   6.487
  179    HA   GLN  23           HA       GLN  23 -13.741  -3.509   8.943
  180    HB2  GLN  23           HB2      GLN  23 -14.517  -4.173   6.097
  181    HB3  GLN  23           HB1      GLN  23 -15.588  -4.419   7.475
  182    HG2  GLN  23           HG2      GLN  23 -14.360  -1.767   6.774
  183    HG3  GLN  23           HG1      GLN  23 -15.946  -2.287   6.205
  184   HE21  GLN  23          HE21      GLN  23 -14.840  -0.182   8.167
  185   HE22  GLN  23          HE22      GLN  23 -15.859  -0.359   9.550
  186    H    SER  24           HN       SER  24 -12.250  -5.577   6.544
  187    HA   SER  24           HA       SER  24 -13.024  -8.064   7.646
  188    HB2  SER  24           HB2      SER  24 -10.535  -7.482   6.021
  189    HB3  SER  24           HB1      SER  24 -11.354  -9.034   6.193
  190    HG   SER  24           HG       SER  24 -12.808  -6.851   5.203
  191    H    ILE  25           HN       ILE  25 -10.468  -5.791   8.384
  192    HA   ILE  25           HA       ILE  25  -9.282  -7.695  10.283
  193    HB   ILE  25           HB       ILE  25  -7.821  -6.521   8.536
  194   HG12  ILE  25          HG12      ILE  25  -7.088  -6.232  11.459
  195   HG13  ILE  25          HG11      ILE  25  -6.932  -7.705  10.508
  196   HG21  ILE  25          HG21      ILE  25  -7.155  -4.288   8.856
  197   HG22  ILE  25          HG22      ILE  25  -7.938  -4.197  10.433
  198   HG23  ILE  25          HG23      ILE  25  -8.916  -4.277   8.969
  199   HD11  ILE  25          HD11      ILE  25  -5.399  -5.141  10.201
  200   HD12  ILE  25          HD12      ILE  25  -5.364  -6.440   9.009
  201   HD13  ILE  25          HD13      ILE  25  -4.785  -6.732  10.649
  202    H    ASP  26           HN       ASP  26 -11.679  -5.735  10.295
  203    HA   ASP  26           HA       ASP  26 -12.867  -4.498  11.719
  204    HB2  ASP  26           HB2      ASP  26 -13.018  -5.225  13.988
  205    HB3  ASP  26           HB1      ASP  26 -12.724  -6.635  12.988
  206    H    ARG  27           HN       ARG  27 -10.687  -3.099  10.752
  207    HA   ARG  27           HA       ARG  27 -10.321  -1.258  13.026
  208    HB2  ARG  27           HB2      ARG  27  -8.149  -2.111  11.112
  209    HB3  ARG  27           HB1      ARG  27  -8.006  -0.782  12.255
  210    HG2  ARG  27           HG2      ARG  27  -8.404  -2.390  14.101
  211    HG3  ARG  27           HG1      ARG  27  -8.388  -3.695  12.912
  212    HD2  ARG  27           HD2      ARG  27  -6.139  -1.828  13.627
  213    HD3  ARG  27           HD1      ARG  27  -6.215  -3.573  13.881
  214    HE   ARG  27           HE       ARG  27  -6.485  -3.393  11.229
  215   HH11  ARG  27          HH21      ARG  27  -4.171  -2.008  13.449
  216   HH12  ARG  27          HH22      ARG  27  -2.917  -1.890  12.263
  217   HH21  ARG  27          HH11      ARG  27  -4.860  -3.213   9.662
  218   HH22  ARG  27          HH12      ARG  27  -3.313  -2.570  10.097
  219    H    THR  28           HN       THR  28  -9.640   0.961  12.282
  220    HA   THR  28           HA       THR  28 -11.357   1.735  10.113
  221    HB   THR  28           HB       THR  28 -11.497   3.406  11.666
  222    HG1  THR  28           HG1      THR  28 -10.881   4.727  10.079
  223   HG21  THR  28          HG21      THR  28  -9.958   2.504  13.272
  224   HG22  THR  28          HG22      THR  28  -9.600   4.216  13.035
  225   HG23  THR  28          HG23      THR  28  -8.581   2.990  12.281
  226    HA   PRO  29           HA       PRO  29  -8.826   1.793   6.537
  227    HB2  PRO  29           HB2      PRO  29  -9.407   4.733   6.607
  228    HB3  PRO  29           HB1      PRO  29  -9.435   3.618   5.236
  229    HG2  PRO  29           HG2      PRO  29 -11.689   4.353   6.473
  230    HG3  PRO  29           HG1      PRO  29 -11.470   2.713   5.837
  231    HD2  PRO  29           HD2      PRO  29 -11.544   3.644   8.632
  232    HD3  PRO  29           HD1      PRO  29 -11.821   2.020   7.975
  233    H    HIS  30           HN       HIS  30  -8.215   4.436   8.877
  234    HA   HIS  30           HA       HIS  30  -5.692   5.172   7.871
  235    HB2  HIS  30           HB2      HIS  30  -6.919   5.429  10.607
  236    HB3  HIS  30           HB1      HIS  30  -5.315   6.054  10.233
  237    HD1  HIS  30           HD1      HIS  30  -8.394   7.436  10.725
  238    HD2  HIS  30           HD2      HIS  30  -5.808   7.549   7.466
  239    HE1  HIS  30           HE1      HIS  30  -9.073   9.462   9.398
  240    HE2  HIS  30           HE2      HIS  30  -7.530   9.486   7.402
  241    H    TRP  31           HN       TRP  31  -6.513   2.920  10.484
  242    HA   TRP  31           HA       TRP  31  -3.846   2.244  11.104
  243    HB2  TRP  31           HB2      TRP  31  -6.231   0.456  11.549
  244    HB3  TRP  31           HB1      TRP  31  -4.709   0.439  12.421
  245    HD1  TRP  31           HD1      TRP  31  -7.344   0.555  13.996
  246    HE1  TRP  31           HE1      TRP  31  -7.949   2.570  15.485
  247    HE3  TRP  31           HE3      TRP  31  -4.352   4.113  11.834
  248    HZ2  TRP  31           HZ2      TRP  31  -7.267   5.286  15.700
  249    HZ3  TRP  31           HZ3      TRP  31  -4.400   6.394  12.746
  250    HH2  TRP  31           HH2      TRP  31  -5.828   6.968  14.639
  251    H    LEU  32           HN       LEU  32  -6.312   0.959   9.039
  252    HA   LEU  32           HA       LEU  32  -4.795  -1.255   8.194
  253    HB2  LEU  32           HB2      LEU  32  -7.154  -1.356   7.821
  254    HB3  LEU  32           HB1      LEU  32  -7.083   0.075   6.793
  255    HG   LEU  32           HG       LEU  32  -5.384  -1.304   5.400
  256   HD11  LEU  32          HD11      LEU  32  -6.758  -3.468   6.959
  257   HD12  LEU  32          HD12      LEU  32  -5.027  -3.159   6.812
  258   HD13  LEU  32          HD13      LEU  32  -5.943  -3.738   5.420
  259   HD21  LEU  32          HD21      LEU  32  -8.260  -2.123   5.316
  260   HD22  LEU  32          HD22      LEU  32  -7.098  -2.098   3.988
  261   HD23  LEU  32          HD23      LEU  32  -7.646  -0.585   4.712
  262    H    ILE  33           HN       ILE  33  -5.210   1.958   6.814
  263    HA   ILE  33           HA       ILE  33  -3.997   1.562   4.371
  264    HB   ILE  33           HB       ILE  33  -4.015   3.980   6.157
  265   HG12  ILE  33          HG12      ILE  33  -5.222   3.574   3.421
  266   HG13  ILE  33          HG11      ILE  33  -6.066   3.143   4.905
  267   HG21  ILE  33          HG21      ILE  33  -3.059   5.299   4.345
  268   HG22  ILE  33          HG22      ILE  33  -2.819   3.833   3.395
  269   HG23  ILE  33          HG23      ILE  33  -1.924   4.067   4.898
  270   HD11  ILE  33          HD11      ILE  33  -6.719   5.339   4.004
  271   HD12  ILE  33          HD12      ILE  33  -5.066   5.903   4.249
  272   HD13  ILE  33          HD13      ILE  33  -6.052   5.432   5.633
  273    H    LYS  34           HN       LYS  34  -2.387   2.502   7.414
  274    HA   LYS  34           HA       LYS  34   0.231   2.373   6.346
  275    HB2  LYS  34           HB2      LYS  34   1.000   2.249   8.659
  276    HB3  LYS  34           HB1      LYS  34  -0.307   3.414   8.524
  277    HG2  LYS  34           HG2      LYS  34  -1.867   1.714   9.393
  278    HG3  LYS  34           HG1      LYS  34  -0.506   0.614   9.606
  279    HD2  LYS  34           HD2      LYS  34   0.539   2.294  11.112
  280    HD3  LYS  34           HD1      LYS  34  -0.925   3.270  10.973
  281    HE2  LYS  34           HE2      LYS  34  -1.460   2.128  12.865
  282    HE3  LYS  34           HE1      LYS  34  -2.050   0.963  11.683
  283    HZ1  LYS  34           HZ1      LYS  34  -0.570  -0.523  12.370
  284    HZ2  LYS  34           HZ2      LYS  34  -0.202   0.502  13.663
  285    HZ3  LYS  34           HZ3      LYS  34   0.712   0.569  12.241
  286    H    GLN  35           HN       GLN  35  -1.833  -0.037   7.823
  287    HA   GLN  35           HA       GLN  35   0.043  -2.170   7.820
  288    HB2  GLN  35           HB2      GLN  35  -1.682  -2.315   9.385
  289    HB3  GLN  35           HB1      GLN  35  -2.920  -1.963   8.191
  290    HG2  GLN  35           HG2      GLN  35  -3.157  -4.235   8.688
  291    HG3  GLN  35           HG1      GLN  35  -2.338  -4.184   7.129
  292   HE21  GLN  35          HE21      GLN  35  -1.367  -6.163   7.287
  293   HE22  GLN  35          HE22      GLN  35  -0.115  -6.529   8.431
  294    H    ALA  36           HN       ALA  36  -2.380  -1.108   5.518
  295    HA   ALA  36           HA       ALA  36  -2.597  -3.433   3.986
  296    HB1  ALA  36           HB1      ALA  36  -3.136  -0.537   3.458
  297    HB2  ALA  36           HB2      ALA  36  -4.278  -1.864   3.672
  298    HB3  ALA  36           HB3      ALA  36  -3.333  -1.745   2.188
  299    H    ILE  37           HN       ILE  37  -0.582  -0.534   3.471
  300    HA   ILE  37           HA       ILE  37   0.667  -1.651   1.169
  301    HB   ILE  37           HB       ILE  37   0.628   0.771   1.578
  302   HG12  ILE  37          HG12      ILE  37   2.992   1.249   1.013
  303   HG13  ILE  37          HG11      ILE  37   3.411  -0.401   1.461
  304   HG21  ILE  37          HG21      ILE  37   1.896   1.858   3.250
  305   HG22  ILE  37          HG22      ILE  37   2.680   0.354   3.731
  306   HG23  ILE  37          HG23      ILE  37   0.963   0.597   4.054
  307   HD11  ILE  37          HD11      ILE  37   1.400   0.229  -0.673
  308   HD12  ILE  37          HD12      ILE  37   2.223  -1.299  -0.355
  309   HD13  ILE  37          HD13      ILE  37   3.125   0.072  -0.998
  310    H    PHE  38           HN       PHE  38   1.438  -1.532   4.590
  311    HA   PHE  38           HA       PHE  38   3.927  -2.882   4.387
  312    HB2  PHE  38           HB2      PHE  38   3.770  -1.748   6.381
  313    HB3  PHE  38           HB1      PHE  38   2.047  -2.046   6.541
  314    HD1  PHE  38           HD1      PHE  38   1.227  -4.071   7.572
  315    HD2  PHE  38           HD2      PHE  38   5.397  -3.290   7.257
  316    HE1  PHE  38           HE1      PHE  38   1.672  -5.801   9.257
  317    HE2  PHE  38           HE2      PHE  38   5.851  -5.026   8.941
  318    HZ   PHE  38           HZ       PHE  38   3.985  -6.283   9.943
  319    H    ASN  39           HN       ASN  39   0.608  -3.864   4.486
  320    HA   ASN  39           HA       ASN  39   1.002  -6.550   5.247
  321    HB2  ASN  39           HB2      ASN  39  -1.224  -5.193   5.138
  322    HB3  ASN  39           HB1      ASN  39  -1.260  -5.718   3.458
  323   HD21  ASN  39          HD21      ASN  39  -0.675  -8.202   3.311
  324   HD22  ASN  39          HD22      ASN  39  -1.589  -9.196   4.388
  325    H    TYR  40           HN       TYR  40   1.046  -4.808   2.199
  326    HA   TYR  40           HA       TYR  40   1.167  -7.056   0.534
  327    HB2  TYR  40           HB2      TYR  40   0.960  -5.048  -0.667
  328    HB3  TYR  40           HB1      TYR  40   2.199  -4.241   0.288
  329    HD1  TYR  40           HD1      TYR  40   2.194  -7.410  -1.719
  330    HD2  TYR  40           HD2      TYR  40   3.933  -3.584  -1.076
  331    HE1  TYR  40           HE1      TYR  40   3.869  -7.884  -3.455
  332    HE2  TYR  40           HE2      TYR  40   5.610  -4.048  -2.812
  333    HH   TYR  40           HH       TYR  40   6.442  -5.565  -4.209
  334    H    LEU  41           HN       LEU  41   3.536  -5.221   2.326
  335    HA   LEU  41           HA       LEU  41   5.790  -6.767   1.568
  336    HB2  LEU  41           HB2      LEU  41   5.468  -5.124   4.067
  337    HB3  LEU  41           HB1      LEU  41   6.965  -5.539   3.251
  338    HG   LEU  41           HG       LEU  41   4.810  -3.716   2.178
  339   HD11  LEU  41          HD11      LEU  41   6.233  -2.834   4.035
  340   HD12  LEU  41          HD12      LEU  41   6.323  -1.931   2.523
  341   HD13  LEU  41          HD13      LEU  41   7.625  -3.034   2.969
  342   HD21  LEU  41          HD21      LEU  41   7.463  -4.488   0.978
  343   HD22  LEU  41          HD22      LEU  41   6.357  -3.271   0.342
  344   HD23  LEU  41          HD23      LEU  41   5.874  -4.966   0.382
  345    H    GLU  42           HN       GLU  42   3.875  -6.734   4.574
  346    HA   GLU  42           HA       GLU  42   5.196  -8.830   5.887
  347    HB2  GLU  42           HB2      GLU  42   3.758  -7.187   7.024
  348    HB3  GLU  42           HB1      GLU  42   2.346  -7.878   6.239
  349    HG2  GLU  42           HG2      GLU  42   2.798 -10.017   7.399
  350    HG3  GLU  42           HG1      GLU  42   4.136  -9.240   8.243
  351    H    LYS  43           HN       LYS  43   2.452  -8.883   3.659
  352    HA   LYS  43           HA       LYS  43   1.616 -11.517   4.140
  353    HB2  LYS  43           HB2      LYS  43   0.468  -9.729   2.701
  354    HB3  LYS  43           HB1      LYS  43   1.564 -10.222   1.418
  355    HG2  LYS  43           HG2      LYS  43  -0.500 -11.357   1.089
  356    HG3  LYS  43           HG1      LYS  43   0.681 -12.543   1.655
  357    HD2  LYS  43           HD2      LYS  43  -0.235 -12.563   3.834
  358    HD3  LYS  43           HD1      LYS  43  -1.194 -11.116   3.524
  359    HE2  LYS  43           HE2      LYS  43  -1.640 -13.576   1.887
  360    HE3  LYS  43           HE1      LYS  43  -2.321 -13.468   3.510
  361    HZ1  LYS  43           HZ1      LYS  43  -2.906 -11.781   1.157
  362    HZ2  LYS  43           HZ2      LYS  43  -3.255 -11.248   2.724
  363    HZ3  LYS  43           HZ3      LYS  43  -3.983 -12.653   2.128
  364    H    LEU  44           HN       LEU  44   4.100 -10.205   2.002
  365    HA   LEU  44           HA       LEU  44   4.786 -12.872   1.096
  366    HB2  LEU  44           HB2      LEU  44   6.492 -11.759  -0.300
  367    HB3  LEU  44           HB1      LEU  44   4.862 -11.207  -0.607
  368    HG   LEU  44           HG       LEU  44   5.598  -9.285   1.091
  369   HD11  LEU  44          HD11      LEU  44   7.884  -8.675   0.882
  370   HD12  LEU  44          HD12      LEU  44   8.184  -9.951  -0.297
  371   HD13  LEU  44          HD13      LEU  44   7.849 -10.365   1.384
  372   HD21  LEU  44          HD21      LEU  44   6.397  -9.357  -1.815
  373   HD22  LEU  44          HD22      LEU  44   6.107  -7.916  -0.841
  374   HD23  LEU  44          HD23      LEU  44   4.776  -9.012  -1.212
  375    H    GLU  45           HN       GLU  45   5.540 -10.950   3.734
  376    HA   GLU  45           HA       GLU  45   7.691 -12.705   4.501
  377    HB2  GLU  45           HB2      GLU  45   8.905 -11.045   3.172
  378    HB3  GLU  45           HB1      GLU  45   8.208  -9.748   4.134
  379    HG2  GLU  45           HG2      GLU  45   9.360 -10.594   6.111
  380    HG3  GLU  45           HG1      GLU  45  10.054 -11.896   5.148
  381    H1   MET  46           HT1      MET  46  -3.223   0.191 -14.823
  382    H2   MET  46           HT2      MET  46  -4.809   0.158 -15.400
  383    H3   MET  46           HT3      MET  46  -4.205  -1.158 -14.525
  384    HA   MET  46           HA       MET  46  -5.697   0.221 -13.196
  385    HB2  MET  46           HB2      MET  46  -2.786   0.165 -12.384
  386    HB3  MET  46           HB1      MET  46  -4.077   0.653 -11.295
  387    HG2  MET  46           HG2      MET  46  -5.130  -1.588 -11.705
  388    HG3  MET  46           HG1      MET  46  -3.652  -2.043 -12.550
  389    HE1  MET  46           HE1      MET  46  -1.070  -2.661 -10.314
  390    HE2  MET  46           HE2      MET  46  -1.125  -0.926 -10.003
  391    HE3  MET  46           HE3      MET  46  -1.425  -1.540 -11.629
  392    H    ALA  47           HN       ALA  47  -6.383   2.203 -12.563
  393    HA   ALA  47           HA       ALA  47  -4.896   4.512 -13.640
  394    HB1  ALA  47           HB1      ALA  47  -7.084   4.146 -14.693
  395    HB2  ALA  47           HB2      ALA  47  -7.039   5.663 -13.795
  396    HB3  ALA  47           HB3      ALA  47  -7.859   4.258 -13.113
  397    H    THR  48           HN       THR  48  -3.978   3.674 -11.319
  398    HA   THR  48           HA       THR  48  -5.261   4.614  -8.992
  399    HB   THR  48           HB       THR  48  -2.810   4.455  -8.105
  400    HG1  THR  48           HG1      THR  48  -2.238   2.703 -10.106
  401   HG21  THR  48          HG21      THR  48  -4.610   2.772  -7.739
  402   HG22  THR  48          HG22      THR  48  -3.003   2.061  -7.879
  403   HG23  THR  48          HG23      THR  48  -4.122   1.984  -9.240
  404    H    THR  49           HN       THR  49  -5.290   6.563  -8.055
  405    HA   THR  49           HA       THR  49  -3.774   8.745  -9.308
  406    HB   THR  49           HB       THR  49  -5.387  10.172  -7.908
  407    HG1  THR  49           HG1      THR  49  -7.280   8.205  -7.888
  408   HG21  THR  49          HG21      THR  49  -5.644   9.914 -10.319
  409   HG22  THR  49          HG22      THR  49  -7.223   9.895  -9.534
  410   HG23  THR  49          HG23      THR  49  -6.492   8.386 -10.083
  411    H    THR  50           HN       THR  50  -2.875  10.423  -7.784
  412    HA   THR  50           HA       THR  50  -1.371   9.113  -5.726
  413    HB   THR  50           HB       THR  50  -1.487  12.079  -6.296
  414    HG1  THR  50           HG1      THR  50   0.548  11.413  -7.498
  415   HG21  THR  50          HG21      THR  50  -0.405  11.538  -4.187
  416   HG22  THR  50          HG22      THR  50   0.808  12.043  -5.365
  417   HG23  THR  50          HG23      THR  50   0.605  10.332  -4.985
  418    H    LEU  51           HN       LEU  51  -2.375   8.559  -3.930
  419    HA   LEU  51           HA       LEU  51  -4.063  10.542  -2.546
  420    HB2  LEU  51           HB2      LEU  51  -4.192   7.538  -2.238
  421    HB3  LEU  51           HB1      LEU  51  -5.293   8.717  -1.556
  422    HG   LEU  51           HG       LEU  51  -5.026   7.974  -4.471
  423   HD11  LEU  51          HD11      LEU  51  -6.253   6.458  -2.808
  424   HD12  LEU  51          HD12      LEU  51  -7.104   6.941  -4.274
  425   HD13  LEU  51          HD13      LEU  51  -7.463   7.739  -2.743
  426   HD21  LEU  51          HD21      LEU  51  -6.726  10.083  -3.149
  427   HD22  LEU  51          HD22      LEU  51  -6.968   9.493  -4.793
  428   HD23  LEU  51          HD23      LEU  51  -5.474  10.327  -4.367
  429    H    GLY  52           HN       GLY  52  -3.880  10.537  -0.194
  430    HA2  GLY  52           HA2      GLY  52  -1.157  10.237   0.665
  431    HA3  GLY  52           HA1      GLY  52  -2.505  10.782   1.653
  432    H    VAL  53           HN       VAL  53  -0.225   8.536   1.584
  433    HA   VAL  53           HA       VAL  53  -1.894   6.543   2.965
  434    HB   VAL  53           HB       VAL  53   0.139   6.055   0.796
  435   HG11  VAL  53          HG11      VAL  53  -0.829   4.045   2.821
  436   HG12  VAL  53          HG12      VAL  53   0.834   4.559   2.537
  437   HG13  VAL  53          HG13      VAL  53  -0.024   3.629   1.308
  438   HG21  VAL  53          HG21      VAL  53  -1.639   4.645  -0.131
  439   HG22  VAL  53          HG22      VAL  53  -2.169   6.311   0.103
  440   HG23  VAL  53          HG23      VAL  53  -2.668   5.059   1.240
  441    H    LYS  54           HN       LYS  54  -0.713   5.306   4.592
  442    HA   LYS  54           HA       LYS  54   1.508   6.861   5.687
  443    HB2  LYS  54           HB2      LYS  54  -0.169   4.687   6.956
  444    HB3  LYS  54           HB1      LYS  54   1.067   5.633   7.775
  445    HG2  LYS  54           HG2      LYS  54  -0.233   7.670   7.387
  446    HG3  LYS  54           HG1      LYS  54  -1.473   6.715   6.575
  447    HD2  LYS  54           HD2      LYS  54  -2.321   6.951   8.726
  448    HD3  LYS  54           HD1      LYS  54  -1.553   5.363   8.776
  449    HE2  LYS  54           HE2      LYS  54   0.110   7.704   9.515
  450    HE3  LYS  54           HE1      LYS  54  -1.151   7.224  10.648
  451    HZ1  LYS  54           HZ1      LYS  54   1.174   5.650   9.714
  452    HZ2  LYS  54           HZ2      LYS  54  -0.163   4.917  10.443
  453    HZ3  LYS  54           HZ3      LYS  54   0.742   6.058  11.299
  454    H    LEU  55           HN       LEU  55   3.529   6.180   5.405
  455    HA   LEU  55           HA       LEU  55   4.067   3.294   5.144
  456    HB2  LEU  55           HB2      LEU  55   4.526   5.430   3.188
  457    HB3  LEU  55           HB1      LEU  55   5.939   4.443   3.502
  458    HG   LEU  55           HG       LEU  55   3.309   3.185   2.795
  459   HD11  LEU  55          HD11      LEU  55   5.410   4.251   0.915
  460   HD12  LEU  55          HD12      LEU  55   3.722   4.752   1.019
  461   HD13  LEU  55          HD13      LEU  55   4.127   3.132   0.453
  462   HD21  LEU  55          HD21      LEU  55   6.189   2.341   2.506
  463   HD22  LEU  55          HD22      LEU  55   4.790   1.400   1.989
  464   HD23  LEU  55          HD23      LEU  55   5.039   1.742   3.700
  465    H    ASP  56           HN       ASP  56   6.043   2.599   5.954
  466    HA   ASP  56           HA       ASP  56   7.394   4.367   7.807
  467    HB2  ASP  56           HB2      ASP  56   7.769   1.464   7.042
  468    HB3  ASP  56           HB1      ASP  56   8.910   2.290   8.089
  469    H    ASP  57           HN       ASP  57   9.442   5.276   7.493
  470    HA   ASP  57           HA       ASP  57  10.338   5.820   4.931
  471    HB2  ASP  57           HB2      ASP  57  11.633   5.998   7.614
  472    HB3  ASP  57           HB1      ASP  57  12.641   6.201   6.187
  473    HA   PRO  58           HA       PRO  58  13.750   2.354   5.327
  474    HB2  PRO  58           HB2      PRO  58  13.059   0.306   7.046
  475    HB3  PRO  58           HB1      PRO  58  14.190   1.606   7.436
  476    HG2  PRO  58           HG2      PRO  58  11.300   1.328   8.143
  477    HG3  PRO  58           HG1      PRO  58  12.643   1.943   9.126
  478    HD2  PRO  58           HD2      PRO  58  10.887   3.597   7.952
  479    HD3  PRO  58           HD1      PRO  58  12.606   4.020   8.102
  480    H    THR  59           HN       THR  59  10.391   1.431   5.994
  481    HA   THR  59           HA       THR  59  10.477  -0.836   4.287
  482    HB   THR  59           HB       THR  59   8.743   0.023   6.235
  483    HG1  THR  59           HG1      THR  59   7.914  -1.945   4.416
  484   HG21  THR  59          HG21      THR  59   6.524   0.119   5.214
  485   HG22  THR  59          HG22      THR  59   7.253   0.088   3.608
  486   HG23  THR  59          HG23      THR  59   7.524   1.467   4.672
  487    H    ARG  60           HN       ARG  60   9.875   2.550   3.790
  488    HA   ARG  60           HA       ARG  60   8.547   2.430   1.305
  489    HB2  ARG  60           HB2      ARG  60   9.225   4.453   2.922
  490    HB3  ARG  60           HB1      ARG  60  10.591   4.555   1.826
  491    HG2  ARG  60           HG2      ARG  60   7.727   4.625   0.912
  492    HG3  ARG  60           HG1      ARG  60   8.662   6.065   1.310
  493    HD2  ARG  60           HD2      ARG  60   9.128   6.028  -0.897
  494    HD3  ARG  60           HD1      ARG  60  10.358   4.868  -0.397
  495    HE   ARG  60           HE       ARG  60   8.167   3.331  -0.854
  496   HH11  ARG  60          HH21      ARG  60   9.928   5.677  -2.746
  497   HH12  ARG  60          HH22      ARG  60   9.548   4.938  -4.262
  498   HH21  ARG  60          HH11      ARG  60   7.652   2.342  -2.844
  499   HH22  ARG  60          HH12      ARG  60   8.239   3.030  -4.318
  500    H    GLU  61           HN       GLU  61  11.943   2.483   2.252
  501    HA   GLU  61           HA       GLU  61  13.054   2.333  -0.329
  502    HB2  GLU  61           HB2      GLU  61  14.113   1.402   2.343
  503    HB3  GLU  61           HB1      GLU  61  15.062   1.379   0.862
  504    HG2  GLU  61           HG2      GLU  61  14.811   3.800   0.663
  505    HG3  GLU  61           HG1      GLU  61  13.862   3.822   2.148
  506    H    ARG  62           HN       ARG  62  11.846  -0.100   1.906
  507    HA   ARG  62           HA       ARG  62  12.737  -2.393   0.559
  508    HB2  ARG  62           HB2      ARG  62  11.584  -2.248   2.868
  509    HB3  ARG  62           HB1      ARG  62  10.075  -2.289   1.966
  510    HG2  ARG  62           HG2      ARG  62  12.133  -4.391   1.460
  511    HG3  ARG  62           HG1      ARG  62  11.128  -4.491   2.905
  512    HD2  ARG  62           HD2      ARG  62   9.421  -5.287   1.718
  513    HD3  ARG  62           HD1      ARG  62   9.493  -3.912   0.616
  514    HE   ARG  62           HE       ARG  62  11.531  -5.524  -0.201
  515   HH11  ARG  62          HH21      ARG  62   8.108  -6.013   0.298
  516   HH12  ARG  62          HH22      ARG  62   7.964  -7.221  -0.931
  517   HH21  ARG  62          HH11      ARG  62  11.351  -7.114  -1.844
  518   HH22  ARG  62          HH12      ARG  62   9.814  -7.850  -2.154
  519    H    LEU  63           HN       LEU  63   9.926  -0.308   0.074
  520    HA   LEU  63           HA       LEU  63   8.627  -1.897  -1.844
  521    HB2  LEU  63           HB2      LEU  63   8.623   1.009  -1.191
  522    HB3  LEU  63           HB1      LEU  63   8.028   0.548  -2.773
  523    HG   LEU  63           HG       LEU  63   6.404  -0.993  -1.617
  524   HD11  LEU  63          HD11      LEU  63   7.376   0.494   0.813
  525   HD12  LEU  63          HD12      LEU  63   7.501  -1.239   0.511
  526   HD13  LEU  63          HD13      LEU  63   5.918  -0.497   0.747
  527   HD21  LEU  63          HD21      LEU  63   6.334   1.983  -1.248
  528   HD22  LEU  63          HD22      LEU  63   4.981   0.955  -0.781
  529   HD23  LEU  63          HD23      LEU  63   5.514   0.999  -2.462
  530    H    LYS  64           HN       LYS  64  11.240   0.503  -2.109
  531    HA   LYS  64           HA       LYS  64  11.452   0.407  -4.910
  532    HB2  LYS  64           HB2      LYS  64  12.653   2.101  -3.643
  533    HB3  LYS  64           HB1      LYS  64  13.625   0.859  -2.863
  534    HG2  LYS  64           HG2      LYS  64  14.615   0.271  -5.016
  535    HG3  LYS  64           HG1      LYS  64  13.636   1.507  -5.806
  536    HD2  LYS  64           HD2      LYS  64  15.908   2.303  -5.417
  537    HD3  LYS  64           HD1      LYS  64  14.742   3.234  -4.477
  538    HE2  LYS  64           HE2      LYS  64  16.819   2.627  -3.234
  539    HE3  LYS  64           HE1      LYS  64  15.329   2.086  -2.468
  540    HZ1  LYS  64           HZ1      LYS  64  17.144   0.413  -2.481
  541    HZ2  LYS  64           HZ2      LYS  64  17.040   0.349  -4.167
  542    HZ3  LYS  64           HZ3      LYS  64  15.723  -0.127  -3.221
  543    H    ALA  65           HN       ALA  65  12.832  -1.595  -2.412
  544    HA   ALA  65           HA       ALA  65  14.408  -3.261  -4.053
  545    HB1  ALA  65           HB1      ALA  65  13.109  -3.966  -1.419
  546    HB2  ALA  65           HB2      ALA  65  14.647  -3.121  -1.594
  547    HB3  ALA  65           HB3      ALA  65  14.483  -4.781  -2.168
  548    H    ALA  66           HN       ALA  66  11.048  -3.434  -2.965
  549    HA   ALA  66           HA       ALA  66  10.424  -5.945  -4.105
  550    HB1  ALA  66           HB1      ALA  66   8.327  -3.840  -3.954
  551    HB2  ALA  66           HB2      ALA  66   9.085  -4.359  -2.450
  552    HB3  ALA  66           HB3      ALA  66   8.262  -5.536  -3.474
  553    H    ALA  67           HN       ALA  67  10.300  -2.640  -5.281
  554    HA   ALA  67           HA       ALA  67   9.153  -3.092  -7.799
  555    HB1  ALA  67           HB1      ALA  67   9.945  -0.930  -8.383
  556    HB2  ALA  67           HB2      ALA  67  11.231  -1.008  -7.179
  557    HB3  ALA  67           HB3      ALA  67   9.550  -0.867  -6.665
  558    H    GLN  68           HN       GLN  68  12.430  -3.140  -6.657
  559    HA   GLN  68           HA       GLN  68  13.715  -3.674  -9.097
  560    HB2  GLN  68           HB2      GLN  68  14.473  -4.295  -6.236
  561    HB3  GLN  68           HB1      GLN  68  15.549  -4.579  -7.599
  562    HG2  GLN  68           HG2      GLN  68  14.352  -1.898  -6.954
  563    HG3  GLN  68           HG1      GLN  68  15.926  -2.430  -6.365
  564   HE21  GLN  68          HE21      GLN  68  14.649  -0.469  -8.512
  565   HE22  GLN  68          HE22      GLN  68  15.761  -0.617  -9.826
  566    H    SER  69           HN       SER  69  12.233  -5.714  -6.658
  567    HA   SER  69           HA       SER  69  12.987  -8.219  -7.723
  568    HB2  SER  69           HB2      SER  69  10.489  -7.597  -6.127
  569    HB3  SER  69           HB1      SER  69  11.295  -9.158  -6.272
  570    HG   SER  69           HG       SER  69  12.821  -7.025  -5.326
  571    H    ILE  70           HN       ILE  70  10.415  -5.962  -8.483
  572    HA   ILE  70           HA       ILE  70   9.247  -7.885 -10.372
  573    HB   ILE  70           HB       ILE  70   7.780  -6.675  -8.650
  574   HG12  ILE  70          HG12      ILE  70   7.061  -6.446 -11.581
  575   HG13  ILE  70          HG11      ILE  70   6.900  -7.899 -10.601
  576   HG21  ILE  70          HG21      ILE  70   7.123  -4.449  -9.008
  577   HG22  ILE  70          HG22      ILE  70   7.893  -4.391 -10.593
  578   HG23  ILE  70          HG23      ILE  70   8.882  -4.439  -9.135
  579   HD11  ILE  70          HD11      ILE  70   5.366  -5.329 -10.351
  580   HD12  ILE  70          HD12      ILE  70   5.324  -6.607  -9.136
  581   HD13  ILE  70          HD13      ILE  70   4.753  -6.929 -10.774
  582    H    ASP  71           HN       ASP  71  11.654  -5.950 -10.393
  583    HA   ASP  71           HA       ASP  71  12.860  -4.727 -11.812
  584    HB2  ASP  71           HB2      ASP  71  13.007  -5.472 -14.093
  585    HB3  ASP  71           HB1      ASP  71  12.777  -6.863 -13.049
  586    H    ARG  72           HN       ARG  72  10.630  -3.330 -10.916
  587    HA   ARG  72           HA       ARG  72  10.303  -1.528 -13.229
  588    HB2  ARG  72           HB2      ARG  72   8.114  -2.348 -11.318
  589    HB3  ARG  72           HB1      ARG  72   7.978  -1.036 -12.480
  590    HG2  ARG  72           HG2      ARG  72   8.400  -2.676 -14.299
  591    HG3  ARG  72           HG1      ARG  72   8.359  -3.960 -13.088
  592    HD2  ARG  72           HD2      ARG  72   6.133  -2.098 -13.882
  593    HD3  ARG  72           HD1      ARG  72   6.202  -3.849 -14.086
  594    HE   ARG  72           HE       ARG  72   6.419  -3.600 -11.436
  595   HH11  ARG  72          HH21      ARG  72   4.176  -2.243 -13.744
  596   HH12  ARG  72          HH22      ARG  72   2.889  -2.099 -12.596
  597   HH21  ARG  72          HH11      ARG  72   4.750  -3.380  -9.914
  598   HH22  ARG  72          HH12      ARG  72   3.220  -2.737 -10.405
  599    H    THR  73           HN       THR  73   9.630   0.713 -12.533
  600    HA   THR  73           HA       THR  73  11.341   1.505 -10.366
  601    HB   THR  73           HB       THR  73  11.513   3.116 -11.989
  602    HG1  THR  73           HG1      THR  73  11.016   4.628 -10.613
  603   HG21  THR  73          HG21      THR  73   9.920   2.277 -13.551
  604   HG22  THR  73          HG22      THR  73   9.591   3.992 -13.295
  605   HG23  THR  73          HG23      THR  73   8.577   2.776 -12.520
  606    HA   PRO  74           HA       PRO  74   8.801   1.645  -6.807
  607    HB2  PRO  74           HB2      PRO  74   9.387   4.581  -6.910
  608    HB3  PRO  74           HB1      PRO  74   9.420   3.479  -5.528
  609    HG2  PRO  74           HG2      PRO  74  11.670   4.206  -6.778
  610    HG3  PRO  74           HG1      PRO  74  11.455   2.571  -6.127
  611    HD2  PRO  74           HD2      PRO  74  11.511   3.481  -8.932
  612    HD3  PRO  74           HD1      PRO  74  11.807   1.866  -8.262
  613    H    HIS  75           HN       HIS  75   8.205   4.238  -9.198
  614    HA   HIS  75           HA       HIS  75   5.688   5.015  -8.205
  615    HB2  HIS  75           HB2      HIS  75   6.915   5.190 -10.947
  616    HB3  HIS  75           HB1      HIS  75   5.309   5.823 -10.596
  617    HD1  HIS  75           HD1      HIS  75   8.444   7.130 -11.068
  618    HD2  HIS  75           HD2      HIS  75   5.733   7.453  -7.932
  619    HE1  HIS  75           HE1      HIS  75   9.085   9.232  -9.843
  620    HE2  HIS  75           HE2      HIS  75   7.294   9.520  -8.093
  621    H    TRP  76           HN       TRP  76   6.488   2.708 -10.779
  622    HA   TRP  76           HA       TRP  76   3.821   2.023 -11.370
  623    HB2  TRP  76           HB2      TRP  76   6.195   0.216 -11.775
  624    HB3  TRP  76           HB1      TRP  76   4.675   0.191 -12.650
  625    HD1  TRP  76           HD1      TRP  76   7.333   0.265 -14.205
  626    HE1  TRP  76           HE1      TRP  76   7.950   2.242 -15.728
  627    HE3  TRP  76           HE3      TRP  76   4.313   3.868 -12.157
  628    HZ2  TRP  76           HZ2      TRP  76   7.267   4.955 -16.020
  629    HZ3  TRP  76           HZ3      TRP  76   4.366   6.127 -13.123
  630    HH2  TRP  76           HH2      TRP  76   5.813   6.659 -15.014
  631    H    LEU  77           HN       LEU  77   6.286   0.772  -9.278
  632    HA   LEU  77           HA       LEU  77   4.754  -1.414  -8.386
  633    HB2  LEU  77           HB2      LEU  77   7.115  -1.525  -8.024
  634    HB3  LEU  77           HB1      LEU  77   7.058  -0.077  -7.021
  635    HG   LEU  77           HG       LEU  77   5.351  -1.425  -5.602
  636   HD11  LEU  77          HD11      LEU  77   6.723  -3.618  -7.120
  637   HD12  LEU  77          HD12      LEU  77   4.993  -3.306  -6.978
  638   HD13  LEU  77          HD13      LEU  77   5.908  -3.860  -5.576
  639   HD21  LEU  77          HD21      LEU  77   8.226  -2.245  -5.502
  640   HD22  LEU  77          HD22      LEU  77   7.064  -2.193  -4.175
  641   HD23  LEU  77          HD23      LEU  77   7.613  -0.695  -4.927
  642    H    ILE  78           HN       ILE  78   5.172   1.834  -7.095
  643    HA   ILE  78           HA       ILE  78   3.978   1.480  -4.629
  644    HB   ILE  78           HB       ILE  78   3.999   3.869  -6.455
  645   HG12  ILE  78          HG12      ILE  78   5.204   3.513  -3.712
  646   HG13  ILE  78          HG11      ILE  78   6.049   3.049  -5.184
  647   HG21  ILE  78          HG21      ILE  78   3.044   5.220  -4.668
  648   HG22  ILE  78          HG22      ILE  78   2.802   3.771  -3.691
  649   HG23  ILE  78          HG23      ILE  78   1.908   3.979  -5.198
  650   HD11  ILE  78          HD11      ILE  78   6.707   5.261  -4.330
  651   HD12  ILE  78          HD12      ILE  78   5.055   5.825  -4.584
  652   HD13  ILE  78          HD13      ILE  78   6.038   5.324  -5.960
  653    H    LYS  79           HN       LYS  79   2.368   2.357  -7.688
  654    HA   LYS  79           HA       LYS  79  -0.251   2.258  -6.615
  655    HB2  LYS  79           HB2      LYS  79  -1.017   2.080  -8.932
  656    HB3  LYS  79           HB1      LYS  79   0.273   3.264  -8.806
  657    HG2  LYS  79           HG2      LYS  79   1.860   1.583  -9.655
  658    HG3  LYS  79           HG1      LYS  79   0.521   0.453  -9.849
  659    HD2  LYS  79           HD2      LYS  79  -0.550   2.009 -11.418
  660    HD3  LYS  79           HD1      LYS  79   0.808   3.120 -11.232
  661    HE2  LYS  79           HE2      LYS  79   1.638   2.065 -13.033
  662    HE3  LYS  79           HE1      LYS  79   2.093   0.813 -11.880
  663    HZ1  LYS  79           HZ1      LYS  79   0.677  -0.604 -12.807
  664    HZ2  LYS  79           HZ2      LYS  79   0.493   0.502 -14.075
  665    HZ3  LYS  79           HZ3      LYS  79  -0.597   0.508 -12.778
  666    H    GLN  80           HN       GLN  80   1.809  -0.180  -8.045
  667    HA   GLN  80           HA       GLN  80  -0.072  -2.309  -8.015
  668    HB2  GLN  80           HB2      GLN  80   1.656  -2.482  -9.577
  669    HB3  GLN  80           HB1      GLN  80   2.892  -2.113  -8.387
  670    HG2  GLN  80           HG2      GLN  80   3.118  -4.396  -8.864
  671    HG3  GLN  80           HG1      GLN  80   2.325  -4.314  -7.293
  672   HE21  GLN  80          HE21      GLN  80   1.345  -6.294  -7.398
  673   HE22  GLN  80          HE22      GLN  80   0.073  -6.676  -8.513
  674    H    ALA  81           HN       ALA  81   2.343  -1.209  -5.726
  675    HA   ALA  81           HA       ALA  81   2.553  -3.512  -4.156
  676    HB1  ALA  81           HB1      ALA  81   3.103  -0.610  -3.677
  677    HB2  ALA  81           HB2      ALA  81   4.241  -1.945  -3.868
  678    HB3  ALA  81           HB3      ALA  81   3.295  -1.797  -2.388
  679    H    ILE  82           HN       ILE  82   0.556  -0.593  -3.686
  680    HA   ILE  82           HA       ILE  82  -0.699  -1.665  -1.367
  681    HB   ILE  82           HB       ILE  82  -0.656   0.749  -1.817
  682   HG12  ILE  82          HG12      ILE  82  -3.019   1.242  -1.263
  683   HG13  ILE  82          HG11      ILE  82  -3.441  -0.415  -1.684
  684   HG21  ILE  82          HG21      ILE  82  -1.919   1.810  -3.509
  685   HG22  ILE  82          HG22      ILE  82  -2.705   0.299  -3.965
  686   HG23  ILE  82          HG23      ILE  82  -0.987   0.533  -4.290
  687   HD11  ILE  82          HD11      ILE  82  -1.432   0.246   0.442
  688   HD12  ILE  82          HD12      ILE  82  -2.257  -1.286   0.149
  689   HD13  ILE  82          HD13      ILE  82  -3.158   0.098   0.767
  690    H    PHE  83           HN       PHE  83  -1.465  -1.608  -4.790
  691    HA   PHE  83           HA       PHE  83  -3.956  -2.949  -4.567
  692    HB2  PHE  83           HB2      PHE  83  -3.790  -1.849  -6.581
  693    HB3  PHE  83           HB1      PHE  83  -2.068  -2.163  -6.735
  694    HD1  PHE  83           HD1      PHE  83  -1.263  -4.210  -7.728
  695    HD2  PHE  83           HD2      PHE  83  -5.428  -3.401  -7.424
  696    HE1  PHE  83           HE1      PHE  83  -1.719  -5.971  -9.377
  697    HE2  PHE  83           HE2      PHE  83  -5.893  -5.167  -9.073
  698    HZ   PHE  83           HZ       PHE  83  -4.036  -6.454 -10.052
  699    H    ASN  84           HN       ASN  84  -0.636  -3.941  -4.645
  700    HA   ASN  84           HA       ASN  84  -1.049  -6.640  -5.354
  701    HB2  ASN  84           HB2      ASN  84   1.189  -5.305  -5.291
  702    HB3  ASN  84           HB1      ASN  84   1.230  -5.782  -3.596
  703   HD21  ASN  84          HD21      ASN  84   0.600  -8.261  -3.391
  704   HD22  ASN  84          HD22      ASN  84   1.508  -9.294  -4.438
  705    H    TYR  85           HN       TYR  85  -1.078  -4.837  -2.343
  706    HA   TYR  85           HA       TYR  85  -1.204  -7.051  -0.633
  707    HB2  TYR  85           HB2      TYR  85  -0.995  -5.022   0.531
  708    HB3  TYR  85           HB1      TYR  85  -2.231  -4.230  -0.440
  709    HD1  TYR  85           HD1      TYR  85  -2.227  -7.361   1.623
  710    HD2  TYR  85           HD2      TYR  85  -3.974  -3.551   0.907
  711    HE1  TYR  85           HE1      TYR  85  -3.907  -7.809   3.361
  712    HE2  TYR  85           HE2      TYR  85  -5.656  -3.989   2.646
  713    HH   TYR  85           HH       TYR  85  -6.464  -5.464   4.096
  714    H    LEU  86           HN       LEU  86  -3.567  -5.247  -2.461
  715    HA   LEU  86           HA       LEU  86  -5.827  -6.768  -1.675
  716    HB2  LEU  86           HB2      LEU  86  -5.486  -5.172  -4.202
  717    HB3  LEU  86           HB1      LEU  86  -6.993  -5.574  -3.395
  718    HG   LEU  86           HG       LEU  86  -4.848  -3.728  -2.338
  719   HD11  LEU  86          HD11      LEU  86  -6.270  -2.887  -4.216
  720   HD12  LEU  86          HD12      LEU  86  -6.365  -1.956  -2.722
  721   HD13  LEU  86          HD13      LEU  86  -7.662  -3.072  -3.150
  722   HD21  LEU  86          HD21      LEU  86  -7.503  -4.492  -1.135
  723   HD22  LEU  86          HD22      LEU  86  -6.406  -3.259  -0.516
  724   HD23  LEU  86          HD23      LEU  86  -5.914  -4.952  -0.524
  725    H    GLU  87           HN       GLU  87  -3.919  -6.794  -4.687
  726    HA   GLU  87           HA       GLU  87  -5.232  -8.911  -5.963
  727    HB2  GLU  87           HB2      GLU  87  -3.772  -7.296  -7.120
  728    HB3  GLU  87           HB1      GLU  87  -2.371  -7.989  -6.318
  729    HG2  GLU  87           HG2      GLU  87  -2.851 -10.144  -7.444
  730    HG3  GLU  87           HG1      GLU  87  -4.167  -9.358  -8.312
  731    H    LYS  88           HN       LYS  88  -2.491  -8.942  -3.728
  732    HA   LYS  88           HA       LYS  88  -1.673 -11.593  -4.147
  733    HB2  LYS  88           HB2      LYS  88  -0.526  -9.760  -2.754
  734    HB3  LYS  88           HB1      LYS  88  -1.601 -10.250  -1.453
  735    HG2  LYS  88           HG2      LYS  88   0.489 -11.350  -1.142
  736    HG3  LYS  88           HG1      LYS  88  -0.693 -12.558  -1.655
  737    HD2  LYS  88           HD2      LYS  88   0.185 -12.642  -3.843
  738    HD3  LYS  88           HD1      LYS  88   1.119 -11.165  -3.608
  739    HE2  LYS  88           HE2      LYS  88   1.654 -13.566  -1.908
  740    HE3  LYS  88           HE1      LYS  88   2.308 -13.480  -3.543
  741    HZ1  LYS  88           HZ1      LYS  88   2.869 -11.686  -1.255
  742    HZ2  LYS  88           HZ2      LYS  88   3.235 -11.245  -2.848
  743    HZ3  LYS  88           HZ3      LYS  88   3.961 -12.607  -2.161
  744    H    LEU  89           HN       LEU  89  -4.162 -10.225  -2.055
  745    HA   LEU  89           HA       LEU  89  -4.841 -12.873  -1.077
  746    HB2  LEU  89           HB2      LEU  89  -6.506 -11.727   0.334
  747    HB3  LEU  89           HB1      LEU  89  -4.871 -11.159   0.588
  748    HG   LEU  89           HG       LEU  89  -5.637  -9.280  -1.130
  749   HD11  LEU  89          HD11      LEU  89  -7.924  -8.679  -0.937
  750   HD12  LEU  89          HD12      LEU  89  -8.218  -9.928   0.273
  751   HD13  LEU  89          HD13      LEU  89  -7.881 -10.381  -1.398
  752   HD21  LEU  89          HD21      LEU  89  -6.436  -9.290   1.777
  753   HD22  LEU  89          HD22      LEU  89  -6.150  -7.871   0.769
  754   HD23  LEU  89          HD23      LEU  89  -4.816  -8.953   1.166
  755    H    GLU  90           HN       GLU  90  -5.617 -10.983  -3.733
  756    HA   GLU  90           HA       GLU  90  -7.785 -12.740  -4.456
  757    HB2  GLU  90           HB2      GLU  90  -8.967 -11.038  -3.126
  758    HB3  GLU  90           HB1      GLU  90  -8.285  -9.773  -4.138
  759    HG2  GLU  90           HG2      GLU  90  -9.483 -10.656  -6.068
  760    HG3  GLU  90           HG1      GLU  90 -10.166 -11.934  -5.067
  Start of MODEL   13
    1    H1   MET   1           HT1      MET   1  -4.464  -0.744 -11.103
    2    H2   MET   1           HT2      MET   1  -5.250   0.282 -12.192
    3    H3   MET   1           HT3      MET   1  -4.924   0.812 -10.613
    4    HA   MET   1           HA       MET   1  -2.644   0.948 -10.985
    5    HB2  MET   1           HB2      MET   1  -1.627   0.238 -13.174
    6    HB3  MET   1           HB1      MET   1  -2.190  -1.075 -12.152
    7    HG2  MET   1           HG2      MET   1  -4.113  -1.410 -13.517
    8    HG3  MET   1           HG1      MET   1  -3.779   0.054 -14.441
    9    HE1  MET   1           HE1      MET   1  -0.849  -2.679 -13.496
   10    HE2  MET   1           HE2      MET   1  -1.435  -3.892 -14.634
   11    HE3  MET   1           HE3      MET   1  -2.475  -3.337 -13.323
   12    H    ALA   2           HN       ALA   2  -5.312   2.237 -12.040
   13    HA   ALA   2           HA       ALA   2  -4.003   4.289 -13.720
   14    HB1  ALA   2           HB1      ALA   2  -6.267   4.795 -14.593
   15    HB2  ALA   2           HB2      ALA   2  -6.919   3.460 -13.642
   16    HB3  ALA   2           HB3      ALA   2  -5.783   3.138 -14.952
   17    H    THR   3           HN       THR   3  -3.913   3.906 -10.994
   18    HA   THR   3           HA       THR   3  -5.748   5.359  -9.458
   19    HB   THR   3           HB       THR   3  -4.678   4.196  -7.887
   20    HG1  THR   3           HG1      THR   3  -3.536   6.240  -7.633
   21   HG21  THR   3          HG21      THR   3  -2.459   3.760  -9.894
   22   HG22  THR   3          HG22      THR   3  -3.827   2.688  -9.598
   23   HG23  THR   3          HG23      THR   3  -2.607   2.926  -8.347
   24    H    THR   4           HN       THR   4  -5.266   7.151  -8.104
   25    HA   THR   4           HA       THR   4  -3.582   9.183  -9.415
   26    HB   THR   4           HB       THR   4  -5.059  10.818  -8.101
   27    HG1  THR   4           HG1      THR   4  -6.008   8.720  -7.002
   28   HG21  THR   4          HG21      THR   4  -5.294  10.630 -10.491
   29   HG22  THR   4          HG22      THR   4  -6.903  10.701  -9.773
   30   HG23  THR   4          HG23      THR   4  -6.250   9.158 -10.324
   31    H    THR   5           HN       THR   5  -2.719  10.833  -7.728
   32    HA   THR   5           HA       THR   5  -1.349   9.308  -5.703
   33    HB   THR   5           HB       THR   5  -1.256  12.306  -6.070
   34    HG1  THR   5           HG1      THR   5  -0.615  10.514  -7.872
   35   HG21  THR   5          HG21      THR   5   0.966  12.104  -5.100
   36   HG22  THR   5          HG22      THR   5   0.793  10.351  -5.011
   37   HG23  THR   5          HG23      THR   5  -0.228  11.390  -4.016
   38    H    LEU   6           HN       LEU   6  -2.310   8.822  -3.854
   39    HA   LEU   6           HA       LEU   6  -4.080  10.808  -2.580
   40    HB2  LEU   6           HB2      LEU   6  -4.194   7.813  -2.203
   41    HB3  LEU   6           HB1      LEU   6  -5.329   8.999  -1.592
   42    HG   LEU   6           HG       LEU   6  -4.942   8.197  -4.477
   43   HD11  LEU   6          HD11      LEU   6  -7.526   8.018  -3.025
   44   HD12  LEU   6          HD12      LEU   6  -6.293   6.805  -2.685
   45   HD13  LEU   6          HD13      LEU   6  -6.886   7.020  -4.331
   46   HD21  LEU   6          HD21      LEU   6  -5.403  10.536  -4.465
   47   HD22  LEU   6          HD22      LEU   6  -6.672  10.338  -3.256
   48   HD23  LEU   6          HD23      LEU   6  -6.897   9.698  -4.884
   49    H    GLY   7           HN       GLY   7  -4.066  10.758  -0.203
   50    HA2  GLY   7           HA2      GLY   7  -1.383  10.628   0.811
   51    HA3  GLY   7           HA1      GLY   7  -2.818  11.087   1.714
   52    H    VAL   8           HN       VAL   8  -0.417   8.844   1.508
   53    HA   VAL   8           HA       VAL   8  -2.030   6.829   2.938
   54    HB   VAL   8           HB       VAL   8   0.042   6.427   0.801
   55   HG11  VAL   8          HG11      VAL   8  -0.852   4.389   2.818
   56   HG12  VAL   8          HG12      VAL   8   0.792   4.930   2.486
   57   HG13  VAL   8          HG13      VAL   8  -0.084   3.980   1.286
   58   HG21  VAL   8          HG21      VAL   8  -1.668   4.963  -0.165
   59   HG22  VAL   8          HG22      VAL   8  -2.261   6.607   0.073
   60   HG23  VAL   8          HG23      VAL   8  -2.731   5.328   1.193
   61    H    LYS   9           HN       LYS   9  -0.791   5.560   4.486
   62    HA   LYS   9           HA       LYS   9   1.352   7.178   5.630
   63    HB2  LYS   9           HB2      LYS   9  -0.386   5.024   6.839
   64    HB3  LYS   9           HB1      LYS   9   0.915   5.842   7.693
   65    HG2  LYS   9           HG2      LYS   9  -0.916   7.030   8.401
   66    HG3  LYS   9           HG1      LYS   9  -0.384   8.003   7.027
   67    HD2  LYS   9           HD2      LYS   9  -2.014   6.458   5.684
   68    HD3  LYS   9           HD1      LYS   9  -2.739   6.179   7.268
   69    HE2  LYS   9           HE2      LYS   9  -3.282   8.454   7.532
   70    HE3  LYS   9           HE1      LYS   9  -2.221   8.942   6.212
   71    HZ1  LYS   9           HZ1      LYS   9  -4.763   8.802   5.830
   72    HZ2  LYS   9           HZ2      LYS   9  -4.477   7.142   5.657
   73    HZ3  LYS   9           HZ3      LYS   9  -3.707   8.244   4.631
   74    H    LEU  10           HN       LEU  10   3.305   6.579   5.078
   75    HA   LEU  10           HA       LEU  10   3.945   3.710   4.953
   76    HB2  LEU  10           HB2      LEU  10   4.392   5.834   2.993
   77    HB3  LEU  10           HB1      LEU  10   5.854   4.957   3.397
   78    HG   LEU  10           HG       LEU  10   3.347   3.525   2.555
   79   HD11  LEU  10          HD11      LEU  10   3.877   5.095   0.783
   80   HD12  LEU  10          HD12      LEU  10   4.295   3.454   0.289
   81   HD13  LEU  10          HD13      LEU  10   5.561   4.573   0.797
   82   HD21  LEU  10          HD21      LEU  10   4.933   2.089   3.566
   83   HD22  LEU  10          HD22      LEU  10   6.271   2.842   2.700
   84   HD23  LEU  10          HD23      LEU  10   5.098   1.860   1.825
   85    H    ASP  11           HN       ASP  11   5.811   3.069   5.936
   86    HA   ASP  11           HA       ASP  11   7.047   4.920   7.794
   87    HB2  ASP  11           HB2      ASP  11   7.296   1.956   7.274
   88    HB3  ASP  11           HB1      ASP  11   8.481   2.777   8.276
   89    H    ASP  12           HN       ASP  12   9.094   5.828   7.517
   90    HA   ASP  12           HA       ASP  12  10.127   6.270   5.013
   91    HB2  ASP  12           HB2      ASP  12  11.274   6.509   7.747
   92    HB3  ASP  12           HB1      ASP  12  12.398   6.586   6.398
   93    HA   PRO  13           HA       PRO  13  13.523   2.836   5.495
   94    HB2  PRO  13           HB2      PRO  13  13.002   0.871   7.335
   95    HB3  PRO  13           HB1      PRO  13  14.025   2.275   7.654
   96    HG2  PRO  13           HG2      PRO  13  11.153   1.823   8.365
   97    HG3  PRO  13           HG1      PRO  13  12.450   2.540   9.340
   98    HD2  PRO  13           HD2      PRO  13  10.616   4.059   8.100
   99    HD3  PRO  13           HD1      PRO  13  12.307   4.581   8.257
  100    H    THR  14           HN       THR  14  10.170   1.988   6.164
  101    HA   THR  14           HA       THR  14  10.254  -0.470   4.746
  102    HB   THR  14           HB       THR  14   8.433   0.739   6.453
  103    HG1  THR  14           HG1      THR  14   8.632  -1.658   5.037
  104   HG21  THR  14          HG21      THR  14   7.144   0.343   3.753
  105   HG22  THR  14          HG22      THR  14   7.295   1.868   4.625
  106   HG23  THR  14          HG23      THR  14   6.279   0.579   5.271
  107    H    ARG  15           HN       ARG  15   9.500   2.864   3.833
  108    HA   ARG  15           HA       ARG  15   8.431   2.279   1.282
  109    HB2  ARG  15           HB2      ARG  15   8.358   4.541   2.401
  110    HB3  ARG  15           HB1      ARG  15  10.057   4.732   1.980
  111    HG2  ARG  15           HG2      ARG  15   9.486   4.489  -0.392
  112    HG3  ARG  15           HG1      ARG  15   7.784   4.339   0.045
  113    HD2  ARG  15           HD2      ARG  15   7.943   6.591   1.110
  114    HD3  ARG  15           HD1      ARG  15   9.570   6.729   0.446
  115    HE   ARG  15           HE       ARG  15   7.098   7.057  -0.956
  116   HH11  ARG  15          HH21      ARG  15  10.434   6.078  -1.335
  117   HH12  ARG  15          HH22      ARG  15  10.526   6.559  -2.998
  118   HH21  ARG  15          HH11      ARG  15   7.200   7.653  -3.164
  119   HH22  ARG  15          HH12      ARG  15   8.676   7.447  -4.043
  120    H    GLU  16           HN       GLU  16  11.691   2.770   2.484
  121    HA   GLU  16           HA       GLU  16  13.053   2.621   0.022
  122    HB2  GLU  16           HB2      GLU  16  13.899   1.927   2.835
  123    HB3  GLU  16           HB1      GLU  16  15.008   1.927   1.468
  124    HG2  GLU  16           HG2      GLU  16  14.532   4.296   1.089
  125    HG3  GLU  16           HG1      GLU  16  13.426   4.287   2.459
  126    H    ARG  17           HN       ARG  17  11.993   0.203   2.332
  127    HA   ARG  17           HA       ARG  17  13.117  -2.080   1.144
  128    HB2  ARG  17           HB2      ARG  17  11.908  -1.826   3.427
  129    HB3  ARG  17           HB1      ARG  17  10.431  -2.082   2.515
  130    HG2  ARG  17           HG2      ARG  17  12.730  -4.022   2.483
  131    HG3  ARG  17           HG1      ARG  17  11.404  -4.111   3.642
  132    HD2  ARG  17           HD2      ARG  17   9.913  -4.030   1.497
  133    HD3  ARG  17           HD1      ARG  17  11.382  -4.566   0.689
  134    HE   ARG  17           HE       ARG  17  11.033  -6.252   2.847
  135   HH11  ARG  17          HH21      ARG  17   9.272  -5.419  -0.065
  136   HH12  ARG  17          HH22      ARG  17   8.488  -6.958  -0.185
  137   HH21  ARG  17          HH11      ARG  17   9.997  -8.282   2.699
  138   HH22  ARG  17          HH12      ARG  17   8.899  -8.602   1.403
  139    H    LEU  18           HN       LEU  18  10.163  -0.269   0.525
  140    HA   LEU  18           HA       LEU  18   8.976  -2.053  -1.281
  141    HB2  LEU  18           HB2      LEU  18   8.710   0.831  -0.691
  142    HB3  LEU  18           HB1      LEU  18   8.229   0.352  -2.306
  143    HG   LEU  18           HG       LEU  18   6.705  -1.358  -1.225
  144   HD11  LEU  18          HD11      LEU  18   6.078  -0.997   1.089
  145   HD12  LEU  18          HD12      LEU  18   7.298   0.269   1.238
  146   HD13  LEU  18          HD13      LEU  18   7.790  -1.402   0.966
  147   HD21  LEU  18          HD21      LEU  18   6.290   1.593  -0.811
  148   HD22  LEU  18          HD22      LEU  18   5.024   0.391  -0.566
  149   HD23  LEU  18          HD23      LEU  18   5.746   0.598  -2.162
  150    H    LYS  19           HN       LYS  19  11.443   0.469  -1.733
  151    HA   LYS  19           HA       LYS  19  11.519   0.329  -4.533
  152    HB2  LYS  19           HB2      LYS  19  12.715   2.061  -3.207
  153    HB3  LYS  19           HB1      LYS  19  13.878   0.833  -2.720
  154    HG2  LYS  19           HG2      LYS  19  14.422   0.486  -5.126
  155    HG3  LYS  19           HG1      LYS  19  13.377   1.855  -5.508
  156    HD2  LYS  19           HD2      LYS  19  15.795   1.956  -3.706
  157    HD3  LYS  19           HD1      LYS  19  15.757   2.486  -5.388
  158    HE2  LYS  19           HE2      LYS  19  14.123   3.634  -3.125
  159    HE3  LYS  19           HE1      LYS  19  15.542   4.376  -3.859
  160    HZ1  LYS  19           HZ1      LYS  19  12.922   3.872  -5.153
  161    HZ2  LYS  19           HZ2      LYS  19  14.299   4.386  -5.989
  162    HZ3  LYS  19           HZ3      LYS  19  13.618   5.373  -4.798
  163    H    ALA  20           HN       ALA  20  13.115  -1.571  -2.079
  164    HA   ALA  20           HA       ALA  20  14.678  -3.198  -3.760
  165    HB1  ALA  20           HB1      ALA  20  13.452  -4.012  -1.127
  166    HB2  ALA  20           HB2      ALA  20  14.927  -3.060  -1.286
  167    HB3  ALA  20           HB3      ALA  20  14.874  -4.712  -1.902
  168    H    ALA  21           HN       ALA  21  11.343  -3.495  -2.614
  169    HA   ALA  21           HA       ALA  21  10.828  -6.021  -3.805
  170    HB1  ALA  21           HB1      ALA  21   9.019  -3.815  -2.854
  171    HB2  ALA  21           HB2      ALA  21   9.334  -5.378  -2.102
  172    HB3  ALA  21           HB3      ALA  21   8.397  -5.291  -3.592
  173    H    ALA  22           HN       ALA  22  10.541  -2.686  -4.891
  174    HA   ALA  22           HA       ALA  22   9.290  -3.136  -7.379
  175    HB1  ALA  22           HB1      ALA  22  10.044  -0.957  -7.998
  176    HB2  ALA  22           HB2      ALA  22  11.320  -0.996  -6.782
  177    HB3  ALA  22           HB3      ALA  22   9.631  -0.902  -6.284
  178    H    GLN  23           HN       GLN  23  12.610  -3.168  -6.372
  179    HA   GLN  23           HA       GLN  23  13.788  -3.633  -8.888
  180    HB2  GLN  23           HB2      GLN  23  14.680  -4.373  -6.091
  181    HB3  GLN  23           HB1      GLN  23  15.693  -4.552  -7.520
  182    HG2  GLN  23           HG2      GLN  23  14.479  -1.932  -6.701
  183    HG3  GLN  23           HG1      GLN  23  16.060  -2.472  -6.139
  184   HE21  GLN  23          HE21      GLN  23  14.883  -0.353  -8.092
  185   HE22  GLN  23          HE22      GLN  23  15.955  -0.453  -9.441
  186    H    SER  24           HN       SER  24  12.503  -5.727  -6.388
  187    HA   SER  24           HA       SER  24  13.140  -8.202  -7.608
  188    HB2  SER  24           HB2      SER  24  12.622  -7.955  -5.199
  189    HB3  SER  24           HB1      SER  24  10.957  -7.547  -5.609
  190    HG   SER  24           HG       SER  24  11.401  -9.779  -6.848
  191    H    ILE  25           HN       ILE  25  10.641  -5.873  -8.097
  192    HA   ILE  25           HA       ILE  25   9.015  -7.746  -9.648
  193    HB   ILE  25           HB       ILE  25   8.245  -5.841  -7.871
  194   HG12  ILE  25          HG12      ILE  25   6.533  -6.483 -10.264
  195   HG13  ILE  25          HG11      ILE  25   6.914  -7.683  -9.032
  196   HG21  ILE  25          HG21      ILE  25   9.020  -4.005  -9.297
  197   HG22  ILE  25          HG22      ILE  25   7.279  -3.945  -9.019
  198   HG23  ILE  25          HG23      ILE  25   7.907  -4.532 -10.559
  199   HD11  ILE  25          HD11      ILE  25   5.553  -5.052  -8.504
  200   HD12  ILE  25          HD12      ILE  25   5.841  -6.346  -7.341
  201   HD13  ILE  25          HD13      ILE  25   4.732  -6.603  -8.688
  202    H    ASP  26           HN       ASP  26  11.568  -5.830 -10.006
  203    HA   ASP  26           HA       ASP  26  12.741  -4.927 -11.676
  204    HB2  ASP  26           HB2      ASP  26  12.101  -7.220 -12.664
  205    HB3  ASP  26           HB1      ASP  26  10.964  -6.319 -13.661
  206    H    ARG  27           HN       ARG  27  10.678  -3.352 -10.648
  207    HA   ARG  27           HA       ARG  27  10.296  -1.660 -13.006
  208    HB2  ARG  27           HB2      ARG  27   8.040  -2.549 -11.212
  209    HB3  ARG  27           HB1      ARG  27   7.935  -1.140 -12.261
  210    HG2  ARG  27           HG2      ARG  27   8.360  -2.555 -14.207
  211    HG3  ARG  27           HG1      ARG  27   8.452  -3.969 -13.157
  212    HD2  ARG  27           HD2      ARG  27   6.048  -2.192 -13.547
  213    HD3  ARG  27           HD1      ARG  27   6.276  -3.799 -14.236
  214    HE   ARG  27           HE       ARG  27   6.481  -3.773 -11.380
  215   HH11  ARG  27          HH21      ARG  27   4.280  -3.926 -14.081
  216   HH12  ARG  27          HH22      ARG  27   3.012  -4.695 -13.185
  217   HH21  ARG  27          HH11      ARG  27   4.812  -4.796 -10.175
  218   HH22  ARG  27          HH12      ARG  27   3.321  -5.200 -10.960
  219    H    THR  28           HN       THR  28   9.588   0.542 -12.399
  220    HA   THR  28           HA       THR  28  11.278   1.517 -10.333
  221    HB   THR  28           HB       THR  28  11.139   3.144 -11.926
  222    HG1  THR  28           HG1      THR  28   9.524   4.751 -11.313
  223   HG21  THR  28          HG21      THR  28   9.063   3.690 -13.192
  224   HG22  THR  28          HG22      THR  28   8.268   2.354 -12.363
  225   HG23  THR  28          HG23      THR  28   9.640   2.041 -13.427
  226    HA   PRO  29           HA       PRO  29   8.778   1.516  -6.692
  227    HB2  PRO  29           HB2      PRO  29   8.970   4.234  -5.994
  228    HB3  PRO  29           HB1      PRO  29  10.033   2.932  -5.454
  229    HG2  PRO  29           HG2      PRO  29  10.422   4.919  -7.631
  230    HG3  PRO  29           HG1      PRO  29  11.619   4.173  -6.558
  231    HD2  PRO  29           HD2      PRO  29  11.373   3.423  -9.123
  232    HD3  PRO  29           HD1      PRO  29  11.757   2.246  -7.848
  233    H    HIS  30           HN       HIS  30   8.173   4.023  -9.113
  234    HA   HIS  30           HA       HIS  30   5.682   4.911  -8.128
  235    HB2  HIS  30           HB2      HIS  30   6.894   6.103  -9.902
  236    HB3  HIS  30           HB1      HIS  30   6.660   4.745 -10.994
  237    HD1  HIS  30           HD1      HIS  30   4.872   7.662  -9.481
  238    HD2  HIS  30           HD2      HIS  30   4.146   4.618 -12.213
  239    HE1  HIS  30           HE1      HIS  30   2.687   8.246 -10.574
  240    HE2  HIS  30           HE2      HIS  30   2.436   6.553 -12.416
  241    H    TRP  31           HN       TRP  31   6.608   2.294 -10.281
  242    HA   TRP  31           HA       TRP  31   4.004   1.393 -10.884
  243    HB2  TRP  31           HB2      TRP  31   6.743   0.409 -11.262
  244    HB3  TRP  31           HB1      TRP  31   5.535  -0.858 -11.084
  245    HD1  TRP  31           HD1      TRP  31   7.134   1.107 -13.646
  246    HE1  TRP  31           HE1      TRP  31   5.772   1.097 -15.840
  247    HE3  TRP  31           HE3      TRP  31   2.725  -0.708 -11.837
  248    HZ2  TRP  31           HZ2      TRP  31   3.159   0.407 -16.675
  249    HZ3  TRP  31           HZ3      TRP  31   0.842  -1.017 -13.388
  250    HH2  TRP  31           HH2      TRP  31   1.055  -0.470 -15.758
  251    H    LEU  32           HN       LEU  32   6.437   0.310  -8.614
  252    HA   LEU  32           HA       LEU  32   4.854  -1.712  -7.497
  253    HB2  LEU  32           HB2      LEU  32   7.246  -1.757  -7.141
  254    HB3  LEU  32           HB1      LEU  32   7.127  -0.302  -6.155
  255    HG   LEU  32           HG       LEU  32   5.537  -1.572  -4.656
  256   HD11  LEU  32          HD11      LEU  32   5.831  -4.073  -4.739
  257   HD12  LEU  32          HD12      LEU  32   6.487  -3.851  -6.361
  258   HD13  LEU  32          HD13      LEU  32   4.831  -3.362  -6.005
  259   HD21  LEU  32          HD21      LEU  32   7.232  -2.556  -3.376
  260   HD22  LEU  32          HD22      LEU  32   7.955  -1.169  -4.192
  261   HD23  LEU  32          HD23      LEU  32   8.257  -2.802  -4.788
  262    H    ILE  33           HN       ILE  33   5.127   1.674  -6.583
  263    HA   ILE  33           HA       ILE  33   3.795   1.398  -4.118
  264    HB   ILE  33           HB       ILE  33   3.849   3.714  -6.062
  265   HG12  ILE  33          HG12      ILE  33   5.124   3.433  -3.342
  266   HG13  ILE  33          HG11      ILE  33   5.949   3.005  -4.838
  267   HG21  ILE  33          HG21      ILE  33   1.800   3.890  -4.807
  268   HG22  ILE  33          HG22      ILE  33   2.953   5.096  -4.233
  269   HG23  ILE  33          HG23      ILE  33   2.669   3.628  -3.296
  270   HD11  ILE  33          HD11      ILE  33   5.729   5.314  -5.609
  271   HD12  ILE  33          HD12      ILE  33   6.593   5.213  -4.074
  272   HD13  ILE  33          HD13      ILE  33   4.908   5.730  -4.105
  273    H    LYS  34           HN       LYS  34   2.568   2.106  -7.352
  274    HA   LYS  34           HA       LYS  34  -0.181   2.064  -6.803
  275    HB2  LYS  34           HB2      LYS  34   1.339   1.271  -9.304
  276    HB3  LYS  34           HB1      LYS  34  -0.402   1.494  -9.238
  277    HG2  LYS  34           HG2      LYS  34  -0.233   3.783  -8.999
  278    HG3  LYS  34           HG1      LYS  34   1.425   3.701  -8.408
  279    HD2  LYS  34           HD2      LYS  34   1.388   4.598 -10.659
  280    HD3  LYS  34           HD1      LYS  34   2.176   3.023 -10.650
  281    HE2  LYS  34           HE2      LYS  34  -0.742   3.202 -11.254
  282    HE3  LYS  34           HE1      LYS  34   0.428   3.635 -12.498
  283    HZ1  LYS  34           HZ1      LYS  34   0.038   1.022 -11.182
  284    HZ2  LYS  34           HZ2      LYS  34   1.474   1.394 -11.988
  285    HZ3  LYS  34           HZ3      LYS  34   0.011   1.389 -12.834
  286    H    GLN  35           HN       GLN  35   2.022  -0.487  -7.855
  287    HA   GLN  35           HA       GLN  35   0.048  -2.523  -7.932
  288    HB2  GLN  35           HB2      GLN  35   3.058  -2.630  -7.901
  289    HB3  GLN  35           HB1      GLN  35   2.040  -4.054  -8.065
  290    HG2  GLN  35           HG2      GLN  35   1.682  -1.749  -9.924
  291    HG3  GLN  35           HG1      GLN  35   3.007  -2.881 -10.171
  292   HE21  GLN  35          HE21      GLN  35   0.416  -4.443  -8.740
  293   HE22  GLN  35          HE22      GLN  35  -0.278  -5.135 -10.162
  294    H    ALA  36           HN       ALA  36   2.658  -1.868  -5.596
  295    HA   ALA  36           HA       ALA  36   2.344  -3.967  -3.895
  296    HB1  ALA  36           HB1      ALA  36   3.015  -1.113  -3.250
  297    HB2  ALA  36           HB2      ALA  36   4.117  -2.471  -3.482
  298    HB3  ALA  36           HB3      ALA  36   3.080  -2.409  -2.057
  299    H    ILE  37           HN       ILE  37   0.339  -1.017  -3.935
  300    HA   ILE  37           HA       ILE  37  -1.100  -1.992  -1.641
  301    HB   ILE  37           HB       ILE  37  -0.748   0.429  -2.083
  302   HG12  ILE  37          HG12      ILE  37  -3.120   1.087  -1.483
  303   HG13  ILE  37          HG11      ILE  37  -3.550  -0.607  -1.702
  304   HG21  ILE  37          HG21      ILE  37  -2.894   0.122  -4.168
  305   HG22  ILE  37          HG22      ILE  37  -1.186   0.414  -4.498
  306   HG23  ILE  37          HG23      ILE  37  -2.139   1.626  -3.640
  307   HD11  ILE  37          HD11      ILE  37  -1.258  -0.109   0.065
  308   HD12  ILE  37          HD12      ILE  37  -2.611  -1.228   0.238
  309   HD13  ILE  37          HD13      ILE  37  -2.816   0.476   0.645
  310    H    PHE  38           HN       PHE  38  -1.978  -1.659  -5.116
  311    HA   PHE  38           HA       PHE  38  -4.524  -2.938  -4.677
  312    HB2  PHE  38           HB2      PHE  38  -4.965  -1.935  -6.636
  313    HB3  PHE  38           HB1      PHE  38  -3.282  -1.464  -6.788
  314    HD1  PHE  38           HD2      PHE  38  -5.514  -4.399  -7.409
  315    HD2  PHE  38           HD1      PHE  38  -2.105  -2.158  -8.620
  316    HE1  PHE  38           HE2      PHE  38  -5.295  -5.818  -9.406
  317    HE2  PHE  38           HE1      PHE  38  -1.886  -3.567 -10.622
  318    HZ   PHE  38           HZ       PHE  38  -3.479  -5.402 -11.016
  319    H    ASN  39           HN       ASN  39  -1.378  -3.922  -5.826
  320    HA   ASN  39           HA       ASN  39  -2.123  -6.568  -6.504
  321    HB2  ASN  39           HB2      ASN  39   0.004  -5.438  -7.294
  322    HB3  ASN  39           HB1      ASN  39   0.628  -5.650  -5.664
  323   HD21  ASN  39          HD21      ASN  39   2.325  -6.905  -6.468
  324   HD22  ASN  39          HD22      ASN  39   2.087  -8.536  -6.981
  325    H    TYR  40           HN       TYR  40  -1.277  -4.878  -3.530
  326    HA   TYR  40           HA       TYR  40  -0.786  -7.165  -1.964
  327    HB2  TYR  40           HB2      TYR  40  -0.361  -5.100  -0.860
  328    HB3  TYR  40           HB1      TYR  40  -1.956  -4.470  -1.252
  329    HD1  TYR  40           HD2      TYR  40  -0.707  -7.571   0.447
  330    HD2  TYR  40           HD1      TYR  40  -3.247  -4.165   0.646
  331    HE1  TYR  40           HE2      TYR  40  -1.527  -8.321   2.637
  332    HE2  TYR  40           HE1      TYR  40  -4.079  -4.913   2.835
  333    HH   TYR  40           HH       TYR  40  -4.206  -6.706   4.229
  334    H    LEU  41           HN       LEU  41  -3.673  -5.471  -2.966
  335    HA   LEU  41           HA       LEU  41  -5.548  -7.022  -1.562
  336    HB2  LEU  41           HB2      LEU  41  -5.941  -5.628  -4.205
  337    HB3  LEU  41           HB1      LEU  41  -7.209  -6.163  -3.119
  338    HG   LEU  41           HG       LEU  41  -5.242  -3.927  -2.666
  339   HD11  LEU  41          HD11      LEU  41  -8.233  -3.824  -2.543
  340   HD12  LEU  41          HD12      LEU  41  -7.370  -3.651  -4.068
  341   HD13  LEU  41          HD13      LEU  41  -7.087  -2.503  -2.760
  342   HD21  LEU  41          HD21      LEU  41  -7.169  -5.219  -0.747
  343   HD22  LEU  41          HD22      LEU  41  -6.435  -3.636  -0.489
  344   HD23  LEU  41          HD23      LEU  41  -5.419  -5.075  -0.579
  345    H    GLU  42           HN       GLU  42  -4.172  -7.312  -4.778
  346    HA   GLU  42           HA       GLU  42  -5.617  -9.634  -5.546
  347    HB2  GLU  42           HB2      GLU  42  -4.573  -8.049  -7.142
  348    HB3  GLU  42           HB1      GLU  42  -2.986  -8.582  -6.606
  349    HG2  GLU  42           HG2      GLU  42  -3.478 -10.842  -7.416
  350    HG3  GLU  42           HG1      GLU  42  -5.062 -10.288  -7.959
  351    H    LYS  43           HN       LYS  43  -2.474  -9.080  -4.073
  352    HA   LYS  43           HA       LYS  43  -1.460 -11.703  -4.219
  353    HB2  LYS  43           HB2      LYS  43  -0.207  -9.547  -3.715
  354    HB3  LYS  43           HB1      LYS  43  -0.836  -9.661  -2.081
  355    HG2  LYS  43           HG2      LYS  43   1.342 -10.529  -2.005
  356    HG3  LYS  43           HG1      LYS  43   0.273 -11.934  -1.959
  357    HD2  LYS  43           HD2      LYS  43   0.709 -12.470  -4.208
  358    HD3  LYS  43           HD1      LYS  43   1.414 -10.885  -4.531
  359    HE2  LYS  43           HE2      LYS  43   2.626 -12.839  -2.593
  360    HE3  LYS  43           HE1      LYS  43   3.034 -12.821  -4.309
  361    HZ1  LYS  43           HZ1      LYS  43   3.406 -10.588  -2.387
  362    HZ2  LYS  43           HZ2      LYS  43   3.707 -10.487  -4.048
  363    HZ3  LYS  43           HZ3      LYS  43   4.628 -11.530  -3.085
  364    H    LEU  44           HN       LEU  44  -3.263  -9.986  -1.682
  365    HA   LEU  44           HA       LEU  44  -3.257 -12.268   0.063
  366    HB2  LEU  44           HB2      LEU  44  -4.418 -10.978   1.608
  367    HB3  LEU  44           HB1      LEU  44  -3.429  -9.807   0.763
  368    HG   LEU  44           HG       LEU  44  -5.732  -9.646  -0.676
  369   HD11  LEU  44          HD11      LEU  44  -7.584  -9.542   0.937
  370   HD12  LEU  44          HD12      LEU  44  -6.529 -10.213   2.180
  371   HD13  LEU  44          HD13      LEU  44  -6.948 -11.177   0.763
  372   HD21  LEU  44          HD21      LEU  44  -6.155  -7.595   0.569
  373   HD22  LEU  44          HD22      LEU  44  -4.433  -7.794   0.246
  374   HD23  LEU  44          HD23      LEU  44  -5.074  -8.142   1.851
  375    H    GLU  45           HN       GLU  45  -5.108 -11.217  -2.570
  376    HA   GLU  45           HA       GLU  45  -6.917 -11.981  -3.645
  377    HB2  GLU  45           HB2      GLU  45  -6.184 -14.455  -2.078
  378    HB3  GLU  45           HB1      GLU  45  -7.458 -14.434  -3.297
  379    HG2  GLU  45           HG2      GLU  45  -5.802 -13.652  -4.961
  380    HG3  GLU  45           HG1      GLU  45  -4.552 -13.774  -3.729
  381    H1   MET  46           HT1      MET  46   4.620  -0.181  11.291
  382    H2   MET  46           HT2      MET  46   5.351   0.901  12.363
  383    H3   MET  46           HT3      MET  46   5.056   1.368  10.756
  384    HA   MET  46           HA       MET  46   2.759   1.441  11.065
  385    HB2  MET  46           HB2      MET  46   1.717   0.819  13.264
  386    HB3  MET  46           HB1      MET  46   2.344  -0.531  12.334
  387    HG2  MET  46           HG2      MET  46   4.250  -0.716  13.759
  388    HG3  MET  46           HG1      MET  46   3.828   0.776  14.599
  389    HE1  MET  46           HE1      MET  46   1.048  -2.148  13.717
  390    HE2  MET  46           HE2      MET  46   1.680  -3.267  14.925
  391    HE3  MET  46           HE3      MET  46   2.714  -2.711  13.609
  392    H    ALA  47           HN       ALA  47   5.359   2.874  12.082
  393    HA   ALA  47           HA       ALA  47   3.968   4.954  13.656
  394    HB1  ALA  47           HB1      ALA  47   6.207   5.583  14.509
  395    HB2  ALA  47           HB2      ALA  47   6.912   4.232  13.621
  396    HB3  ALA  47           HB3      ALA  47   5.784   3.926  14.942
  397    H    THR  48           HN       THR  48   3.885   4.459  10.952
  398    HA   THR  48           HA       THR  48   5.685   5.903   9.361
  399    HB   THR  48           HB       THR  48   4.669   4.634   7.839
  400    HG1  THR  48           HG1      THR  48   3.479   6.619   7.466
  401   HG21  THR  48          HG21      THR  48   2.448   4.221   9.849
  402   HG22  THR  48          HG22      THR  48   3.846   3.175   9.602
  403   HG23  THR  48          HG23      THR  48   2.625   3.329   8.338
  404    H    THR  49           HN       THR  49   5.151   7.624   7.934
  405    HA   THR  49           HA       THR  49   3.402   9.654   9.159
  406    HB   THR  49           HB       THR  49   4.827  11.280   7.783
  407    HG1  THR  49           HG1      THR  49   5.848   9.146   6.785
  408   HG21  THR  49          HG21      THR  49   5.074  11.190  10.178
  409   HG22  THR  49          HG22      THR  49   6.679  11.281   9.452
  410   HG23  THR  49          HG23      THR  49   6.074   9.742  10.063
  411    H    THR  50           HN       THR  50   2.514  11.219   7.397
  412    HA   THR  50           HA       THR  50   1.177   9.573   5.443
  413    HB   THR  50           HB       THR  50   0.994  12.578   5.688
  414    HG1  THR  50           HG1      THR  50   0.464  10.905   7.596
  415   HG21  THR  50          HG21      THR  50  -1.227  12.266   4.746
  416   HG22  THR  50          HG22      THR  50  -1.000  10.517   4.732
  417   HG23  THR  50          HG23      THR  50  -0.020  11.542   3.683
  418    H    LEU  51           HN       LEU  51   2.142   9.043   3.609
  419    HA   LEU  51           HA       LEU  51   3.851  11.028   2.252
  420    HB2  LEU  51           HB2      LEU  51   4.067   8.026   1.999
  421    HB3  LEU  51           HB1      LEU  51   5.163   9.225   1.343
  422    HG   LEU  51           HG       LEU  51   4.796   8.528   4.257
  423   HD11  LEU  51          HD11      LEU  51   7.388   8.370   2.819
  424   HD12  LEU  51          HD12      LEU  51   6.195   7.107   2.525
  425   HD13  LEU  51          HD13      LEU  51   6.776   7.407   4.162
  426   HD21  LEU  51          HD21      LEU  51   5.184  10.877   4.149
  427   HD22  LEU  51          HD22      LEU  51   6.458  10.669   2.948
  428   HD23  LEU  51          HD23      LEU  51   6.704  10.105   4.601
  429    H    GLY  52           HN       GLY  52   3.804  10.952  -0.094
  430    HA2  GLY  52           HA2      GLY  52   1.150  10.645  -1.120
  431    HA3  GLY  52           HA1      GLY  52   2.571  11.124  -2.035
  432    H    VAL  53           HN       VAL  53   0.257   8.807  -1.758
  433    HA   VAL  53           HA       VAL  53   1.946   6.794  -3.100
  434    HB   VAL  53           HB       VAL  53  -0.111   6.405  -0.946
  435   HG11  VAL  53          HG11      VAL  53   0.843   4.320  -2.887
  436   HG12  VAL  53          HG12      VAL  53  -0.817   4.822  -2.572
  437   HG13  VAL  53          HG13      VAL  53   0.089   3.946  -1.338
  438   HG21  VAL  53          HG21      VAL  53   1.646   5.031   0.069
  439   HG22  VAL  53          HG22      VAL  53   2.187   6.683  -0.231
  440   HG23  VAL  53          HG23      VAL  53   2.696   5.379  -1.305
  441    H    LYS  54           HN       LYS  54   0.750   5.419  -4.595
  442    HA   LYS  54           HA       LYS  54  -1.445   6.915  -5.805
  443    HB2  LYS  54           HB2      LYS  54   0.372   4.774  -6.916
  444    HB3  LYS  54           HB1      LYS  54  -0.960   5.498  -7.807
  445    HG2  LYS  54           HG2      LYS  54   0.814   6.732  -8.571
  446    HG3  LYS  54           HG1      LYS  54   0.257   7.738  -7.232
  447    HD2  LYS  54           HD2      LYS  54   1.948   6.349  -5.829
  448    HD3  LYS  54           HD1      LYS  54   2.661   5.961  -7.395
  449    HE2  LYS  54           HE2      LYS  54   3.072   8.263  -7.860
  450    HE3  LYS  54           HE1      LYS  54   2.129   8.772  -6.459
  451    HZ1  LYS  54           HZ1      LYS  54   4.728   8.651  -6.369
  452    HZ2  LYS  54           HZ2      LYS  54   4.433   7.021  -6.014
  453    HZ3  LYS  54           HZ3      LYS  54   3.790   8.230  -5.023
  454    H    LEU  55           HN       LEU  55  -3.383   6.275  -5.236
  455    HA   LEU  55           HA       LEU  55  -3.933   3.394  -4.993
  456    HB2  LEU  55           HB2      LEU  55  -4.437   5.573  -3.111
  457    HB3  LEU  55           HB1      LEU  55  -5.873   4.641  -3.477
  458    HG   LEU  55           HG       LEU  55  -3.323   3.316  -2.587
  459   HD11  LEU  55          HD11      LEU  55  -3.906   4.934  -0.874
  460   HD12  LEU  55          HD12      LEU  55  -4.272   3.300  -0.320
  461   HD13  LEU  55          HD13      LEU  55  -5.572   4.357  -0.870
  462   HD21  LEU  55          HD21      LEU  55  -4.863   1.794  -3.543
  463   HD22  LEU  55          HD22      LEU  55  -6.226   2.539  -2.709
  464   HD23  LEU  55          HD23      LEU  55  -5.026   1.627  -1.795
  465    H    ASP  56           HN       ASP  56  -5.764   2.659  -5.968
  466    HA   ASP  56           HA       ASP  56  -7.072   4.407  -7.871
  467    HB2  ASP  56           HB2      ASP  56  -7.280   1.458  -7.232
  468    HB3  ASP  56           HB1      ASP  56  -8.437   2.229  -8.303
  469    H    ASP  57           HN       ASP  57  -9.174   5.221  -7.649
  470    HA   ASP  57           HA       ASP  57 -10.193   5.747  -5.142
  471    HB2  ASP  57           HB2      ASP  57 -11.355   5.860  -7.878
  472    HB3  ASP  57           HB1      ASP  57 -12.479   5.949  -6.528
  473    HA   PRO  58           HA       PRO  58 -13.478   2.186  -5.496
  474    HB2  PRO  58           HB2      PRO  58 -12.886   0.172  -7.262
  475    HB3  PRO  58           HB1      PRO  58 -13.959   1.526  -7.632
  476    HG2  PRO  58           HG2      PRO  58 -11.071   1.152  -8.326
  477    HG3  PRO  58           HG1      PRO  58 -12.392   1.784  -9.328
  478    HD2  PRO  58           HD2      PRO  58 -10.619   3.416  -8.150
  479    HD3  PRO  58           HD1      PRO  58 -12.328   3.868  -8.320
  480    H    THR  59           HN       THR  59 -10.094   1.428  -6.130
  481    HA   THR  59           HA       THR  59 -10.098  -0.978  -4.619
  482    HB   THR  59           HB       THR  59  -8.322   0.204  -6.379
  483    HG1  THR  59           HG1      THR  59  -8.641  -2.135  -5.049
  484   HG21  THR  59          HG21      THR  59  -7.012   0.021  -3.666
  485   HG22  THR  59          HG22      THR  59  -7.238   1.488  -4.619
  486   HG23  THR  59          HG23      THR  59  -6.163   0.215  -5.200
  487    H    ARG  60           HN       ARG  60  -9.453   2.413  -3.841
  488    HA   ARG  60           HA       ARG  60  -8.375   1.974  -1.268
  489    HB2  ARG  60           HB2      ARG  60  -8.380   4.183  -2.492
  490    HB3  ARG  60           HB1      ARG  60 -10.085   4.334  -2.077
  491    HG2  ARG  60           HG2      ARG  60  -9.504   4.226   0.303
  492    HG3  ARG  60           HG1      ARG  60  -7.798   4.119  -0.130
  493    HD2  ARG  60           HD2      ARG  60  -8.030   6.314  -1.290
  494    HD3  ARG  60           HD1      ARG  60  -9.670   6.422  -0.650
  495    HE   ARG  60           HE       ARG  60  -7.247   6.956   0.748
  496   HH11  ARG  60          HH21      ARG  60 -10.493   5.728   1.166
  497   HH12  ARG  60          HH22      ARG  60 -10.590   6.176   2.836
  498   HH21  ARG  60          HH11      ARG  60  -7.361   7.534   2.961
  499   HH22  ARG  60          HH12      ARG  60  -8.801   7.207   3.862
  500    H    GLU  61           HN       GLU  61 -11.662   2.328  -2.472
  501    HA   GLU  61           HA       GLU  61 -13.014   2.209  -0.002
  502    HB2  GLU  61           HB2      GLU  61 -13.860   1.319  -2.770
  503    HB3  GLU  61           HB1      GLU  61 -14.953   1.461  -1.396
  504    HG2  GLU  61           HG2      GLU  61 -14.473   3.843  -1.244
  505    HG3  GLU  61           HG1      GLU  61 -13.355   3.711  -2.600
  506    H    ARG  62           HN       ARG  62 -11.882  -0.258  -2.242
  507    HA   ARG  62           HA       ARG  62 -12.923  -2.529  -0.974
  508    HB2  ARG  62           HB2      ARG  62 -11.714  -2.324  -3.261
  509    HB3  ARG  62           HB1      ARG  62 -10.233  -2.495  -2.334
  510    HG2  ARG  62           HG2      ARG  62 -12.463  -4.508  -2.217
  511    HG3  ARG  62           HG1      ARG  62 -11.149  -4.596  -3.389
  512    HD2  ARG  62           HD2      ARG  62  -9.645  -4.377  -1.250
  513    HD3  ARG  62           HD1      ARG  62 -11.087  -4.965  -0.427
  514    HE   ARG  62           HE       ARG  62 -10.632  -6.659  -2.577
  515   HH11  ARG  62          HH21      ARG  62  -9.016  -5.755   0.396
  516   HH12  ARG  62          HH22      ARG  62  -8.200  -7.274   0.566
  517   HH21  ARG  62          HH11      ARG  62  -9.555  -8.657  -2.368
  518   HH22  ARG  62          HH12      ARG  62  -8.509  -8.949  -1.021
  519    H    LEU  63           HN       LEU  63 -10.013  -0.622  -0.428
  520    HA   LEU  63           HA       LEU  63  -8.781  -2.288   1.455
  521    HB2  LEU  63           HB2      LEU  63  -8.611   0.575   0.748
  522    HB3  LEU  63           HB1      LEU  63  -8.118   0.182   2.383
  523    HG   LEU  63           HG       LEU  63  -6.542  -1.526   1.373
  524   HD11  LEU  63          HD11      LEU  63  -5.918  -1.234  -0.952
  525   HD12  LEU  63          HD12      LEU  63  -7.176  -0.015  -1.153
  526   HD13  LEU  63          HD13      LEU  63  -7.616  -1.689  -0.815
  527   HD21  LEU  63          HD21      LEU  63  -6.209   1.418   0.851
  528   HD22  LEU  63          HD22      LEU  63  -4.909   0.244   0.652
  529   HD23  LEU  63          HD23      LEU  63  -5.641   0.488   2.238
  530    H    LYS  64           HN       LYS  64 -11.323   0.175   1.816
  531    HA   LYS  64           HA       LYS  64 -11.396   0.132   4.618
  532    HB2  LYS  64           HB2      LYS  64 -12.638   1.785   3.243
  533    HB3  LYS  64           HB1      LYS  64 -13.766   0.513   2.788
  534    HG2  LYS  64           HG2      LYS  64 -14.305   0.217   5.200
  535    HG3  LYS  64           HG1      LYS  64 -13.297   1.622   5.547
  536    HD2  LYS  64           HD2      LYS  64 -15.702   1.623   3.727
  537    HD3  LYS  64           HD1      LYS  64 -15.704   2.168   5.404
  538    HE2  LYS  64           HE2      LYS  64 -14.056   3.343   3.165
  539    HE3  LYS  64           HE1      LYS  64 -15.524   4.044   3.841
  540    HZ1  LYS  64           HZ1      LYS  64 -12.933   3.651   5.232
  541    HZ2  LYS  64           HZ2      LYS  64 -14.354   4.136   6.010
  542    HZ3  LYS  64           HZ3      LYS  64 -13.663   5.123   4.824
  543    H    ALA  65           HN       ALA  65 -12.925  -1.910   2.237
  544    HA   ALA  65           HA       ALA  65 -14.452  -3.503   3.988
  545    HB1  ALA  65           HB1      ALA  65 -13.207  -4.389   1.384
  546    HB2  ALA  65           HB2      ALA  65 -14.710  -3.476   1.512
  547    HB3  ALA  65           HB3      ALA  65 -14.604  -5.099   2.192
  548    H    ALA  66           HN       ALA  66 -11.110  -3.751   2.848
  549    HA   ALA  66           HA       ALA  66 -10.518  -6.212   4.133
  550    HB1  ALA  66           HB1      ALA  66  -8.777  -3.987   3.104
  551    HB2  ALA  66           HB2      ALA  66  -9.040  -5.587   2.411
  552    HB3  ALA  66           HB3      ALA  66  -8.110  -5.412   3.899
  553    H    ALA  67           HN       ALA  67 -10.333  -2.835   5.095
  554    HA   ALA  67           HA       ALA  67  -9.079  -3.158   7.602
  555    HB1  ALA  67           HB1      ALA  67  -9.870  -0.967   8.126
  556    HB2  ALA  67           HB2      ALA  67 -11.144  -1.077   6.912
  557    HB3  ALA  67           HB3      ALA  67  -9.455  -0.978   6.412
  558    H    GLN  68           HN       GLN  68 -12.391  -3.330   6.585
  559    HA   GLN  68           HA       GLN  68 -13.559  -3.696   9.129
  560    HB2  GLN  68           HB2      GLN  68 -14.450  -4.642   6.392
  561    HB3  GLN  68           HB1      GLN  68 -15.449  -4.705   7.838
  562    HG2  GLN  68           HG2      GLN  68 -14.294  -2.164   6.730
  563    HG3  GLN  68           HG1      GLN  68 -15.890  -2.774   6.302
  564   HE21  GLN  68          HE21      GLN  68 -14.126  -0.897   8.437
  565   HE22  GLN  68          HE22      GLN  68 -15.335  -0.674   9.648
  566    H    SER  69           HN       SER  69 -12.224  -5.861   6.711
  567    HA   SER  69           HA       SER  69 -12.774  -8.305   8.034
  568    HB2  SER  69           HB2      SER  69 -12.260  -8.104   5.608
  569    HB3  SER  69           HB1      SER  69 -10.599  -7.681   6.017
  570    HG   SER  69           HG       SER  69 -10.895  -9.846   7.293
  571    H    ILE  70           HN       ILE  70 -10.322  -5.893   8.399
  572    HA   ILE  70           HA       ILE  70  -8.644  -7.658  10.014
  573    HB   ILE  70           HB       ILE  70  -7.936  -5.782   8.187
  574   HG12  ILE  70          HG12      ILE  70  -6.209  -6.278  10.601
  575   HG13  ILE  70          HG11      ILE  70  -6.551  -7.540   9.421
  576   HG21  ILE  70          HG21      ILE  70  -8.781  -3.929   9.556
  577   HG22  ILE  70          HG22      ILE  70  -7.044  -3.816   9.274
  578   HG23  ILE  70          HG23      ILE  70  -7.650  -4.376  10.833
  579   HD11  ILE  70          HD11      ILE  70  -5.276  -4.891   8.782
  580   HD12  ILE  70          HD12      ILE  70  -5.520  -6.241   7.674
  581   HD13  ILE  70          HD13      ILE  70  -4.405  -6.404   9.031
  582    H    ASP  71           HN       ASP  71 -11.257  -5.805  10.326
  583    HA   ASP  71           HA       ASP  71 -12.464  -4.922  11.985
  584    HB2  ASP  71           HB2      ASP  71 -11.699  -7.152  13.042
  585    HB3  ASP  71           HB1      ASP  71 -10.604  -6.163  13.998
  586    H    ARG  72           HN       ARG  72 -10.448  -3.307  10.880
  587    HA   ARG  72           HA       ARG  72 -10.138  -1.485  13.157
  588    HB2  ARG  72           HB2      ARG  72  -7.856  -2.380  11.398
  589    HB3  ARG  72           HB1      ARG  72  -7.789  -0.931  12.391
  590    HG2  ARG  72           HG2      ARG  72  -8.159  -2.294  14.395
  591    HG3  ARG  72           HG1      ARG  72  -8.197  -3.745  13.392
  592    HD2  ARG  72           HD2      ARG  72  -5.866  -1.858  13.705
  593    HD3  ARG  72           HD1      ARG  72  -6.020  -3.447  14.451
  594    HE   ARG  72           HE       ARG  72  -6.228  -3.509  11.587
  595   HH11  ARG  72          HH21      ARG  72  -4.039  -3.526  14.301
  596   HH12  ARG  72          HH22      ARG  72  -2.755  -4.311  13.444
  597   HH21  ARG  72          HH11      ARG  72  -4.530  -4.548  10.428
  598   HH22  ARG  72          HH12      ARG  72  -3.038  -4.898  11.236
  599    H    THR  73           HN       THR  73  -9.503   0.721  12.451
  600    HA   THR  73           HA       THR  73 -11.206   1.587  10.346
  601    HB   THR  73           HB       THR  73 -11.084   3.298  11.862
  602    HG1  THR  73           HG1      THR  73  -9.294   4.832  11.272
  603   HG21  THR  73          HG21      THR  73  -9.054   3.880  13.166
  604   HG22  THR  73          HG22      THR  73  -8.218   2.542  12.380
  605   HG23  THR  73          HG23      THR  73  -9.607   2.225  13.420
  606    HA   PRO  74           HA       PRO  74  -8.714   1.489   6.705
  607    HB2  PRO  74           HB2      PRO  74  -8.989   4.178   5.916
  608    HB3  PRO  74           HB1      PRO  74 -10.019   2.831   5.427
  609    HG2  PRO  74           HG2      PRO  74 -10.443   4.869   7.554
  610    HG3  PRO  74           HG1      PRO  74 -11.629   4.073   6.503
  611    HD2  PRO  74           HD2      PRO  74 -11.369   3.380   9.075
  612    HD3  PRO  74           HD1      PRO  74 -11.698   2.160   7.824
  613    H    HIS  75           HN       HIS  75  -8.199   4.107   9.034
  614    HA   HIS  75           HA       HIS  75  -5.728   5.028   8.033
  615    HB2  HIS  75           HB2      HIS  75  -6.970   6.263   9.764
  616    HB3  HIS  75           HB1      HIS  75  -6.695   4.958  10.911
  617    HD1  HIS  75           HD1      HIS  75  -5.016   7.871   9.287
  618    HD2  HIS  75           HD2      HIS  75  -4.134   4.931  12.087
  619    HE1  HIS  75           HE1      HIS  75  -2.824   8.552  10.308
  620    HE2  HIS  75           HE2      HIS  75  -2.452   6.899  12.167
  621    H    TRP  76           HN       TRP  76  -6.568   2.464  10.290
  622    HA   TRP  76           HA       TRP  76  -3.934   1.674  10.933
  623    HB2  TRP  76           HB2      TRP  76  -6.644   0.627  11.350
  624    HB3  TRP  76           HB1      TRP  76  -5.406  -0.615  11.219
  625    HD1  TRP  76           HD1      TRP  76  -7.068   1.367  13.717
  626    HE1  TRP  76           HE1      TRP  76  -5.708   1.474  15.916
  627    HE3  TRP  76           HE3      TRP  76  -2.584  -0.306  11.955
  628    HZ2  TRP  76           HZ2      TRP  76  -3.068   0.924  16.761
  629    HZ3  TRP  76           HZ3      TRP  76  -0.689  -0.488  13.513
  630    HH2  TRP  76           HH2      TRP  76  -0.927   0.114  15.867
  631    H    LEU  77           HN       LEU  77  -6.324   0.436   8.703
  632    HA   LEU  77           HA       LEU  77  -4.679  -1.578   7.664
  633    HB2  LEU  77           HB2      LEU  77  -7.066  -1.711   7.312
  634    HB3  LEU  77           HB1      LEU  77  -6.993  -0.288   6.275
  635    HG   LEU  77           HG       LEU  77  -5.366  -1.559   4.819
  636   HD11  LEU  77          HD11      LEU  77  -5.580  -4.062   4.992
  637   HD12  LEU  77          HD12      LEU  77  -6.242  -3.804   6.606
  638   HD13  LEU  77          HD13      LEU  77  -4.602  -3.276   6.230
  639   HD21  LEU  77          HD21      LEU  77  -7.030  -2.646   3.581
  640   HD22  LEU  77          HD22      LEU  77  -7.796  -1.253   4.345
  641   HD23  LEU  77          HD23      LEU  77  -8.044  -2.870   5.004
  642    H    ILE  78           HN       ILE  78  -5.072   1.756   6.612
  643    HA   ILE  78           HA       ILE  78  -3.720   1.437   4.167
  644    HB   ILE  78           HB       ILE  78  -3.846   3.825   6.022
  645   HG12  ILE  78          HG12      ILE  78  -5.107   3.389   3.315
  646   HG13  ILE  78          HG11      ILE  78  -5.919   2.996   4.826
  647   HG21  ILE  78          HG21      ILE  78  -1.804   4.016   4.750
  648   HG22  ILE  78          HG22      ILE  78  -2.998   5.156   4.131
  649   HG23  ILE  78          HG23      ILE  78  -2.670   3.661   3.255
  650   HD11  ILE  78          HD11      ILE  78  -5.780   5.343   5.500
  651   HD12  ILE  78          HD12      ILE  78  -6.638   5.145   3.971
  652   HD13  ILE  78          HD13      ILE  78  -4.972   5.722   3.978
  653    H    LYS  79           HN       LYS  79  -2.515   2.300   7.374
  654    HA   LYS  79           HA       LYS  79   0.235   2.324   6.819
  655    HB2  LYS  79           HB2      LYS  79  -1.255   1.579   9.354
  656    HB3  LYS  79           HB1      LYS  79   0.477   1.860   9.274
  657    HG2  LYS  79           HG2      LYS  79   0.228   4.131   8.945
  658    HG3  LYS  79           HG1      LYS  79  -1.431   3.969   8.370
  659    HD2  LYS  79           HD2      LYS  79  -1.413   4.953  10.583
  660    HD3  LYS  79           HD1      LYS  79  -2.141   3.350  10.643
  661    HE2  LYS  79           HE2      LYS  79   0.772   3.674  11.219
  662    HE3  LYS  79           HE1      LYS  79  -0.412   4.095  12.455
  663    HZ1  LYS  79           HZ1      LYS  79   0.060   1.456  11.207
  664    HZ2  LYS  79           HZ2      LYS  79  -1.354   1.800  12.063
  665    HZ3  LYS  79           HZ3      LYS  79   0.142   1.875  12.845
  666    H    GLN  80           HN       GLN  80  -1.884  -0.251   7.996
  667    HA   GLN  80           HA       GLN  80   0.132  -2.237   8.151
  668    HB2  GLN  80           HB2      GLN  80  -2.872  -2.400   8.060
  669    HB3  GLN  80           HB1      GLN  80  -1.844  -3.810   8.248
  670    HG2  GLN  80           HG2      GLN  80  -1.814  -1.458  10.117
  671    HG3  GLN  80           HG1      GLN  80  -2.810  -2.888  10.359
  672   HE21  GLN  80          HE21      GLN  80  -0.567  -4.561   9.200
  673   HE22  GLN  80          HE22      GLN  80   0.550  -4.723  10.505
  674    H    ALA  81           HN       ALA  81  -2.474  -1.737   5.769
  675    HA   ALA  81           HA       ALA  81  -2.089  -3.880   4.142
  676    HB1  ALA  81           HB1      ALA  81  -2.850  -1.073   3.398
  677    HB2  ALA  81           HB2      ALA  81  -3.908  -2.455   3.684
  678    HB3  ALA  81           HB3      ALA  81  -2.877  -2.414   2.254
  679    H    ILE  82           HN       ILE  82  -0.186  -0.863   4.065
  680    HA   ILE  82           HA       ILE  82   1.287  -1.880   1.812
  681    HB   ILE  82           HB       ILE  82   0.857   0.543   2.161
  682   HG12  ILE  82          HG12      ILE  82   3.208   1.253   1.533
  683   HG13  ILE  82          HG11      ILE  82   3.691  -0.416   1.820
  684   HG21  ILE  82          HG21      ILE  82   3.009   0.384   4.256
  685   HG22  ILE  82          HG22      ILE  82   1.292   0.633   4.574
  686   HG23  ILE  82          HG23      ILE  82   2.206   1.842   3.672
  687   HD11  ILE  82          HD11      ILE  82   1.385  -0.064   0.036
  688   HD12  ILE  82          HD12      ILE  82   2.775  -1.143  -0.094
  689   HD13  ILE  82          HD13      ILE  82   2.923   0.549  -0.569
  690    H    PHE  83           HN       PHE  83   2.151  -1.384   5.272
  691    HA   PHE  83           HA       PHE  83   4.738  -2.593   4.885
  692    HB2  PHE  83           HB2      PHE  83   5.137  -1.505   6.809
  693    HB3  PHE  83           HB1      PHE  83   3.439  -1.085   6.938
  694    HD1  PHE  83           HD2      PHE  83   5.775  -3.906   7.681
  695    HD2  PHE  83           HD1      PHE  83   2.266  -1.763   8.781
  696    HE1  PHE  83           HE2      PHE  83   5.595  -5.259   9.727
  697    HE2  PHE  83           HE1      PHE  83   2.084  -3.107  10.831
  698    HZ   PHE  83           HZ       PHE  83   3.747  -4.859  11.306
  699    H    ASN  84           HN       ASN  84   1.624  -3.642   6.080
  700    HA   ASN  84           HA       ASN  84   2.467  -6.236   6.831
  701    HB2  ASN  84           HB2      ASN  84   0.298  -5.154   7.597
  702    HB3  ASN  84           HB1      ASN  84  -0.329  -5.475   5.985
  703   HD21  ASN  84          HD21      ASN  84  -1.953  -6.783   6.902
  704   HD22  ASN  84          HD22      ASN  84  -1.612  -8.377   7.475
  705    H    TYR  85           HN       TYR  85   1.562  -4.678   3.804
  706    HA   TYR  85           HA       TYR  85   1.140  -7.042   2.333
  707    HB2  TYR  85           HB2      TYR  85   0.648  -5.044   1.140
  708    HB3  TYR  85           HB1      TYR  85   2.219  -4.340   1.507
  709    HD1  TYR  85           HD2      TYR  85   1.079  -7.550  -0.056
  710    HD2  TYR  85           HD1      TYR  85   3.513  -4.078  -0.398
  711    HE1  TYR  85           HE2      TYR  85   1.934  -8.371  -2.207
  712    HE2  TYR  85           HE1      TYR  85   4.379  -4.896  -2.548
  713    HH   TYR  85           HH       TYR  85   4.559  -6.720  -3.869
  714    H    LEU  86           HN       LEU  86   3.964  -5.222   3.282
  715    HA   LEU  86           HA       LEU  86   5.886  -6.769   1.935
  716    HB2  LEU  86           HB2      LEU  86   6.235  -5.263   4.521
  717    HB3  LEU  86           HB1      LEU  86   7.521  -5.804   3.459
  718    HG   LEU  86           HG       LEU  86   5.492  -3.644   2.920
  719   HD11  LEU  86          HD11      LEU  86   8.476  -3.451   2.778
  720   HD12  LEU  86          HD12      LEU  86   7.612  -3.241   4.299
  721   HD13  LEU  86          HD13      LEU  86   7.287  -2.161   2.944
  722   HD21  LEU  86          HD21      LEU  86   7.449  -4.949   1.042
  723   HD22  LEU  86          HD22      LEU  86   6.666  -3.401   0.730
  724   HD23  LEU  86          HD23      LEU  86   5.696  -4.866   0.878
  725    H    GLU  87           HN       GLU  87   4.498  -6.972   5.157
  726    HA   GLU  87           HA       GLU  87   6.022  -9.209   6.026
  727    HB2  GLU  87           HB2      GLU  87   4.915  -7.580   7.540
  728    HB3  GLU  87           HB1      GLU  87   3.353  -8.209   7.041
  729    HG2  GLU  87           HG2      GLU  87   3.948 -10.398   7.971
  730    HG3  GLU  87           HG1      GLU  87   5.506  -9.748   8.475
  731    H    LYS  88           HN       LYS  88   2.860  -8.829   4.549
  732    HA   LYS  88           HA       LYS  88   1.937 -11.473   4.783
  733    HB2  LYS  88           HB2      LYS  88   0.635  -9.368   4.179
  734    HB3  LYS  88           HB1      LYS  88   1.274  -9.547   2.555
  735    HG2  LYS  88           HG2      LYS  88  -0.901 -10.458   2.547
  736    HG3  LYS  88           HG1      LYS  88   0.213 -11.828   2.508
  737    HD2  LYS  88           HD2      LYS  88  -0.150 -12.314   4.789
  738    HD3  LYS  88           HD1      LYS  88  -0.937 -10.760   5.071
  739    HE2  LYS  88           HE2      LYS  88  -2.085 -12.757   3.153
  740    HE3  LYS  88           HE1      LYS  88  -2.402 -12.868   4.883
  741    HZ1  LYS  88           HZ1      LYS  88  -3.045 -10.565   3.122
  742    HZ2  LYS  88           HZ2      LYS  88  -3.267 -10.588   4.800
  743    HZ3  LYS  88           HZ3      LYS  88  -4.149 -11.644   3.817
  744    H    LEU  89           HN       LEU  89   3.729  -9.812   2.205
  745    HA   LEU  89           HA       LEU  89   3.794 -12.166   0.561
  746    HB2  LEU  89           HB2      LEU  89   4.976 -10.927  -1.018
  747    HB3  LEU  89           HB1      LEU  89   3.901  -9.763  -0.274
  748    HG   LEU  89           HG       LEU  89   6.129  -9.386   1.232
  749   HD11  LEU  89          HD11      LEU  89   8.054  -9.316  -0.301
  750   HD12  LEU  89          HD12      LEU  89   7.088 -10.133  -1.530
  751   HD13  LEU  89          HD13      LEU  89   7.479 -10.960  -0.022
  752   HD21  LEU  89          HD21      LEU  89   6.538  -7.417  -0.159
  753   HD22  LEU  89          HD22      LEU  89   4.813  -7.654   0.127
  754   HD23  LEU  89          HD23      LEU  89   5.519  -8.098  -1.427
  755    H    GLU  90           HN       GLU  90   5.588 -10.935   3.148
  756    HA   GLU  90           HA       GLU  90   7.367 -11.604   4.315
  757    HB2  GLU  90           HB2      GLU  90   6.895 -14.165   2.780
  758    HB3  GLU  90           HB1      GLU  90   8.063 -14.018   4.088
  759    HG2  GLU  90           HG2      GLU  90   6.238 -13.350   5.609
  760    HG3  GLU  90           HG1      GLU  90   5.087 -13.574   4.297
  Start of MODEL   14
    1    H1   MET   1           HT1      MET   1   6.656  -0.007  13.756
    2    H2   MET   1           HT2      MET   1   5.308  -0.968  14.093
    3    H3   MET   1           HT3      MET   1   5.547   0.479  14.938
    4    HA   MET   1           HA       MET   1   5.038   0.264  12.029
    5    HB2  MET   1           HB2      MET   1   3.234   1.044  14.326
    6    HB3  MET   1           HB1      MET   1   2.867   1.408  12.649
    7    HG2  MET   1           HG2      MET   1   2.854  -0.983  12.135
    8    HG3  MET   1           HG1      MET   1   3.220  -1.339  13.824
    9    HE1  MET   1           HE1      MET   1   0.732  -0.091  11.236
   10    HE2  MET   1           HE2      MET   1   0.605   1.341  12.258
   11    HE3  MET   1           HE3      MET   1  -0.754   0.224  12.135
   12    H    ALA   2           HN       ALA   2   7.035   1.638  11.989
   13    HA   ALA   2           HA       ALA   2   6.639   4.366  12.968
   14    HB1  ALA   2           HB1      ALA   2   9.034   3.091  11.636
   15    HB2  ALA   2           HB2      ALA   2   8.823   3.337  13.370
   16    HB3  ALA   2           HB3      ALA   2   8.972   4.726  12.293
   17    H    THR   3           HN       THR   3   4.768   4.169  11.314
   18    HA   THR   3           HA       THR   3   5.482   4.355   8.561
   19    HB   THR   3           HB       THR   3   3.116   4.710   8.131
   20    HG1  THR   3           HG1      THR   3   1.669   4.768   9.920
   21   HG21  THR   3          HG21      THR   3   3.682   2.578  10.188
   22   HG22  THR   3          HG22      THR   3   3.837   2.429   8.438
   23   HG23  THR   3          HG23      THR   3   2.245   2.632   9.168
   24    H    THR   4           HN       THR   4   5.626   6.004   7.269
   25    HA   THR   4           HA       THR   4   5.397   8.724   8.372
   26    HB   THR   4           HB       THR   4   7.053   8.924   6.169
   27    HG1  THR   4           HG1      THR   4   7.201   6.362   7.210
   28   HG21  THR   4          HG21      THR   4   8.874   9.180   7.826
   29   HG22  THR   4          HG22      THR   4   7.809   8.517   9.066
   30   HG23  THR   4          HG23      THR   4   7.412  10.051   8.292
   31    H    THR   5           HN       THR   5   4.315  10.259   7.096
   32    HA   THR   5           HA       THR   5   2.387   9.219   5.268
   33    HB   THR   5           HB       THR   5   3.033  12.129   5.754
   34    HG1  THR   5           HG1      THR   5   1.138  11.793   7.268
   35   HG21  THR   5          HG21      THR   5   1.553  11.618   3.833
   36   HG22  THR   5          HG22      THR   5   0.729  12.514   5.109
   37   HG23  THR   5          HG23      THR   5   0.456  10.781   4.932
   38    H    LEU   6           HN       LEU   6   2.755   8.745   3.220
   39    HA   LEU   6           HA       LEU   6   4.487  10.518   1.637
   40    HB2  LEU   6           HB2      LEU   6   4.376   7.504   1.478
   41    HB3  LEU   6           HB1      LEU   6   5.288   8.542   0.398
   42    HG   LEU   6           HG       LEU   6   5.777   8.324   3.370
   43   HD11  LEU   6          HD11      LEU   6   7.748   7.042   2.781
   44   HD12  LEU   6          HD12      LEU   6   7.304   7.116   1.075
   45   HD13  LEU   6          HD13      LEU   6   6.285   6.236   2.215
   46   HD21  LEU   6          HD21      LEU   6   7.269   9.712   1.149
   47   HD22  LEU   6          HD22      LEU   6   7.915   9.451   2.769
   48   HD23  LEU   6          HD23      LEU   6   6.485  10.456   2.543
   49    H    GLY   7           HN       GLY   7   3.876  10.761  -0.554
   50    HA2  GLY   7           HA2      GLY   7   1.056  10.529  -1.009
   51    HA3  GLY   7           HA1      GLY   7   2.244  11.165  -2.138
   52    H    VAL   8           HN       VAL   8   0.306   8.505  -1.272
   53    HA   VAL   8           HA       VAL   8   1.599   6.798  -3.296
   54    HB   VAL   8           HB       VAL   8  -0.186   6.029  -0.978
   55   HG11  VAL   8          HG11      VAL   8   0.247   3.691  -1.668
   56   HG12  VAL   8          HG12      VAL   8   1.003   4.297  -3.140
   57   HG13  VAL   8          HG13      VAL   8  -0.709   4.595  -2.843
   58   HG21  VAL   8          HG21      VAL   8   2.722   5.461  -1.542
   59   HG22  VAL   8          HG22      VAL   8   1.799   4.806  -0.189
   60   HG23  VAL   8          HG23      VAL   8   2.086   6.543  -0.303
   61    H    LYS   9           HN       LYS   9   0.347   5.989  -4.979
   62    HA   LYS   9           HA       LYS   9  -2.306   7.227  -5.201
   63    HB2  LYS   9           HB2      LYS   9  -0.721   6.184  -7.536
   64    HB3  LYS   9           HB1      LYS   9  -2.041   7.345  -7.538
   65    HG2  LYS   9           HG2      LYS   9  -0.214   8.635  -6.000
   66    HG3  LYS   9           HG1      LYS   9   0.831   7.750  -7.111
   67    HD2  LYS   9           HD2      LYS   9  -1.497   9.371  -8.096
   68    HD3  LYS   9           HD1      LYS   9   0.068  10.113  -7.778
   69    HE2  LYS   9           HE2      LYS   9   1.109   8.556  -9.373
   70    HE3  LYS   9           HE1      LYS   9  -0.474   7.851  -9.702
   71    HZ1  LYS   9           HZ1      LYS   9   0.131   9.487 -11.388
   72    HZ2  LYS   9           HZ2      LYS   9   0.296  10.685 -10.207
   73    HZ3  LYS   9           HZ3      LYS   9  -1.223  10.008 -10.519
   74    H    LEU  10           HN       LEU  10  -4.022   5.940  -5.121
   75    HA   LEU  10           HA       LEU  10  -3.822   3.229  -6.206
   76    HB2  LEU  10           HB2      LEU  10  -5.265   2.373  -4.344
   77    HB3  LEU  10           HB1      LEU  10  -3.617   2.731  -3.911
   78    HG   LEU  10           HG       LEU  10  -4.623   5.014  -3.095
   79   HD11  LEU  10          HD11      LEU  10  -6.920   4.558  -2.127
   80   HD12  LEU  10          HD12      LEU  10  -7.013   3.198  -3.245
   81   HD13  LEU  10          HD13      LEU  10  -6.843   4.840  -3.866
   82   HD21  LEU  10          HD21      LEU  10  -4.958   2.390  -1.653
   83   HD22  LEU  10          HD22      LEU  10  -5.061   3.976  -0.887
   84   HD23  LEU  10          HD23      LEU  10  -3.547   3.449  -1.624
   85    H    ASP  11           HN       ASP  11  -6.277   2.317  -6.075
   86    HA   ASP  11           HA       ASP  11  -7.681   4.244  -7.742
   87    HB2  ASP  11           HB2      ASP  11  -8.242   1.339  -7.106
   88    HB3  ASP  11           HB1      ASP  11  -9.299   2.326  -8.101
   89    H    ASP  12           HN       ASP  12  -9.369   5.440  -7.080
   90    HA   ASP  12           HA       ASP  12 -10.124   5.765  -4.454
   91    HB2  ASP  12           HB2      ASP  12 -11.150   6.638  -7.034
   92    HB3  ASP  12           HB1      ASP  12 -12.439   6.427  -5.856
   93    HA   PRO  13           HA       PRO  13 -13.965   2.800  -5.146
   94    HB2  PRO  13           HB2      PRO  13 -13.439   0.828  -7.021
   95    HB3  PRO  13           HB1      PRO  13 -14.457   2.244  -7.302
   96    HG2  PRO  13           HG2      PRO  13 -11.601   1.782  -8.042
   97    HG3  PRO  13           HG1      PRO  13 -12.881   2.596  -8.960
   98    HD2  PRO  13           HD2      PRO  13 -10.990   3.983  -7.663
   99    HD3  PRO  13           HD1      PRO  13 -12.666   4.564  -7.751
  100    H    THR  14           HN       THR  14 -10.657   1.699  -5.776
  101    HA   THR  14           HA       THR  14 -10.987  -0.688  -4.243
  102    HB   THR  14           HB       THR  14  -9.130   0.054  -6.096
  103    HG1  THR  14           HG1      THR  14  -8.614  -1.937  -4.152
  104   HG21  THR  14          HG21      THR  14  -6.948   0.124  -5.055
  105   HG22  THR  14          HG22      THR  14  -7.670   0.001  -3.451
  106   HG23  THR  14          HG23      THR  14  -7.924   1.451  -4.422
  107    H    ARG  15           HN       ARG  15 -10.205   2.615  -3.546
  108    HA   ARG  15           HA       ARG  15  -8.943   2.277  -1.054
  109    HB2  ARG  15           HB2      ARG  15  -9.185   4.448  -2.326
  110    HB3  ARG  15           HB1      ARG  15 -10.863   4.503  -1.784
  111    HG2  ARG  15           HG2      ARG  15 -10.010   4.427   0.575
  112    HG3  ARG  15           HG1      ARG  15  -8.385   4.626  -0.080
  113    HD2  ARG  15           HD2      ARG  15  -9.234   6.718  -1.215
  114    HD3  ARG  15           HD1      ARG  15 -10.699   6.546  -0.248
  115    HE   ARG  15           HE       ARG  15  -8.086   7.388   0.665
  116   HH11  ARG  15          HH21      ARG  15 -11.244   6.201   1.588
  117   HH12  ARG  15          HH22      ARG  15 -11.134   6.769   3.220
  118   HH21  ARG  15          HH11      ARG  15  -7.914   8.127   2.833
  119   HH22  ARG  15          HH12      ARG  15  -9.226   7.865   3.933
  120    H    GLU  16           HN       GLU  16 -12.306   2.419  -2.081
  121    HA   GLU  16           HA       GLU  16 -13.534   2.053   0.431
  122    HB2  GLU  16           HB2      GLU  16 -15.082   2.582  -1.204
  123    HB3  GLU  16           HB1      GLU  16 -14.301   1.584  -2.415
  124    HG2  GLU  16           HG2      GLU  16 -16.540   0.785  -1.803
  125    HG3  GLU  16           HG1      GLU  16 -15.281  -0.404  -1.499
  126    H    ARG  17           HN       ARG  17 -12.331  -0.248  -1.987
  127    HA   ARG  17           HA       ARG  17 -13.015  -2.588  -0.590
  128    HB2  ARG  17           HB2      ARG  17 -12.273  -2.531  -2.992
  129    HB3  ARG  17           HB1      ARG  17 -10.624  -2.296  -2.419
  130    HG2  ARG  17           HG2      ARG  17 -10.890  -4.427  -1.108
  131    HG3  ARG  17           HG1      ARG  17 -12.405  -4.680  -1.972
  132    HD2  ARG  17           HD2      ARG  17 -11.182  -4.636  -4.099
  133    HD3  ARG  17           HD1      ARG  17  -9.672  -4.410  -3.218
  134    HE   ARG  17           HE       ARG  17 -11.013  -6.863  -3.684
  135   HH11  ARG  17          HH21      ARG  17  -9.187  -5.206  -1.192
  136   HH12  ARG  17          HH22      ARG  17  -8.544  -6.663  -0.514
  137   HH21  ARG  17          HH11      ARG  17 -10.157  -8.794  -2.789
  138   HH22  ARG  17          HH12      ARG  17  -9.085  -8.712  -1.435
  139    H    LEU  18           HN       LEU  18 -10.339  -0.352  -0.267
  140    HA   LEU  18           HA       LEU  18  -8.659  -1.952   1.326
  141    HB2  LEU  18           HB2      LEU  18  -8.936   0.933   0.784
  142    HB3  LEU  18           HB1      LEU  18  -8.282   0.558   2.364
  143    HG   LEU  18           HG       LEU  18  -6.557  -0.882   1.159
  144   HD11  LEU  18          HD11      LEU  18  -7.711  -1.053  -0.979
  145   HD12  LEU  18          HD12      LEU  18  -6.109  -0.335  -1.162
  146   HD13  LEU  18          HD13      LEU  18  -7.544   0.687  -1.210
  147   HD21  LEU  18          HD21      LEU  18  -6.638   2.105   0.818
  148   HD22  LEU  18          HD22      LEU  18  -5.210   1.123   0.501
  149   HD23  LEU  18          HD23      LEU  18  -5.894   1.184   2.125
  150    H    LYS  19           HN       LYS  19 -11.436   0.106   2.056
  151    HA   LYS  19           HA       LYS  19 -11.348  -0.196   4.860
  152    HB2  LYS  19           HB2      LYS  19 -12.737   1.489   3.615
  153    HB3  LYS  19           HB1      LYS  19 -13.811   0.184   3.142
  154    HG2  LYS  19           HG2      LYS  19 -13.268   0.596   6.039
  155    HG3  LYS  19           HG1      LYS  19 -14.337   1.724   5.206
  156    HD2  LYS  19           HD2      LYS  19 -15.671  -0.231   4.416
  157    HD3  LYS  19           HD1      LYS  19 -14.658  -1.268   5.422
  158    HE2  LYS  19           HE2      LYS  19 -16.422   0.988   6.367
  159    HE3  LYS  19           HE1      LYS  19 -16.725  -0.736   6.574
  160    HZ1  LYS  19           HZ1      LYS  19 -14.731   0.970   7.913
  161    HZ2  LYS  19           HZ2      LYS  19 -14.464  -0.695   7.779
  162    HZ3  LYS  19           HZ3      LYS  19 -15.829  -0.122   8.592
  163    H    ALA  20           HN       ALA  20 -12.856  -2.034   2.305
  164    HA   ALA  20           HA       ALA  20 -14.131  -3.975   3.894
  165    HB1  ALA  20           HB1      ALA  20 -13.073  -4.315   1.084
  166    HB2  ALA  20           HB2      ALA  20 -14.639  -3.614   1.498
  167    HB3  ALA  20           HB3      ALA  20 -14.300  -5.305   1.872
  168    H    ALA  21           HN       ALA  21 -10.915  -3.776   2.461
  169    HA   ALA  21           HA       ALA  21  -9.978  -6.312   3.269
  170    HB1  ALA  21           HB1      ALA  21  -8.358  -3.788   2.899
  171    HB2  ALA  21           HB2      ALA  21  -8.839  -4.873   1.594
  172    HB3  ALA  21           HB3      ALA  21  -7.752  -5.443   2.862
  173    H    ALA  22           HN       ALA  22 -10.058  -3.147   4.767
  174    HA   ALA  22           HA       ALA  22  -8.672  -3.706   7.138
  175    HB1  ALA  22           HB1      ALA  22  -9.714  -1.739   8.037
  176    HB2  ALA  22           HB2      ALA  22 -10.998  -1.815   6.831
  177    HB3  ALA  22           HB3      ALA  22  -9.349  -1.431   6.339
  178    H    GLN  23           HN       GLN  23 -12.003  -4.040   6.223
  179    HA   GLN  23           HA       GLN  23 -12.979  -4.933   8.722
  180    HB2  GLN  23           HB2      GLN  23 -14.011  -5.294   5.904
  181    HB3  GLN  23           HB1      GLN  23 -14.897  -5.807   7.334
  182    HG2  GLN  23           HG2      GLN  23 -13.977  -2.983   6.896
  183    HG3  GLN  23           HG1      GLN  23 -15.553  -3.577   6.376
  184   HE21  GLN  23          HE21      GLN  23 -13.568  -2.663   9.075
  185   HE22  GLN  23          HE22      GLN  23 -14.811  -2.712  10.275
  186    H    SER  24           HN       SER  24 -11.631  -6.521   5.906
  187    HA   SER  24           HA       SER  24 -12.075  -9.186   6.740
  188    HB2  SER  24           HB2      SER  24 -11.599  -8.554   4.395
  189    HB3  SER  24           HB1      SER  24  -9.962  -8.099   4.859
  190    HG   SER  24           HG       SER  24 -10.223 -10.503   5.761
  191    H    ILE  25           HN       ILE  25  -9.740  -6.792   7.605
  192    HA   ILE  25           HA       ILE  25  -8.102  -8.807   8.982
  193    HB   ILE  25           HB       ILE  25  -7.273  -6.832   7.294
  194   HG12  ILE  25          HG12      ILE  25  -5.961  -8.772   8.067
  195   HG13  ILE  25          HG11      ILE  25  -5.018  -7.289   8.057
  196   HG21  ILE  25          HG21      ILE  25  -7.895  -5.051   8.833
  197   HG22  ILE  25          HG22      ILE  25  -6.156  -5.087   8.542
  198   HG23  ILE  25          HG23      ILE  25  -6.812  -5.724  10.050
  199   HD11  ILE  25          HD11      ILE  25  -6.190  -8.667  10.459
  200   HD12  ILE  25          HD12      ILE  25  -5.366  -7.108  10.498
  201   HD13  ILE  25          HD13      ILE  25  -4.487  -8.558  10.013
  202    H    ASP  26           HN       ASP  26 -10.650  -6.986   9.493
  203    HA   ASP  26           HA       ASP  26 -11.796  -6.192  11.248
  204    HB2  ASP  26           HB2      ASP  26  -9.797  -7.892  12.731
  205    HB3  ASP  26           HB1      ASP  26 -11.117  -7.055  13.538
  206    H    ARG  27           HN       ARG  27 -10.059  -4.345  10.214
  207    HA   ARG  27           HA       ARG  27  -9.377  -2.826  12.647
  208    HB2  ARG  27           HB2      ARG  27  -7.528  -3.797  10.653
  209    HB3  ARG  27           HB1      ARG  27  -7.515  -2.042  10.697
  210    HG2  ARG  27           HG2      ARG  27  -5.876  -2.600  12.213
  211    HG3  ARG  27           HG1      ARG  27  -7.277  -2.340  13.251
  212    HD2  ARG  27           HD2      ARG  27  -7.643  -4.691  13.462
  213    HD3  ARG  27           HD1      ARG  27  -6.432  -5.046  12.228
  214    HE   ARG  27           HE       ARG  27  -5.957  -4.307  14.998
  215   HH11  ARG  27          HH21      ARG  27  -4.612  -4.943  11.835
  216   HH12  ARG  27          HH22      ARG  27  -2.976  -5.007  12.396
  217   HH21  ARG  27          HH11      ARG  27  -3.800  -4.418  15.752
  218   HH22  ARG  27          HH12      ARG  27  -2.516  -4.724  14.632
  219    H    THR  28           HN       THR  28  -8.983  -0.488  12.133
  220    HA   THR  28           HA       THR  28 -11.125   0.573  10.567
  221    HB   THR  28           HB       THR  28  -8.798   2.050  11.840
  222    HG1  THR  28           HG1      THR  28 -11.232   1.085  12.935
  223   HG21  THR  28          HG21      THR  28 -11.600   3.014  11.250
  224   HG22  THR  28          HG22      THR  28 -10.185   3.374  10.260
  225   HG23  THR  28          HG23      THR  28 -10.274   3.963  11.920
  226    HA   PRO  29           HA       PRO  29  -9.237   0.842   6.553
  227    HB2  PRO  29           HB2      PRO  29  -9.904   3.562   6.088
  228    HB3  PRO  29           HB1      PRO  29 -10.782   2.132   5.544
  229    HG2  PRO  29           HG2      PRO  29 -11.273   3.875   7.896
  230    HG3  PRO  29           HG1      PRO  29 -12.427   2.953   6.915
  231    HD2  PRO  29           HD2      PRO  29 -11.750   2.147   9.371
  232    HD3  PRO  29           HD1      PRO  29 -12.007   0.973   8.063
  233    H    HIS  30           HN       HIS  30  -8.637   3.541   8.796
  234    HA   HIS  30           HA       HIS  30  -6.431   4.627   7.447
  235    HB2  HIS  30           HB2      HIS  30  -7.709   5.659   9.376
  236    HB3  HIS  30           HB1      HIS  30  -6.779   4.614  10.446
  237    HD1  HIS  30           HD1      HIS  30  -6.046   7.171   7.721
  238    HD2  HIS  30           HD2      HIS  30  -4.522   5.802  11.332
  239    HE1  HIS  30           HE1      HIS  30  -4.100   8.666   8.231
  240    HE2  HIS  30           HE2      HIS  30  -3.445   8.038  10.578
  241    H    TRP  31           HN       TRP  31  -6.581   2.110   9.954
  242    HA   TRP  31           HA       TRP  31  -3.766   1.776  10.114
  243    HB2  TRP  31           HB2      TRP  31  -5.750  -0.407  10.720
  244    HB3  TRP  31           HB1      TRP  31  -4.157  -0.166  11.420
  245    HD1  TRP  31           HD1      TRP  31  -7.526  -0.028  12.430
  246    HE1  TRP  31           HE1      TRP  31  -7.943   1.594  14.379
  247    HE3  TRP  31           HE3      TRP  31  -3.191   2.658  12.171
  248    HZ2  TRP  31           HZ2      TRP  31  -6.607   3.724  15.644
  249    HZ3  TRP  31           HZ3      TRP  31  -2.838   4.474  13.796
  250    HH2  TRP  31           HH2      TRP  31  -4.510   4.994  15.495
  251    H    LEU  32           HN       LEU  32  -6.376   0.316   8.359
  252    HA   LEU  32           HA       LEU  32  -4.953  -1.765   7.173
  253    HB2  LEU  32           HB2      LEU  32  -7.419  -1.592   7.197
  254    HB3  LEU  32           HB1      LEU  32  -7.309  -0.293   6.029
  255    HG   LEU  32           HG       LEU  32  -7.924  -2.630   5.173
  256   HD11  LEU  32          HD11      LEU  32  -6.935  -2.246   3.077
  257   HD12  LEU  32          HD12      LEU  32  -5.567  -1.391   3.789
  258   HD13  LEU  32          HD13      LEU  32  -7.168  -0.651   3.797
  259   HD21  LEU  32          HD21      LEU  32  -6.213  -3.870   6.400
  260   HD22  LEU  32          HD22      LEU  32  -4.954  -3.038   5.487
  261   HD23  LEU  32          HD23      LEU  32  -6.075  -4.119   4.660
  262    H    ILE  33           HN       ILE  33  -5.413   1.559   6.158
  263    HA   ILE  33           HA       ILE  33  -4.292   1.301   3.601
  264    HB   ILE  33           HB       ILE  33  -4.379   3.644   5.502
  265   HG12  ILE  33          HG12      ILE  33  -5.883   3.223   2.919
  266   HG13  ILE  33          HG11      ILE  33  -6.501   2.681   4.475
  267   HG21  ILE  33          HG21      ILE  33  -2.508   4.094   4.123
  268   HG22  ILE  33          HG22      ILE  33  -3.852   5.034   3.474
  269   HG23  ILE  33          HG23      ILE  33  -3.353   3.542   2.678
  270   HD11  ILE  33          HD11      ILE  33  -7.329   4.912   3.600
  271   HD12  ILE  33          HD12      ILE  33  -5.723   5.533   3.986
  272   HD13  ILE  33          HD13      ILE  33  -6.744   4.869   5.262
  273    H    LYS  34           HN       LYS  34  -2.746   2.416   6.627
  274    HA   LYS  34           HA       LYS  34  -0.132   2.484   5.518
  275    HB2  LYS  34           HB2      LYS  34   0.648   2.666   7.844
  276    HB3  LYS  34           HB1      LYS  34  -0.691   3.754   7.523
  277    HG2  LYS  34           HG2      LYS  34  -2.217   2.273   8.658
  278    HG3  LYS  34           HG1      LYS  34  -0.936   1.086   8.889
  279    HD2  LYS  34           HD2      LYS  34  -0.998   2.143  10.939
  280    HD3  LYS  34           HD1      LYS  34   0.288   3.018  10.111
  281    HE2  LYS  34           HE2      LYS  34  -1.143   4.859   9.661
  282    HE3  LYS  34           HE1      LYS  34  -2.573   3.952  10.156
  283    HZ1  LYS  34           HZ1      LYS  34  -1.880   5.488  11.890
  284    HZ2  LYS  34           HZ2      LYS  34  -0.344   4.781  11.949
  285    HZ3  LYS  34           HZ3      LYS  34  -1.700   3.892  12.420
  286    H    GLN  35           HN       GLN  35  -1.917   0.028   7.283
  287    HA   GLN  35           HA       GLN  35   0.244  -1.788   7.515
  288    HB2  GLN  35           HB2      GLN  35  -2.741  -2.157   7.721
  289    HB3  GLN  35           HB1      GLN  35  -1.590  -3.457   7.994
  290    HG2  GLN  35           HG2      GLN  35  -0.611  -2.258   9.847
  291    HG3  GLN  35           HG1      GLN  35  -1.657  -0.875   9.536
  292   HE21  GLN  35          HE21      GLN  35  -3.829  -2.903   8.856
  293   HE22  GLN  35          HE22      GLN  35  -4.449  -3.353  10.400
  294    H    ALA  36           HN       ALA  36  -2.473  -1.523   5.225
  295    HA   ALA  36           HA       ALA  36  -2.130  -3.862   3.827
  296    HB1  ALA  36           HB1      ALA  36  -2.945  -2.535   1.796
  297    HB2  ALA  36           HB2      ALA  36  -3.034  -1.161   2.898
  298    HB3  ALA  36           HB3      ALA  36  -3.993  -2.607   3.212
  299    H    ILE  37           HN       ILE  37  -0.331  -0.817   3.394
  300    HA   ILE  37           HA       ILE  37   1.117  -1.993   1.219
  301    HB   ILE  37           HB       ILE  37   0.860   0.381   1.193
  302   HG12  ILE  37          HG12      ILE  37   3.202   1.133   0.928
  303   HG13  ILE  37          HG11      ILE  37   3.748  -0.341   1.719
  304   HG21  ILE  37          HG21      ILE  37   2.401   0.467   3.775
  305   HG22  ILE  37          HG22      ILE  37   0.683   0.805   3.571
  306   HG23  ILE  37          HG23      ILE  37   1.884   1.866   2.835
  307   HD11  ILE  37          HD11      ILE  37   2.137  -0.298  -0.817
  308   HD12  ILE  37          HD12      ILE  37   2.941  -1.682  -0.074
  309   HD13  ILE  37          HD13      ILE  37   3.899  -0.370  -0.759
  310    H    PHE  38           HN       PHE  38   2.149  -1.293   4.620
  311    HA   PHE  38           HA       PHE  38   4.670  -2.602   4.082
  312    HB2  PHE  38           HB2      PHE  38   5.383  -1.814   6.091
  313    HB3  PHE  38           HB1      PHE  38   3.987  -0.760   5.931
  314    HD1  PHE  38           HD2      PHE  38   5.235  -3.847   7.538
  315    HD2  PHE  38           HD1      PHE  38   2.210  -0.854   7.475
  316    HE1  PHE  38           HE2      PHE  38   4.387  -4.666   9.696
  317    HE2  PHE  38           HE1      PHE  38   1.363  -1.663   9.638
  318    HZ   PHE  38           HZ       PHE  38   2.448  -3.574  10.750
  319    H    ASN  39           HN       ASN  39   1.635  -3.504   5.550
  320    HA   ASN  39           HA       ASN  39   2.514  -6.023   6.497
  321    HB2  ASN  39           HB2      ASN  39   0.424  -4.818   7.287
  322    HB3  ASN  39           HB1      ASN  39  -0.321  -5.302   5.768
  323   HD21  ASN  39          HD21      ASN  39  -1.871  -6.341   7.199
  324   HD22  ASN  39          HD22      ASN  39  -1.521  -7.912   7.822
  325    H    TYR  40           HN       TYR  40   1.447  -4.748   3.404
  326    HA   TYR  40           HA       TYR  40   0.903  -7.214   2.152
  327    HB2  TYR  40           HB2      TYR  40   0.418  -5.261   0.863
  328    HB3  TYR  40           HB1      TYR  40   2.031  -4.610   1.108
  329    HD1  TYR  40           HD2      TYR  40   1.003  -8.009  -0.093
  330    HD2  TYR  40           HD1      TYR  40   2.888  -4.309  -1.017
  331    HE1  TYR  40           HE2      TYR  40   1.694  -8.912  -2.273
  332    HE2  TYR  40           HE1      TYR  40   3.582  -5.201  -3.197
  333    HH   TYR  40           HH       TYR  40   3.054  -6.886  -4.737
  334    H    LEU  41           HN       LEU  41   3.773  -5.328   2.712
  335    HA   LEU  41           HA       LEU  41   5.643  -7.015   1.482
  336    HB2  LEU  41           HB2      LEU  41   6.051  -5.175   3.828
  337    HB3  LEU  41           HB1      LEU  41   7.309  -5.805   2.780
  338    HG   LEU  41           HG       LEU  41   5.107  -3.908   1.961
  339   HD11  LEU  41          HD11      LEU  41   8.058  -3.391   2.049
  340   HD12  LEU  41          HD12      LEU  41   6.989  -3.048   3.408
  341   HD13  LEU  41          HD13      LEU  41   6.741  -2.233   1.865
  342   HD21  LEU  41          HD21      LEU  41   6.366  -3.761  -0.167
  343   HD22  LEU  41          HD22      LEU  41   5.640  -5.344   0.109
  344   HD23  LEU  41          HD23      LEU  41   7.369  -5.109   0.372
  345    H    GLU  42           HN       GLU  42   4.539  -6.814   4.846
  346    HA   GLU  42           HA       GLU  42   6.177  -8.900   5.836
  347    HB2  GLU  42           HB2      GLU  42   5.131  -7.155   7.252
  348    HB3  GLU  42           HB1      GLU  42   3.557  -7.868   6.941
  349    HG2  GLU  42           HG2      GLU  42   4.283  -9.935   8.039
  350    HG3  GLU  42           HG1      GLU  42   5.853  -9.205   8.359
  351    H    LYS  43           HN       LYS  43   2.827  -8.839   4.688
  352    HA   LYS  43           HA       LYS  43   2.269 -11.553   5.288
  353    HB2  LYS  43           HB2      LYS  43   0.541  -9.776   4.996
  354    HB3  LYS  43           HB1      LYS  43   0.863  -9.805   3.267
  355    HG2  LYS  43           HG2      LYS  43   0.178 -12.149   3.178
  356    HG3  LYS  43           HG1      LYS  43  -0.147 -12.117   4.912
  357    HD2  LYS  43           HD2      LYS  43  -1.497 -10.300   2.922
  358    HD3  LYS  43           HD1      LYS  43  -2.165 -11.847   3.441
  359    HE2  LYS  43           HE2      LYS  43  -1.848 -10.879   5.834
  360    HE3  LYS  43           HE1      LYS  43  -1.778  -9.325   5.005
  361    HZ1  LYS  43           HZ1      LYS  43  -3.938  -9.845   3.996
  362    HZ2  LYS  43           HZ2      LYS  43  -4.022  -9.790   5.684
  363    HZ3  LYS  43           HZ3      LYS  43  -4.012 -11.282   4.892
  364    H    LEU  44           HN       LEU  44   3.377  -9.935   2.320
  365    HA   LEU  44           HA       LEU  44   3.195 -12.311   0.743
  366    HB2  LEU  44           HB2      LEU  44   4.126 -11.109  -1.015
  367    HB3  LEU  44           HB1      LEU  44   3.292  -9.873  -0.097
  368    HG   LEU  44           HG       LEU  44   5.716  -9.587   0.992
  369   HD11  LEU  44          HD11      LEU  44   7.290 -10.762  -0.047
  370   HD12  LEU  44          HD12      LEU  44   7.020  -9.741  -1.460
  371   HD13  LEU  44          HD13      LEU  44   6.167 -11.277  -1.304
  372   HD21  LEU  44          HD21      LEU  44   6.101  -7.770  -0.586
  373   HD22  LEU  44          HD22      LEU  44   4.406  -7.841  -0.101
  374   HD23  LEU  44          HD23      LEU  44   4.898  -8.456  -1.679
  375    H    GLU  45           HN       GLU  45   5.466 -10.945   2.908
  376    HA   GLU  45           HA       GLU  45   7.391 -11.616   3.827
  377    HB2  GLU  45           HB2      GLU  45   6.442 -14.282   2.779
  378    HB3  GLU  45           HB1      GLU  45   7.909 -14.106   3.736
  379    HG2  GLU  45           HG2      GLU  45   6.561 -13.128   5.563
  380    HG3  GLU  45           HG1      GLU  45   5.110 -13.402   4.601
  381    H1   MET  46           HT1      MET  46  -6.397   1.207 -14.350
  382    H2   MET  46           HT2      MET  46  -5.026   0.296 -14.732
  383    H3   MET  46           HT3      MET  46  -5.233   1.835 -15.402
  384    HA   MET  46           HA       MET  46  -4.878   1.269 -12.512
  385    HB2  MET  46           HB2      MET  46  -2.956   2.303 -14.607
  386    HB3  MET  46           HB1      MET  46  -2.670   2.447 -12.880
  387    HG2  MET  46           HG2      MET  46  -2.702   0.016 -12.668
  388    HG3  MET  46           HG1      MET  46  -2.994  -0.130 -14.400
  389    HE1  MET  46           HE1      MET  46  -0.596   0.807 -11.581
  390    HE2  MET  46           HE2      MET  46  -0.439   2.334 -12.450
  391    HE3  MET  46           HE3      MET  46   0.918   1.209 -12.391
  392    H    ALA  47           HN       ALA  47  -6.819   2.647 -12.289
  393    HA   ALA  47           HA       ALA  47  -6.442   5.455 -13.019
  394    HB1  ALA  47           HB1      ALA  47  -8.832   4.067 -11.797
  395    HB2  ALA  47           HB2      ALA  47  -8.622   4.445 -13.507
  396    HB3  ALA  47           HB3      ALA  47  -8.771   5.748 -12.327
  397    H    THR  48           HN       THR  48  -4.568   5.114 -11.386
  398    HA   THR  48           HA       THR  48  -5.295   5.074  -8.631
  399    HB   THR  48           HB       THR  48  -2.928   5.395  -8.166
  400    HG1  THR  48           HG1      THR  48  -1.477   5.813  -9.768
  401   HG21  THR  48          HG21      THR  48  -3.498   3.423 -10.376
  402   HG22  THR  48          HG22      THR  48  -3.642   3.145  -8.640
  403   HG23  THR  48          HG23      THR  48  -2.055   3.402  -9.364
  404    H    THR  49           HN       THR  49  -5.392   6.616  -7.202
  405    HA   THR  49           HA       THR  49  -5.153   9.415  -8.077
  406    HB   THR  49           HB       THR  49  -6.842   9.366  -5.852
  407    HG1  THR  49           HG1      THR  49  -6.908   6.967  -6.529
  408   HG21  THR  49          HG21      THR  49  -8.595   9.964  -7.476
  409   HG22  THR  49          HG22      THR  49  -7.547   9.431  -8.790
  410   HG23  THR  49          HG23      THR  49  -7.085  10.816  -7.801
  411    H    THR  50           HN       THR  50  -4.027  10.810  -6.713
  412    HA   THR  50           HA       THR  50  -2.149   9.635  -4.931
  413    HB   THR  50           HB       THR  50  -2.773  12.577  -5.177
  414    HG1  THR  50           HG1      THR  50  -1.128  12.540  -6.820
  415   HG21  THR  50          HG21      THR  50  -1.287  11.895  -3.320
  416   HG22  THR  50          HG22      THR  50  -0.456  12.881  -4.524
  417   HG23  THR  50          HG23      THR  50  -0.208  11.134  -4.490
  418    H    LEU  51           HN       LEU  51  -2.526   9.016  -2.924
  419    HA   LEU  51           HA       LEU  51  -4.254  10.673  -1.216
  420    HB2  LEU  51           HB2      LEU  51  -4.166   7.654  -1.283
  421    HB3  LEU  51           HB1      LEU  51  -5.065   8.614  -0.126
  422    HG   LEU  51           HG       LEU  51  -5.562   8.632  -3.104
  423   HD11  LEU  51          HD11      LEU  51  -7.536   7.313  -2.615
  424   HD12  LEU  51          HD12      LEU  51  -7.091   7.252  -0.909
  425   HD13  LEU  51          HD13      LEU  51  -6.077   6.460  -2.114
  426   HD21  LEU  51          HD21      LEU  51  -7.045   9.843  -0.776
  427   HD22  LEU  51          HD22      LEU  51  -7.692   9.718  -2.411
  428   HD23  LEU  51          HD23      LEU  51  -6.257  10.695  -2.104
  429    H    GLY  52           HN       GLY  52  -3.667  10.701   1.012
  430    HA2  GLY  52           HA2      GLY  52  -0.840  10.448   1.440
  431    HA3  GLY  52           HA1      GLY  52  -2.030  10.984   2.619
  432    H    VAL  53           HN       VAL  53  -0.091   8.405   1.529
  433    HA   VAL  53           HA       VAL  53  -1.392   6.535   3.399
  434    HB   VAL  53           HB       VAL  53   0.396   5.954   1.028
  435   HG11  VAL  53          HG11      VAL  53  -0.060   3.568   1.519
  436   HG12  VAL  53          HG12      VAL  53  -0.812   4.057   3.037
  437   HG13  VAL  53          HG13      VAL  53   0.903   4.364   2.764
  438   HG21  VAL  53          HG21      VAL  53  -2.519   5.361   1.532
  439   HG22  VAL  53          HG22      VAL  53  -1.595   4.813   0.134
  440   HG23  VAL  53          HG23      VAL  53  -1.870   6.536   0.388
  441    H    LYS  54           HN       LYS  54  -0.126   5.544   4.982
  442    HA   LYS  54           HA       LYS  54   2.525   6.764   5.311
  443    HB2  LYS  54           HB2      LYS  54   0.914   5.571   7.555
  444    HB3  LYS  54           HB1      LYS  54   2.251   6.708   7.651
  445    HG2  LYS  54           HG2      LYS  54   0.464   8.137   6.197
  446    HG3  LYS  54           HG1      LYS  54  -0.612   7.187   7.222
  447    HD2  LYS  54           HD2      LYS  54   1.721   8.740   8.315
  448    HD3  LYS  54           HD1      LYS  54   0.123   9.453   8.111
  449    HE2  LYS  54           HE2      LYS  54  -0.834   7.823   9.622
  450    HE3  LYS  54           HE1      LYS  54   0.719   6.996   9.758
  451    HZ1  LYS  54           HZ1      LYS  54   0.347   8.433  11.661
  452    HZ2  LYS  54           HZ2      LYS  54   0.143   9.776  10.651
  453    HZ3  LYS  54           HZ3      LYS  54   1.648   9.012  10.748
  454    H    LEU  55           HN       LEU  55   4.231   5.473   5.140
  455    HA   LEU  55           HA       LEU  55   3.997   2.685   6.004
  456    HB2  LEU  55           HB2      LEU  55   5.458   1.982   4.085
  457    HB3  LEU  55           HB1      LEU  55   3.810   2.374   3.678
  458    HG   LEU  55           HG       LEU  55   4.821   4.719   3.062
  459   HD11  LEU  55          HD11      LEU  55   7.117   4.334   2.055
  460   HD12  LEU  55          HD12      LEU  55   7.204   2.887   3.059
  461   HD13  LEU  55          HD13      LEU  55   7.041   4.474   3.811
  462   HD21  LEU  55          HD21      LEU  55   5.141   2.225   1.402
  463   HD22  LEU  55          HD22      LEU  55   5.257   3.869   0.773
  464   HD23  LEU  55          HD23      LEU  55   3.738   3.293   1.462
  465    H    ASP  56           HN       ASP  56   6.470   1.775   5.776
  466    HA   ASP  56           HA       ASP  56   7.870   3.548   7.612
  467    HB2  ASP  56           HB2      ASP  56   8.412   0.699   6.752
  468    HB3  ASP  56           HB1      ASP  56   9.468   1.595   7.832
  469    H    ASP  57           HN       ASP  57   9.583   4.773   7.060
  470    HA   ASP  57           HA       ASP  57  10.356   5.312   4.477
  471    HB2  ASP  57           HB2      ASP  57  11.470   5.869   7.133
  472    HB3  ASP  57           HB1      ASP  57  12.676   5.849   5.853
  473    HA   PRO  58           HA       PRO  58  14.159   2.252   4.927
  474    HB2  PRO  58           HB2      PRO  58  13.591   0.131   6.622
  475    HB3  PRO  58           HB1      PRO  58  14.630   1.501   7.028
  476    HG2  PRO  58           HG2      PRO  58  11.763   1.024   7.714
  477    HG3  PRO  58           HG1      PRO  58  13.051   1.736   8.704
  478    HD2  PRO  58           HD2      PRO  58  11.190   3.261   7.524
  479    HD3  PRO  58           HD1      PRO  58  12.876   3.802   7.664
  480    H    THR  59           HN       THR  59  10.845   1.117   5.469
  481    HA   THR  59           HA       THR  59  11.148  -1.112   3.718
  482    HB   THR  59           HB       THR  59   9.307  -0.522   5.640
  483    HG1  THR  59           HG1      THR  59   8.560  -2.326   3.641
  484   HG21  THR  59          HG21      THR  59   7.120  -0.346   4.622
  485   HG22  THR  59          HG22      THR  59   7.833  -0.329   3.009
  486   HG23  THR  59          HG23      THR  59   8.103   1.026   4.104
  487    H    ARG  60           HN       ARG  60  10.386   2.249   3.311
  488    HA   ARG  60           HA       ARG  60   9.121   2.131   0.801
  489    HB2  ARG  60           HB2      ARG  60   9.382   4.190   2.241
  490    HB3  ARG  60           HB1      ARG  60  11.060   4.272   1.705
  491    HG2  ARG  60           HG2      ARG  60  10.203   4.392  -0.653
  492    HG3  ARG  60           HG1      ARG  60   8.582   4.560   0.021
  493    HD2  ARG  60           HD2      ARG  60   9.468   6.538   1.322
  494    HD3  ARG  60           HD1      ARG  60  10.925   6.425   0.337
  495    HE   ARG  60           HE       ARG  60   8.341   7.417  -0.473
  496   HH11  ARG  60          HH21      ARG  60  11.390   6.108  -1.585
  497   HH12  ARG  60          HH22      ARG  60  11.278   6.829  -3.157
  498   HH21  ARG  60          HH11      ARG  60   8.181   8.364  -2.562
  499   HH22  ARG  60          HH12      ARG  60   9.458   8.127  -3.712
  500    H    GLU  61           HN       GLU  61  12.479   2.145   1.836
  501    HA   GLU  61           HA       GLU  61  13.711   1.984  -0.699
  502    HB2  GLU  61           HB2      GLU  61  15.249   2.368   0.991
  503    HB3  GLU  61           HB1      GLU  61  14.463   1.262   2.102
  504    HG2  GLU  61           HG2      GLU  61  16.683   0.491   1.451
  505    HG3  GLU  61           HG1      GLU  61  15.426  -0.636   0.963
  506    H    ARG  62           HN       ARG  62  12.468  -0.493   1.520
  507    HA   ARG  62           HA       ARG  62  13.143  -2.721  -0.061
  508    HB2  ARG  62           HB2      ARG  62  12.404  -2.850   2.342
  509    HB3  ARG  62           HB1      ARG  62  10.756  -2.563   1.789
  510    HG2  ARG  62           HG2      ARG  62  11.052  -4.587   0.292
  511    HG3  ARG  62           HG1      ARG  62  12.525  -4.922   1.200
  512    HD2  ARG  62           HD2      ARG  62  11.210  -5.019   3.269
  513    HD3  ARG  62           HD1      ARG  62   9.743  -4.703   2.345
  514    HE   ARG  62           HE       ARG  62  11.023  -7.208   2.686
  515   HH11  ARG  62          HH21      ARG  62   9.329  -5.341   0.249
  516   HH12  ARG  62          HH22      ARG  62   8.700  -6.734  -0.565
  517   HH21  ARG  62          HH11      ARG  62  10.177  -9.057   1.614
  518   HH22  ARG  62          HH12      ARG  62   9.173  -8.851   0.222
  519    H    LEU  63           HN       LEU  63  10.501  -0.436  -0.208
  520    HA   LEU  63           HA       LEU  63   8.798  -1.893  -1.913
  521    HB2  LEU  63           HB2      LEU  63   9.098   0.935  -1.137
  522    HB3  LEU  63           HB1      LEU  63   8.441   0.698  -2.742
  523    HG   LEU  63           HG       LEU  63   6.706  -0.824  -1.657
  524   HD11  LEU  63          HD11      LEU  63   7.855  -1.175   0.460
  525   HD12  LEU  63          HD12      LEU  63   6.260  -0.459   0.701
  526   HD13  LEU  63          HD13      LEU  63   7.706   0.542   0.830
  527   HD21  LEU  63          HD21      LEU  63   6.808   2.126  -1.078
  528   HD22  LEU  63          HD22      LEU  63   5.372   1.131  -0.841
  529   HD23  LEU  63          HD23      LEU  63   6.058   1.317  -2.455
  530    H    LYS  64           HN       LYS  64  11.588   0.194  -2.479
  531    HA   LYS  64           HA       LYS  64  11.502   0.117  -5.294
  532    HB2  LYS  64           HB2      LYS  64  12.891   1.707  -3.970
  533    HB3  LYS  64           HB1      LYS  64  13.937   0.372  -3.520
  534    HG2  LYS  64           HG2      LYS  64  13.491   0.932  -6.411
  535    HG3  LYS  64           HG1      LYS  64  14.560   1.988  -5.488
  536    HD2  LYS  64           HD2      LYS  64  15.786  -0.080  -4.742
  537    HD3  LYS  64           HD1      LYS  64  14.817  -0.988  -5.903
  538    HE2  LYS  64           HE2      LYS  64  16.820   1.188  -6.451
  539    HE3  LYS  64           HE1      LYS  64  16.878  -0.496  -6.966
  540    HZ1  LYS  64           HZ1      LYS  64  15.189   1.693  -7.990
  541    HZ2  LYS  64           HZ2      LYS  64  14.737   0.077  -8.216
  542    HZ3  LYS  64           HZ3      LYS  64  16.201   0.641  -8.848
  543    H    ALA  65           HN       ALA  65  12.985  -1.934  -2.896
  544    HA   ALA  65           HA       ALA  65  14.253  -3.749  -4.636
  545    HB1  ALA  65           HB1      ALA  65  13.182  -4.307  -1.867
  546    HB2  ALA  65           HB2      ALA  65  14.756  -3.593  -2.217
  547    HB3  ALA  65           HB3      ALA  65  14.402  -5.243  -2.733
  548    H    ALA  66           HN       ALA  66  11.037  -3.630  -3.201
  549    HA   ALA  66           HA       ALA  66  10.079  -6.087  -4.210
  550    HB1  ALA  66           HB1      ALA  66   8.481  -3.587  -3.632
  551    HB2  ALA  66           HB2      ALA  66   8.955  -4.778  -2.420
  552    HB3  ALA  66           HB3      ALA  66   7.862  -5.234  -3.729
  553    H    ALA  67           HN       ALA  67  10.181  -2.807  -5.445
  554    HA   ALA  67           HA       ALA  67   8.791  -3.161  -7.851
  555    HB1  ALA  67           HB1      ALA  67   9.850  -1.138  -8.591
  556    HB2  ALA  67           HB2      ALA  67  11.133  -1.323  -7.396
  557    HB3  ALA  67           HB3      ALA  67   9.488  -0.965  -6.873
  558    H    GLN  68           HN       GLN  68  12.124  -3.580  -6.978
  559    HA   GLN  68           HA       GLN  68  13.095  -4.283  -9.535
  560    HB2  GLN  68           HB2      GLN  68  14.103  -4.893  -6.749
  561    HB3  GLN  68           HB1      GLN  68  14.988  -5.313  -8.210
  562    HG2  GLN  68           HG2      GLN  68  14.124  -2.511  -7.571
  563    HG3  GLN  68           HG1      GLN  68  15.676  -3.176  -7.064
  564   HE21  GLN  68          HE21      GLN  68  13.766  -2.032  -9.729
  565   HE22  GLN  68          HE22      GLN  68  15.033  -2.018 -10.902
  566    H    SER  69           HN       SER  69  11.778  -6.113  -6.838
  567    HA   SER  69           HA       SER  69  12.168  -8.692  -7.910
  568    HB2  SER  69           HB2      SER  69  11.712  -8.255  -5.517
  569    HB3  SER  69           HB1      SER  69  10.076  -7.751  -5.927
  570    HG   SER  69           HG       SER  69  10.583 -10.164  -6.993
  571    H    ILE  70           HN       ILE  70   9.842  -6.213  -8.556
  572    HA   ILE  70           HA       ILE  70   8.193  -8.096 -10.093
  573    HB   ILE  70           HB       ILE  70   7.372  -6.260  -8.252
  574   HG12  ILE  70          HG12      ILE  70   6.052  -8.123  -9.185
  575   HG13  ILE  70          HG11      ILE  70   5.116  -6.642  -9.051
  576   HG21  ILE  70          HG21      ILE  70   8.008  -4.363  -9.646
  577   HG22  ILE  70          HG22      ILE  70   6.269  -4.411  -9.351
  578   HG23  ILE  70          HG23      ILE  70   6.914  -4.929 -10.908
  579   HD11  ILE  70          HD11      ILE  70   6.283  -7.823 -11.559
  580   HD12  ILE  70          HD12      ILE  70   5.470  -6.260 -11.469
  581   HD13  ILE  70          HD13      ILE  70   4.580  -7.740 -11.107
  582    H    ASP  71           HN       ASP  71  10.763  -6.267 -10.478
  583    HA   ASP  71           HA       ASP  71  11.895  -5.343 -12.180
  584    HB2  ASP  71           HB2      ASP  71   9.885  -6.953 -13.729
  585    HB3  ASP  71           HB1      ASP  71  11.102  -5.979 -14.543
  586    H    ARG  72           HN       ARG  72  10.176  -3.575 -10.975
  587    HA   ARG  72           HA       ARG  72   9.515  -1.858 -13.275
  588    HB2  ARG  72           HB2      ARG  72   7.641  -2.968 -11.371
  589    HB3  ARG  72           HB1      ARG  72   7.631  -1.214 -11.307
  590    HG2  ARG  72           HG2      ARG  72   6.015  -1.653 -12.881
  591    HG3  ARG  72           HG1      ARG  72   7.435  -1.367 -13.887
  592    HD2  ARG  72           HD2      ARG  72   7.765  -3.714 -14.207
  593    HD3  ARG  72           HD1      ARG  72   6.527  -4.106 -13.012
  594    HE   ARG  72           HE       ARG  72   6.118  -3.295 -15.760
  595   HH11  ARG  72          HH21      ARG  72   4.688  -3.842 -12.625
  596   HH12  ARG  72          HH22      ARG  72   3.058  -3.791 -13.203
  597   HH21  ARG  72          HH11      ARG  72   3.968  -3.280 -16.555
  598   HH22  ARG  72          HH12      ARG  72   2.648  -3.495 -15.454
  599    H    THR  73           HN       THR  73   9.119   0.430 -12.566
  600    HA   THR  73           HA       THR  73  11.268   1.348 -10.920
  601    HB   THR  73           HB       THR  73   8.948   2.921 -12.085
  602    HG1  THR  73           HG1      THR  73  11.282   1.879 -13.236
  603   HG21  THR  73          HG21      THR  73  11.734   3.852 -11.383
  604   HG22  THR  73          HG22      THR  73  10.307   4.116 -10.381
  605   HG23  THR  73          HG23      THR  73  10.406   4.844 -11.984
  606    HA   PRO  74           HA       PRO  74   9.381   1.302  -6.893
  607    HB2  PRO  74           HB2      PRO  74  10.082   3.970  -6.212
  608    HB3  PRO  74           HB1      PRO  74  10.939   2.490  -5.781
  609    HG2  PRO  74           HG2      PRO  74  11.464   4.407  -7.983
  610    HG3  PRO  74           HG1      PRO  74  12.600   3.388  -7.080
  611    HD2  PRO  74           HD2      PRO  74  11.913   2.801  -9.596
  612    HD3  PRO  74           HD1      PRO  74  12.152   1.518  -8.390
  613    H    HIS  75           HN       HIS  75   8.820   4.168  -8.914
  614    HA   HIS  75           HA       HIS  75   6.630   5.197  -7.499
  615    HB2  HIS  75           HB2      HIS  75   7.932   6.342  -9.332
  616    HB3  HIS  75           HB1      HIS  75   7.030   5.371 -10.488
  617    HD1  HIS  75           HD1      HIS  75   6.293   7.842  -7.691
  618    HD2  HIS  75           HD2      HIS  75   4.763   6.565 -11.330
  619    HE1  HIS  75           HE1      HIS  75   4.374   9.379  -8.182
  620    HE2  HIS  75           HE2      HIS  75   3.744   8.819 -10.558
  621    H    TRP  76           HN       TRP  76   6.747   2.880 -10.195
  622    HA   TRP  76           HA       TRP  76   3.931   2.578 -10.375
  623    HB2  TRP  76           HB2      TRP  76   5.894   0.441 -11.158
  624    HB3  TRP  76           HB1      TRP  76   4.304   0.749 -11.835
  625    HD1  TRP  76           HD1      TRP  76   7.676   0.943 -12.833
  626    HE1  TRP  76           HE1      TRP  76   8.106   2.716 -14.642
  627    HE3  TRP  76           HE3      TRP  76   3.363   3.632 -12.352
  628    HZ2  TRP  76           HZ2      TRP  76   6.788   4.954 -15.726
  629    HZ3  TRP  76           HZ3      TRP  76   3.025   5.578 -13.822
  630    HH2  TRP  76           HH2      TRP  76   4.702   6.224 -15.472
  631    H    LEU  77           HN       LEU  77   6.531   0.965  -8.743
  632    HA   LEU  77           HA       LEU  77   5.090  -1.197  -7.728
  633    HB2  LEU  77           HB2      LEU  77   7.559  -1.035  -7.738
  634    HB3  LEU  77           HB1      LEU  77   7.458   0.163  -6.465
  635    HG   LEU  77           HG       LEU  77   8.055  -2.244  -5.810
  636   HD11  LEU  77          HD11      LEU  77   7.074  -2.027  -3.687
  637   HD12  LEU  77          HD12      LEU  77   5.710  -1.107  -4.323
  638   HD13  LEU  77          HD13      LEU  77   7.316  -0.380  -4.273
  639   HD21  LEU  77          HD21      LEU  77   6.334  -3.364  -7.133
  640   HD22  LEU  77          HD22      LEU  77   5.082  -2.596  -6.156
  641   HD23  LEU  77          HD23      LEU  77   6.190  -3.752  -5.419
  642    H    ILE  78           HN       ILE  78   5.583   2.030  -6.439
  643    HA   ILE  78           HA       ILE  78   4.461   1.576  -3.914
  644    HB   ILE  78           HB       ILE  78   4.570   4.063  -5.621
  645   HG12  ILE  78          HG12      ILE  78   6.058   3.430  -3.072
  646   HG13  ILE  78          HG11      ILE  78   6.678   2.999  -4.661
  647   HG21  ILE  78          HG21      ILE  78   2.697   4.421  -4.218
  648   HG22  ILE  78          HG22      ILE  78   4.047   5.293  -3.492
  649   HG23  ILE  78          HG23      ILE  78   3.531   3.748  -2.817
  650   HD11  ILE  78          HD11      ILE  78   7.530   5.148  -3.626
  651   HD12  ILE  78          HD12      ILE  78   5.929   5.815  -3.954
  652   HD13  ILE  78          HD13      ILE  78   6.936   5.242  -5.284
  653    H    LYS  79           HN       LYS  79   2.920   2.936  -6.838
  654    HA   LYS  79           HA       LYS  79   0.310   2.940  -5.719
  655    HB2  LYS  79           HB2      LYS  79  -0.477   3.323  -8.011
  656    HB3  LYS  79           HB1      LYS  79   0.887   4.356  -7.622
  657    HG2  LYS  79           HG2      LYS  79   2.371   2.856  -8.849
  658    HG3  LYS  79           HG1      LYS  79   0.997   1.823  -9.239
  659    HD2  LYS  79           HD2      LYS  79   1.243   3.120 -11.146
  660    HD3  LYS  79           HD1      LYS  79  -0.032   3.955 -10.258
  661    HE2  LYS  79           HE2      LYS  79   1.473   5.630  -9.509
  662    HE3  LYS  79           HE1      LYS  79   2.874   4.712 -10.065
  663    HZ1  LYS  79           HZ1      LYS  79   2.359   6.499 -11.597
  664    HZ2  LYS  79           HZ2      LYS  79   0.785   5.913 -11.807
  665    HZ3  LYS  79           HZ3      LYS  79   2.103   5.004 -12.345
  666    H    GLN  80           HN       GLN  80   2.070   0.620  -7.675
  667    HA   GLN  80           HA       GLN  80  -0.108  -1.151  -8.047
  668    HB2  GLN  80           HB2      GLN  80   2.873  -1.519  -8.289
  669    HB3  GLN  80           HB1      GLN  80   1.717  -2.793  -8.655
  670    HG2  GLN  80           HG2      GLN  80   0.735  -1.460 -10.406
  671    HG3  GLN  80           HG1      GLN  80   1.775  -0.099  -9.993
  672   HE21  GLN  80          HE21      GLN  80   3.976  -2.125  -9.479
  673   HE22  GLN  80          HE22      GLN  80   4.585  -2.467 -11.054
  674    H    ALA  81           HN       ALA  81   2.620  -1.103  -5.756
  675    HA   ALA  81           HA       ALA  81   2.256  -3.534  -4.540
  676    HB1  ALA  81           HB1      ALA  81   3.087  -2.380  -2.415
  677    HB2  ALA  81           HB2      ALA  81   3.179  -0.921  -3.403
  678    HB3  ALA  81           HB3      ALA  81   4.130  -2.341  -3.836
  679    H    ILE  82           HN       ILE  82   0.479  -0.519  -3.872
  680    HA   ILE  82           HA       ILE  82  -0.978  -1.853  -1.796
  681    HB   ILE  82           HB       ILE  82  -0.701   0.510  -1.581
  682   HG12  ILE  82          HG12      ILE  82  -3.036   1.255  -1.248
  683   HG13  ILE  82          HG11      ILE  82  -3.595  -0.145  -2.156
  684   HG21  ILE  82          HG21      ILE  82  -2.247   0.812  -4.144
  685   HG22  ILE  82          HG22      ILE  82  -0.525   1.120  -3.917
  686   HG23  ILE  82          HG23      ILE  82  -1.717   2.128  -3.097
  687   HD11  ILE  82          HD11      ILE  82  -1.979  -0.321   0.371
  688   HD12  ILE  82          HD12      ILE  82  -2.796  -1.634  -0.479
  689   HD13  ILE  82          HD13      ILE  82  -3.741  -0.374   0.313
  690    H    PHE  83           HN       PHE  83  -2.008  -0.876  -5.129
  691    HA   PHE  83           HA       PHE  83  -4.540  -2.206  -4.696
  692    HB2  PHE  83           HB2      PHE  83  -5.245  -1.252  -6.636
  693    HB3  PHE  83           HB1      PHE  83  -3.841  -0.226  -6.392
  694    HD1  PHE  83           HD2      PHE  83  -5.112  -3.165  -8.242
  695    HD2  PHE  83           HD1      PHE  83  -2.064  -0.210  -7.940
  696    HE1  PHE  83           HE2      PHE  83  -4.271  -3.815 -10.458
  697    HE2  PHE  83           HE1      PHE  83  -1.224  -0.849 -10.161
  698    HZ   PHE  83           HZ       PHE  83  -2.324  -2.656 -11.422
  699    H    ASN  84           HN       ASN  84  -1.510  -3.005  -6.226
  700    HA   ASN  84           HA       ASN  84  -2.393  -5.433  -7.382
  701    HB2  ASN  84           HB2      ASN  84  -0.300  -4.175  -8.061
  702    HB3  ASN  84           HB1      ASN  84   0.435  -4.770  -6.577
  703   HD21  ASN  84          HD21      ASN  84   2.011  -5.726  -7.979
  704   HD22  ASN  84          HD22      ASN  84   1.678  -7.230  -8.754
  705    H    TYR  85           HN       TYR  85  -1.325  -4.420  -4.193
  706    HA   TYR  85           HA       TYR  85  -0.802  -6.985  -3.146
  707    HB2  TYR  85           HB2      TYR  85  -0.302  -5.144  -1.704
  708    HB3  TYR  85           HB1      TYR  85  -1.910  -4.464  -1.889
  709    HD1  TYR  85           HD2      TYR  85  -0.897  -7.956  -0.977
  710    HD2  TYR  85           HD1      TYR  85  -2.763  -4.337   0.255
  711    HE1  TYR  85           HE2      TYR  85  -1.588  -9.034   1.122
  712    HE2  TYR  85           HE1      TYR  85  -3.458  -5.404   2.355
  713    HH   TYR  85           HH       TYR  85  -2.910  -7.223   3.754
  714    H    LEU  86           HN       LEU  86  -3.661  -5.035  -3.547
  715    HA   LEU  86           HA       LEU  86  -5.538  -6.803  -2.460
  716    HB2  LEU  86           HB2      LEU  86  -5.947  -4.790  -4.658
  717    HB3  LEU  86           HB1      LEU  86  -7.201  -5.492  -3.653
  718    HG   LEU  86           HG       LEU  86  -4.990  -3.663  -2.710
  719   HD11  LEU  86          HD11      LEU  86  -7.942  -3.135  -2.743
  720   HD12  LEU  86          HD12      LEU  86  -6.877  -2.690  -4.077
  721   HD13  LEU  86          HD13      LEU  86  -6.621  -1.997  -2.476
  722   HD21  LEU  86          HD21      LEU  86  -6.231  -3.670  -0.568
  723   HD22  LEU  86          HD22      LEU  86  -5.515  -5.232  -0.965
  724   HD23  LEU  86          HD23      LEU  86  -7.244  -4.971  -1.195
  725    H    GLU  87           HN       GLU  87  -4.459  -6.330  -5.808
  726    HA   GLU  87           HA       GLU  87  -6.096  -8.331  -6.950
  727    HB2  GLU  87           HB2      GLU  87  -5.040  -6.498  -8.243
  728    HB3  GLU  87           HB1      GLU  87  -3.467  -7.238  -7.976
  729    HG2  GLU  87           HG2      GLU  87  -4.172  -9.215  -9.218
  730    HG3  GLU  87           HG1      GLU  87  -5.760  -8.492  -9.474
  731    H    LYS  88           HN       LYS  88  -2.748  -8.389  -5.795
  732    HA   LYS  88           HA       LYS  88  -2.225 -11.061  -6.598
  733    HB2  LYS  88           HB2      LYS  88  -0.472  -9.340  -6.197
  734    HB3  LYS  88           HB1      LYS  88  -0.792  -9.468  -4.472
  735    HG2  LYS  88           HG2      LYS  88  -0.164 -11.846  -4.557
  736    HG3  LYS  88           HG1      LYS  88   0.218 -11.662  -6.270
  737    HD2  LYS  88           HD2      LYS  88   1.506 -10.001  -4.117
  738    HD3  LYS  88           HD1      LYS  88   2.172 -11.539  -4.664
  739    HE2  LYS  88           HE2      LYS  88   2.068 -10.521  -7.017
  740    HE3  LYS  88           HE1      LYS  88   1.850  -8.977  -6.193
  741    HZ1  LYS  88           HZ1      LYS  88   3.927  -9.318  -5.038
  742    HZ2  LYS  88           HZ2      LYS  88   4.182  -9.423  -6.708
  743    HZ3  LYS  88           HZ3      LYS  88   4.134 -10.832  -5.772
  744    H    LEU  89           HN       LEU  89  -3.309  -9.650  -3.524
  745    HA   LEU  89           HA       LEU  89  -3.122 -12.125  -2.116
  746    HB2  LEU  89           HB2      LEU  89  -4.012 -11.033  -0.274
  747    HB3  LEU  89           HB1      LEU  89  -3.214  -9.734  -1.134
  748    HG   LEU  89           HG       LEU  89  -5.661  -9.400  -2.140
  749   HD11  LEU  89          HD11      LEU  89  -7.210 -10.641  -1.145
  750   HD12  LEU  89          HD12      LEU  89  -6.894  -9.740   0.338
  751   HD13  LEU  89          HD13      LEU  89  -6.049 -11.258   0.029
  752   HD21  LEU  89          HD21      LEU  89  -6.013  -7.691  -0.445
  753   HD22  LEU  89          HD22      LEU  89  -4.323  -7.733  -0.952
  754   HD23  LEU  89          HD23      LEU  89  -4.800  -8.450   0.586
  755    H    GLU  90           HN       GLU  90  -5.439 -10.619  -4.149
  756    HA   GLU  90           HA       GLU  90  -7.394 -11.234  -5.060
  757    HB2  GLU  90           HB2      GLU  90  -6.404 -13.989  -4.294
  758    HB3  GLU  90           HB1      GLU  90  -7.794 -13.692  -5.323
  759    HG2  GLU  90           HG2      GLU  90  -6.360 -12.535  -6.938
  760    HG3  GLU  90           HG1      GLU  90  -4.966 -12.826  -5.903
  Start of MODEL   15
    1    H1   MET   1           HT1      MET   1   3.652  -0.313  12.955
    2    H2   MET   1           HT2      MET   1   3.346   1.069  12.027
    3    H3   MET   1           HT3      MET   1   3.557   1.205  13.699
    4    HA   MET   1           HA       MET   1   5.839   0.400  13.465
    5    HB2  MET   1           HB2      MET   1   5.101  -0.525  11.063
    6    HB3  MET   1           HB1      MET   1   5.736   1.035  10.557
    7    HG2  MET   1           HG2      MET   1   7.872   0.518  11.628
    8    HG3  MET   1           HG1      MET   1   7.236  -1.044  12.136
    9    HE1  MET   1           HE1      MET   1   6.644  -2.922  10.719
   10    HE2  MET   1           HE2      MET   1   7.119  -3.175   9.041
   11    HE3  MET   1           HE3      MET   1   5.696  -2.203   9.416
   12    H    ALA   2           HN       ALA   2   7.253   2.188  11.479
   13    HA   ALA   2           HA       ALA   2   6.497   4.732  12.763
   14    HB1  ALA   2           HB1      ALA   2   8.673   3.836  13.500
   15    HB2  ALA   2           HB2      ALA   2   8.838   5.367  12.641
   16    HB3  ALA   2           HB3      ALA   2   9.229   3.853  11.826
   17    H    THR   3           HN       THR   3   5.309   3.780  10.398
   18    HA   THR   3           HA       THR   3   6.551   4.752   8.065
   19    HB   THR   3           HB       THR   3   4.281   4.519   7.043
   20    HG1  THR   3           HG1      THR   3   2.670   3.533   8.435
   21   HG21  THR   3          HG21      THR   3   5.313   2.232   8.717
   22   HG22  THR   3          HG22      THR   3   5.688   2.585   7.031
   23   HG23  THR   3          HG23      THR   3   4.067   2.058   7.481
   24    H    THR   4           HN       THR   4   6.651   6.718   7.214
   25    HA   THR   4           HA       THR   4   5.319   8.930   8.587
   26    HB   THR   4           HB       THR   4   6.838  10.333   7.094
   27    HG1  THR   4           HG1      THR   4   7.389   7.855   6.123
   28   HG21  THR   4          HG21      THR   4   8.040   8.400   9.077
   29   HG22  THR   4          HG22      THR   4   7.379   9.999   9.418
   30   HG23  THR   4          HG23      THR   4   8.856   9.840   8.468
   31    H    THR   5           HN       THR   5   4.384  10.695   7.218
   32    HA   THR   5           HA       THR   5   2.516   9.569   5.385
   33    HB   THR   5           HB       THR   5   3.005  12.514   5.761
   34    HG1  THR   5           HG1      THR   5   1.125  11.460   7.418
   35   HG21  THR   5          HG21      THR   5   0.463  10.936   5.333
   36   HG22  THR   5          HG22      THR   5   1.359  11.755   4.054
   37   HG23  THR   5          HG23      THR   5   0.627  12.692   5.356
   38    H    LEU   6           HN       LEU   6   3.061   8.980   3.414
   39    HA   LEU   6           HA       LEU   6   4.704  10.787   1.767
   40    HB2  LEU   6           HB2      LEU   6   4.657   7.767   1.597
   41    HB3  LEU   6           HB1      LEU   6   5.627   8.845   0.617
   42    HG   LEU   6           HG       LEU   6   5.962   8.258   3.560
   43   HD11  LEU   6          HD11      LEU   6   6.829   6.752   1.582
   44   HD12  LEU   6          HD12      LEU   6   7.827   7.068   3.000
   45   HD13  LEU   6          HD13      LEU   6   8.098   7.975   1.512
   46   HD21  LEU   6          HD21      LEU   6   6.403  10.595   3.297
   47   HD22  LEU   6          HD22      LEU   6   7.349  10.305   1.838
   48   HD23  LEU   6          HD23      LEU   6   7.951   9.756   3.402
   49    H    GLY   7           HN       GLY   7   3.974  11.084  -0.361
   50    HA2  GLY   7           HA2      GLY   7   1.193  10.676  -0.799
   51    HA3  GLY   7           HA1      GLY   7   2.340  11.310  -1.969
   52    H    VAL   8           HN       VAL   8   0.150   8.985  -1.594
   53    HA   VAL   8           HA       VAL   8   1.563   7.112  -3.374
   54    HB   VAL   8           HB       VAL   8  -0.280   6.307  -1.105
   55   HG11  VAL   8          HG11      VAL   8   0.556   3.987  -1.698
   56   HG12  VAL   8          HG12      VAL   8   1.128   4.689  -3.212
   57   HG13  VAL   8          HG13      VAL   8  -0.590   4.718  -2.821
   58   HG21  VAL   8          HG21      VAL   8   1.867   7.005  -0.247
   59   HG22  VAL   8          HG22      VAL   8   2.701   5.985  -1.419
   60   HG23  VAL   8          HG23      VAL   8   1.733   5.249  -0.142
   61    H    LYS   9           HN       LYS   9  -0.148   5.698  -4.587
   62    HA   LYS   9           HA       LYS   9  -2.416   7.458  -5.224
   63    HB2  LYS   9           HB2      LYS   9  -0.849   5.576  -6.983
   64    HB3  LYS   9           HB1      LYS   9  -2.382   6.287  -7.469
   65    HG2  LYS   9           HG2      LYS   9  -1.476   8.490  -7.384
   66    HG3  LYS   9           HG1      LYS   9   0.012   7.908  -6.640
   67    HD2  LYS   9           HD2      LYS   9   0.619   8.205  -8.864
   68    HD3  LYS   9           HD1      LYS   9   0.257   6.482  -8.779
   69    HE2  LYS   9           HE2      LYS   9  -1.996   8.261  -9.472
   70    HE3  LYS   9           HE1      LYS   9  -0.716   8.120 -10.675
   71    HZ1  LYS   9           HZ1      LYS   9  -2.272   6.463 -11.169
   72    HZ2  LYS   9           HZ2      LYS   9  -2.417   5.968  -9.559
   73    HZ3  LYS   9           HZ3      LYS   9  -0.994   5.646 -10.421
   74    H    LEU  10           HN       LEU  10  -4.391   6.737  -4.907
   75    HA   LEU  10           HA       LEU  10  -4.903   3.847  -4.735
   76    HB2  LEU  10           HB2      LEU  10  -5.270   5.912  -2.662
   77    HB3  LEU  10           HB1      LEU  10  -6.624   4.823  -2.884
   78    HG   LEU  10           HG       LEU  10  -3.838   3.788  -2.434
   79   HD11  LEU  10          HD11      LEU  10  -5.897   4.608  -0.396
   80   HD12  LEU  10          HD12      LEU  10  -4.239   5.190  -0.547
   81   HD13  LEU  10          HD13      LEU  10  -4.549   3.527  -0.047
   82   HD21  LEU  10          HD21      LEU  10  -6.623   2.688  -2.248
   83   HD22  LEU  10          HD22      LEU  10  -5.253   1.904  -1.465
   84   HD23  LEU  10          HD23      LEU  10  -5.269   2.105  -3.217
   85    H    ASP  11           HN       ASP  11  -6.767   3.207  -5.673
   86    HA   ASP  11           HA       ASP  11  -8.394   5.219  -7.048
   87    HB2  ASP  11           HB2      ASP  11  -7.397   3.091  -8.157
   88    HB3  ASP  11           HB1      ASP  11  -8.697   2.242  -7.334
   89    H    ASP  12           HN       ASP  12 -10.813   4.815  -7.022
   90    HA   ASP  12           HA       ASP  12 -11.781   4.800  -4.375
   91    HB2  ASP  12           HB2      ASP  12 -13.095   4.754  -7.057
   92    HB3  ASP  12           HB1      ASP  12 -14.073   4.391  -5.641
   93    HA   PRO  13           HA       PRO  13 -13.625   0.340  -5.360
   94    HB2  PRO  13           HB2      PRO  13 -11.992  -1.067  -7.112
   95    HB3  PRO  13           HB1      PRO  13 -13.552  -0.347  -7.517
   96    HG2  PRO  13           HG2      PRO  13 -10.797   0.717  -7.964
   97    HG3  PRO  13           HG1      PRO  13 -12.219   0.798  -9.023
   98    HD2  PRO  13           HD2      PRO  13 -11.443   2.920  -7.603
   99    HD3  PRO  13           HD1      PRO  13 -13.167   2.548  -7.820
  100    H    THR  14           HN       THR  14 -10.094   0.846  -5.575
  101    HA   THR  14           HA       THR  14  -9.526  -1.527  -4.103
  102    HB   THR  14           HB       THR  14  -7.471  -1.142  -4.846
  103    HG1  THR  14           HG1      THR  14  -6.489  -0.371  -3.153
  104   HG21  THR  14          HG21      THR  14  -6.795   0.972  -5.926
  105   HG22  THR  14          HG22      THR  14  -8.326   1.685  -5.418
  106   HG23  THR  14          HG23      THR  14  -8.315   0.328  -6.546
  107    H    ARG  15           HN       ARG  15 -10.071   1.845  -3.248
  108    HA   ARG  15           HA       ARG  15  -9.284   1.715  -0.554
  109    HB2  ARG  15           HB2      ARG  15 -10.087   3.724  -2.085
  110    HB3  ARG  15           HB1      ARG  15 -11.660   3.344  -1.406
  111    HG2  ARG  15           HG2      ARG  15  -9.251   3.934   0.295
  112    HG3  ARG  15           HG1      ARG  15 -10.354   5.183  -0.278
  113    HD2  ARG  15           HD2      ARG  15 -11.239   4.731   1.796
  114    HD3  ARG  15           HD1      ARG  15 -12.178   3.630   0.787
  115    HE   ARG  15           HE       ARG  15 -10.950   1.822   1.625
  116   HH11  ARG  15          HH21      ARG  15 -10.113   4.844   3.150
  117   HH12  ARG  15          HH22      ARG  15  -9.103   4.103   4.349
  118   HH21  ARG  15          HH11      ARG  15  -9.635   0.833   3.184
  119   HH22  ARG  15          HH12      ARG  15  -8.818   1.803   4.369
  120    H    GLU  16           HN       GLU  16 -12.418   1.151  -2.121
  121    HA   GLU  16           HA       GLU  16 -13.893   0.470   0.162
  122    HB2  GLU  16           HB2      GLU  16 -14.175  -0.444  -2.707
  123    HB3  GLU  16           HB1      GLU  16 -15.398  -0.680  -1.464
  124    HG2  GLU  16           HG2      GLU  16 -15.616   1.734  -1.205
  125    HG3  GLU  16           HG1      GLU  16 -14.371   1.983  -2.428
  126    H    ARG  17           HN       ARG  17 -12.058  -1.554  -2.103
  127    HA   ARG  17           HA       ARG  17 -12.583  -4.027  -0.867
  128    HB2  ARG  17           HB2      ARG  17 -11.580  -3.729  -3.148
  129    HB3  ARG  17           HB1      ARG  17 -10.070  -3.276  -2.368
  130    HG2  ARG  17           HG2      ARG  17 -10.092  -5.499  -1.222
  131    HG3  ARG  17           HG1      ARG  17 -11.472  -5.934  -2.232
  132    HD2  ARG  17           HD2      ARG  17  -8.819  -5.028  -3.327
  133    HD3  ARG  17           HD1      ARG  17  -9.234  -6.716  -3.062
  134    HE   ARG  17           HE       ARG  17 -10.720  -6.635  -4.848
  135   HH11  ARG  17          HH21      ARG  17  -9.174  -3.529  -4.337
  136   HH12  ARG  17          HH22      ARG  17  -9.615  -2.909  -5.892
  137   HH21  ARG  17          HH11      ARG  17 -11.295  -5.825  -6.893
  138   HH22  ARG  17          HH12      ARG  17 -10.826  -4.222  -7.356
  139    H    LEU  18           HN       LEU  18 -10.184  -1.534  -0.314
  140    HA   LEU  18           HA       LEU  18  -8.583  -2.906   1.532
  141    HB2  LEU  18           HB2      LEU  18  -8.954  -0.135   0.695
  142    HB3  LEU  18           HB1      LEU  18  -8.560  -0.276   2.396
  143    HG   LEU  18           HG       LEU  18  -6.568  -1.694   1.682
  144   HD11  LEU  18          HD11      LEU  18  -5.796  -1.572  -0.545
  145   HD12  LEU  18          HD12      LEU  18  -7.065  -0.432  -0.994
  146   HD13  LEU  18          HD13      LEU  18  -7.476  -2.105  -0.616
  147   HD21  LEU  18          HD21      LEU  18  -6.453   1.105   0.615
  148   HD22  LEU  18          HD22      LEU  18  -5.206   0.188   1.462
  149   HD23  LEU  18          HD23      LEU  18  -6.616   0.778   2.340
  150    H    LYS  19           HN       LYS  19 -11.726  -1.366   1.829
  151    HA   LYS  19           HA       LYS  19 -11.758  -1.284   4.663
  152    HB2  LYS  19           HB2      LYS  19 -13.437  -0.054   3.308
  153    HB3  LYS  19           HB1      LYS  19 -14.134  -1.593   2.815
  154    HG2  LYS  19           HG2      LYS  19 -14.683  -2.092   5.149
  155    HG3  LYS  19           HG1      LYS  19 -13.988  -0.548   5.640
  156    HD2  LYS  19           HD2      LYS  19 -15.656   0.628   4.281
  157    HD3  LYS  19           HD1      LYS  19 -16.352  -0.922   3.802
  158    HE2  LYS  19           HE2      LYS  19 -17.717  -0.110   5.553
  159    HE3  LYS  19           HE1      LYS  19 -16.717  -1.375   6.263
  160    HZ1  LYS  19           HZ1      LYS  19 -15.359   0.223   7.315
  161    HZ2  LYS  19           HZ2      LYS  19 -16.949   0.727   7.596
  162    HZ3  LYS  19           HZ3      LYS  19 -16.014   1.501   6.422
  163    H    ALA  20           HN       ALA  20 -12.665  -3.652   2.267
  164    HA   ALA  20           HA       ALA  20 -13.599  -5.660   4.003
  165    HB1  ALA  20           HB1      ALA  20 -13.867  -5.734   1.538
  166    HB2  ALA  20           HB2      ALA  20 -13.199  -7.228   2.195
  167    HB3  ALA  20           HB3      ALA  20 -12.143  -6.071   1.385
  168    H    ALA  21           HN       ALA  21 -10.362  -4.843   2.845
  169    HA   ALA  21           HA       ALA  21  -8.979  -6.940   4.150
  170    HB1  ALA  21           HB1      ALA  21  -7.896  -4.203   3.481
  171    HB2  ALA  21           HB2      ALA  21  -8.030  -5.523   2.321
  172    HB3  ALA  21           HB3      ALA  21  -6.972  -5.685   3.723
  173    H    ALA  22           HN       ALA  22  -9.908  -3.677   5.061
  174    HA   ALA  22           HA       ALA  22  -8.659  -3.511   7.554
  175    HB1  ALA  22           HB1      ALA  22 -10.003  -1.645   7.972
  176    HB2  ALA  22           HB2      ALA  22 -11.341  -2.288   7.021
  177    HB3  ALA  22           HB3      ALA  22  -9.896  -1.684   6.211
  178    H    GLN  23           HN       GLN  23 -11.729  -4.788   6.560
  179    HA   GLN  23           HA       GLN  23 -12.777  -5.393   9.098
  180    HB2  GLN  23           HB2      GLN  23 -13.266  -6.620   6.379
  181    HB3  GLN  23           HB1      GLN  23 -14.193  -7.046   7.813
  182    HG2  GLN  23           HG2      GLN  23 -13.968  -4.255   6.720
  183    HG3  GLN  23           HG1      GLN  23 -15.279  -5.363   6.328
  184   HE21  GLN  23          HE21      GLN  23 -13.968  -3.191   8.631
  185   HE22  GLN  23          HE22      GLN  23 -15.233  -3.310   9.802
  186    H    SER  24           HN       SER  24 -10.744  -7.166   6.858
  187    HA   SER  24           HA       SER  24 -10.638  -9.618   8.183
  188    HB2  SER  24           HB2      SER  24  -8.524  -8.272   6.481
  189    HB3  SER  24           HB1      SER  24  -8.543  -9.982   6.914
  190    HG   SER  24           HG       SER  24 -10.034  -8.612   5.038
  191    H    ILE  25           HN       ILE  25  -8.865  -6.609   8.731
  192    HA   ILE  25           HA       ILE  25  -7.409  -7.928  10.927
  193    HB   ILE  25           HB       ILE  25  -5.967  -6.997   9.159
  194   HG12  ILE  25          HG12      ILE  25  -4.420  -5.772  10.566
  195   HG13  ILE  25          HG11      ILE  25  -5.704  -5.375  11.701
  196   HG21  ILE  25          HG21      ILE  25  -5.796  -4.452   9.083
  197   HG22  ILE  25          HG22      ILE  25  -7.396  -4.454   9.827
  198   HG23  ILE  25          HG23      ILE  25  -7.153  -5.216   8.255
  199   HD11  ILE  25          HD11      ILE  25  -4.770  -8.176  11.131
  200   HD12  ILE  25          HD12      ILE  25  -5.872  -7.649  12.404
  201   HD13  ILE  25          HD13      ILE  25  -4.175  -7.176  12.456
  202    H    ASP  26           HN       ASP  26 -10.144  -6.531  10.657
  203    HA   ASP  26           HA       ASP  26 -11.508  -5.135  11.786
  204    HB2  ASP  26           HB2      ASP  26 -11.487  -5.396  14.239
  205    HB3  ASP  26           HB1      ASP  26 -11.371  -6.928  13.392
  206    H    ARG  27           HN       ARG  27  -9.686  -3.570  10.601
  207    HA   ARG  27           HA       ARG  27  -9.052  -1.580  12.683
  208    HB2  ARG  27           HB2      ARG  27  -7.531  -2.261  10.178
  209    HB3  ARG  27           HB1      ARG  27  -7.274  -0.766  11.064
  210    HG2  ARG  27           HG2      ARG  27  -6.932  -3.530  12.199
  211    HG3  ARG  27           HG1      ARG  27  -5.629  -2.498  11.611
  212    HD2  ARG  27           HD2      ARG  27  -6.953  -0.855  13.367
  213    HD3  ARG  27           HD1      ARG  27  -7.077  -2.433  14.146
  214    HE   ARG  27           HE       ARG  27  -4.712  -0.845  13.812
  215   HH11  ARG  27          HH21      ARG  27  -5.928  -4.099  14.241
  216   HH12  ARG  27          HH22      ARG  27  -4.438  -4.707  14.890
  217   HH21  ARG  27          HH11      ARG  27  -2.730  -1.657  14.658
  218   HH22  ARG  27          HH12      ARG  27  -2.621  -3.322  15.126
  219    H    THR  28           HN       THR  28  -8.915   0.649  11.885
  220    HA   THR  28           HA       THR  28 -11.308   1.359  10.540
  221    HB   THR  28           HB       THR  28  -9.003   3.217  11.138
  222    HG1  THR  28           HG1      THR  28 -10.254   3.428  13.230
  223   HG21  THR  28          HG21      THR  28 -10.889   4.178   9.910
  224   HG22  THR  28          HG22      THR  28 -10.778   4.857  11.534
  225   HG23  THR  28          HG23      THR  28 -11.995   3.633  11.172
  226    HA   PRO  29           HA       PRO  29 -10.202   1.184   6.242
  227    HB2  PRO  29           HB2      PRO  29 -11.445   3.912   6.351
  228    HB3  PRO  29           HB1      PRO  29 -11.648   2.637   5.142
  229    HG2  PRO  29           HG2      PRO  29 -13.471   2.990   7.045
  230    HG3  PRO  29           HG1      PRO  29 -13.008   1.360   6.523
  231    HD2  PRO  29           HD2      PRO  29 -12.386   2.778   9.045
  232    HD3  PRO  29           HD1      PRO  29 -12.472   1.037   8.719
  233    H    HIS  30           HN       HIS  30  -9.763   4.550   7.471
  234    HA   HIS  30           HA       HIS  30  -7.706   5.198   5.663
  235    HB2  HIS  30           HB2      HIS  30  -9.093   6.794   7.074
  236    HB3  HIS  30           HB1      HIS  30  -8.034   6.393   8.420
  237    HD1  HIS  30           HD1      HIS  30  -7.886   7.988   4.980
  238    HD2  HIS  30           HD2      HIS  30  -5.751   7.880   8.545
  239    HE1  HIS  30           HE1      HIS  30  -6.059   9.689   4.720
  240    HE2  HIS  30           HE2      HIS  30  -5.004   9.820   7.003
  241    H    TRP  31           HN       TRP  31  -7.531   4.128   9.037
  242    HA   TRP  31           HA       TRP  31  -4.746   4.103   9.249
  243    HB2  TRP  31           HB2      TRP  31  -6.240   3.965  11.215
  244    HB3  TRP  31           HB1      TRP  31  -6.716   2.341  10.717
  245    HD1  TRP  31           HD1      TRP  31  -5.380   0.467  11.842
  246    HE1  TRP  31           HE1      TRP  31  -3.063   0.263  12.943
  247    HE3  TRP  31           HE3      TRP  31  -3.668   5.214  11.032
  248    HZ2  TRP  31           HZ2      TRP  31  -0.814   1.897  13.419
  249    HZ3  TRP  31           HZ3      TRP  31  -1.424   5.814  11.840
  250    HH2  TRP  31           HH2      TRP  31  -0.027   4.188  13.010
  251    H    LEU  32           HN       LEU  32  -7.058   1.752   8.180
  252    HA   LEU  32           HA       LEU  32  -5.363  -0.425   7.831
  253    HB2  LEU  32           HB2      LEU  32  -7.816  -0.606   7.730
  254    HB3  LEU  32           HB1      LEU  32  -7.810   0.271   6.215
  255    HG   LEU  32           HG       LEU  32  -8.065  -2.291   6.145
  256   HD11  LEU  32          HD11      LEU  32  -7.264  -2.359   4.008
  257   HD12  LEU  32          HD12      LEU  32  -5.824  -1.421   4.399
  258   HD13  LEU  32          HD13      LEU  32  -7.388  -0.618   4.262
  259   HD21  LEU  32          HD21      LEU  32  -6.069  -3.609   6.176
  260   HD22  LEU  32          HD22      LEU  32  -6.191  -2.740   7.707
  261   HD23  LEU  32          HD23      LEU  32  -5.075  -2.180   6.461
  262    H    ILE  33           HN       ILE  33  -5.926   2.372   5.822
  263    HA   ILE  33           HA       ILE  33  -4.726   1.399   3.464
  264    HB   ILE  33           HB       ILE  33  -4.733   4.221   4.566
  265   HG12  ILE  33          HG12      ILE  33  -6.392   3.037   2.334
  266   HG13  ILE  33          HG11      ILE  33  -6.960   3.217   3.992
  267   HG21  ILE  33          HG21      ILE  33  -3.814   3.155   1.914
  268   HG22  ILE  33          HG22      ILE  33  -2.921   4.143   3.070
  269   HG23  ILE  33          HG23      ILE  33  -4.259   4.843   2.160
  270   HD11  ILE  33          HD11      ILE  33  -6.553   5.664   3.789
  271   HD12  ILE  33          HD12      ILE  33  -7.798   5.039   2.708
  272   HD13  ILE  33          HD13      ILE  33  -6.191   5.408   2.082
  273    H    LYS  34           HN       LYS  34  -3.459   3.065   6.298
  274    HA   LYS  34           HA       LYS  34  -0.737   3.138   5.501
  275    HB2  LYS  34           HB2      LYS  34  -1.615   2.838   8.368
  276    HB3  LYS  34           HB1      LYS  34  -0.248   3.742   7.732
  277    HG2  LYS  34           HG2      LYS  34  -3.163   4.460   7.593
  278    HG3  LYS  34           HG1      LYS  34  -1.868   5.325   8.420
  279    HD2  LYS  34           HD2      LYS  34  -0.877   5.957   6.323
  280    HD3  LYS  34           HD1      LYS  34  -2.009   4.938   5.432
  281    HE2  LYS  34           HE2      LYS  34  -3.796   6.428   6.661
  282    HE3  LYS  34           HE1      LYS  34  -2.452   7.566   6.760
  283    HZ1  LYS  34           HZ1      LYS  34  -4.059   7.528   4.706
  284    HZ2  LYS  34           HZ2      LYS  34  -3.009   6.320   4.171
  285    HZ3  LYS  34           HZ3      LYS  34  -2.416   7.865   4.516
  286    H    GLN  35           HN       GLN  35  -2.621   0.796   7.330
  287    HA   GLN  35           HA       GLN  35  -0.473  -0.986   7.797
  288    HB2  GLN  35           HB2      GLN  35  -3.445  -1.496   7.793
  289    HB3  GLN  35           HB1      GLN  35  -2.230  -2.631   8.363
  290    HG2  GLN  35           HG2      GLN  35  -1.521  -0.736   9.948
  291    HG3  GLN  35           HG1      GLN  35  -3.093  -0.036   9.563
  292   HE21  GLN  35          HE21      GLN  35  -3.995  -2.952   9.197
  293   HE22  GLN  35          HE22      GLN  35  -4.338  -3.466  10.809
  294    H    ALA  36           HN       ALA  36  -2.931  -0.717   5.299
  295    HA   ALA  36           HA       ALA  36  -2.721  -3.123   4.020
  296    HB1  ALA  36           HB1      ALA  36  -2.996  -1.509   1.885
  297    HB2  ALA  36           HB2      ALA  36  -3.441  -0.394   3.179
  298    HB3  ALA  36           HB3      ALA  36  -4.314  -1.915   2.983
  299    H    ILE  37           HN       ILE  37  -0.614  -0.286   3.629
  300    HA   ILE  37           HA       ILE  37   0.969  -1.664   1.694
  301    HB   ILE  37           HB       ILE  37   0.981   0.688   1.510
  302   HG12  ILE  37          HG12      ILE  37   3.395   1.260   1.715
  303   HG13  ILE  37          HG11      ILE  37   3.637  -0.242   2.601
  304   HG21  ILE  37          HG21      ILE  37   0.391   1.325   3.749
  305   HG22  ILE  37          HG22      ILE  37   1.841   2.194   3.248
  306   HG23  ILE  37          HG23      ILE  37   1.972   0.819   4.344
  307   HD11  ILE  37          HD11      ILE  37   3.072  -1.540   0.694
  308   HD12  ILE  37          HD12      ILE  37   4.249  -0.326   0.193
  309   HD13  ILE  37          HD13      ILE  37   2.542  -0.110  -0.192
  310    H    PHE  38           HN       PHE  38   1.603  -0.959   5.211
  311    HA   PHE  38           HA       PHE  38   4.073  -2.465   4.975
  312    HB2  PHE  38           HB2      PHE  38   4.598  -1.699   7.041
  313    HB3  PHE  38           HB1      PHE  38   3.239  -0.615   6.803
  314    HD1  PHE  38           HD1      PHE  38   4.200  -3.872   8.308
  315    HD2  PHE  38           HD2      PHE  38   1.431  -0.641   8.277
  316    HE1  PHE  38           HE1      PHE  38   3.166  -4.747  10.359
  317    HE2  PHE  38           HE2      PHE  38   0.388  -1.516  10.327
  318    HZ   PHE  38           HZ       PHE  38   1.255  -3.570  11.370
  319    H    ASN  39           HN       ASN  39   0.823  -3.173   6.036
  320    HA   ASN  39           HA       ASN  39   1.387  -5.767   7.004
  321    HB2  ASN  39           HB2      ASN  39  -0.695  -4.518   7.591
  322    HB3  ASN  39           HB1      ASN  39  -1.238  -4.736   5.930
  323   HD21  ASN  39          HD21      ASN  39   0.376  -6.990   8.155
  324   HD22  ASN  39          HD22      ASN  39  -0.887  -8.172   8.127
  325    H    TYR  40           HN       TYR  40   0.876  -4.354   3.864
  326    HA   TYR  40           HA       TYR  40   0.291  -6.695   2.426
  327    HB2  TYR  40           HB2      TYR  40   0.135  -4.763   1.110
  328    HB3  TYR  40           HB1      TYR  40   1.624  -4.088   1.752
  329    HD1  TYR  40           HD1      TYR  40   0.859  -7.319   0.006
  330    HD2  TYR  40           HD2      TYR  40   3.088  -3.697   0.031
  331    HE1  TYR  40           HE1      TYR  40   2.053  -8.045  -2.013
  332    HE2  TYR  40           HE2      TYR  40   4.293  -4.419  -1.985
  333    HH   TYR  40           HH       TYR  40   4.824  -6.351  -3.218
  334    H    LEU  41           HN       LEU  41   3.233  -5.139   3.475
  335    HA   LEU  41           HA       LEU  41   4.995  -7.077   2.421
  336    HB2  LEU  41           HB2      LEU  41   5.420  -5.110   4.645
  337    HB3  LEU  41           HB1      LEU  41   6.688  -6.029   3.853
  338    HG   LEU  41           HG       LEU  41   4.926  -3.949   2.548
  339   HD11  LEU  41          HD11      LEU  41   6.995  -3.470   4.176
  340   HD12  LEU  41          HD12      LEU  41   6.596  -2.463   2.785
  341   HD13  LEU  41          HD13      LEU  41   7.857  -3.687   2.653
  342   HD21  LEU  41          HD21      LEU  41   6.525  -4.270   0.631
  343   HD22  LEU  41          HD22      LEU  41   5.392  -5.592   0.905
  344   HD23  LEU  41          HD23      LEU  41   7.068  -5.744   1.432
  345    H    GLU  42           HN       GLU  42   3.720  -6.539   5.673
  346    HA   GLU  42           HA       GLU  42   5.010  -8.644   6.983
  347    HB2  GLU  42           HB2      GLU  42   3.830  -6.765   8.091
  348    HB3  GLU  42           HB1      GLU  42   2.297  -7.473   7.605
  349    HG2  GLU  42           HG2      GLU  42   2.881  -9.497   8.919
  350    HG3  GLU  42           HG1      GLU  42   4.317  -8.651   9.496
  351    H    LYS  43           HN       LYS  43   1.944  -8.584   5.241
  352    HA   LYS  43           HA       LYS  43   0.969 -11.087   6.042
  353    HB2  LYS  43           HB2      LYS  43  -0.332  -9.290   4.894
  354    HB3  LYS  43           HB1      LYS  43   0.476  -9.727   3.396
  355    HG2  LYS  43           HG2      LYS  43  -0.486 -11.974   3.538
  356    HG3  LYS  43           HG1      LYS  43  -1.309 -11.519   5.030
  357    HD2  LYS  43           HD2      LYS  43  -1.701 -10.024   2.449
  358    HD3  LYS  43           HD1      LYS  43  -2.676 -11.428   2.882
  359    HE2  LYS  43           HE2      LYS  43  -3.945  -9.587   3.582
  360    HE3  LYS  43           HE1      LYS  43  -3.189 -10.190   5.054
  361    HZ1  LYS  43           HZ1      LYS  43  -1.499  -8.280   3.872
  362    HZ2  LYS  43           HZ2      LYS  43  -2.280  -8.206   5.371
  363    HZ3  LYS  43           HZ3      LYS  43  -3.055  -7.620   3.982
  364    H    LEU  44           HN       LEU  44   3.085 -10.224   3.314
  365    HA   LEU  44           HA       LEU  44   3.015 -12.928   2.328
  366    HB2  LEU  44           HB2      LEU  44   4.858 -12.130   0.787
  367    HB3  LEU  44           HB1      LEU  44   3.287 -11.381   0.611
  368    HG   LEU  44           HG       LEU  44   4.469  -9.613   2.286
  369   HD11  LEU  44          HD11      LEU  44   6.741  -9.229   1.609
  370   HD12  LEU  44          HD12      LEU  44   6.671 -10.566   0.461
  371   HD13  LEU  44          HD13      LEU  44   6.599 -10.887   2.194
  372   HD21  LEU  44          HD21      LEU  44   4.686  -9.657  -0.721
  373   HD22  LEU  44          HD22      LEU  44   4.814  -8.230   0.308
  374   HD23  LEU  44          HD23      LEU  44   3.289  -9.111   0.207
  375    H    GLU  45           HN       GLU  45   4.946 -11.140   4.557
  376    HA   GLU  45           HA       GLU  45   7.207 -12.909   4.458
  377    HB2  GLU  45           HB2      GLU  45   6.406 -10.684   6.322
  378    HB3  GLU  45           HB1      GLU  45   7.825 -11.681   6.617
  379    HG2  GLU  45           HG2      GLU  45   8.747 -11.001   4.455
  380    HG3  GLU  45           HG1      GLU  45   7.327 -10.000   4.169
  381    H1   MET  46           HT1      MET  46  -3.690   0.049 -13.004
  382    H2   MET  46           HT2      MET  46  -3.308   1.446 -12.128
  383    H3   MET  46           HT3      MET  46  -3.563   1.538 -13.796
  384    HA   MET  46           HA       MET  46  -5.861   0.863 -13.499
  385    HB2  MET  46           HB2      MET  46  -5.115  -0.135 -11.134
  386    HB3  MET  46           HB1      MET  46  -5.666   1.442 -10.584
  387    HG2  MET  46           HG2      MET  46  -7.847   1.046 -11.606
  388    HG3  MET  46           HG1      MET  46  -7.299  -0.532 -12.167
  389    HE1  MET  46           HE1      MET  46  -6.735  -2.454 -10.817
  390    HE2  MET  46           HE2      MET  46  -7.201  -2.746  -9.142
  391    HE3  MET  46           HE3      MET  46  -5.742  -1.823  -9.502
  392    H    ALA  47           HN       ALA  47  -7.157   2.671 -11.452
  393    HA   ALA  47           HA       ALA  47  -6.318   5.213 -12.693
  394    HB1  ALA  47           HB1      ALA  47  -8.521   4.413 -13.458
  395    HB2  ALA  47           HB2      ALA  47  -8.635   5.929 -12.563
  396    HB3  ALA  47           HB3      ALA  47  -9.083   4.410 -11.786
  397    H    THR  48           HN       THR  48  -5.164   4.180 -10.355
  398    HA   THR  48           HA       THR  48  -6.375   5.126  -7.994
  399    HB   THR  48           HB       THR  48  -4.103   4.814  -6.991
  400    HG1  THR  48           HG1      THR  48  -2.530   3.816  -8.416
  401   HG21  THR  48          HG21      THR  48  -5.210   2.589  -8.701
  402   HG22  THR  48          HG22      THR  48  -5.568   2.921  -7.006
  403   HG23  THR  48          HG23      THR  48  -3.964   2.358  -7.474
  404    H    THR  49           HN       THR  49  -6.420   7.078  -7.094
  405    HA   THR  49           HA       THR  49  -5.013   9.274  -8.420
  406    HB   THR  49           HB       THR  49  -6.492  10.705  -6.924
  407    HG1  THR  49           HG1      THR  49  -7.127   8.237  -5.969
  408   HG21  THR  49          HG21      THR  49  -7.754   8.824  -8.919
  409   HG22  THR  49          HG22      THR  49  -7.050  10.408  -9.246
  410   HG23  THR  49          HG23      THR  49  -8.529  10.280  -8.295
  411    H    THR  50           HN       THR  50  -3.983  10.957  -7.048
  412    HA   THR  50           HA       THR  50  -2.179   9.752  -5.215
  413    HB   THR  50           HB       THR  50  -2.585  12.718  -5.539
  414    HG1  THR  50           HG1      THR  50  -0.733  11.488  -7.177
  415   HG21  THR  50          HG21      THR  50  -0.090  11.069  -5.098
  416   HG22  THR  50          HG22      THR  50  -0.986  11.887  -3.818
  417   HG23  THR  50          HG23      THR  50  -0.211  12.829  -5.091
  418    H    LEU  51           HN       LEU  51  -2.741   9.141  -3.260
  419    HA   LEU  51           HA       LEU  51  -4.334  10.958  -1.577
  420    HB2  LEU  51           HB2      LEU  51  -4.374   7.934  -1.477
  421    HB3  LEU  51           HB1      LEU  51  -5.303   9.014  -0.459
  422    HG   LEU  51           HG       LEU  51  -5.682   8.515  -3.412
  423   HD11  LEU  51          HD11      LEU  51  -6.585   6.995  -1.456
  424   HD12  LEU  51          HD12      LEU  51  -7.577   7.370  -2.865
  425   HD13  LEU  51          HD13      LEU  51  -7.815   8.256  -1.359
  426   HD21  LEU  51          HD21      LEU  51  -6.040  10.859  -3.087
  427   HD22  LEU  51          HD22      LEU  51  -6.988  10.564  -1.630
  428   HD23  LEU  51          HD23      LEU  51  -7.616  10.075  -3.204
  429    H    GLY  52           HN       GLY  52  -3.640  11.124   0.587
  430    HA2  GLY  52           HA2      GLY  52  -0.844  10.679   0.993
  431    HA3  GLY  52           HA1      GLY  52  -1.971  11.326   2.175
  432    H    VAL  53           HN       VAL  53   0.151   8.935   1.742
  433    HA   VAL  53           HA       VAL  53  -1.314   7.080   3.499
  434    HB   VAL  53           HB       VAL  53   0.500   6.259   1.214
  435   HG11  VAL  53          HG11      VAL  53  -0.414   3.958   1.761
  436   HG12  VAL  53          HG12      VAL  53  -0.963   4.649   3.289
  437   HG13  VAL  53          HG13      VAL  53   0.756   4.627   2.898
  438   HG21  VAL  53          HG21      VAL  53  -1.624   7.050   0.375
  439   HG22  VAL  53          HG22      VAL  53  -2.489   6.029   1.522
  440   HG23  VAL  53          HG23      VAL  53  -1.545   5.294   0.227
  441    H    LYS  54           HN       LYS  54   0.351   5.587   4.676
  442    HA   LYS  54           HA       LYS  54   2.673   7.260   5.354
  443    HB2  LYS  54           HB2      LYS  54   1.046   5.386   7.068
  444    HB3  LYS  54           HB1      LYS  54   2.599   6.041   7.571
  445    HG2  LYS  54           HG2      LYS  54   1.758   8.271   7.536
  446    HG3  LYS  54           HG1      LYS  54   0.255   7.751   6.777
  447    HD2  LYS  54           HD2      LYS  54  -0.322   8.036   9.022
  448    HD3  LYS  54           HD1      LYS  54  -0.069   6.298   8.869
  449    HE2  LYS  54           HE2      LYS  54   2.293   7.905   9.620
  450    HE3  LYS  54           HE1      LYS  54   1.010   7.796  10.824
  451    HZ1  LYS  54           HZ1      LYS  54   2.479   6.025  11.229
  452    HZ2  LYS  54           HZ2      LYS  54   2.551   5.578   9.601
  453    HZ3  LYS  54           HZ3      LYS  54   1.129   5.326  10.488
  454    H    LEU  55           HN       LEU  55   4.624   6.483   5.027
  455    HA   LEU  55           HA       LEU  55   5.046   3.583   4.784
  456    HB2  LEU  55           HB2      LEU  55   5.479   5.686   2.760
  457    HB3  LEU  55           HB1      LEU  55   6.796   4.547   2.954
  458    HG   LEU  55           HG       LEU  55   3.978   3.616   2.482
  459   HD11  LEU  55          HD11      LEU  55   6.061   4.421   0.462
  460   HD12  LEU  55          HD12      LEU  55   4.421   5.050   0.630
  461   HD13  LEU  55          HD13      LEU  55   4.680   3.392   0.088
  462   HD21  LEU  55          HD21      LEU  55   6.725   2.431   2.266
  463   HD22  LEU  55          HD22      LEU  55   5.332   1.712   1.463
  464   HD23  LEU  55          HD23      LEU  55   5.353   1.867   3.220
  465    H    ASP  56           HN       ASP  56   6.887   2.867   5.712
  466    HA   ASP  56           HA       ASP  56   8.582   4.796   7.122
  467    HB2  ASP  56           HB2      ASP  56   7.526   2.685   8.196
  468    HB3  ASP  56           HB1      ASP  56   8.784   1.805   7.342
  469    H    ASP  57           HN       ASP  57  10.985   4.318   7.074
  470    HA   ASP  57           HA       ASP  57  11.945   4.330   4.423
  471    HB2  ASP  57           HB2      ASP  57  13.244   4.220   7.102
  472    HB3  ASP  57           HB1      ASP  57  14.219   3.780   5.706
  473    HA   PRO  58           HA       PRO  58  13.650  -0.207   5.313
  474    HB2  PRO  58           HB2      PRO  58  11.972  -1.596   7.036
  475    HB3  PRO  58           HB1      PRO  58  13.556  -0.939   7.455
  476    HG2  PRO  58           HG2      PRO  58  10.840   0.208   7.931
  477    HG3  PRO  58           HG1      PRO  58  12.266   0.218   8.987
  478    HD2  PRO  58           HD2      PRO  58  11.559   2.395   7.616
  479    HD3  PRO  58           HD1      PRO  58  13.270   1.961   7.818
  480    H    THR  59           HN       THR  59  10.138   0.408   5.548
  481    HA   THR  59           HA       THR  59   9.494  -1.911   4.024
  482    HB   THR  59           HB       THR  59   7.454  -1.477   4.780
  483    HG1  THR  59           HG1      THR  59   6.499  -0.642   3.101
  484   HG21  THR  59          HG21      THR  59   6.846   0.635   5.904
  485   HG22  THR  59          HG22      THR  59   8.398   1.310   5.408
  486   HG23  THR  59          HG23      THR  59   8.345  -0.069   6.509
  487    H    ARG  60           HN       ARG  60  10.137   1.464   3.244
  488    HA   ARG  60           HA       ARG  60   9.349   1.414   0.548
  489    HB2  ARG  60           HB2      ARG  60  10.206   3.367   2.119
  490    HB3  ARG  60           HB1      ARG  60  11.770   2.956   1.438
  491    HG2  ARG  60           HG2      ARG  60   9.386   3.649  -0.260
  492    HG3  ARG  60           HG1      ARG  60  10.521   4.854   0.342
  493    HD2  ARG  60           HD2      ARG  60  11.405   4.420  -1.735
  494    HD3  ARG  60           HD1      ARG  60  12.304   3.268  -0.747
  495    HE   ARG  60           HE       ARG  60  11.036   1.518  -1.638
  496   HH11  ARG  60          HH21      ARG  60  10.252   4.599  -3.075
  497   HH12  ARG  60          HH22      ARG  60   9.222   3.915  -4.287
  498   HH21  ARG  60          HH11      ARG  60   9.688   0.602  -3.214
  499   HH22  ARG  60          HH12      ARG  60   8.886   1.623  -4.367
  500    H    GLU  61           HN       GLU  61  12.464   0.721   2.102
  501    HA   GLU  61           HA       GLU  61  13.915   0.048  -0.199
  502    HB2  GLU  61           HB2      GLU  61  14.188  -0.941   2.648
  503    HB3  GLU  61           HB1      GLU  61  15.404  -1.155   1.394
  504    HG2  GLU  61           HG2      GLU  61  15.696   1.235   1.212
  505    HG3  GLU  61           HG1      GLU  61  14.399   1.508   2.374
  506    H    ARG  62           HN       ARG  62  12.036  -1.978   2.031
  507    HA   ARG  62           HA       ARG  62  12.480  -4.437   0.737
  508    HB2  ARG  62           HB2      ARG  62  11.480  -4.150   3.025
  509    HB3  ARG  62           HB1      ARG  62   9.987  -3.642   2.248
  510    HG2  ARG  62           HG2      ARG  62   9.943  -5.847   1.072
  511    HG3  ARG  62           HG1      ARG  62  11.314  -6.336   2.069
  512    HD2  ARG  62           HD2      ARG  62   8.697  -5.365   3.195
  513    HD3  ARG  62           HD1      ARG  62   9.052  -7.062   2.899
  514    HE   ARG  62           HE       ARG  62  10.543  -7.064   4.677
  515   HH11  ARG  62          HH21      ARG  62   9.107  -3.904   4.223
  516   HH12  ARG  62          HH22      ARG  62   9.639  -3.295   5.752
  517   HH21  ARG  62          HH11      ARG  62  11.246  -6.267   6.697
  518   HH22  ARG  62          HH12      ARG  62  10.866  -4.644   7.169
  519    H    LEU  63           HN       LEU  63  10.164  -1.857   0.240
  520    HA   LEU  63           HA       LEU  63   8.517  -3.133  -1.634
  521    HB2  LEU  63           HB2      LEU  63   8.977  -0.396  -0.735
  522    HB3  LEU  63           HB1      LEU  63   8.584  -0.485  -2.440
  523    HG   LEU  63           HG       LEU  63   6.544  -1.852  -1.764
  524   HD11  LEU  63          HD11      LEU  63   5.772  -1.765   0.461
  525   HD12  LEU  63          HD12      LEU  63   7.064  -0.666   0.941
  526   HD13  LEU  63          HD13      LEU  63   7.438  -2.339   0.529
  527   HD21  LEU  63          HD21      LEU  63   6.521   0.925  -0.635
  528   HD22  LEU  63          HD22      LEU  63   5.243   0.069  -1.499
  529   HD23  LEU  63          HD23      LEU  63   6.672   0.630  -2.366
  530    H    LYS  64           HN       LYS  64  11.705  -1.683  -1.901
  531    HA   LYS  64           HA       LYS  64  11.739  -1.536  -4.730
  532    HB2  LYS  64           HB2      LYS  64  13.458  -0.386  -3.368
  533    HB3  LYS  64           HB1      LYS  64  14.096  -1.953  -2.881
  534    HG2  LYS  64           HG2      LYS  64  14.643  -2.457  -5.213
  535    HG3  LYS  64           HG1      LYS  64  14.007  -0.886  -5.699
  536    HD2  LYS  64           HD2      LYS  64  15.705   0.227  -4.343
  537    HD3  LYS  64           HD1      LYS  64  16.335  -1.342  -3.836
  538    HE2  LYS  64           HE2      LYS  64  17.740  -0.543  -5.588
  539    HE3  LYS  64           HE1      LYS  64  16.764  -1.853  -6.249
  540    HZ1  LYS  64           HZ1      LYS  64  15.340  -0.262  -7.311
  541    HZ2  LYS  64           HZ2      LYS  64  16.941   0.081  -7.736
  542    HZ3  LYS  64           HZ3      LYS  64  16.150   1.034  -6.583
  543    H    ALA  65           HN       ALA  65  12.566  -3.992  -2.395
  544    HA   ALA  65           HA       ALA  65  13.443  -5.983  -4.182
  545    HB1  ALA  65           HB1      ALA  65  13.700  -6.131  -1.720
  546    HB2  ALA  65           HB2      ALA  65  12.991  -7.586  -2.420
  547    HB3  ALA  65           HB3      ALA  65  11.966  -6.421  -1.581
  548    H    ALA  66           HN       ALA  66  10.231  -5.106  -3.001
  549    HA   ALA  66           HA       ALA  66   8.781  -7.116  -4.365
  550    HB1  ALA  66           HB1      ALA  66   7.792  -4.359  -3.632
  551    HB2  ALA  66           HB2      ALA  66   7.881  -5.709  -2.501
  552    HB3  ALA  66           HB3      ALA  66   6.819  -5.804  -3.906
  553    H    ALA  67           HN       ALA  67   9.808  -3.857  -5.188
  554    HA   ALA  67           HA       ALA  67   8.574  -3.585  -7.678
  555    HB1  ALA  67           HB1      ALA  67   9.976  -1.752  -8.044
  556    HB2  ALA  67           HB2      ALA  67  11.293  -2.464  -7.113
  557    HB3  ALA  67           HB3      ALA  67   9.870  -1.836  -6.284
  558    H    GLN  68           HN       GLN  68  11.599  -4.985  -6.717
  559    HA   GLN  68           HA       GLN  68  12.636  -5.560  -9.267
  560    HB2  GLN  68           HB2      GLN  68  13.077  -6.869  -6.579
  561    HB3  GLN  68           HB1      GLN  68  13.991  -7.293  -8.021
  562    HG2  GLN  68           HG2      GLN  68  13.865  -4.519  -6.872
  563    HG3  GLN  68           HG1      GLN  68  15.127  -5.685  -6.484
  564   HE21  GLN  68          HE21      GLN  68  13.985  -3.371  -8.716
  565   HE22  GLN  68          HE22      GLN  68  15.241  -3.542  -9.892
  566    H    SER  69           HN       SER  69  10.536  -7.302  -7.079
  567    HA   SER  69           HA       SER  69  10.362  -9.741  -8.432
  568    HB2  SER  69           HB2      SER  69   8.244  -8.366  -6.757
  569    HB3  SER  69           HB1      SER  69   8.299 -10.084  -7.150
  570    HG   SER  69           HG       SER  69  10.350  -8.710  -5.737
  571    H    ILE  70           HN       ILE  70   8.703  -6.668  -8.944
  572    HA   ILE  70           HA       ILE  70   7.205  -7.893 -11.168
  573    HB   ILE  70           HB       ILE  70   5.787  -6.969  -9.375
  574   HG12  ILE  70          HG12      ILE  70   4.277  -5.663 -10.748
  575   HG13  ILE  70          HG11      ILE  70   5.572  -5.276 -11.874
  576   HG21  ILE  70          HG21      ILE  70   5.687  -4.423  -9.233
  577   HG22  ILE  70          HG22      ILE  70   7.287  -4.450  -9.976
  578   HG23  ILE  70          HG23      ILE  70   7.021  -5.245  -8.424
  579   HD11  ILE  70          HD11      ILE  70   4.556  -8.061 -11.374
  580   HD12  ILE  70          HD12      ILE  70   5.673  -7.535 -12.633
  581   HD13  ILE  70          HD13      ILE  70   3.990  -7.011 -12.672
  582    H    ASP  71           HN       ASP  71   9.976  -6.573 -10.853
  583    HA   ASP  71           HA       ASP  71  11.377  -5.176 -11.937
  584    HB2  ASP  71           HB2      ASP  71  11.396  -5.393 -14.379
  585    HB3  ASP  71           HB1      ASP  71  11.175  -6.943 -13.587
  586    H    ARG  72           HN       ARG  72   9.634  -3.598 -10.715
  587    HA   ARG  72           HA       ARG  72   9.021  -1.542 -12.738
  588    HB2  ARG  72           HB2      ARG  72   7.503  -2.266 -10.244
  589    HB3  ARG  72           HB1      ARG  72   7.283  -0.730 -11.067
  590    HG2  ARG  72           HG2      ARG  72   6.839  -3.444 -12.287
  591    HG3  ARG  72           HG1      ARG  72   5.580  -2.364 -11.684
  592    HD2  ARG  72           HD2      ARG  72   6.985  -0.742 -13.389
  593    HD3  ARG  72           HD1      ARG  72   7.059  -2.304 -14.204
  594    HE   ARG  72           HE       ARG  72   4.752  -0.635 -13.861
  595   HH11  ARG  72          HH21      ARG  72   5.846  -3.928 -14.322
  596   HH12  ARG  72          HH22      ARG  72   4.358  -4.457 -15.039
  597   HH21  ARG  72          HH11      ARG  72   2.776  -1.332 -14.795
  598   HH22  ARG  72          HH12      ARG  72   2.610  -2.974 -15.313
  599    H    THR  73           HN       THR  73   8.974   0.662 -11.909
  600    HA   THR  73           HA       THR  73  11.383   1.270 -10.546
  601    HB   THR  73           HB       THR  73   9.135   3.207 -11.115
  602    HG1  THR  73           HG1      THR  73  10.452   3.409 -13.194
  603   HG21  THR  73          HG21      THR  73  11.048   4.086  -9.862
  604   HG22  THR  73          HG22      THR  73  10.958   4.801 -11.471
  605   HG23  THR  73          HG23      THR  73  12.139   3.536 -11.134
  606    HA   PRO  74           HA       PRO  74  10.258   1.020  -6.258
  607    HB2  PRO  74           HB2      PRO  74  11.592   3.707  -6.299
  608    HB3  PRO  74           HB1      PRO  74  11.748   2.397  -5.120
  609    HG2  PRO  74           HG2      PRO  74  13.587   2.735  -7.012
  610    HG3  PRO  74           HG1      PRO  74  13.069   1.110  -6.528
  611    HD2  PRO  74           HD2      PRO  74  12.503   2.602  -9.019
  612    HD3  PRO  74           HD1      PRO  74  12.525   0.852  -8.729
  613    H    HIS  75           HN       HIS  75   9.926   4.421  -7.424
  614    HA   HIS  75           HA       HIS  75   7.892   5.097  -5.600
  615    HB2  HIS  75           HB2      HIS  75   9.321   6.682  -6.975
  616    HB3  HIS  75           HB1      HIS  75   8.256   6.336  -8.332
  617    HD1  HIS  75           HD1      HIS  75   8.124   7.838  -4.848
  618    HD2  HIS  75           HD2      HIS  75   6.024   7.896  -8.437
  619    HE1  HIS  75           HE1      HIS  75   6.336   9.581  -4.556
  620    HE2  HIS  75           HE2      HIS  75   5.301   9.802  -6.844
  621    H    TRP  76           HN       TRP  76   7.680   4.097  -8.993
  622    HA   TRP  76           HA       TRP  76   4.895   4.162  -9.199
  623    HB2  TRP  76           HB2      TRP  76   6.386   4.020 -11.170
  624    HB3  TRP  76           HB1      TRP  76   6.806   2.371 -10.707
  625    HD1  TRP  76           HD1      TRP  76   5.412   0.567 -11.877
  626    HE1  TRP  76           HE1      TRP  76   3.090   0.463 -12.983
  627    HE3  TRP  76           HE3      TRP  76   3.855   5.347 -10.957
  628    HZ2  TRP  76           HZ2      TRP  76   0.896   2.181 -13.421
  629    HZ3  TRP  76           HZ3      TRP  76   1.632   6.039 -11.752
  630    HH2  TRP  76           HH2      TRP  76   0.184   4.487 -12.959
  631    H    LEU  77           HN       LEU  77   7.140   1.722  -8.186
  632    HA   LEU  77           HA       LEU  77   5.381  -0.410  -7.877
  633    HB2  LEU  77           HB2      LEU  77   7.831  -0.659  -7.779
  634    HB3  LEU  77           HB1      LEU  77   7.844   0.183  -6.243
  635    HG   LEU  77           HG       LEU  77   8.026  -2.388  -6.235
  636   HD11  LEU  77          HD11      LEU  77   7.219  -2.482  -4.101
  637   HD12  LEU  77          HD12      LEU  77   5.810  -1.491  -4.471
  638   HD13  LEU  77          HD13      LEU  77   7.397  -0.741  -4.313
  639   HD21  LEU  77          HD21      LEU  77   5.990  -3.643  -6.300
  640   HD22  LEU  77          HD22      LEU  77   6.142  -2.742  -7.809
  641   HD23  LEU  77          HD23      LEU  77   5.041  -2.178  -6.551
  642    H    ILE  78           HN       ILE  78   6.028   2.330  -5.809
  643    HA   ILE  78           HA       ILE  78   4.796   1.344  -3.473
  644    HB   ILE  78           HB       ILE  78   4.890   4.188  -4.511
  645   HG12  ILE  78          HG12      ILE  78   6.510   2.902  -2.306
  646   HG13  ILE  78          HG11      ILE  78   7.085   3.106  -3.959
  647   HG21  ILE  78          HG21      ILE  78   3.936   3.090  -1.885
  648   HG22  ILE  78          HG22      ILE  78   3.075   4.131  -3.018
  649   HG23  ILE  78          HG23      ILE  78   4.433   4.769  -2.091
  650   HD11  ILE  78          HD11      ILE  78   6.750   5.558  -3.697
  651   HD12  ILE  78          HD12      ILE  78   7.974   4.871  -2.629
  652   HD13  ILE  78          HD13      ILE  78   6.376   5.272  -1.997
  653    H    LYS  79           HN       LYS  79   3.581   3.112  -6.267
  654    HA   LYS  79           HA       LYS  79   0.862   3.248  -5.468
  655    HB2  LYS  79           HB2      LYS  79   1.728   2.981  -8.342
  656    HB3  LYS  79           HB1      LYS  79   0.392   3.916  -7.685
  657    HG2  LYS  79           HG2      LYS  79   3.329   4.536  -7.541
  658    HG3  LYS  79           HG1      LYS  79   2.059   5.460  -8.343
  659    HD2  LYS  79           HD2      LYS  79   1.096   6.075  -6.227
  660    HD3  LYS  79           HD1      LYS  79   2.206   5.008  -5.365
  661    HE2  LYS  79           HE2      LYS  79   4.031   6.463  -6.557
  662    HE3  LYS  79           HE1      LYS  79   2.722   7.639  -6.668
  663    HZ1  LYS  79           HZ1      LYS  79   4.297   7.579  -4.604
  664    HZ2  LYS  79           HZ2      LYS  79   3.243   6.369  -4.078
  665    HZ3  LYS  79           HZ3      LYS  79   2.654   7.918  -4.417
  666    H    GLN  80           HN       GLN  80   2.677   0.896  -7.353
  667    HA   GLN  80           HA       GLN  80   0.480  -0.815  -7.857
  668    HB2  GLN  80           HB2      GLN  80   3.438  -1.403  -7.868
  669    HB3  GLN  80           HB1      GLN  80   2.195  -2.498  -8.455
  670    HG2  GLN  80           HG2      GLN  80   1.527  -0.556 -10.002
  671    HG3  GLN  80           HG1      GLN  80   3.117   0.096  -9.612
  672   HE21  GLN  80          HE21      GLN  80   3.964  -2.836  -9.305
  673   HE22  GLN  80          HE22      GLN  80   4.279  -3.333 -10.928
  674    H    ALA  81           HN       ALA  81   2.947  -0.679  -5.355
  675    HA   ALA  81           HA       ALA  81   2.660  -3.102  -4.126
  676    HB1  ALA  81           HB1      ALA  81   2.982  -1.546  -1.957
  677    HB2  ALA  81           HB2      ALA  81   3.460  -0.416  -3.225
  678    HB3  ALA  81           HB3      ALA  81   4.288  -1.965  -3.065
  679    H    ILE  82           HN       ILE  82   0.638  -0.213  -3.674
  680    HA   ILE  82           HA       ILE  82  -0.987  -1.585  -1.770
  681    HB   ILE  82           HB       ILE  82  -0.928   0.761  -1.532
  682   HG12  ILE  82          HG12      ILE  82  -3.323   1.410  -1.721
  683   HG13  ILE  82          HG11      ILE  82  -3.611  -0.060  -2.644
  684   HG21  ILE  82          HG21      ILE  82  -0.319   1.430  -3.758
  685   HG22  ILE  82          HG22      ILE  82  -1.742   2.331  -3.236
  686   HG23  ILE  82          HG23      ILE  82  -1.914   0.986  -4.363
  687   HD11  ILE  82          HD11      ILE  82  -3.084  -1.423  -0.769
  688   HD12  ILE  82          HD12      ILE  82  -4.228  -0.189  -0.242
  689   HD13  ILE  82          HD13      ILE  82  -2.517  -0.031   0.152
  690    H    PHE  83           HN       PHE  83  -1.598  -0.781  -5.269
  691    HA   PHE  83           HA       PHE  83  -4.111  -2.221  -5.071
  692    HB2  PHE  83           HB2      PHE  83  -4.610  -1.386  -7.115
  693    HB3  PHE  83           HB1      PHE  83  -3.217  -0.352  -6.853
  694    HD1  PHE  83           HD1      PHE  83  -4.285  -3.539  -8.433
  695    HD2  PHE  83           HD2      PHE  83  -1.411  -0.402  -8.329
  696    HE1  PHE  83           HE1      PHE  83  -3.282  -4.398 -10.506
  697    HE2  PHE  83           HE2      PHE  83  -0.399  -1.261 -10.401
  698    HZ   PHE  83           HZ       PHE  83  -1.334  -3.260 -11.492
  699    H    ASN  84           HN       ASN  84  -0.881  -2.994  -6.142
  700    HA   ASN  84           HA       ASN  84  -1.516  -5.551  -7.164
  701    HB2  ASN  84           HB2      ASN  84   0.600  -4.350  -7.734
  702    HB3  ASN  84           HB1      ASN  84   1.143  -4.620  -6.081
  703   HD21  ASN  84          HD21      ASN  84  -0.546  -6.771  -8.352
  704   HD22  ASN  84          HD22      ASN  84   0.677  -7.994  -8.351
  705    H    TYR  85           HN       TYR  85  -0.975  -4.218  -3.998
  706    HA   TYR  85           HA       TYR  85  -0.449  -6.605  -2.611
  707    HB2  TYR  85           HB2      TYR  85  -0.254  -4.703  -1.254
  708    HB3  TYR  85           HB1      TYR  85  -1.728  -3.984  -1.881
  709    HD1  TYR  85           HD1      TYR  85  -1.039  -7.273  -0.211
  710    HD2  TYR  85           HD2      TYR  85  -3.175  -3.596  -0.146
  711    HE1  TYR  85           HE1      TYR  85  -2.245  -8.015   1.795
  712    HE2  TYR  85           HE2      TYR  85  -4.393  -4.332   1.857
  713    HH   TYR  85           HH       TYR  85  -4.971  -6.288   3.043
  714    H    LEU  86           HN       LEU  86  -3.338  -4.952  -3.651
  715    HA   LEU  86           HA       LEU  86  -5.156  -6.878  -2.666
  716    HB2  LEU  86           HB2      LEU  86  -5.517  -4.823  -4.822
  717    HB3  LEU  86           HB1      LEU  86  -6.813  -5.737  -4.070
  718    HG   LEU  86           HG       LEU  86  -5.007  -3.750  -2.681
  719   HD11  LEU  86          HD11      LEU  86  -7.062  -3.172  -4.305
  720   HD12  LEU  86          HD12      LEU  86  -6.618  -2.207  -2.898
  721   HD13  LEU  86          HD13      LEU  86  -7.921  -3.387  -2.780
  722   HD21  LEU  86          HD21      LEU  86  -6.626  -4.088  -0.786
  723   HD22  LEU  86          HD22      LEU  86  -5.529  -5.432  -1.095
  724   HD23  LEU  86          HD23      LEU  86  -7.205  -5.521  -1.635
  725    H    GLU  87           HN       GLU  87  -3.801  -6.279  -5.877
  726    HA   GLU  87           HA       GLU  87  -5.137  -8.323  -7.262
  727    HB2  GLU  87           HB2      GLU  87  -3.931  -6.401  -8.296
  728    HB3  GLU  87           HB1      GLU  87  -2.411  -7.177  -7.878
  729    HG2  GLU  87           HG2      GLU  87  -3.119  -9.128  -9.271
  730    HG3  GLU  87           HG1      GLU  87  -4.498  -8.167  -9.803
  731    H    LYS  88           HN       LYS  88  -2.180  -8.386  -5.370
  732    HA   LYS  88           HA       LYS  88  -1.219 -10.881  -6.299
  733    HB2  LYS  88           HB2      LYS  88   0.134  -9.164  -5.097
  734    HB3  LYS  88           HB1      LYS  88  -0.701  -9.606  -3.616
  735    HG2  LYS  88           HG2      LYS  88   0.188 -11.871  -3.783
  736    HG3  LYS  88           HG1      LYS  88   1.016 -11.438  -5.279
  737    HD2  LYS  88           HD2      LYS  88   1.486  -9.996  -2.679
  738    HD3  LYS  88           HD1      LYS  88   2.417 -11.413  -3.164
  739    HE2  LYS  88           HE2      LYS  88   3.718  -9.588  -3.849
  740    HE3  LYS  88           HE1      LYS  88   2.918 -10.140  -5.317
  741    HZ1  LYS  88           HZ1      LYS  88   1.290  -8.218  -4.080
  742    HZ2  LYS  88           HZ2      LYS  88   2.075  -8.119  -5.576
  743    HZ3  LYS  88           HZ3      LYS  88   2.862  -7.591  -4.170
  744    H    LEU  89           HN       LEU  89  -3.326 -10.011  -3.577
  745    HA   LEU  89           HA       LEU  89  -3.391 -12.745  -2.683
  746    HB2  LEU  89           HB2      LEU  89  -5.190 -11.927  -1.115
  747    HB3  LEU  89           HB1      LEU  89  -3.597 -11.231  -0.917
  748    HG   LEU  89           HG       LEU  89  -4.739  -9.376  -2.534
  749   HD11  LEU  89          HD11      LEU  89  -6.990  -8.947  -1.825
  750   HD12  LEU  89          HD12      LEU  89  -6.945 -10.306  -0.703
  751   HD13  LEU  89          HD13      LEU  89  -6.906 -10.597  -2.442
  752   HD21  LEU  89          HD21      LEU  89  -4.929  -9.501   0.474
  753   HD22  LEU  89          HD22      LEU  89  -5.011  -8.041  -0.513
  754   HD23  LEU  89          HD23      LEU  89  -3.519  -8.979  -0.449
  755    H    GLU  90           HN       GLU  90  -5.341 -10.686  -4.725
  756    HA   GLU  90           HA       GLU  90  -7.594 -12.450  -4.771
  757    HB2  GLU  90           HB2      GLU  90  -6.825 -10.110  -6.525
  758    HB3  GLU  90           HB1      GLU  90  -8.309 -11.029  -6.737
  759    HG2  GLU  90           HG2      GLU  90  -8.972 -10.441  -4.433
  760    HG3  GLU  90           HG1      GLU  90  -7.515  -9.464  -4.288
  Start of MODEL   16
    1    H1   MET   1           HT1      MET   1  -4.301   0.569 -10.288
    2    H2   MET   1           HT2      MET   1  -3.803   1.541 -11.581
    3    H3   MET   1           HT3      MET   1  -3.935  -0.134 -11.789
    4    HA   MET   1           HA       MET   1  -5.834   0.521 -12.760
    5    HB2  MET   1           HB2      MET   1  -6.543   0.379  -9.818
    6    HB3  MET   1           HB1      MET   1  -7.679   0.178 -11.149
    7    HG2  MET   1           HG2      MET   1  -5.374  -1.611 -10.421
    8    HG3  MET   1           HG1      MET   1  -7.096  -1.990 -10.361
    9    HE1  MET   1           HE1      MET   1  -5.147  -4.024 -13.330
   10    HE2  MET   1           HE2      MET   1  -5.393  -4.030 -11.583
   11    HE3  MET   1           HE3      MET   1  -4.114  -3.043 -12.291
   12    H    ALA   2           HN       ALA   2  -7.437   2.079 -10.252
   13    HA   ALA   2           HA       ALA   2  -7.118   4.651 -11.644
   14    HB1  ALA   2           HB1      ALA   2  -9.282   3.670  -9.778
   15    HB2  ALA   2           HB2      ALA   2  -9.400   3.831 -11.531
   16    HB3  ALA   2           HB3      ALA   2  -9.234   5.268 -10.522
   17    H    THR   3           HN       THR   3  -5.011   3.993 -10.058
   18    HA   THR   3           HA       THR   3  -5.262   4.849  -7.364
   19    HB   THR   3           HB       THR   3  -2.837   4.703  -7.263
   20    HG1  THR   3           HG1      THR   3  -2.493   5.626  -9.411
   21   HG21  THR   3          HG21      THR   3  -3.015   2.482  -7.169
   22   HG22  THR   3          HG22      THR   3  -3.063   2.377  -8.929
   23   HG23  THR   3          HG23      THR   3  -4.556   2.604  -8.018
   24    H    THR   4           HN       THR   4  -5.202   6.808  -6.526
   25    HA   THR   4           HA       THR   4  -4.327   9.059  -8.217
   26    HB   THR   4           HB       THR   4  -6.366   9.127  -5.978
   27    HG1  THR   4           HG1      THR   4  -7.091   7.928  -7.821
   28   HG21  THR   4          HG21      THR   4  -6.949  11.326  -6.939
   29   HG22  THR   4          HG22      THR   4  -5.615  11.166  -8.082
   30   HG23  THR   4          HG23      THR   4  -5.286  11.280  -6.353
   31    H    THR   5           HN       THR   5  -3.113  10.738  -7.161
   32    HA   THR   5           HA       THR   5  -1.500   9.697  -4.998
   33    HB   THR   5           HB       THR   5  -1.263  12.380  -6.371
   34    HG1  THR   5           HG1      THR   5  -1.102  10.504  -7.797
   35   HG21  THR   5          HG21      THR   5   1.031  12.335  -5.573
   36   HG22  THR   5          HG22      THR   5   0.775  10.747  -4.848
   37   HG23  THR   5          HG23      THR   5  -0.072  12.155  -4.208
   38    H    LEU   6           HN       LEU   6  -2.450   9.752  -3.077
   39    HA   LEU   6           HA       LEU   6  -3.358  12.351  -2.045
   40    HB2  LEU   6           HB2      LEU   6  -4.828  10.422  -0.648
   41    HB3  LEU   6           HB1      LEU   6  -5.438  11.596  -1.796
   42    HG   LEU   6           HG       LEU   6  -4.851   9.816  -3.589
   43   HD11  LEU   6          HD11      LEU   6  -4.879   7.536  -2.843
   44   HD12  LEU   6          HD12      LEU   6  -5.069   8.044  -1.165
   45   HD13  LEU   6          HD13      LEU   6  -3.569   8.390  -2.026
   46   HD21  LEU   6          HD21      LEU   6  -7.034   8.832  -3.385
   47   HD22  LEU   6          HD22      LEU   6  -7.130  10.528  -2.913
   48   HD23  LEU   6          HD23      LEU   6  -7.117   9.269  -1.678
   49    H    GLY   7           HN       GLY   7  -3.406  12.326   0.422
   50    HA2  GLY   7           HA2      GLY   7  -0.857  11.540   1.382
   51    HA3  GLY   7           HA1      GLY   7  -2.168  12.186   2.356
   52    H    VAL   8           HN       VAL   8  -0.221   9.584   1.913
   53    HA   VAL   8           HA       VAL   8  -2.097   7.779   3.298
   54    HB   VAL   8           HB       VAL   8  -0.099   6.981   1.171
   55   HG11  VAL   8          HG11      VAL   8  -1.263   4.748   1.364
   56   HG12  VAL   8          HG12      VAL   8  -1.943   5.343   2.878
   57   HG13  VAL   8          HG13      VAL   8  -0.196   5.194   2.695
   58   HG21  VAL   8          HG21      VAL   8  -3.113   7.012   1.100
   59   HG22  VAL   8          HG22      VAL   8  -2.070   6.344  -0.155
   60   HG23  VAL   8          HG23      VAL   8  -2.033   8.072   0.195
   61    H    LYS   9           HN       LYS   9  -1.022   6.209   4.695
   62    HA   LYS   9           HA       LYS   9   1.371   7.344   5.897
   63    HB2  LYS   9           HB2      LYS   9  -0.580   5.231   6.798
   64    HB3  LYS   9           HB1      LYS   9   0.889   5.607   7.686
   65    HG2  LYS   9           HG2      LYS   9   0.118   7.909   7.986
   66    HG3  LYS   9           HG1      LYS   9  -1.356   7.528   7.093
   67    HD2  LYS   9           HD2      LYS   9  -1.965   5.875   8.782
   68    HD3  LYS   9           HD1      LYS   9  -0.475   6.209   9.662
   69    HE2  LYS   9           HE2      LYS   9  -2.852   7.358  10.226
   70    HE3  LYS   9           HE1      LYS   9  -1.294   8.094  10.587
   71    HZ1  LYS   9           HZ1      LYS   9  -1.434   9.432   8.648
   72    HZ2  LYS   9           HZ2      LYS   9  -2.920   9.575   9.445
   73    HZ3  LYS   9           HZ3      LYS   9  -2.786   8.594   8.074
   74    H    LEU  10           HN       LEU  10   3.207   6.733   5.012
   75    HA   LEU  10           HA       LEU  10   3.755   3.865   4.647
   76    HB2  LEU  10           HB2      LEU  10   3.532   5.799   2.569
   77    HB3  LEU  10           HB1      LEU  10   5.231   5.412   2.745
   78    HG   LEU  10           HG       LEU  10   3.116   3.303   2.361
   79   HD11  LEU  10          HD11      LEU  10   4.681   4.883   0.346
   80   HD12  LEU  10          HD12      LEU  10   2.947   4.564   0.394
   81   HD13  LEU  10          HD13      LEU  10   4.071   3.266  -0.005
   82   HD21  LEU  10          HD21      LEU  10   5.273   2.605   3.336
   83   HD22  LEU  10          HD22      LEU  10   6.098   3.267   1.924
   84   HD23  LEU  10          HD23      LEU  10   4.988   1.910   1.741
   85    H    ASP  11           HN       ASP  11   5.821   3.275   5.286
   86    HA   ASP  11           HA       ASP  11   7.285   5.221   6.852
   87    HB2  ASP  11           HB2      ASP  11   8.468   2.540   6.342
   88    HB3  ASP  11           HB1      ASP  11   8.412   3.469   7.825
   89    H    ASP  12           HN       ASP  12   9.342   6.016   6.422
   90    HA   ASP  12           HA       ASP  12  10.151   6.320   3.758
   91    HB2  ASP  12           HB2      ASP  12  11.402   6.909   6.395
   92    HB3  ASP  12           HB1      ASP  12  12.474   6.846   5.003
   93    HA   PRO  13           HA       PRO  13  13.619   2.983   4.584
   94    HB2  PRO  13           HB2      PRO  13  13.045   1.210   6.612
   95    HB3  PRO  13           HB1      PRO  13  14.119   2.602   6.779
   96    HG2  PRO  13           HG2      PRO  13  11.245   2.319   7.558
   97    HG3  PRO  13           HG1      PRO  13  12.573   3.107   8.433
   98    HD2  PRO  13           HD2      PRO  13  10.761   4.528   7.057
   99    HD3  PRO  13           HD1      PRO  13  12.467   5.017   7.124
  100    H    THR  14           HN       THR  14  10.261   2.164   5.387
  101    HA   THR  14           HA       THR  14  10.354  -0.364   4.090
  102    HB   THR  14           HB       THR  14   8.560   0.809   5.799
  103    HG1  THR  14           HG1      THR  14   7.284  -1.158   5.187
  104   HG21  THR  14          HG21      THR  14   6.422   0.962   4.723
  105   HG22  THR  14          HG22      THR  14   7.116   0.488   3.173
  106   HG23  THR  14          HG23      THR  14   7.535   2.045   3.887
  107    H    ARG  15           HN       ARG  15   9.752   2.916   3.056
  108    HA   ARG  15           HA       ARG  15   8.554   2.378   0.564
  109    HB2  ARG  15           HB2      ARG  15   8.752   4.643   1.654
  110    HB3  ARG  15           HB1      ARG  15  10.448   4.652   1.198
  111    HG2  ARG  15           HG2      ARG  15   9.819   4.547  -1.161
  112    HG3  ARG  15           HG1      ARG  15   8.113   4.536  -0.702
  113    HD2  ARG  15           HD2      ARG  15   8.498   6.716   0.459
  114    HD3  ARG  15           HD1      ARG  15  10.119   6.737  -0.230
  115    HE   ARG  15           HE       ARG  15   9.224   7.265  -2.289
  116   HH11  ARG  15          HH21      ARG  15   6.666   6.402  -0.069
  117   HH12  ARG  15          HH22      ARG  15   5.401   7.062  -1.053
  118   HH21  ARG  15          HH11      ARG  15   7.560   8.155  -3.598
  119   HH22  ARG  15          HH12      ARG  15   5.913   8.068  -3.064
  120    H    GLU  16           HN       GLU  16  11.890   2.577   1.657
  121    HA   GLU  16           HA       GLU  16  13.172   2.139  -0.809
  122    HB2  GLU  16           HB2      GLU  16  14.005   1.318   1.985
  123    HB3  GLU  16           HB1      GLU  16  15.068   1.331   0.583
  124    HG2  GLU  16           HG2      GLU  16  14.763   3.744   0.372
  125    HG3  GLU  16           HG1      GLU  16  13.696   3.729   1.776
  126    H    ARG  17           HN       ARG  17  11.873  -0.035   1.634
  127    HA   ARG  17           HA       ARG  17  12.637  -2.498   0.514
  128    HB2  ARG  17           HB2      ARG  17  11.774  -2.290   2.805
  129    HB3  ARG  17           HB1      ARG  17  10.202  -1.818   2.183
  130    HG2  ARG  17           HG2      ARG  17  10.186  -4.124   2.924
  131    HG3  ARG  17           HG1      ARG  17   9.923  -4.027   1.185
  132    HD2  ARG  17           HD2      ARG  17  12.270  -4.619   0.802
  133    HD3  ARG  17           HD1      ARG  17  12.529  -4.713   2.545
  134    HE   ARG  17           HE       ARG  17  11.385  -6.727   2.601
  135   HH11  ARG  17          HH21      ARG  17  11.173  -5.305  -0.594
  136   HH12  ARG  17          HH22      ARG  17  10.531  -6.734  -1.331
  137   HH21  ARG  17          HH11      ARG  17  10.504  -8.625   1.633
  138   HH22  ARG  17          HH12      ARG  17  10.137  -8.621  -0.058
  139    H    LEU  18           HN       LEU  18   9.870  -0.391  -0.012
  140    HA   LEU  18           HA       LEU  18   8.384  -2.044  -1.713
  141    HB2  LEU  18           HB2      LEU  18   8.491   0.848  -1.129
  142    HB3  LEU  18           HB1      LEU  18   7.836   0.429  -2.699
  143    HG   LEU  18           HG       LEU  18   6.212  -1.094  -1.511
  144   HD11  LEU  18          HD11      LEU  18   7.485  -1.288   0.590
  145   HD12  LEU  18          HD12      LEU  18   5.820  -0.762   0.840
  146   HD13  LEU  18          HD13      LEU  18   7.137   0.408   0.929
  147   HD21  LEU  18          HD21      LEU  18   4.859   0.876  -0.612
  148   HD22  LEU  18          HD22      LEU  18   5.336   0.916  -2.308
  149   HD23  LEU  18          HD23      LEU  18   6.218   1.878  -1.121
  150    H    LYS  19           HN       LYS  19  11.076   0.170  -2.362
  151    HA   LYS  19           HA       LYS  19  11.032  -0.035  -5.160
  152    HB2  LYS  19           HB2      LYS  19  12.429   1.639  -4.110
  153    HB3  LYS  19           HB1      LYS  19  13.375   0.394  -3.304
  154    HG2  LYS  19           HG2      LYS  19  14.292  -0.349  -5.391
  155    HG3  LYS  19           HG1      LYS  19  13.223   0.722  -6.294
  156    HD2  LYS  19           HD2      LYS  19  15.488   1.631  -6.155
  157    HD3  LYS  19           HD1      LYS  19  14.331   2.666  -5.318
  158    HE2  LYS  19           HE2      LYS  19  16.475   2.329  -4.092
  159    HE3  LYS  19           HE1      LYS  19  15.043   1.850  -3.183
  160    HZ1  LYS  19           HZ1      LYS  19  16.889   0.023  -4.628
  161    HZ2  LYS  19           HZ2      LYS  19  15.495  -0.458  -3.801
  162    HZ3  LYS  19           HZ3      LYS  19  16.790   0.217  -2.950
  163    H    ALA  20           HN       ALA  20  12.488  -2.019  -2.699
  164    HA   ALA  20           HA       ALA  20  13.824  -3.840  -4.387
  165    HB1  ALA  20           HB1      ALA  20  13.939  -5.312  -2.475
  166    HB2  ALA  20           HB2      ALA  20  12.656  -4.416  -1.662
  167    HB3  ALA  20           HB3      ALA  20  14.223  -3.656  -1.937
  168    H    ALA  21           HN       ALA  21  10.557  -3.694  -3.066
  169    HA   ALA  21           HA       ALA  21   9.630  -6.162  -4.091
  170    HB1  ALA  21           HB1      ALA  21   7.396  -5.307  -3.684
  171    HB2  ALA  21           HB2      ALA  21   8.020  -3.665  -3.539
  172    HB3  ALA  21           HB3      ALA  21   8.446  -4.879  -2.333
  173    H    ALA  22           HN       ALA  22   9.752  -2.883  -5.336
  174    HA   ALA  22           HA       ALA  22   8.405  -3.236  -7.756
  175    HB1  ALA  22           HB1      ALA  22  10.782  -1.437  -7.345
  176    HB2  ALA  22           HB2      ALA  22   9.174  -1.056  -6.730
  177    HB3  ALA  22           HB3      ALA  22   9.439  -1.213  -8.467
  178    H    GLN  23           HN       GLN  23  11.753  -3.622  -6.891
  179    HA   GLN  23           HA       GLN  23  12.721  -4.333  -9.440
  180    HB2  GLN  23           HB2      GLN  23  13.766  -4.970  -6.672
  181    HB3  GLN  23           HB1      GLN  23  14.661  -5.260  -8.158
  182    HG2  GLN  23           HG2      GLN  23  13.631  -2.549  -7.396
  183    HG3  GLN  23           HG1      GLN  23  15.207  -3.139  -6.877
  184   HE21  GLN  23          HE21      GLN  23  15.636  -4.599  -9.397
  185   HE22  GLN  23          HE22      GLN  23  16.002  -3.398 -10.583
  186    H    SER  24           HN       SER  24  11.472  -6.255  -6.735
  187    HA   SER  24           HA       SER  24  11.990  -8.762  -7.969
  188    HB2  SER  24           HB2      SER  24  10.500  -9.694  -6.214
  189    HB3  SER  24           HB1      SER  24  11.752  -8.640  -5.561
  190    HG   SER  24           HG       SER  24   9.471  -7.278  -6.179
  191    H    ILE  25           HN       ILE  25   9.578  -6.398  -8.454
  192    HA   ILE  25           HA       ILE  25   7.864  -8.349  -9.828
  193    HB   ILE  25           HB       ILE  25   7.114  -6.586  -7.915
  194   HG12  ILE  25          HG12      ILE  25   5.771  -8.448  -8.833
  195   HG13  ILE  25          HG11      ILE  25   4.820  -6.995  -8.560
  196   HG21  ILE  25          HG21      ILE  25   7.611  -4.627  -9.249
  197   HG22  ILE  25          HG22      ILE  25   5.887  -4.738  -8.893
  198   HG23  ILE  25          HG23      ILE  25   6.487  -5.176 -10.491
  199   HD11  ILE  25          HD11      ILE  25   5.787  -8.080 -11.189
  200   HD12  ILE  25          HD12      ILE  25   5.029  -6.499 -10.994
  201   HD13  ILE  25          HD13      ILE  25   4.124  -7.964 -10.611
  202    H    ASP  26           HN       ASP  26  10.317  -6.394 -10.414
  203    HA   ASP  26           HA       ASP  26  11.260  -5.444 -12.219
  204    HB2  ASP  26           HB2      ASP  26   9.172  -7.113 -13.616
  205    HB3  ASP  26           HB1      ASP  26  10.376  -6.175 -14.491
  206    H    ARG  27           HN       ARG  27   9.560  -3.771 -10.876
  207    HA   ARG  27           HA       ARG  27   8.563  -2.084 -13.083
  208    HB2  ARG  27           HB2      ARG  27   7.109  -2.657 -10.495
  209    HB3  ARG  27           HB1      ARG  27   6.646  -1.399 -11.632
  210    HG2  ARG  27           HG2      ARG  27   6.854  -4.260 -12.495
  211    HG3  ARG  27           HG1      ARG  27   5.405  -3.644 -11.700
  212    HD2  ARG  27           HD2      ARG  27   5.171  -1.942 -13.438
  213    HD3  ARG  27           HD1      ARG  27   6.630  -2.539 -14.225
  214    HE   ARG  27           HE       ARG  27   5.357  -4.126 -15.224
  215   HH11  ARG  27          HH21      ARG  27   3.700  -3.202 -12.272
  216   HH12  ARG  27          HH22      ARG  27   2.307  -4.181 -12.599
  217   HH21  ARG  27          HH11      ARG  27   3.514  -5.381 -15.670
  218   HH22  ARG  27          HH12      ARG  27   2.195  -5.407 -14.545
  219    H    THR  28           HN       THR  28   8.267   0.219 -12.395
  220    HA   THR  28           HA       THR  28  10.551   1.091 -10.873
  221    HB   THR  28           HB       THR  28  10.061   2.361 -12.841
  222    HG1  THR  28           HG1      THR  28  10.051   4.391 -11.974
  223   HG21  THR  28          HG21      THR  28   7.697   1.830 -13.082
  224   HG22  THR  28          HG22      THR  28   7.950   3.573 -13.167
  225   HG23  THR  28          HG23      THR  28   7.312   2.846 -11.693
  226    HA   PRO  29           HA       PRO  29   9.038   1.501  -6.749
  227    HB2  PRO  29           HB2      PRO  29   9.847   4.360  -7.115
  228    HB3  PRO  29           HB1      PRO  29  10.145   3.275  -5.752
  229    HG2  PRO  29           HG2      PRO  29  12.038   3.759  -7.575
  230    HG3  PRO  29           HG1      PRO  29  11.849   2.160  -6.837
  231    HD2  PRO  29           HD2      PRO  29  11.237   3.043  -9.585
  232    HD3  PRO  29           HD1      PRO  29  11.570   1.414  -8.971
  233    H    HIS  30           HN       HIS  30   8.232   4.463  -8.639
  234    HA   HIS  30           HA       HIS  30   5.984   5.114  -7.077
  235    HB2  HIS  30           HB2      HIS  30   6.973   5.951  -9.754
  236    HB3  HIS  30           HB1      HIS  30   5.301   6.322  -9.346
  237    HD1  HIS  30           HD1      HIS  30   8.782   7.378  -8.684
  238    HD2  HIS  30           HD2      HIS  30   4.995   8.092  -7.119
  239    HE1  HIS  30           HE1      HIS  30   9.028   9.410  -7.225
  240    HE2  HIS  30           HE2      HIS  30   6.716   9.883  -6.353
  241    H    TRP  31           HN       TRP  31   6.221   3.266 -10.077
  242    HA   TRP  31           HA       TRP  31   3.444   2.847 -10.384
  243    HB2  TRP  31           HB2      TRP  31   5.154   2.551 -12.200
  244    HB3  TRP  31           HB1      TRP  31   5.704   1.097 -11.378
  245    HD1  TRP  31           HD1      TRP  31   4.174  -1.076 -11.571
  246    HE1  TRP  31           HE1      TRP  31   2.260  -1.705 -13.175
  247    HE3  TRP  31           HE3      TRP  31   3.168   3.553 -13.493
  248    HZ2  TRP  31           HZ2      TRP  31   0.549  -0.412 -15.006
  249    HZ3  TRP  31           HZ3      TRP  31   1.379   3.770 -15.170
  250    HH2  TRP  31           HH2      TRP  31   0.098   1.827 -15.910
  251    H    LEU  32           HN       LEU  32   6.042   1.138  -8.852
  252    HA   LEU  32           HA       LEU  32   4.664  -1.168  -8.080
  253    HB2  LEU  32           HB2      LEU  32   7.090  -1.036  -8.048
  254    HB3  LEU  32           HB1      LEU  32   7.022   0.174  -6.786
  255    HG   LEU  32           HG       LEU  32   7.641  -2.240  -6.142
  256   HD11  LEU  32          HD11      LEU  32   5.388  -1.125  -4.519
  257   HD12  LEU  32          HD12      LEU  32   6.947  -0.308  -4.622
  258   HD13  LEU  32          HD13      LEU  32   6.853  -1.947  -3.978
  259   HD21  LEU  32          HD21      LEU  32   5.775  -3.291  -7.395
  260   HD22  LEU  32          HD22      LEU  32   4.652  -2.593  -6.229
  261   HD23  LEU  32          HD23      LEU  32   5.855  -3.769  -5.700
  262    H    ILE  33           HN       ILE  33   5.101   1.903  -6.439
  263    HA   ILE  33           HA       ILE  33   4.009   1.119  -3.987
  264    HB   ILE  33           HB       ILE  33   3.946   3.860  -5.256
  265   HG12  ILE  33          HG12      ILE  33   5.820   2.742  -3.163
  266   HG13  ILE  33          HG11      ILE  33   6.199   2.788  -4.881
  267   HG21  ILE  33          HG21      ILE  33   3.493   3.019  -2.396
  268   HG22  ILE  33          HG22      ILE  33   2.284   3.683  -3.496
  269   HG23  ILE  33          HG23      ILE  33   3.635   4.683  -2.963
  270   HD11  ILE  33          HD11      ILE  33   5.913   5.259  -4.796
  271   HD12  ILE  33          HD12      ILE  33   7.253   4.638  -3.833
  272   HD13  ILE  33          HD13      ILE  33   5.751   5.122  -3.045
  273    H    LYS  34           HN       LYS  34   2.404   2.657  -6.789
  274    HA   LYS  34           HA       LYS  34  -0.180   2.584  -5.624
  275    HB2  LYS  34           HB2      LYS  34  -1.032   3.170  -7.742
  276    HB3  LYS  34           HB1      LYS  34   0.559   3.907  -7.678
  277    HG2  LYS  34           HG2      LYS  34   1.419   1.943  -8.963
  278    HG3  LYS  34           HG1      LYS  34  -0.260   1.440  -9.176
  279    HD2  LYS  34           HD2      LYS  34  -0.623   3.831 -10.071
  280    HD3  LYS  34           HD1      LYS  34   1.135   3.868 -10.237
  281    HE2  LYS  34           HE2      LYS  34   0.084   3.175 -12.316
  282    HE3  LYS  34           HE1      LYS  34   1.042   1.863 -11.628
  283    HZ1  LYS  34           HZ1      LYS  34  -1.150   1.163 -12.463
  284    HZ2  LYS  34           HZ2      LYS  34  -1.883   2.146 -11.294
  285    HZ3  LYS  34           HZ3      LYS  34  -0.930   0.832 -10.814
  286    H    GLN  35           HN       GLN  35   1.661   0.300  -7.539
  287    HA   GLN  35           HA       GLN  35  -0.379  -1.616  -7.927
  288    HB2  GLN  35           HB2      GLN  35   2.634  -1.809  -7.923
  289    HB3  GLN  35           HB1      GLN  35   1.606  -3.202  -8.220
  290    HG2  GLN  35           HG2      GLN  35   1.334  -0.717  -9.861
  291    HG3  GLN  35           HG1      GLN  35   2.579  -1.912 -10.218
  292   HE21  GLN  35          HE21      GLN  35   0.421  -1.154 -11.915
  293   HE22  GLN  35          HE22      GLN  35  -0.554  -2.562 -12.168
  294    H    ALA  36           HN       ALA  36   2.372  -1.582  -5.693
  295    HA   ALA  36           HA       ALA  36   2.000  -3.805  -4.233
  296    HB1  ALA  36           HB1      ALA  36   2.923  -2.462  -2.268
  297    HB2  ALA  36           HB2      ALA  36   2.938  -1.093  -3.381
  298    HB3  ALA  36           HB3      ALA  36   3.887  -2.535  -3.742
  299    H    ILE  37           HN       ILE  37   0.202  -0.761  -3.686
  300    HA   ILE  37           HA       ILE  37  -1.102  -1.924  -1.426
  301    HB   ILE  37           HB       ILE  37  -0.782   0.502  -1.590
  302   HG12  ILE  37          HG12      ILE  37  -3.117   1.137  -0.876
  303   HG13  ILE  37          HG11      ILE  37  -3.619  -0.489  -1.328
  304   HG21  ILE  37          HG21      ILE  37  -1.241   0.750  -3.996
  305   HG22  ILE  37          HG22      ILE  37  -2.143   1.892  -3.001
  306   HG23  ILE  37          HG23      ILE  37  -2.953   0.477  -3.673
  307   HD11  ILE  37          HD11      ILE  37  -1.355  -0.120   0.575
  308   HD12  ILE  37          HD12      ILE  37  -2.485  -1.465   0.418
  309   HD13  ILE  37          HD13      ILE  37  -3.016   0.055   1.136
  310    H    PHE  38           HN       PHE  38  -2.311  -1.259  -4.792
  311    HA   PHE  38           HA       PHE  38  -4.766  -2.638  -4.092
  312    HB2  PHE  38           HB2      PHE  38  -5.608  -2.072  -6.166
  313    HB3  PHE  38           HB1      PHE  38  -4.432  -0.791  -5.931
  314    HD1  PHE  38           HD1      PHE  38  -4.990  -4.040  -7.620
  315    HD2  PHE  38           HD2      PHE  38  -2.715  -0.447  -7.484
  316    HE1  PHE  38           HE1      PHE  38  -3.977  -4.606  -9.785
  317    HE2  PHE  38           HE2      PHE  38  -1.695  -1.010  -9.649
  318    HZ   PHE  38           HZ       PHE  38  -2.324  -3.092 -10.801
  319    H    ASN  39           HN       ASN  39  -1.751  -3.447  -5.552
  320    HA   ASN  39           HA       ASN  39  -2.456  -6.008  -6.528
  321    HB2  ASN  39           HB2      ASN  39  -0.408  -4.703  -7.231
  322    HB3  ASN  39           HB1      ASN  39   0.286  -5.085  -5.661
  323   HD21  ASN  39          HD21      ASN  39   1.944  -5.948  -7.192
  324   HD22  ASN  39          HD22      ASN  39   1.781  -7.591  -7.693
  325    H    TYR  40           HN       TYR  40  -1.488  -4.676  -3.431
  326    HA   TYR  40           HA       TYR  40  -0.920  -7.098  -2.126
  327    HB2  TYR  40           HB2      TYR  40  -0.459  -5.098  -0.900
  328    HB3  TYR  40           HB1      TYR  40  -2.094  -4.494  -1.133
  329    HD1  TYR  40           HD2      TYR  40  -0.860  -7.798   0.120
  330    HD2  TYR  40           HD1      TYR  40  -3.041  -4.246   0.957
  331    HE1  TYR  40           HE2      TYR  40  -1.509  -8.721   2.301
  332    HE2  TYR  40           HE1      TYR  40  -3.702  -5.162   3.140
  333    HH   TYR  40           HH       TYR  40  -2.323  -7.311   4.721
  334    H    LEU  41           HN       LEU  41  -3.846  -5.270  -2.695
  335    HA   LEU  41           HA       LEU  41  -5.670  -6.976  -1.436
  336    HB2  LEU  41           HB2      LEU  41  -6.124  -5.258  -3.870
  337    HB3  LEU  41           HB1      LEU  41  -7.370  -5.893  -2.812
  338    HG   LEU  41           HG       LEU  41  -5.264  -3.868  -2.053
  339   HD11  LEU  41          HD11      LEU  41  -6.831  -2.232  -2.261
  340   HD12  LEU  41          HD12      LEU  41  -8.180  -3.332  -1.989
  341   HD13  LEU  41          HD13      LEU  41  -7.358  -3.315  -3.549
  342   HD21  LEU  41          HD21      LEU  41  -5.737  -5.210  -0.134
  343   HD22  LEU  41          HD22      LEU  41  -7.472  -5.135  -0.442
  344   HD23  LEU  41          HD23      LEU  41  -6.599  -3.683   0.047
  345    H    GLU  42           HN       GLU  42  -4.466  -6.901  -4.763
  346    HA   GLU  42           HA       GLU  42  -6.003  -9.085  -5.714
  347    HB2  GLU  42           HB2      GLU  42  -4.980  -7.404  -7.202
  348    HB3  GLU  42           HB1      GLU  42  -3.383  -7.985  -6.754
  349    HG2  GLU  42           HG2      GLU  42  -3.888 -10.159  -7.742
  350    HG3  GLU  42           HG1      GLU  42  -5.493  -9.585  -8.187
  351    H    LYS  43           HN       LYS  43  -2.784  -8.821  -4.328
  352    HA   LYS  43           HA       LYS  43  -1.910 -11.459  -4.796
  353    HB2  LYS  43           HB2      LYS  43  -0.528  -9.423  -4.144
  354    HB3  LYS  43           HB1      LYS  43  -1.070  -9.694  -2.496
  355    HG2  LYS  43           HG2      LYS  43   0.942 -10.770  -2.464
  356    HG3  LYS  43           HG1      LYS  43  -0.123 -12.103  -2.911
  357    HD2  LYS  43           HD2      LYS  43   0.437 -11.772  -5.266
  358    HD3  LYS  43           HD1      LYS  43   1.477 -10.413  -4.836
  359    HE2  LYS  43           HE2      LYS  43   2.786 -12.018  -3.400
  360    HE3  LYS  43           HE1      LYS  43   1.850 -13.318  -4.136
  361    HZ1  LYS  43           HZ1      LYS  43   2.669 -12.209  -6.328
  362    HZ2  LYS  43           HZ2      LYS  43   3.681 -13.265  -5.480
  363    HZ3  LYS  43           HZ3      LYS  43   3.897 -11.593  -5.339
  364    H    LEU  44           HN       LEU  44  -3.536  -9.966  -2.009
  365    HA   LEU  44           HA       LEU  44  -3.512 -12.411  -0.505
  366    HB2  LEU  44           HB2      LEU  44  -4.649 -11.252   1.199
  367    HB3  LEU  44           HB1      LEU  44  -3.536 -10.096   0.502
  368    HG   LEU  44           HG       LEU  44  -5.780  -9.531  -0.920
  369   HD11  LEU  44          HD11      LEU  44  -6.775 -10.121   1.858
  370   HD12  LEU  44          HD12      LEU  44  -7.021 -11.213   0.495
  371   HD13  LEU  44          HD13      LEU  44  -7.705  -9.588   0.457
  372   HD21  LEU  44          HD21      LEU  44  -4.972  -8.431   1.768
  373   HD22  LEU  44          HD22      LEU  44  -6.060  -7.638   0.630
  374   HD23  LEU  44          HD23      LEU  44  -4.372  -7.908   0.194
  375    H    GLU  45           HN       GLU  45  -5.551 -10.939  -2.827
  376    HA   GLU  45           HA       GLU  45  -7.437 -11.530  -3.888
  377    HB2  GLU  45           HB2      GLU  45  -6.728 -14.261  -2.800
  378    HB3  GLU  45           HB1      GLU  45  -8.010 -13.972  -3.971
  379    HG2  GLU  45           HG2      GLU  45  -6.367 -13.060  -5.541
  380    HG3  GLU  45           HG1      GLU  45  -5.088 -13.351  -4.369
  381    H1   MET  46           HT1      MET  46   4.128   0.310  10.861
  382    H2   MET  46           HT2      MET  46   3.721   1.339  12.142
  383    H3   MET  46           HT3      MET  46   3.945  -0.316  12.428
  384    HA   MET  46           HA       MET  46   5.912   0.414  13.143
  385    HB2  MET  46           HB2      MET  46   6.359   0.326  10.149
  386    HB3  MET  46           HB1      MET  46   7.590   0.108  11.388
  387    HG2  MET  46           HG2      MET  46   5.288  -1.707  10.733
  388    HG3  MET  46           HG1      MET  46   7.015  -2.050  10.616
  389    HE1  MET  46           HE1      MET  46   5.167  -4.170  13.602
  390    HE2  MET  46           HE2      MET  46   5.382  -4.153  11.851
  391    HE3  MET  46           HE3      MET  46   4.105  -3.189  12.592
  392    H    ALA  47           HN       ALA  47   7.443   2.004  10.735
  393    HA   ALA  47           HA       ALA  47   6.969   4.573  12.062
  394    HB1  ALA  47           HB1      ALA  47   9.158   3.692  10.178
  395    HB2  ALA  47           HB2      ALA  47   9.277   3.828  11.933
  396    HB3  ALA  47           HB3      ALA  47   9.053   5.275  10.949
  397    H    THR  48           HN       THR  48   4.854   3.917  10.510
  398    HA   THR  48           HA       THR  48   5.089   4.794   7.809
  399    HB   THR  48           HB       THR  48   2.667   4.588   7.706
  400    HG1  THR  48           HG1      THR  48   2.327   5.462   9.888
  401   HG21  THR  48          HG21      THR  48   2.906   2.375   7.571
  402   HG22  THR  48          HG22      THR  48   2.953   2.239   9.328
  403   HG23  THR  48          HG23      THR  48   4.442   2.521   8.426
  404    H    THR  49           HN       THR  49   4.992   6.772   7.009
  405    HA   THR  49           HA       THR  49   4.067   8.972   8.743
  406    HB   THR  49           HB       THR  49   6.072   9.144   6.481
  407    HG1  THR  49           HG1      THR  49   6.733   7.870   8.375
  408   HG21  THR  49          HG21      THR  49   6.640  11.312   7.528
  409   HG22  THR  49          HG22      THR  49   5.322  11.084   8.677
  410   HG23  THR  49          HG23      THR  49   4.972  11.265   6.958
  411    H    THR  50           HN       THR  50   2.846  10.675   7.706
  412    HA   THR  50           HA       THR  50   1.214   9.635   5.549
  413    HB   THR  50           HB       THR  50   0.942  12.298   6.953
  414    HG1  THR  50           HG1      THR  50   0.861  10.267   8.285
  415   HG21  THR  50          HG21      THR  50  -1.370  12.189   6.205
  416   HG22  THR  50          HG22      THR  50  -1.081  10.616   5.463
  417   HG23  THR  50          HG23      THR  50  -0.288  12.053   4.818
  418    H    LEU  51           HN       LEU  51   2.177   9.737   3.631
  419    HA   LEU  51           HA       LEU  51   3.017  12.375   2.643
  420    HB2  LEU  51           HB2      LEU  51   4.540  10.515   1.216
  421    HB3  LEU  51           HB1      LEU  51   5.117  11.675   2.394
  422    HG   LEU  51           HG       LEU  51   4.569   9.845   4.144
  423   HD11  LEU  51          HD11      LEU  51   4.643   7.581   3.351
  424   HD12  LEU  51          HD12      LEU  51   4.822   8.128   1.684
  425   HD13  LEU  51          HD13      LEU  51   3.316   8.425   2.553
  426   HD21  LEU  51          HD21      LEU  51   6.771   8.908   3.919
  427   HD22  LEU  51          HD22      LEU  51   6.833  10.616   3.484
  428   HD23  LEU  51          HD23      LEU  51   6.845   9.383   2.223
  429    H    GLY  52           HN       GLY  52   3.036  12.439   0.200
  430    HA2  GLY  52           HA2      GLY  52   0.533  11.588  -0.802
  431    HA3  GLY  52           HA1      GLY  52   1.833  12.289  -1.752
  432    H    VAL  53           HN       VAL  53  -0.046   9.623  -1.358
  433    HA   VAL  53           HA       VAL  53   1.866   7.893  -2.791
  434    HB   VAL  53           HB       VAL  53  -0.106   7.007  -0.674
  435   HG11  VAL  53          HG11      VAL  53   1.107   4.806  -0.912
  436   HG12  VAL  53          HG12      VAL  53   1.772   5.446  -2.415
  437   HG13  VAL  53          HG13      VAL  53   0.029   5.254  -2.234
  438   HG21  VAL  53          HG21      VAL  53   2.907   7.109  -0.609
  439   HG22  VAL  53          HG22      VAL  53   1.884   6.390   0.634
  440   HG23  VAL  53          HG23      VAL  53   1.803   8.123   0.320
  441    H    LYS  54           HN       LYS  54   0.805   6.307  -4.198
  442    HA   LYS  54           HA       LYS  54  -1.612   7.423  -5.375
  443    HB2  LYS  54           HB2      LYS  54   0.375   5.362  -6.318
  444    HB3  LYS  54           HB1      LYS  54  -1.106   5.725  -7.192
  445    HG2  LYS  54           HG2      LYS  54  -0.388   8.041  -7.458
  446    HG3  LYS  54           HG1      LYS  54   1.096   7.683  -6.573
  447    HD2  LYS  54           HD2      LYS  54   1.735   6.067  -8.290
  448    HD3  LYS  54           HD1      LYS  54   0.241   6.396  -9.168
  449    HE2  LYS  54           HE2      LYS  54   2.605   7.606  -9.680
  450    HE3  LYS  54           HE1      LYS  54   1.033   8.314 -10.043
  451    HZ1  LYS  54           HZ1      LYS  54   1.112   9.617  -8.091
  452    HZ2  LYS  54           HZ2      LYS  54   2.630   9.783  -8.821
  453    HZ3  LYS  54           HZ3      LYS  54   2.444   8.773  -7.478
  454    H    LEU  55           HN       LEU  55  -3.439   6.754  -4.529
  455    HA   LEU  55           HA       LEU  55  -3.918   3.870  -4.208
  456    HB2  LEU  55           HB2      LEU  55  -3.755   5.778  -2.095
  457    HB3  LEU  55           HB1      LEU  55  -5.440   5.337  -2.282
  458    HG   LEU  55           HG       LEU  55  -3.258   3.292  -1.934
  459   HD11  LEU  55          HD11      LEU  55  -4.866   4.790   0.108
  460   HD12  LEU  55          HD12      LEU  55  -3.124   4.514   0.056
  461   HD13  LEU  55          HD13      LEU  55  -4.217   3.182   0.431
  462   HD21  LEU  55          HD21      LEU  55  -5.393   2.544  -2.922
  463   HD22  LEU  55          HD22      LEU  55  -6.236   3.153  -1.498
  464   HD23  LEU  55          HD23      LEU  55  -5.083   1.828  -1.341
  465    H    ASP  56           HN       ASP  56  -5.965   3.243  -4.866
  466    HA   ASP  56           HA       ASP  56  -7.469   5.193  -6.390
  467    HB2  ASP  56           HB2      ASP  56  -8.574   2.459  -5.974
  468    HB3  ASP  56           HB1      ASP  56  -8.537   3.435  -7.427
  469    H    ASP  57           HN       ASP  57  -9.549   5.911  -5.955
  470    HA   ASP  57           HA       ASP  57 -10.355   6.139  -3.283
  471    HB2  ASP  57           HB2      ASP  57 -11.567   6.813  -5.901
  472    HB3  ASP  57           HB1      ASP  57 -12.694   6.620  -4.564
  473    HA   PRO  58           HA       PRO  58 -13.759   2.757  -4.176
  474    HB2  PRO  58           HB2      PRO  58 -13.133   1.030  -6.232
  475    HB3  PRO  58           HB1      PRO  58 -14.246   2.394  -6.377
  476    HG2  PRO  58           HG2      PRO  58 -11.368   2.203  -7.162
  477    HG3  PRO  58           HG1      PRO  58 -12.717   2.974  -8.019
  478    HD2  PRO  58           HD2      PRO  58 -10.939   4.414  -6.619
  479    HD3  PRO  58           HD1      PRO  58 -12.657   4.860  -6.673
  480    H    THR  59           HN       THR  59 -10.385   2.018  -4.994
  481    HA   THR  59           HA       THR  59 -10.415  -0.527  -3.733
  482    HB   THR  59           HB       THR  59  -8.652   0.707  -5.422
  483    HG1  THR  59           HG1      THR  59  -7.371  -1.210  -4.994
  484   HG21  THR  59          HG21      THR  59  -6.524   0.936  -4.345
  485   HG22  THR  59          HG22      THR  59  -7.198   0.425  -2.797
  486   HG23  THR  59          HG23      THR  59  -7.676   1.971  -3.500
  487    H    ARG  60           HN       ARG  60  -9.890   2.750  -2.646
  488    HA   ARG  60           HA       ARG  60  -8.687   2.200  -0.160
  489    HB2  ARG  60           HB2      ARG  60  -8.945   4.478  -1.221
  490    HB3  ARG  60           HB1      ARG  60 -10.637   4.438  -0.749
  491    HG2  ARG  60           HG2      ARG  60  -9.983   4.312   1.602
  492    HG3  ARG  60           HG1      ARG  60  -8.282   4.347   1.127
  493    HD2  ARG  60           HD2      ARG  60  -8.717   6.536   0.012
  494    HD3  ARG  60           HD1      ARG  60 -10.338   6.509   0.699
  495    HE   ARG  60           HE       ARG  60  -9.461   7.047   2.756
  496   HH11  ARG  60          HH21      ARG  60  -6.872   6.218   0.558
  497   HH12  ARG  60          HH22      ARG  60  -5.621   6.861   1.570
  498   HH21  ARG  60          HH11      ARG  60  -7.821   7.916   4.098
  499   HH22  ARG  60          HH12      ARG  60  -6.166   7.840   3.589
  500    H    GLU  61           HN       GLU  61 -12.031   2.327  -1.259
  501    HA   GLU  61           HA       GLU  61 -13.311   1.821   1.198
  502    HB2  GLU  61           HB2      GLU  61 -14.119   0.976  -1.597
  503    HB3  GLU  61           HB1      GLU  61 -15.179   0.977  -0.195
  504    HG2  GLU  61           HG2      GLU  61 -14.951   3.396  -0.016
  505    HG3  GLU  61           HG1      GLU  61 -13.879   3.401  -1.417
  506    H    ARG  62           HN       ARG  62 -11.944  -0.281  -1.271
  507    HA   ARG  62           HA       ARG  62 -12.646  -2.781  -0.193
  508    HB2  ARG  62           HB2      ARG  62 -11.794  -2.507  -2.481
  509    HB3  ARG  62           HB1      ARG  62 -10.234  -2.008  -1.853
  510    HG2  ARG  62           HG2      ARG  62 -10.155  -4.294  -2.639
  511    HG3  ARG  62           HG1      ARG  62  -9.898  -4.229  -0.898
  512    HD2  ARG  62           HD2      ARG  62 -12.228  -4.893  -0.534
  513    HD3  ARG  62           HD1      ARG  62 -12.482  -4.954  -2.279
  514    HE   ARG  62           HE       ARG  62 -11.268  -6.928  -2.382
  515   HH11  ARG  62          HH21      ARG  62 -11.160  -5.602   0.857
  516   HH12  ARG  62          HH22      ARG  62 -10.487  -7.035   1.562
  517   HH21  ARG  62          HH11      ARG  62 -10.344  -8.829  -1.457
  518   HH22  ARG  62          HH12      ARG  62 -10.013  -8.868   0.241
  519    H    LEU  63           HN       LEU  63  -9.927  -0.619   0.364
  520    HA   LEU  63           HA       LEU  63  -8.403  -2.268   2.033
  521    HB2  LEU  63           HB2      LEU  63  -8.579   0.633   1.507
  522    HB3  LEU  63           HB1      LEU  63  -7.910   0.197   3.067
  523    HG   LEU  63           HG       LEU  63  -6.256  -1.266   1.845
  524   HD11  LEU  63          HD11      LEU  63  -7.529  -1.447  -0.256
  525   HD12  LEU  63          HD12      LEU  63  -5.878  -0.879  -0.500
  526   HD13  LEU  63          HD13      LEU  63  -7.221   0.262  -0.562
  527   HD21  LEU  63          HD21      LEU  63  -4.948   0.748   0.983
  528   HD22  LEU  63          HD22      LEU  63  -5.422   0.745   2.681
  529   HD23  LEU  63          HD23      LEU  63  -6.326   1.712   1.515
  530    H    LYS  64           HN       LYS  64 -11.142  -0.125   2.731
  531    HA   LYS  64           HA       LYS  64 -11.091  -0.388   5.524
  532    HB2  LYS  64           HB2      LYS  64 -12.524   1.278   4.514
  533    HB3  LYS  64           HB1      LYS  64 -13.443   0.033   3.677
  534    HG2  LYS  64           HG2      LYS  64 -14.357  -0.774   5.735
  535    HG3  LYS  64           HG1      LYS  64 -13.296   0.273   6.675
  536    HD2  LYS  64           HD2      LYS  64 -15.569   1.168   6.569
  537    HD3  LYS  64           HD1      LYS  64 -14.420   2.241   5.771
  538    HE2  LYS  64           HE2      LYS  64 -16.581   1.906   4.550
  539    HE3  LYS  64           HE1      LYS  64 -15.136   1.536   3.613
  540    HZ1  LYS  64           HZ1      LYS  64 -16.963  -0.410   4.911
  541    HZ2  LYS  64           HZ2      LYS  64 -15.506  -0.830   4.164
  542    HZ3  LYS  64           HZ3      LYS  64 -16.760  -0.159   3.250
  543    H    ALA  65           HN       ALA  65 -12.508  -2.350   3.021
  544    HA   ALA  65           HA       ALA  65 -13.809  -4.230   4.669
  545    HB1  ALA  65           HB1      ALA  65 -13.894  -5.664   2.727
  546    HB2  ALA  65           HB2      ALA  65 -12.631  -4.724   1.932
  547    HB3  ALA  65           HB3      ALA  65 -14.213  -4.003   2.225
  548    H    ALA  66           HN       ALA  66 -10.547  -3.995   3.353
  549    HA   ALA  66           HA       ALA  66  -9.572  -6.467   4.327
  550    HB1  ALA  66           HB1      ALA  66  -7.355  -5.562   3.930
  551    HB2  ALA  66           HB2      ALA  66  -8.011  -3.930   3.817
  552    HB3  ALA  66           HB3      ALA  66  -8.417  -5.129   2.590
  553    H    ALA  67           HN       ALA  67  -9.758  -3.218   5.638
  554    HA   ALA  67           HA       ALA  67  -8.390  -3.590   8.043
  555    HB1  ALA  67           HB1      ALA  67 -10.807  -1.834   7.680
  556    HB2  ALA  67           HB2      ALA  67  -9.210  -1.406   7.070
  557    HB3  ALA  67           HB3      ALA  67  -9.466  -1.606   8.803
  558    H    GLN  68           HN       GLN  68 -11.733  -4.019   7.189
  559    HA   GLN  68           HA       GLN  68 -12.677  -4.814   9.719
  560    HB2  GLN  68           HB2      GLN  68 -13.721  -5.416   6.943
  561    HB3  GLN  68           HB1      GLN  68 -14.604  -5.747   8.428
  562    HG2  GLN  68           HG2      GLN  68 -13.623  -3.002   7.730
  563    HG3  GLN  68           HG1      GLN  68 -15.178  -3.610   7.171
  564   HE21  GLN  68          HE21      GLN  68 -15.758  -5.106   9.567
  565   HE22  GLN  68          HE22      GLN  68 -16.119  -3.957  10.803
  566    H    SER  69           HN       SER  69 -11.375  -6.650   6.976
  567    HA   SER  69           HA       SER  69 -11.843  -9.194   8.166
  568    HB2  SER  69           HB2      SER  69 -10.318 -10.059   6.398
  569    HB3  SER  69           HB1      SER  69 -11.614  -9.048   5.765
  570    HG   SER  69           HG       SER  69  -9.299  -7.688   6.403
  571    H    ILE  70           HN       ILE  70  -9.476  -6.785   8.676
  572    HA   ILE  70           HA       ILE  70  -7.720  -8.719  10.019
  573    HB   ILE  70           HB       ILE  70  -7.014  -6.907   8.136
  574   HG12  ILE  70          HG12      ILE  70  -5.627  -8.754   9.009
  575   HG13  ILE  70          HG11      ILE  70  -4.708  -7.274   8.773
  576   HG21  ILE  70          HG21      ILE  70  -7.547  -4.983   9.504
  577   HG22  ILE  70          HG22      ILE  70  -5.822  -5.053   9.145
  578   HG23  ILE  70          HG23      ILE  70  -6.411  -5.531  10.736
  579   HD11  ILE  70          HD11      ILE  70  -5.652  -8.444  11.374
  580   HD12  ILE  70          HD12      ILE  70  -4.929  -6.843  11.218
  581   HD13  ILE  70          HD13      ILE  70  -3.992  -8.278  10.801
  582    H    ASP  71           HN       ASP  71 -10.214  -6.841  10.653
  583    HA   ASP  71           HA       ASP  71 -11.177  -5.950  12.480
  584    HB2  ASP  71           HB2      ASP  71  -8.988  -7.431  13.952
  585    HB3  ASP  71           HB1      ASP  71 -10.416  -6.733  14.705
  586    H    ARG  72           HN       ARG  72  -9.502  -4.216  11.152
  587    HA   ARG  72           HA       ARG  72  -8.542  -2.543  13.388
  588    HB2  ARG  72           HB2      ARG  72  -7.097  -3.031  10.779
  589    HB3  ARG  72           HB1      ARG  72  -6.656  -1.784  11.936
  590    HG2  ARG  72           HG2      ARG  72  -6.789  -4.662  12.750
  591    HG3  ARG  72           HG1      ARG  72  -5.361  -4.001  11.953
  592    HD2  ARG  72           HD2      ARG  72  -5.175  -2.308  13.721
  593    HD3  ARG  72           HD1      ARG  72  -6.590  -2.992  14.517
  594    HE   ARG  72           HE       ARG  72  -5.211  -4.518  15.467
  595   HH11  ARG  72          HH21      ARG  72  -3.703  -3.522  12.459
  596   HH12  ARG  72          HH22      ARG  72  -2.268  -4.460  12.720
  597   HH21  ARG  72          HH11      ARG  72  -3.306  -5.720  15.827
  598   HH22  ARG  72          HH12      ARG  72  -2.038  -5.697  14.646
  599    H    THR  73           HN       THR  73  -8.298  -0.224  12.742
  600    HA   THR  73           HA       THR  73 -10.620   0.629  11.265
  601    HB   THR  73           HB       THR  73 -10.135   1.868  13.258
  602    HG1  THR  73           HG1      THR  73 -10.184   3.916  12.428
  603   HG21  THR  73          HG21      THR  73  -7.753   1.389  13.452
  604   HG22  THR  73          HG22      THR  73  -8.053   3.121  13.585
  605   HG23  THR  73          HG23      THR  73  -7.416   2.449  12.084
  606    HA   PRO  74           HA       PRO  74  -9.137   1.159   7.141
  607    HB2  PRO  74           HB2      PRO  74 -10.013   3.991   7.566
  608    HB3  PRO  74           HB1      PRO  74 -10.291   2.925   6.183
  609    HG2  PRO  74           HG2      PRO  74 -12.189   3.328   8.018
  610    HG3  PRO  74           HG1      PRO  74 -11.961   1.746   7.254
  611    HD2  PRO  74           HD2      PRO  74 -11.356   2.605  10.014
  612    HD3  PRO  74           HD1      PRO  74 -11.662   0.978   9.378
  613    H    HIS  75           HN       HIS  75  -8.396   4.079   9.113
  614    HA   HIS  75           HA       HIS  75  -6.177   4.848   7.562
  615    HB2  HIS  75           HB2      HIS  75  -7.212   5.573  10.245
  616    HB3  HIS  75           HB1      HIS  75  -5.526   5.958   9.914
  617    HD1  HIS  75           HD1      HIS  75  -8.987   7.031   9.148
  618    HD2  HIS  75           HD2      HIS  75  -5.133   7.842   7.815
  619    HE1  HIS  75           HE1      HIS  75  -9.175   9.130   7.779
  620    HE2  HIS  75           HE2      HIS  75  -6.798   9.735   7.209
  621    H    TRP  76           HN       TRP  76  -6.334   2.935  10.530
  622    HA   TRP  76           HA       TRP  76  -3.557   2.550  10.797
  623    HB2  TRP  76           HB2      TRP  76  -5.253   2.172  12.611
  624    HB3  TRP  76           HB1      TRP  76  -5.772   0.726  11.755
  625    HD1  TRP  76           HD1      TRP  76  -4.178  -1.408  11.875
  626    HE1  TRP  76           HE1      TRP  76  -2.242  -2.031  13.455
  627    HE3  TRP  76           HE3      TRP  76  -3.302   3.186  13.934
  628    HZ2  TRP  76           HZ2      TRP  76  -0.566  -0.744  15.323
  629    HZ3  TRP  76           HZ3      TRP  76  -1.517   3.406  15.614
  630    HH2  TRP  76           HH2      TRP  76  -0.179   1.480  16.294
  631    H    LEU  77           HN       LEU  77  -6.127   0.811   9.243
  632    HA   LEU  77           HA       LEU  77  -4.700  -1.443   8.412
  633    HB2  LEU  77           HB2      LEU  77  -7.130  -1.359   8.381
  634    HB3  LEU  77           HB1      LEU  77  -7.086  -0.123   7.144
  635    HG   LEU  77           HG       LEU  77  -7.652  -2.539   6.453
  636   HD11  LEU  77          HD11      LEU  77  -5.426  -1.342   4.852
  637   HD12  LEU  77          HD12      LEU  77  -7.002  -0.563   4.971
  638   HD13  LEU  77          HD13      LEU  77  -6.871  -2.185   4.295
  639   HD21  LEU  77          HD21      LEU  77  -5.763  -3.573   7.684
  640   HD22  LEU  77          HD22      LEU  77  -4.656  -2.828   6.531
  641   HD23  LEU  77          HD23      LEU  77  -5.834  -4.019   5.980
  642    H    ILE  78           HN       ILE  78  -5.203   1.653   6.836
  643    HA   ILE  78           HA       ILE  78  -4.095   0.942   4.368
  644    HB   ILE  78           HB       ILE  78  -4.091   3.657   5.694
  645   HG12  ILE  78          HG12      ILE  78  -5.940   2.541   3.577
  646   HG13  ILE  78          HG11      ILE  78  -6.320   2.544   5.296
  647   HG21  ILE  78          HG21      ILE  78  -3.621   2.885   2.817
  648   HG22  ILE  78          HG22      ILE  78  -2.426   3.552   3.929
  649   HG23  ILE  78          HG23      ILE  78  -3.799   4.534   3.416
  650   HD11  ILE  78          HD11      ILE  78  -6.089   5.022   5.262
  651   HD12  ILE  78          HD12      ILE  78  -7.415   4.391   4.286
  652   HD13  ILE  78          HD13      ILE  78  -5.925   4.925   3.509
  653    H    LYS  79           HN       LYS  79  -2.521   2.452   7.206
  654    HA   LYS  79           HA       LYS  79   0.062   2.462   6.034
  655    HB2  LYS  79           HB2      LYS  79   0.907   3.023   8.161
  656    HB3  LYS  79           HB1      LYS  79  -0.700   3.726   8.117
  657    HG2  LYS  79           HG2      LYS  79  -1.509   1.716   9.368
  658    HG3  LYS  79           HG1      LYS  79   0.183   1.251   9.567
  659    HD2  LYS  79           HD2      LYS  79   0.494   3.630  10.505
  660    HD3  LYS  79           HD1      LYS  79  -1.264   3.632  10.670
  661    HE2  LYS  79           HE2      LYS  79  -0.228   2.929  12.742
  662    HE3  LYS  79           HE1      LYS  79  -1.123   1.590  12.021
  663    HZ1  LYS  79           HZ1      LYS  79   1.101   0.990  12.888
  664    HZ2  LYS  79           HZ2      LYS  79   1.791   1.990  11.706
  665    HZ3  LYS  79           HZ3      LYS  79   0.890   0.634  11.243
  666    H    GLN  80           HN       GLN  80  -1.724   0.097   7.900
  667    HA   GLN  80           HA       GLN  80   0.361  -1.779   8.239
  668    HB2  GLN  80           HB2      GLN  80  -2.646  -2.057   8.236
  669    HB3  GLN  80           HB1      GLN  80  -1.574  -3.418   8.520
  670    HG2  GLN  80           HG2      GLN  80  -1.373  -0.945  10.185
  671    HG3  GLN  80           HG1      GLN  80  -2.591  -2.171  10.527
  672   HE21  GLN  80          HE21      GLN  80  -0.426  -1.361  12.214
  673   HE22  GLN  80          HE22      GLN  80   0.571  -2.752  12.465
  674    H    ALA  81           HN       ALA  81  -2.395  -1.752   6.011
  675    HA   ALA  81           HA       ALA  81  -1.981  -3.938   4.505
  676    HB1  ALA  81           HB1      ALA  81  -2.933  -2.574   2.569
  677    HB2  ALA  81           HB2      ALA  81  -2.976  -1.229   3.710
  678    HB3  ALA  81           HB3      ALA  81  -3.894  -2.697   4.042
  679    H    ILE  82           HN       ILE  82  -0.250  -0.846   4.019
  680    HA   ILE  82           HA       ILE  82   1.078  -1.933   1.735
  681    HB   ILE  82           HB       ILE  82   0.704   0.482   1.950
  682   HG12  ILE  82          HG12      ILE  82   3.024   1.184   1.250
  683   HG13  ILE  82          HG11      ILE  82   3.563  -0.440   1.667
  684   HG21  ILE  82          HG21      ILE  82   1.159   0.688   4.361
  685   HG22  ILE  82          HG22      ILE  82   2.032   1.872   3.389
  686   HG23  ILE  82          HG23      ILE  82   2.877   0.463   4.031
  687   HD11  ILE  82          HD11      ILE  82   1.290  -0.082  -0.228
  688   HD12  ILE  82          HD12      ILE  82   2.451  -1.404  -0.098
  689   HD13  ILE  82          HD13      ILE  82   2.947   0.142  -0.785
  690    H    PHE  83           HN       PHE  83   2.274  -1.310   5.113
  691    HA   PHE  83           HA       PHE  83   4.759  -2.617   4.385
  692    HB2  PHE  83           HB2      PHE  83   5.589  -2.074   6.470
  693    HB3  PHE  83           HB1      PHE  83   4.383  -0.816   6.263
  694    HD1  PHE  83           HD1      PHE  83   5.015  -4.089   7.880
  695    HD2  PHE  83           HD2      PHE  83   2.664  -0.543   7.825
  696    HE1  PHE  83           HE1      PHE  83   4.018  -4.724  10.033
  697    HE2  PHE  83           HE2      PHE  83   1.659  -1.176   9.979
  698    HZ   PHE  83           HZ       PHE  83   2.335  -3.269  11.084
  699    H    ASN  84           HN       ASN  84   1.764  -3.530   5.825
  700    HA   ASN  84           HA       ASN  84   2.537  -6.092   6.747
  701    HB2  ASN  84           HB2      ASN  84   0.450  -4.860   7.478
  702    HB3  ASN  84           HB1      ASN  84  -0.233  -5.234   5.901
  703   HD21  ASN  84          HD21      ASN  84  -1.824  -6.148   7.554
  704   HD22  ASN  84          HD22      ASN  84  -1.612  -7.809   7.974
  705    H    TYR  85           HN       TYR  85   1.522  -4.718   3.679
  706    HA   TYR  85           HA       TYR  85   1.022  -7.124   2.322
  707    HB2  TYR  85           HB2      TYR  85   0.515  -5.106   1.140
  708    HB3  TYR  85           HB1      TYR  85   2.140  -4.475   1.381
  709    HD1  TYR  85           HD2      TYR  85   0.977  -7.783   0.074
  710    HD2  TYR  85           HD1      TYR  85   3.067  -4.164  -0.712
  711    HE1  TYR  85           HE2      TYR  85   1.641  -8.655  -2.123
  712    HE2  TYR  85           HE1      TYR  85   3.743  -5.029  -2.911
  713    HH   TYR  85           HH       TYR  85   2.484  -7.064  -4.548
  714    H    LEU  86           HN       LEU  86   3.905  -5.241   2.932
  715    HA   LEU  86           HA       LEU  86   5.773  -6.877   1.640
  716    HB2  LEU  86           HB2      LEU  86   6.181  -5.200   4.111
  717    HB3  LEU  86           HB1      LEU  86   7.443  -5.780   3.040
  718    HG   LEU  86           HG       LEU  86   5.287  -3.792   2.324
  719   HD11  LEU  86          HD11      LEU  86   6.813  -2.122   2.572
  720   HD12  LEU  86          HD12      LEU  86   8.190  -3.182   2.278
  721   HD13  LEU  86          HD13      LEU  86   7.365  -3.221   3.836
  722   HD21  LEU  86          HD21      LEU  86   5.796  -5.077   0.374
  723   HD22  LEU  86          HD22      LEU  86   7.528  -4.966   0.688
  724   HD23  LEU  86          HD23      LEU  86   6.621  -3.525   0.231
  725    H    GLU  87           HN       GLU  87   4.552  -6.899   4.955
  726    HA   GLU  87           HA       GLU  87   6.145  -9.053   5.888
  727    HB2  GLU  87           HB2      GLU  87   5.025  -7.359   7.337
  728    HB3  GLU  87           HB1      GLU  87   3.476  -8.086   6.937
  729    HG2  GLU  87           HG2      GLU  87   4.144 -10.159   8.001
  730    HG3  GLU  87           HG1      GLU  87   5.738  -9.489   8.345
  731    H    LYS  88           HN       LYS  88   2.919  -8.848   4.505
  732    HA   LYS  88           HA       LYS  88   2.116 -11.519   4.921
  733    HB2  LYS  88           HB2      LYS  88   0.679  -9.500   4.321
  734    HB3  LYS  88           HB1      LYS  88   1.215  -9.728   2.664
  735    HG2  LYS  88           HG2      LYS  88  -0.757 -10.862   2.607
  736    HG3  LYS  88           HG1      LYS  88   0.330 -12.174   3.067
  737    HD2  LYS  88           HD2      LYS  88  -0.267 -11.881   5.406
  738    HD3  LYS  88           HD1      LYS  88  -1.298 -10.510   4.991
  739    HE2  LYS  88           HE2      LYS  88  -2.594 -12.099   3.511
  740    HE3  LYS  88           HE1      LYS  88  -1.685 -13.406   4.267
  741    HZ1  LYS  88           HZ1      LYS  88  -2.535 -12.339   6.446
  742    HZ2  LYS  88           HZ2      LYS  88  -3.580 -13.313   5.542
  743    HZ3  LYS  88           HZ3      LYS  88  -3.709 -11.629   5.455
  744    H    LEU  89           HN       LEU  89   3.696  -9.916   2.168
  745    HA   LEU  89           HA       LEU  89   3.714 -12.317   0.597
  746    HB2  LEU  89           HB2      LEU  89   4.829 -11.099  -1.078
  747    HB3  LEU  89           HB1      LEU  89   3.698  -9.979  -0.351
  748    HG   LEU  89           HG       LEU  89   5.932  -9.405   1.079
  749   HD11  LEU  89          HD11      LEU  89   6.938  -9.926  -1.709
  750   HD12  LEU  89          HD12      LEU  89   7.203 -11.037  -0.366
  751   HD13  LEU  89          HD13      LEU  89   7.858  -9.401  -0.298
  752   HD21  LEU  89          HD21      LEU  89   5.111  -8.266  -1.590
  753   HD22  LEU  89          HD22      LEU  89   6.183  -7.477  -0.433
  754   HD23  LEU  89          HD23      LEU  89   4.499  -7.784  -0.008
  755    H    GLU  90           HN       GLU  90   5.786 -10.826   2.905
  756    HA   GLU  90           HA       GLU  90   7.658 -11.454   3.975
  757    HB2  GLU  90           HB2      GLU  90   7.019 -14.152   2.767
  758    HB3  GLU  90           HB1      GLU  90   8.279 -13.880   3.965
  759    HG2  GLU  90           HG2      GLU  90   6.599 -13.081   5.552
  760    HG3  GLU  90           HG1      GLU  90   5.338 -13.348   4.355
  Start of MODEL   17
    1    H1   MET   1           HT1      MET   1   7.024   0.899  14.722
    2    H2   MET   1           HT2      MET   1   6.209  -0.479  14.177
    3    H3   MET   1           HT3      MET   1   5.361   0.961  14.430
    4    HA   MET   1           HA       MET   1   7.501   0.596  12.429
    5    HB2  MET   1           HB2      MET   1   5.554   0.850  10.795
    6    HB3  MET   1           HB1      MET   1   5.696  -0.693  11.621
    7    HG2  MET   1           HG2      MET   1   3.885   1.481  12.614
    8    HG3  MET   1           HG1      MET   1   3.373   0.311  11.398
    9    HE1  MET   1           HE1      MET   1   1.441   0.150  13.225
   10    HE2  MET   1           HE2      MET   1   1.454  -1.246  14.301
   11    HE3  MET   1           HE3      MET   1   1.616  -1.474  12.560
   12    H    ALA   2           HN       ALA   2   8.109   2.401  11.389
   13    HA   ALA   2           HA       ALA   2   7.256   4.941  12.542
   14    HB1  ALA   2           HB1      ALA   2   9.184   5.846  11.219
   15    HB2  ALA   2           HB2      ALA   2   9.530   4.195  10.703
   16    HB3  ALA   2           HB3      ALA   2   9.630   4.625  12.410
   17    H    THR   3           HN       THR   3   5.153   4.257  11.356
   18    HA   THR   3           HA       THR   3   4.994   4.493   8.550
   19    HB   THR   3           HB       THR   3   2.473   5.049   9.321
   20    HG1  THR   3           HG1      THR   3   3.085   5.157  11.544
   21   HG21  THR   3          HG21      THR   3   2.990   3.131   8.006
   22   HG22  THR   3          HG22      THR   3   2.141   2.546   9.437
   23   HG23  THR   3          HG23      THR   3   3.893   2.387   9.326
   24    H    THR   4           HN       THR   4   5.643   6.329   7.581
   25    HA   THR   4           HA       THR   4   4.576   8.867   8.616
   26    HB   THR   4           HB       THR   4   6.299   9.867   6.944
   27    HG1  THR   4           HG1      THR   4   6.761   7.366   6.415
   28   HG21  THR   4          HG21      THR   4   6.511  10.133   9.331
   29   HG22  THR   4          HG22      THR   4   8.089   9.727   8.654
   30   HG23  THR   4          HG23      THR   4   7.146   8.496   9.494
   31    H    THR   5           HN       THR   5   3.475  10.280   7.209
   32    HA   THR   5           HA       THR   5   1.949   8.936   5.203
   33    HB   THR   5           HB       THR   5   2.009  11.902   5.770
   34    HG1  THR   5           HG1      THR   5   1.351   9.906   7.403
   35   HG21  THR   5          HG21      THR   5   0.795  11.303   3.742
   36   HG22  THR   5          HG22      THR   5  -0.337  11.796   5.001
   37   HG23  THR   5          HG23      THR   5  -0.123  10.086   4.628
   38    H    LEU   6           HN       LEU   6   2.658   8.516   3.260
   39    HA   LEU   6           HA       LEU   6   4.280  10.509   1.824
   40    HB2  LEU   6           HB2      LEU   6   4.544   7.504   1.593
   41    HB3  LEU   6           HB1      LEU   6   5.489   8.696   0.725
   42    HG   LEU   6           HG       LEU   6   5.606   8.081   3.679
   43   HD11  LEU   6          HD11      LEU   6   7.992   8.062   1.946
   44   HD12  LEU   6          HD12      LEU   6   6.821   6.772   1.683
   45   HD13  LEU   6          HD13      LEU   6   7.543   6.996   3.277
   46   HD21  LEU   6          HD21      LEU   6   5.844  10.449   3.496
   47   HD22  LEU   6          HD22      LEU   6   6.931  10.290   2.117
   48   HD23  LEU   6          HD23      LEU   6   7.454   9.763   3.717
   49    H    GLY   7           HN       GLY   7   4.034  10.335  -0.563
   50    HA2  GLY   7           HA2      GLY   7   1.255  10.095  -1.238
   51    HA3  GLY   7           HA1      GLY   7   2.554  10.553  -2.324
   52    H    VAL   8           HN       VAL   8   0.229   8.328  -1.837
   53    HA   VAL   8           HA       VAL   8   1.674   6.291  -3.393
   54    HB   VAL   8           HB       VAL   8  -0.229   5.781  -1.095
   55   HG11  VAL   8          HG11      VAL   8   0.989   3.816  -3.029
   56   HG12  VAL   8          HG12      VAL   8  -0.726   4.133  -2.766
   57   HG13  VAL   8          HG13      VAL   8   0.234   3.367  -1.500
   58   HG21  VAL   8          HG21      VAL   8   1.708   4.595  -0.126
   59   HG22  VAL   8          HG22      VAL   8   2.007   6.317  -0.369
   60   HG23  VAL   8          HG23      VAL   8   2.687   5.137  -1.489
   61    H    LYS   9           HN       LYS   9   0.018   4.821  -4.561
   62    HA   LYS   9           HA       LYS   9  -2.051   6.594  -5.654
   63    HB2  LYS   9           HB2      LYS   9  -0.858   4.136  -6.947
   64    HB3  LYS   9           HB1      LYS   9  -1.946   5.292  -7.692
   65    HG2  LYS   9           HG2      LYS   9   0.217   5.742  -8.534
   66    HG3  LYS   9           HG1      LYS   9  -0.151   7.029  -7.383
   67    HD2  LYS   9           HD2      LYS   9   1.216   6.015  -5.707
   68    HD3  LYS   9           HD1      LYS   9   1.432   4.562  -6.676
   69    HE2  LYS   9           HE2      LYS   9   2.882   5.614  -8.147
   70    HE3  LYS   9           HE1      LYS   9   2.325   7.227  -7.693
   71    HZ1  LYS   9           HZ1      LYS   9   3.323   5.997  -5.399
   72    HZ2  LYS   9           HZ2      LYS   9   3.964   7.326  -6.225
   73    HZ3  LYS   9           HZ3      LYS   9   4.465   5.756  -6.624
   74    H    LEU  10           HN       LEU  10  -4.088   6.117  -5.338
   75    HA   LEU  10           HA       LEU  10  -4.900   3.348  -4.872
   76    HB2  LEU  10           HB2      LEU  10  -5.319   5.676  -3.040
   77    HB3  LEU  10           HB1      LEU  10  -6.556   4.441  -3.147
   78    HG   LEU  10           HG       LEU  10  -3.704   3.735  -2.515
   79   HD11  LEU  10          HD11      LEU  10  -4.331   5.371  -0.861
   80   HD12  LEU  10          HD12      LEU  10  -4.388   3.766  -0.132
   81   HD13  LEU  10          HD13      LEU  10  -5.883   4.573  -0.606
   82   HD21  LEU  10          HD21      LEU  10  -4.929   1.857  -1.350
   83   HD22  LEU  10          HD22      LEU  10  -5.018   1.860  -3.111
   84   HD23  LEU  10          HD23      LEU  10  -6.389   2.428  -2.158
   85    H    ASP  11           HN       ASP  11  -6.669   2.851  -5.972
   86    HA   ASP  11           HA       ASP  11  -7.996   4.869  -7.581
   87    HB2  ASP  11           HB2      ASP  11  -8.770   1.952  -7.320
   88    HB3  ASP  11           HB1      ASP  11  -9.150   3.042  -8.638
   89    H    ASP  12           HN       ASP  12 -10.374   5.118  -7.500
   90    HA   ASP  12           HA       ASP  12 -11.459   5.441  -4.969
   91    HB2  ASP  12           HB2      ASP  12 -12.632   5.256  -7.701
   92    HB3  ASP  12           HB1      ASP  12 -13.737   5.045  -6.349
   93    HA   PRO  13           HA       PRO  13 -13.542   1.015  -5.498
   94    HB2  PRO  13           HB2      PRO  13 -12.006  -0.662  -7.081
   95    HB3  PRO  13           HB1      PRO  13 -13.513   0.110  -7.584
   96    HG2  PRO  13           HG2      PRO  13 -10.691   0.930  -8.110
   97    HG3  PRO  13           HG1      PRO  13 -12.100   0.997  -9.185
   98    HD2  PRO  13           HD2      PRO  13 -11.171   3.195  -7.974
   99    HD3  PRO  13           HD1      PRO  13 -12.913   2.935  -8.202
  100    H    THR  14           HN       THR  14  -9.989   1.396  -5.747
  101    HA   THR  14           HA       THR  14  -9.482  -0.819  -4.023
  102    HB   THR  14           HB       THR  14  -7.199  -0.132  -3.881
  103    HG1  THR  14           HG1      THR  14  -8.226   2.362  -4.275
  104   HG21  THR  14          HG21      THR  14  -6.987   0.648  -6.499
  105   HG22  THR  14          HG22      THR  14  -8.557  -0.154  -6.463
  106   HG23  THR  14          HG23      THR  14  -7.114  -1.016  -5.932
  107    H    ARG  15           HN       ARG  15  -9.947   2.639  -3.562
  108    HA   ARG  15           HA       ARG  15  -9.163   2.808  -0.868
  109    HB2  ARG  15           HB2      ARG  15  -9.597   4.751  -2.356
  110    HB3  ARG  15           HB1      ARG  15 -11.313   4.376  -2.322
  111    HG2  ARG  15           HG2      ARG  15 -11.065   6.111  -0.793
  112    HG3  ARG  15           HG1      ARG  15 -11.145   4.660   0.208
  113    HD2  ARG  15           HD2      ARG  15  -8.670   4.639   0.301
  114    HD3  ARG  15           HD1      ARG  15  -8.653   6.151  -0.606
  115    HE   ARG  15           HE       ARG  15  -9.418   7.282   1.269
  116   HH11  ARG  15          HH21      ARG  15  -9.261   3.836   1.868
  117   HH12  ARG  15          HH22      ARG  15  -9.454   3.991   3.580
  118   HH21  ARG  15          HH11      ARG  15  -9.693   7.505   3.521
  119   HH22  ARG  15          HH12      ARG  15  -9.719   6.096   4.526
  120    H    GLU  16           HN       GLU  16 -12.290   2.183  -2.386
  121    HA   GLU  16           HA       GLU  16 -13.712   1.769   0.031
  122    HB2  GLU  16           HB2      GLU  16 -14.302   0.933  -2.812
  123    HB3  GLU  16           HB1      GLU  16 -15.435   0.749  -1.478
  124    HG2  GLU  16           HG2      GLU  16 -14.307   3.343  -2.512
  125    HG3  GLU  16           HG1      GLU  16 -15.941   2.734  -2.773
  126    H    ARG  17           HN       ARG  17 -12.068  -0.383  -2.252
  127    HA   ARG  17           HA       ARG  17 -12.849  -2.804  -1.035
  128    HB2  ARG  17           HB2      ARG  17 -11.731  -2.552  -3.317
  129    HB3  ARG  17           HB1      ARG  17 -10.208  -2.417  -2.440
  130    HG2  ARG  17           HG2      ARG  17 -10.797  -4.602  -1.333
  131    HG3  ARG  17           HG1      ARG  17 -12.102  -4.745  -2.506
  132    HD2  ARG  17           HD2      ARG  17 -10.442  -4.623  -4.323
  133    HD3  ARG  17           HD1      ARG  17  -9.155  -4.554  -3.120
  134    HE   ARG  17           HE       ARG  17 -10.314  -6.879  -4.104
  135   HH11  ARG  17          HH21      ARG  17  -9.424  -5.530  -0.980
  136   HH12  ARG  17          HH22      ARG  17  -9.371  -7.071  -0.197
  137   HH21  ARG  17          HH11      ARG  17 -10.215  -8.893  -3.088
  138   HH22  ARG  17          HH12      ARG  17  -9.840  -8.987  -1.394
  139    H    LEU  18           HN       LEU  18 -10.218  -0.559  -0.453
  140    HA   LEU  18           HA       LEU  18  -8.779  -2.087   1.401
  141    HB2  LEU  18           HB2      LEU  18  -8.899   0.737   0.622
  142    HB3  LEU  18           HB1      LEU  18  -8.502   0.504   2.312
  143    HG   LEU  18           HG       LEU  18  -6.658  -1.083   1.506
  144   HD11  LEU  18          HD11      LEU  18  -7.152   0.338  -1.096
  145   HD12  LEU  18          HD12      LEU  18  -7.493  -1.363  -0.782
  146   HD13  LEU  18          HD13      LEU  18  -5.832  -0.772  -0.730
  147   HD21  LEU  18          HD21      LEU  18  -6.492   1.845   0.814
  148   HD22  LEU  18          HD22      LEU  18  -5.124   0.765   1.083
  149   HD23  LEU  18          HD23      LEU  18  -6.227   1.137   2.408
  150    H    LYS  19           HN       LYS  19 -11.649  -0.050   1.697
  151    HA   LYS  19           HA       LYS  19 -11.873  -0.102   4.493
  152    HB2  LYS  19           HB2      LYS  19 -13.294   1.274   2.931
  153    HB3  LYS  19           HB1      LYS  19 -14.190  -0.194   2.562
  154    HG2  LYS  19           HG2      LYS  19 -14.688  -0.380   5.019
  155    HG3  LYS  19           HG1      LYS  19 -14.006   1.236   5.200
  156    HD2  LYS  19           HD2      LYS  19 -16.367   0.472   3.482
  157    HD3  LYS  19           HD1      LYS  19 -16.432   1.337   5.016
  158    HE2  LYS  19           HE2      LYS  19 -15.270   2.291   2.405
  159    HE3  LYS  19           HE1      LYS  19 -16.662   2.942   3.267
  160    HZ1  LYS  19           HZ1      LYS  19 -13.807   3.148   4.000
  161    HZ2  LYS  19           HZ2      LYS  19 -15.041   3.469   5.110
  162    HZ3  LYS  19           HZ3      LYS  19 -14.906   4.398   3.702
  163    H    ALA  20           HN       ALA  20 -13.013  -2.328   2.045
  164    HA   ALA  20           HA       ALA  20 -14.276  -4.186   3.737
  165    HB1  ALA  20           HB1      ALA  20 -13.932  -5.798   1.838
  166    HB2  ALA  20           HB2      ALA  20 -13.031  -4.528   1.009
  167    HB3  ALA  20           HB3      ALA  20 -14.736  -4.293   1.393
  168    H    ALA  21           HN       ALA  21 -10.971  -3.863   2.565
  169    HA   ALA  21           HA       ALA  21  -9.928  -6.220   3.727
  170    HB1  ALA  21           HB1      ALA  21  -8.792  -4.842   1.967
  171    HB2  ALA  21           HB2      ALA  21  -7.758  -5.278   3.327
  172    HB3  ALA  21           HB3      ALA  21  -8.428  -3.651   3.216
  173    H    ALA  22           HN       ALA  22 -10.361  -2.922   4.843
  174    HA   ALA  22           HA       ALA  22  -9.081  -3.067   7.318
  175    HB1  ALA  22           HB1      ALA  22 -10.327  -1.115   7.911
  176    HB2  ALA  22           HB2      ALA  22 -11.571  -1.483   6.718
  177    HB3  ALA  22           HB3      ALA  22  -9.962  -0.996   6.189
  178    H    GLN  23           HN       GLN  23 -12.341  -3.746   6.347
  179    HA   GLN  23           HA       GLN  23 -13.413  -4.452   8.849
  180    HB2  GLN  23           HB2      GLN  23 -14.185  -5.263   6.038
  181    HB3  GLN  23           HB1      GLN  23 -15.161  -5.603   7.462
  182    HG2  GLN  23           HG2      GLN  23 -14.335  -2.835   6.641
  183    HG3  GLN  23           HG1      GLN  23 -15.848  -3.587   6.135
  184   HE21  GLN  23          HE21      GLN  23 -15.049  -1.268   7.957
  185   HE22  GLN  23          HE22      GLN  23 -15.978  -1.536   9.387
  186    H    SER  24           HN       SER  24 -11.752  -6.256   6.358
  187    HA   SER  24           HA       SER  24 -12.144  -8.849   7.341
  188    HB2  SER  24           HB2      SER  24  -9.822  -7.742   5.743
  189    HB3  SER  24           HB1      SER  24 -10.204  -9.452   5.942
  190    HG   SER  24           HG       SER  24 -12.108  -7.635   4.909
  191    H    ILE  25           HN       ILE  25  -9.778  -6.365   8.159
  192    HA   ILE  25           HA       ILE  25  -8.486  -8.227  10.022
  193    HB   ILE  25           HB       ILE  25  -7.038  -7.075   8.365
  194   HG12  ILE  25          HG12      ILE  25  -6.382  -6.116  11.152
  195   HG13  ILE  25          HG11      ILE  25  -6.247  -7.804  10.675
  196   HG21  ILE  25          HG21      ILE  25  -7.969  -4.994   7.999
  197   HG22  ILE  25          HG22      ILE  25  -6.540  -4.614   8.962
  198   HG23  ILE  25          HG23      ILE  25  -8.131  -4.653   9.720
  199   HD11  ILE  25          HD11      ILE  25  -4.162  -6.280  10.618
  200   HD12  ILE  25          HD12      ILE  25  -4.844  -5.692   9.100
  201   HD13  ILE  25          HD13      ILE  25  -4.451  -7.401   9.289
  202    H    ASP  26           HN       ASP  26 -10.953  -6.183  10.084
  203    HA   ASP  26           HA       ASP  26 -12.128  -5.075  11.661
  204    HB2  ASP  26           HB2      ASP  26 -11.481  -7.215  12.941
  205    HB3  ASP  26           HB1      ASP  26 -10.305  -6.207  13.774
  206    H    ARG  27           HN       ARG  27 -10.236  -3.568  10.405
  207    HA   ARG  27           HA       ARG  27  -9.364  -1.739  12.564
  208    HB2  ARG  27           HB2      ARG  27  -7.852  -2.820  10.255
  209    HB3  ARG  27           HB1      ARG  27  -7.618  -1.117  10.605
  210    HG2  ARG  27           HG2      ARG  27  -5.920  -2.493  11.673
  211    HG3  ARG  27           HG1      ARG  27  -6.909  -1.654  12.865
  212    HD2  ARG  27           HD2      ARG  27  -7.890  -3.581  13.607
  213    HD3  ARG  27           HD1      ARG  27  -7.709  -4.398  12.058
  214    HE   ARG  27           HE       ARG  27  -5.700  -5.207  12.758
  215   HH11  ARG  27          HH21      ARG  27  -6.591  -2.548  14.847
  216   HH12  ARG  27          HH22      ARG  27  -5.320  -2.843  15.985
  217   HH21  ARG  27          HH11      ARG  27  -4.019  -5.607  14.251
  218   HH22  ARG  27          HH12      ARG  27  -3.852  -4.593  15.644
  219    H    THR  28           HN       THR  28  -9.230   0.551  11.903
  220    HA   THR  28           HA       THR  28 -11.486   1.267  10.264
  221    HB   THR  28           HB       THR  28 -10.438   2.441  12.460
  222    HG1  THR  28           HG1      THR  28 -11.731   4.289  11.799
  223   HG21  THR  28          HG21      THR  28  -8.414   3.215  11.248
  224   HG22  THR  28          HG22      THR  28  -9.371   4.541  11.908
  225   HG23  THR  28          HG23      THR  28  -9.452   4.169  10.186
  226    HA   PRO  29           HA       PRO  29  -9.826   1.896   6.231
  227    HB2  PRO  29           HB2      PRO  29 -10.611   4.758   6.624
  228    HB3  PRO  29           HB1      PRO  29 -10.874   3.702   5.231
  229    HG2  PRO  29           HG2      PRO  29 -12.838   4.181   6.964
  230    HG3  PRO  29           HG1      PRO  29 -12.623   2.574   6.247
  231    HD2  PRO  29           HD2      PRO  29 -12.073   3.497   9.009
  232    HD3  PRO  29           HD1      PRO  29 -12.474   1.874   8.417
  233    H    HIS  30           HN       HIS  30  -9.078   4.756   8.282
  234    HA   HIS  30           HA       HIS  30  -6.761   5.516   6.871
  235    HB2  HIS  30           HB2      HIS  30  -7.976   6.986   8.454
  236    HB3  HIS  30           HB1      HIS  30  -7.420   5.992   9.792
  237    HD1  HIS  30           HD1      HIS  30  -5.342   6.798  10.909
  238    HD2  HIS  30           HD2      HIS  30  -5.696   8.245   7.029
  239    HE1  HIS  30           HE1      HIS  30  -3.414   8.381  10.600
  240    HE2  HIS  30           HE2      HIS  30  -3.874   9.493   8.384
  241    H    TRP  31           HN       TRP  31  -7.173   3.558   9.767
  242    HA   TRP  31           HA       TRP  31  -4.449   3.008  10.222
  243    HB2  TRP  31           HB2      TRP  31  -6.258   2.786  11.927
  244    HB3  TRP  31           HB1      TRP  31  -6.872   1.394  11.045
  245    HD1  TRP  31           HD1      TRP  31  -4.972  -0.695  10.829
  246    HE1  TRP  31           HE1      TRP  31  -3.435  -1.602  12.677
  247    HE3  TRP  31           HE3      TRP  31  -5.052   3.330  13.972
  248    HZ2  TRP  31           HZ2      TRP  31  -2.389  -0.719  15.145
  249    HZ3  TRP  31           HZ3      TRP  31  -3.757   3.216  16.062
  250    HH2  TRP  31           HH2      TRP  31  -2.454   1.232  16.635
  251    H    LEU  32           HN       LEU  32  -7.004   1.389   8.489
  252    HA   LEU  32           HA       LEU  32  -5.589  -0.927   7.815
  253    HB2  LEU  32           HB2      LEU  32  -8.024  -0.761   7.565
  254    HB3  LEU  32           HB1      LEU  32  -7.810   0.398   6.269
  255    HG   LEU  32           HG       LEU  32  -8.368  -2.034   5.640
  256   HD11  LEU  32          HD11      LEU  32  -5.896  -1.091   4.263
  257   HD12  LEU  32          HD12      LEU  32  -7.388  -0.158   4.162
  258   HD13  LEU  32          HD13      LEU  32  -7.350  -1.824   3.585
  259   HD21  LEU  32          HD21      LEU  32  -6.535  -3.585   5.482
  260   HD22  LEU  32          HD22      LEU  32  -6.723  -3.071   7.159
  261   HD23  LEU  32          HD23      LEU  32  -5.426  -2.399   6.170
  262    H    ILE  33           HN       ILE  33  -5.825   2.194   6.257
  263    HA   ILE  33           HA       ILE  33  -4.584   1.565   3.846
  264    HB   ILE  33           HB       ILE  33  -4.484   4.129   5.438
  265   HG12  ILE  33          HG12      ILE  33  -5.996   3.468   2.908
  266   HG13  ILE  33          HG11      ILE  33  -6.689   3.338   4.522
  267   HG21  ILE  33          HG21      ILE  33  -3.444   3.548   2.675
  268   HG22  ILE  33          HG22      ILE  33  -2.552   4.179   4.060
  269   HG23  ILE  33          HG23      ILE  33  -3.773   5.175   3.269
  270   HD11  ILE  33          HD11      ILE  33  -7.237   5.473   4.451
  271   HD12  ILE  33          HD12      ILE  33  -6.525   5.607   2.843
  272   HD13  ILE  33          HD13      ILE  33  -5.538   5.913   4.273
  273    H    LYS  34           HN       LYS  34  -3.093   2.734   6.896
  274    HA   LYS  34           HA       LYS  34  -0.449   2.530   5.900
  275    HB2  LYS  34           HB2      LYS  34   0.342   2.735   8.145
  276    HB3  LYS  34           HB1      LYS  34  -1.063   3.770   7.986
  277    HG2  LYS  34           HG2      LYS  34  -2.420   2.040   9.094
  278    HG3  LYS  34           HG1      LYS  34  -0.951   1.087   9.325
  279    HD2  LYS  34           HD2      LYS  34   0.020   3.055  10.540
  280    HD3  LYS  34           HD1      LYS  34  -1.578   3.804  10.468
  281    HE2  LYS  34           HE2      LYS  34  -1.164   2.648  12.604
  282    HE3  LYS  34           HE1      LYS  34  -2.533   1.975  11.719
  283    HZ1  LYS  34           HZ1      LYS  34   0.199   0.830  11.630
  284    HZ2  LYS  34           HZ2      LYS  34  -1.222   0.141  11.026
  285    HZ3  LYS  34           HZ3      LYS  34  -1.004   0.301  12.695
  286    H    GLN  35           HN       GLN  35  -2.583   0.189   7.434
  287    HA   GLN  35           HA       GLN  35  -0.608  -1.850   7.670
  288    HB2  GLN  35           HB2      GLN  35  -3.617  -1.972   7.686
  289    HB3  GLN  35           HB1      GLN  35  -2.595  -3.386   7.891
  290    HG2  GLN  35           HG2      GLN  35  -1.561  -2.264   9.858
  291    HG3  GLN  35           HG1      GLN  35  -2.771  -0.992   9.692
  292   HE21  GLN  35          HE21      GLN  35  -4.795  -2.936   8.789
  293   HE22  GLN  35          HE22      GLN  35  -5.307  -3.764  10.215
  294    H    ALA  36           HN       ALA  36  -3.008  -1.056   5.195
  295    HA   ALA  36           HA       ALA  36  -2.881  -3.373   3.697
  296    HB1  ALA  36           HB1      ALA  36  -3.513  -0.540   3.041
  297    HB2  ALA  36           HB2      ALA  36  -4.535  -1.976   2.956
  298    HB3  ALA  36           HB3      ALA  36  -3.309  -1.692   1.723
  299    H    ILE  37           HN       ILE  37  -0.745  -0.574   3.662
  300    HA   ILE  37           HA       ILE  37   0.842  -1.793   1.576
  301    HB   ILE  37           HB       ILE  37   0.558   0.590   1.503
  302   HG12  ILE  37          HG12      ILE  37   3.038   1.298   1.668
  303   HG13  ILE  37          HG11      ILE  37   3.335  -0.390   2.073
  304   HG21  ILE  37          HG21      ILE  37   1.984   0.755   4.145
  305   HG22  ILE  37          HG22      ILE  37   0.247   0.951   3.915
  306   HG23  ILE  37          HG23      ILE  37   1.368   2.100   3.184
  307   HD11  ILE  37          HD11      ILE  37   1.754  -0.568  -0.157
  308   HD12  ILE  37          HD12      ILE  37   3.512  -0.703  -0.116
  309   HD13  ILE  37          HD13      ILE  37   2.756   0.846  -0.488
  310    H    PHE  38           HN       PHE  38   1.410  -1.040   5.047
  311    HA   PHE  38           HA       PHE  38   4.015  -2.248   4.945
  312    HB2  PHE  38           HB2      PHE  38   4.319  -1.174   6.894
  313    HB3  PHE  38           HB1      PHE  38   2.690  -0.541   6.733
  314    HD1  PHE  38           HD2      PHE  38   4.582  -3.446   8.107
  315    HD2  PHE  38           HD1      PHE  38   1.101  -1.008   8.340
  316    HE1  PHE  38           HE2      PHE  38   3.928  -4.585  10.186
  317    HE2  PHE  38           HE1      PHE  38   0.446  -2.139  10.423
  318    HZ   PHE  38           HZ       PHE  38   1.857  -3.932  11.346
  319    H    ASN  39           HN       ASN  39   0.804  -3.298   5.980
  320    HA   ASN  39           HA       ASN  39   1.729  -5.799   6.966
  321    HB2  ASN  39           HB2      ASN  39  -0.515  -4.748   7.551
  322    HB3  ASN  39           HB1      ASN  39  -1.054  -5.236   5.951
  323   HD21  ASN  39          HD21      ASN  39  -2.505  -6.127   7.947
  324   HD22  ASN  39          HD22      ASN  39  -2.211  -7.796   8.285
  325    H    TYR  40           HN       TYR  40   1.046  -4.451   3.840
  326    HA   TYR  40           HA       TYR  40   0.707  -6.878   2.427
  327    HB2  TYR  40           HB2      TYR  40   0.276  -4.974   1.118
  328    HB3  TYR  40           HB1      TYR  40   1.717  -4.143   1.688
  329    HD1  TYR  40           HD1      TYR  40   0.911  -7.296  -0.187
  330    HD2  TYR  40           HD2      TYR  40   3.369  -3.841   0.148
  331    HE1  TYR  40           HE1      TYR  40   2.109  -7.955  -2.226
  332    HE2  TYR  40           HE2      TYR  40   4.574  -4.494  -1.893
  333    HH   TYR  40           HH       TYR  40   5.028  -6.530  -3.195
  334    H    LEU  41           HN       LEU  41   3.408  -4.956   3.476
  335    HA   LEU  41           HA       LEU  41   5.443  -6.628   2.442
  336    HB2  LEU  41           HB2      LEU  41   5.530  -4.594   4.659
  337    HB3  LEU  41           HB1      LEU  41   6.938  -5.334   3.922
  338    HG   LEU  41           HG       LEU  41   4.953  -3.536   2.515
  339   HD11  LEU  41          HD11      LEU  41   7.840  -2.927   2.959
  340   HD12  LEU  41          HD12      LEU  41   6.660  -2.600   4.227
  341   HD13  LEU  41          HD13      LEU  41   6.492  -1.833   2.649
  342   HD21  LEU  41          HD21      LEU  41   7.407  -4.975   1.537
  343   HD22  LEU  41          HD22      LEU  41   6.681  -3.609   0.692
  344   HD23  LEU  41          HD23      LEU  41   5.759  -5.094   0.921
  345    H    GLU  42           HN       GLU  42   3.855  -6.335   5.580
  346    HA   GLU  42           HA       GLU  42   5.414  -8.192   6.996
  347    HB2  GLU  42           HB2      GLU  42   3.836  -6.520   7.993
  348    HB3  GLU  42           HB1      GLU  42   2.505  -7.547   7.479
  349    HG2  GLU  42           HG2      GLU  42   3.362  -9.356   8.888
  350    HG3  GLU  42           HG1      GLU  42   4.680  -8.312   9.415
  351    H    LYS  43           HN       LYS  43   2.457  -8.649   5.073
  352    HA   LYS  43           HA       LYS  43   1.948 -11.311   5.800
  353    HB2  LYS  43           HB2      LYS  43   1.323  -9.817   3.256
  354    HB3  LYS  43           HB1      LYS  43   0.775 -11.459   3.561
  355    HG2  LYS  43           HG2      LYS  43  -0.455 -10.692   5.519
  356    HG3  LYS  43           HG1      LYS  43   0.097  -9.042   5.223
  357    HD2  LYS  43           HD2      LYS  43  -1.011  -9.120   3.009
  358    HD3  LYS  43           HD1      LYS  43  -1.639 -10.720   3.411
  359    HE2  LYS  43           HE2      LYS  43  -3.384  -9.222   3.911
  360    HE3  LYS  43           HE1      LYS  43  -2.661  -9.631   5.467
  361    HZ1  LYS  43           HZ1      LYS  43  -2.679  -7.409   5.699
  362    HZ2  LYS  43           HZ2      LYS  43  -2.681  -7.103   4.035
  363    HZ3  LYS  43           HZ3      LYS  43  -1.231  -7.497   4.826
  364    H    LEU  44           HN       LEU  44   3.901 -10.015   3.128
  365    HA   LEU  44           HA       LEU  44   4.641 -12.682   2.305
  366    HB2  LEU  44           HB2      LEU  44   6.174 -11.458   0.712
  367    HB3  LEU  44           HB1      LEU  44   4.457 -11.194   0.501
  368    HG   LEU  44           HG       LEU  44   5.039  -9.086   2.074
  369   HD11  LEU  44          HD11      LEU  44   7.422  -9.691   2.152
  370   HD12  LEU  44          HD12      LEU  44   7.143  -8.121   1.399
  371   HD13  LEU  44          HD13      LEU  44   7.498  -9.528   0.397
  372   HD21  LEU  44          HD21      LEU  44   5.109  -7.763   0.019
  373   HD22  LEU  44          HD22      LEU  44   3.870  -9.016  -0.063
  374   HD23  LEU  44          HD23      LEU  44   5.400  -9.230  -0.915
  375    H    GLU  45           HN       GLU  45   5.659 -10.397   4.535
  376    HA   GLU  45           HA       GLU  45   7.280 -10.286   6.073
  377    HB2  GLU  45           HB2      GLU  45   7.735 -13.136   5.207
  378    HB3  GLU  45           HB1      GLU  45   8.626 -12.381   6.523
  379    HG2  GLU  45           HG2      GLU  45   6.532 -11.955   7.705
  380    HG3  GLU  45           HG1      GLU  45   5.634 -12.699   6.388
  381    H1   MET  46           HT1      MET  46  -6.945   0.809 -14.988
  382    H2   MET  46           HT2      MET  46  -6.207  -0.592 -14.389
  383    H3   MET  46           HT3      MET  46  -5.296   0.814 -14.618
  384    HA   MET  46           HA       MET  46  -7.526   0.525 -12.705
  385    HB2  MET  46           HB2      MET  46  -5.602   0.815 -11.022
  386    HB3  MET  46           HB1      MET  46  -5.788  -0.757 -11.783
  387    HG2  MET  46           HG2      MET  46  -3.883   1.305 -12.840
  388    HG3  MET  46           HG1      MET  46  -3.433   0.173 -11.565
  389    HE1  MET  46           HE1      MET  46  -1.537   0.039 -13.506
  390    HE2  MET  46           HE2      MET  46  -1.548  -1.381 -14.551
  391    HE3  MET  46           HE3      MET  46  -1.589  -1.577 -12.799
  392    H    ALA  47           HN       ALA  47  -8.085   2.353 -11.630
  393    HA   ALA  47           HA       ALA  47  -7.213   4.865 -12.841
  394    HB1  ALA  47           HB1      ALA  47  -9.130   5.815 -11.534
  395    HB2  ALA  47           HB2      ALA  47  -9.498   4.178 -10.992
  396    HB3  ALA  47           HB3      ALA  47  -9.592   4.581 -12.706
  397    H    THR  48           HN       THR  48  -5.123   4.162 -11.641
  398    HA   THR  48           HA       THR  48  -4.961   4.435  -8.838
  399    HB   THR  48           HB       THR  48  -2.433   4.950  -9.636
  400    HG1  THR  48           HG1      THR  48  -3.178   4.983 -11.867
  401   HG21  THR  48          HG21      THR  48  -2.964   3.076  -8.260
  402   HG22  THR  48          HG22      THR  48  -2.134   2.439  -9.680
  403   HG23  THR  48          HG23      THR  48  -3.887   2.307  -9.550
  404    H    THR  49           HN       THR  49  -5.587   6.297  -7.904
  405    HA   THR  49           HA       THR  49  -4.480   8.800  -8.973
  406    HB   THR  49           HB       THR  49  -6.199   9.815  -7.278
  407    HG1  THR  49           HG1      THR  49  -6.693   7.384  -6.709
  408   HG21  THR  49          HG21      THR  49  -6.355  10.123  -9.673
  409   HG22  THR  49          HG22      THR  49  -7.952   9.753  -9.022
  410   HG23  THR  49          HG23      THR  49  -7.034   8.507  -9.867
  411    H    THR  50           HN       THR  50  -3.347  10.212  -7.601
  412    HA   THR  50           HA       THR  50  -1.839   8.893  -5.570
  413    HB   THR  50           HB       THR  50  -1.868  11.856  -6.145
  414    HG1  THR  50           HG1      THR  50  -1.215   9.809  -7.771
  415   HG21  THR  50          HG21      THR  50  -0.611  11.230  -4.155
  416   HG22  THR  50          HG22      THR  50   0.501  11.698  -5.443
  417   HG23  THR  50          HG23      THR  50   0.256   9.993  -5.065
  418    H    LEU  51           HN       LEU  51  -2.546   8.507  -3.620
  419    HA   LEU  51           HA       LEU  51  -4.143  10.538  -2.207
  420    HB2  LEU  51           HB2      LEU  51  -4.454   7.540  -1.947
  421    HB3  LEU  51           HB1      LEU  51  -5.377   8.754  -1.087
  422    HG   LEU  51           HG       LEU  51  -5.515   8.108  -4.033
  423   HD11  LEU  51          HD11      LEU  51  -7.898   8.159  -2.295
  424   HD12  LEU  51          HD12      LEU  51  -6.750   6.852  -2.012
  425   HD13  LEU  51          HD13      LEU  51  -7.469   7.063  -3.609
  426   HD21  LEU  51          HD21      LEU  51  -5.706  10.483  -3.877
  427   HD22  LEU  51          HD22      LEU  51  -6.794  10.361  -2.495
  428   HD23  LEU  51          HD23      LEU  51  -7.329   9.825  -4.088
  429    H    GLY  52           HN       GLY  52  -3.888  10.404   0.171
  430    HA2  GLY  52           HA2      GLY  52  -1.120  10.122   0.855
  431    HA3  GLY  52           HA1      GLY  52  -2.413  10.617   1.933
  432    H    VAL  53           HN       VAL  53  -0.124   8.353   1.487
  433    HA   VAL  53           HA       VAL  53  -1.600   6.364   3.074
  434    HB   VAL  53           HB       VAL  53   0.290   5.782   0.783
  435   HG11  VAL  53          HG11      VAL  53  -0.965   3.873   2.749
  436   HG12  VAL  53          HG12      VAL  53   0.755   4.152   2.480
  437   HG13  VAL  53          HG13      VAL  53  -0.220   3.384   1.227
  438   HG21  VAL  53          HG21      VAL  53  -1.668   4.620  -0.170
  439   HG22  VAL  53          HG22      VAL  53  -1.935   6.350   0.049
  440   HG23  VAL  53          HG23      VAL  53  -2.637   5.199   1.185
  441    H    LYS  54           HN       LYS  54   0.034   4.888   4.265
  442    HA   LYS  54           HA       LYS  54   2.135   6.646   5.321
  443    HB2  LYS  54           HB2      LYS  54   0.910   4.229   6.660
  444    HB3  LYS  54           HB1      LYS  54   2.018   5.381   7.381
  445    HG2  LYS  54           HG2      LYS  54  -0.136   5.877   8.221
  446    HG3  LYS  54           HG1      LYS  54   0.247   7.139   7.047
  447    HD2  LYS  54           HD2      LYS  54  -1.139   6.133   5.397
  448    HD3  LYS  54           HD1      LYS  54  -1.351   4.679   6.365
  449    HE2  LYS  54           HE2      LYS  54  -2.776   5.748   7.862
  450    HE3  LYS  54           HE1      LYS  54  -2.252   7.356   7.351
  451    HZ1  LYS  54           HZ1      LYS  54  -3.287   5.944   5.143
  452    HZ2  LYS  54           HZ2      LYS  54  -3.841   7.387   5.826
  453    HZ3  LYS  54           HZ3      LYS  54  -4.416   5.901   6.403
  454    H    LEU  55           HN       LEU  55   4.163   6.126   5.025
  455    HA   LEU  55           HA       LEU  55   4.921   3.337   4.598
  456    HB2  LEU  55           HB2      LEU  55   5.392   5.629   2.733
  457    HB3  LEU  55           HB1      LEU  55   6.600   4.367   2.858
  458    HG   LEU  55           HG       LEU  55   3.731   3.717   2.238
  459   HD11  LEU  55          HD11      LEU  55   4.388   5.312   0.557
  460   HD12  LEU  55          HD12      LEU  55   4.414   3.695  -0.147
  461   HD13  LEU  55          HD13      LEU  55   5.924   4.481   0.314
  462   HD21  LEU  55          HD21      LEU  55   4.912   1.795   1.098
  463   HD22  LEU  55          HD22      LEU  55   5.003   1.822   2.859
  464   HD23  LEU  55          HD23      LEU  55   6.385   2.344   1.896
  465    H    ASP  56           HN       ASP  56   6.674   2.817   5.709
  466    HA   ASP  56           HA       ASP  56   8.032   4.826   7.301
  467    HB2  ASP  56           HB2      ASP  56   8.753   1.892   7.067
  468    HB3  ASP  56           HB1      ASP  56   9.161   2.987   8.371
  469    H    ASP  57           HN       ASP  57  10.418   5.018   7.229
  470    HA   ASP  57           HA       ASP  57  11.501   5.320   4.689
  471    HB2  ASP  57           HB2      ASP  57  12.635   5.192   7.427
  472    HB3  ASP  57           HB1      ASP  57  13.763   4.863   6.119
  473    HA   PRO  58           HA       PRO  58  13.522   0.868   5.256
  474    HB2  PRO  58           HB2      PRO  58  11.965  -0.771   6.857
  475    HB3  PRO  58           HB1      PRO  58  13.481  -0.013   7.353
  476    HG2  PRO  58           HG2      PRO  58  10.669   0.852   7.863
  477    HG3  PRO  58           HG1      PRO  58  12.075   0.906   8.943
  478    HD2  PRO  58           HD2      PRO  58  11.190   3.109   7.714
  479    HD3  PRO  58           HD1      PRO  58  12.927   2.819   7.942
  480    H    THR  59           HN       THR  59   9.976   1.309   5.497
  481    HA   THR  59           HA       THR  59   9.431  -0.925   3.809
  482    HB   THR  59           HB       THR  59   7.157  -0.208   3.661
  483    HG1  THR  59           HG1      THR  59   8.185   2.259   3.890
  484   HG21  THR  59          HG21      THR  59   6.964   0.613   6.268
  485   HG22  THR  59          HG22      THR  59   8.521  -0.216   6.240
  486   HG23  THR  59          HG23      THR  59   7.061  -1.061   5.725
  487    H    ARG  60           HN       ARG  60   9.958   2.515   3.290
  488    HA   ARG  60           HA       ARG  60   9.153   2.653   0.599
  489    HB2  ARG  60           HB2      ARG  60   9.630   4.611   2.053
  490    HB3  ARG  60           HB1      ARG  60  11.340   4.209   2.009
  491    HG2  ARG  60           HG2      ARG  60  11.094   5.929   0.457
  492    HG3  ARG  60           HG1      ARG  60  11.163   4.461  -0.519
  493    HD2  ARG  60           HD2      ARG  60   8.690   4.451  -0.609
  494    HD3  ARG  60           HD1      ARG  60   8.680   5.975   0.278
  495    HE   ARG  60           HE       ARG  60   9.421   7.079  -1.616
  496   HH11  ARG  60          HH21      ARG  60   9.342   3.623  -2.164
  497   HH12  ARG  60          HH22      ARG  60   9.534   3.758  -3.878
  498   HH21  ARG  60          HH11      ARG  60   9.690   7.274  -3.875
  499   HH22  ARG  60          HH12      ARG  60   9.750   5.851  -4.857
  500    H    GLU  61           HN       GLU  61  12.279   2.014   2.099
  501    HA   GLU  61           HA       GLU  61  13.684   1.529  -0.314
  502    HB2  GLU  61           HB2      GLU  61  14.284   0.734   2.540
  503    HB3  GLU  61           HB1      GLU  61  15.410   0.536   1.203
  504    HG2  GLU  61           HG2      GLU  61  14.299   3.145   2.228
  505    HG3  GLU  61           HG1      GLU  61  15.927   2.525   2.492
  506    H    ARG  62           HN       ARG  62  12.007  -0.549   2.015
  507    HA   ARG  62           HA       ARG  62  12.756  -3.013   0.854
  508    HB2  ARG  62           HB2      ARG  62  11.660  -2.712   3.133
  509    HB3  ARG  62           HB1      ARG  62  10.134  -2.529   2.272
  510    HG2  ARG  62           HG2      ARG  62  10.593  -4.751   1.198
  511    HG3  ARG  62           HG1      ARG  62  11.940  -4.930   2.318
  512    HD2  ARG  62           HD2      ARG  62  10.325  -4.658   4.195
  513    HD3  ARG  62           HD1      ARG  62   9.019  -4.665   3.011
  514    HE   ARG  62           HE       ARG  62  10.234  -6.921   4.107
  515   HH11  ARG  62          HH21      ARG  62   9.242  -5.768   0.933
  516   HH12  ARG  62          HH22      ARG  62   9.101  -7.361   0.274
  517   HH21  ARG  62          HH11      ARG  62  10.018  -8.998   3.249
  518   HH22  ARG  62          HH12      ARG  62   9.546  -9.200   1.589
  519    H    LEU  63           HN       LEU  63  10.165  -0.734   0.232
  520    HA   LEU  63           HA       LEU  63   8.692  -2.271  -1.590
  521    HB2  LEU  63           HB2      LEU  63   8.862   0.564  -0.859
  522    HB3  LEU  63           HB1      LEU  63   8.460   0.311  -2.546
  523    HG   LEU  63           HG       LEU  63   6.589  -1.230  -1.712
  524   HD11  LEU  63          HD11      LEU  63   7.111   0.226   0.865
  525   HD12  LEU  63          HD12      LEU  63   7.421  -1.487   0.579
  526   HD13  LEU  63          HD13      LEU  63   5.770  -0.867   0.519
  527   HD21  LEU  63          HD21      LEU  63   6.475   1.712  -1.070
  528   HD22  LEU  63          HD22      LEU  63   5.088   0.652  -1.320
  529   HD23  LEU  63          HD23      LEU  63   6.197   0.982  -2.651
  530    H    LYS  64           HN       LYS  64  11.608  -0.311  -1.917
  531    HA   LYS  64           HA       LYS  64  11.814  -0.402  -4.718
  532    HB2  LYS  64           HB2      LYS  64  13.260   0.984  -3.201
  533    HB3  LYS  64           HB1      LYS  64  14.129  -0.487  -2.783
  534    HG2  LYS  64           HG2      LYS  64  14.623  -0.753  -5.242
  535    HG3  LYS  64           HG1      LYS  64  13.988   0.878  -5.457
  536    HD2  LYS  64           HD2      LYS  64  16.322   0.080  -3.719
  537    HD3  LYS  64           HD1      LYS  64  16.414   0.919  -5.267
  538    HE2  LYS  64           HE2      LYS  64  15.295   1.941  -2.665
  539    HE3  LYS  64           HE1      LYS  64  16.679   2.556  -3.565
  540    HZ1  LYS  64           HZ1      LYS  64  13.812   2.797  -4.231
  541    HZ2  LYS  64           HZ2      LYS  64  15.017   3.055  -5.389
  542    HZ3  LYS  64           HZ3      LYS  64  14.948   4.030  -4.008
  543    H    ALA  65           HN       ALA  65  12.918  -2.604  -2.238
  544    HA   ALA  65           HA       ALA  65  14.148  -4.513  -3.897
  545    HB1  ALA  65           HB1      ALA  65  13.774  -6.084  -1.968
  546    HB2  ALA  65           HB2      ALA  65  12.895  -4.782  -1.164
  547    HB3  ALA  65           HB3      ALA  65  14.605  -4.585  -1.552
  548    H    ALA  66           HN       ALA  66  10.848  -4.109  -2.735
  549    HA   ALA  66           HA       ALA  66   9.763  -6.465  -3.860
  550    HB1  ALA  66           HB1      ALA  66   8.650  -5.041  -2.122
  551    HB2  ALA  66           HB2      ALA  66   7.609  -5.481  -3.476
  552    HB3  ALA  66           HB3      ALA  66   8.306  -3.864  -3.389
  553    H    ALA  67           HN       ALA  67  10.269  -3.199  -5.023
  554    HA   ALA  67           HA       ALA  67   8.978  -3.348  -7.494
  555    HB1  ALA  67           HB1      ALA  67  10.256  -1.428  -8.114
  556    HB2  ALA  67           HB2      ALA  67  11.495  -1.801  -6.917
  557    HB3  ALA  67           HB3      ALA  67   9.894  -1.280  -6.394
  558    H    GLN  68           HN       GLN  68  12.230  -4.073  -6.524
  559    HA   GLN  68           HA       GLN  68  13.270  -4.829  -9.024
  560    HB2  GLN  68           HB2      GLN  68  14.054  -5.635  -6.214
  561    HB3  GLN  68           HB1      GLN  68  15.019  -5.977  -7.647
  562    HG2  GLN  68           HG2      GLN  68  14.215  -3.206  -6.810
  563    HG3  GLN  68           HG1      GLN  68  15.726  -3.967  -6.318
  564   HE21  GLN  68          HE21      GLN  68  14.930  -1.634  -8.113
  565   HE22  GLN  68          HE22      GLN  68  15.842  -1.892  -9.555
  566    H    SER  69           HN       SER  69  11.653  -6.594  -6.466
  567    HA   SER  69           HA       SER  69  11.947  -9.196  -7.431
  568    HB2  SER  69           HB2      SER  69   9.678  -7.996  -5.824
  569    HB3  SER  69           HB1      SER  69   9.985  -9.722  -6.013
  570    HG   SER  69           HG       SER  69  11.938  -7.945  -4.982
  571    H    ILE  70           HN       ILE  70   9.621  -6.669  -8.272
  572    HA   ILE  70           HA       ILE  70   8.281  -8.541 -10.094
  573    HB   ILE  70           HB       ILE  70   6.865  -7.326  -8.448
  574   HG12  ILE  70          HG12      ILE  70   6.198  -6.431 -11.254
  575   HG13  ILE  70          HG11      ILE  70   6.047  -8.106 -10.736
  576   HG21  ILE  70          HG21      ILE  70   7.825  -5.248  -8.148
  577   HG22  ILE  70          HG22      ILE  70   6.398  -4.875  -9.116
  578   HG23  ILE  70          HG23      ILE  70   7.986  -4.960  -9.879
  579   HD11  ILE  70          HD11      ILE  70   3.983  -6.546 -10.697
  580   HD12  ILE  70          HD12      ILE  70   4.685  -5.945  -9.194
  581   HD13  ILE  70          HD13      ILE  70   4.265  -7.651  -9.352
  582    H    ASP  71           HN       ASP  71  10.788  -6.535 -10.214
  583    HA   ASP  71           HA       ASP  71  11.968  -5.501 -11.842
  584    HB2  ASP  71           HB2      ASP  71  11.237  -7.656 -13.041
  585    HB3  ASP  71           HB1      ASP  71  10.066  -6.649 -13.878
  586    H    ARG  72           HN       ARG  72  10.126  -3.915 -10.588
  587    HA   ARG  72           HA       ARG  72   9.291  -2.104 -12.778
  588    HB2  ARG  72           HB2      ARG  72   7.738  -3.114 -10.459
  589    HB3  ARG  72           HB1      ARG  72   7.542  -1.414 -10.848
  590    HG2  ARG  72           HG2      ARG  72   5.823  -2.797 -11.892
  591    HG3  ARG  72           HG1      ARG  72   6.818  -1.975 -13.091
  592    HD2  ARG  72           HD2      ARG  72   7.777  -3.913 -13.824
  593    HD3  ARG  72           HD1      ARG  72   7.606  -4.716 -12.266
  594    HE   ARG  72           HE       ARG  72   5.606  -5.544 -12.960
  595   HH11  ARG  72          HH21      ARG  72   6.414  -2.837 -15.031
  596   HH12  ARG  72          HH22      ARG  72   5.127  -3.148 -16.149
  597   HH21  ARG  72          HH11      ARG  72   3.923  -5.967 -14.445
  598   HH22  ARG  72          HH12      ARG  72   3.717  -4.944 -15.824
  599    H    THR  73           HN       THR  73   9.194   0.199 -12.144
  600    HA   THR  73           HA       THR  73  11.456   0.902 -10.505
  601    HB   THR  73           HB       THR  73  10.506   2.061 -12.717
  602    HG1  THR  73           HG1      THR  73  11.946   3.621 -12.283
  603   HG21  THR  73          HG21      THR  73   8.383   2.761 -11.626
  604   HG22  THR  73          HG22      THR  73   9.313   4.109 -12.281
  605   HG23  THR  73          HG23      THR  73   9.321   3.793 -10.545
  606    HA   PRO  74           HA       PRO  74   9.789   1.596  -6.476
  607    HB2  PRO  74           HB2      PRO  74  10.631   4.436  -6.909
  608    HB3  PRO  74           HB1      PRO  74  10.861   3.399  -5.495
  609    HG2  PRO  74           HG2      PRO  74  12.846   3.810  -7.228
  610    HG3  PRO  74           HG1      PRO  74  12.600   2.227  -6.471
  611    HD2  PRO  74           HD2      PRO  74  12.105   3.077  -9.261
  612    HD3  PRO  74           HD1      PRO  74  12.441   1.460  -8.615
  613    H    HIS  75           HN       HIS  75   9.113   4.466  -8.538
  614    HA   HIS  75           HA       HIS  75   6.795   5.274  -7.171
  615    HB2  HIS  75           HB2      HIS  75   8.085   6.659  -8.808
  616    HB3  HIS  75           HB1      HIS  75   7.427   5.676 -10.107
  617    HD1  HIS  75           HD1      HIS  75   5.392   6.615 -11.181
  618    HD2  HIS  75           HD2      HIS  75   5.886   8.000  -7.300
  619    HE1  HIS  75           HE1      HIS  75   3.562   8.302 -10.832
  620    HE2  HIS  75           HE2      HIS  75   4.143   9.383  -8.627
  621    H    TRP  76           HN       TRP  76   7.199   3.248 -10.028
  622    HA   TRP  76           HA       TRP  76   4.459   2.756 -10.490
  623    HB2  TRP  76           HB2      TRP  76   6.257   2.467 -12.197
  624    HB3  TRP  76           HB1      TRP  76   6.842   1.076 -11.295
  625    HD1  TRP  76           HD1      TRP  76   4.889  -0.970 -11.044
  626    HE1  TRP  76           HE1      TRP  76   3.328  -1.866 -12.880
  627    HE3  TRP  76           HE3      TRP  76   5.064   3.007 -14.244
  628    HZ2  TRP  76           HZ2      TRP  76   2.305  -0.995 -15.361
  629    HZ3  TRP  76           HZ3      TRP  76   3.766   2.894 -16.332
  630    HH2  TRP  76           HH2      TRP  76   2.416   0.934 -16.877
  631    H    LEU  77           HN       LEU  77   6.976   1.126  -8.721
  632    HA   LEU  77           HA       LEU  77   5.517  -1.158  -8.020
  633    HB2  LEU  77           HB2      LEU  77   7.954  -1.035  -7.776
  634    HB3  LEU  77           HB1      LEU  77   7.764   0.148  -6.499
  635    HG   LEU  77           HG       LEU  77   8.277  -2.281  -5.831
  636   HD11  LEU  77          HD11      LEU  77   5.824  -1.267  -4.470
  637   HD12  LEU  77          HD12      LEU  77   7.333  -0.362  -4.386
  638   HD13  LEU  77          HD13      LEU  77   7.264  -2.016  -3.779
  639   HD21  LEU  77          HD21      LEU  77   6.415  -3.795  -5.647
  640   HD22  LEU  77          HD22      LEU  77   6.612  -3.312  -7.332
  641   HD23  LEU  77          HD23      LEU  77   5.328  -2.599  -6.355
  642    H    ILE  78           HN       ILE  78   5.814   1.984  -6.515
  643    HA   ILE  78           HA       ILE  78   4.556   1.422  -4.098
  644    HB   ILE  78           HB       ILE  78   4.508   3.959  -5.733
  645   HG12  ILE  78          HG12      ILE  78   6.005   3.314  -3.189
  646   HG13  ILE  78          HG11      ILE  78   6.697   3.145  -4.800
  647   HG21  ILE  78          HG21      ILE  78   3.452   3.448  -2.964
  648   HG22  ILE  78          HG22      ILE  78   2.575   4.071  -4.362
  649   HG23  ILE  78          HG23      ILE  78   3.814   5.057  -3.586
  650   HD11  ILE  78          HD11      ILE  78   7.282   5.271  -4.765
  651   HD12  ILE  78          HD12      ILE  78   6.571   5.443  -3.160
  652   HD13  ILE  78          HD13      ILE  78   5.591   5.743  -4.596
  653    H    LYS  79           HN       LYS  79   3.091   2.568  -7.167
  654    HA   LYS  79           HA       LYS  79   0.443   2.428  -6.173
  655    HB2  LYS  79           HB2      LYS  79  -0.347   2.593  -8.423
  656    HB3  LYS  79           HB1      LYS  79   1.065   3.622  -8.279
  657    HG2  LYS  79           HG2      LYS  79   2.410   1.863  -9.357
  658    HG3  LYS  79           HG1      LYS  79   0.936   0.917  -9.576
  659    HD2  LYS  79           HD2      LYS  79  -0.018   2.885 -10.818
  660    HD3  LYS  79           HD1      LYS  79   1.591   3.608 -10.761
  661    HE2  LYS  79           HE2      LYS  79   1.174   2.443 -12.881
  662    HE3  LYS  79           HE1      LYS  79   2.510   1.726 -11.979
  663    HZ1  LYS  79           HZ1      LYS  79  -0.265   0.685 -11.933
  664    HZ2  LYS  79           HZ2      LYS  79   1.109  -0.048 -11.274
  665    HZ3  LYS  79           HZ3      LYS  79   0.949   0.093 -12.952
  666    H    GLN  80           HN       GLN  80   2.535   0.024  -7.665
  667    HA   GLN  80           HA       GLN  80   0.522  -1.981  -7.867
  668    HB2  GLN  80           HB2      GLN  80   3.528  -2.159  -7.886
  669    HB3  GLN  80           HB1      GLN  80   2.480  -3.558  -8.066
  670    HG2  GLN  80           HG2      GLN  80   1.460  -2.439 -10.047
  671    HG3  GLN  80           HG1      GLN  80   2.704  -1.198  -9.908
  672   HE21  GLN  80          HE21      GLN  80   4.694  -3.162  -8.993
  673   HE22  GLN  80          HE22      GLN  80   5.170  -4.031 -10.407
  674    H    ALA  81           HN       ALA  81   2.938  -1.195  -5.405
  675    HA   ALA  81           HA       ALA  81   2.767  -3.484  -3.870
  676    HB1  ALA  81           HB1      ALA  81   3.452  -0.654  -3.261
  677    HB2  ALA  81           HB2      ALA  81   4.447  -2.106  -3.151
  678    HB3  ALA  81           HB3      ALA  81   3.225  -1.780  -1.923
  679    H    ILE  82           HN       ILE  82   0.683  -0.647  -3.882
  680    HA   ILE  82           HA       ILE  82  -0.924  -1.804  -1.774
  681    HB   ILE  82           HB       ILE  82  -0.596   0.574  -1.738
  682   HG12  ILE  82          HG12      ILE  82  -3.063   1.324  -1.913
  683   HG13  ILE  82          HG11      ILE  82  -3.391  -0.364  -2.292
  684   HG21  ILE  82          HG21      ILE  82  -2.022   0.725  -4.381
  685   HG22  ILE  82          HG22      ILE  82  -0.281   0.893  -4.156
  686   HG23  ILE  82          HG23      ILE  82  -1.381   2.072  -3.441
  687   HD11  ILE  82          HD11      ILE  82  -1.814  -0.536  -0.060
  688   HD12  ILE  82          HD12      ILE  82  -3.573  -0.640  -0.098
  689   HD13  ILE  82          HD13      ILE  82  -2.788   0.901   0.250
  690    H    PHE  83           HN       PHE  83  -1.484  -1.093  -5.257
  691    HA   PHE  83           HA       PHE  83  -4.110  -2.256  -5.135
  692    HB2  PHE  83           HB2      PHE  83  -4.395  -1.211  -7.104
  693    HB3  PHE  83           HB1      PHE  83  -2.756  -0.602  -6.953
  694    HD1  PHE  83           HD2      PHE  83  -4.693  -3.503  -8.273
  695    HD2  PHE  83           HD1      PHE  83  -1.177  -1.121  -8.555
  696    HE1  PHE  83           HE2      PHE  83  -4.058  -4.692 -10.330
  697    HE2  PHE  83           HE1      PHE  83  -0.540  -2.303 -10.615
  698    HZ   PHE  83           HZ       PHE  83  -1.978  -4.092 -11.503
  699    H    ASN  84           HN       ASN  84  -0.918  -3.373  -6.154
  700    HA   ASN  84           HA       ASN  84  -1.886  -5.872  -7.101
  701    HB2  ASN  84           HB2      ASN  84   0.363  -4.873  -7.721
  702    HB3  ASN  84           HB1      ASN  84   0.907  -5.315  -6.109
  703   HD21  ASN  84          HD21      ASN  84   2.389  -6.305  -7.970
  704   HD22  ASN  84          HD22      ASN  84   2.062  -7.971  -8.296
  705    H    TYR  85           HN       TYR  85  -1.150  -4.494  -3.992
  706    HA   TYR  85           HA       TYR  85  -0.870  -6.899  -2.539
  707    HB2  TYR  85           HB2      TYR  85  -0.412  -4.976  -1.262
  708    HB3  TYR  85           HB1      TYR  85  -1.840  -4.134  -1.847
  709    HD1  TYR  85           HD1      TYR  85  -1.082  -7.266   0.080
  710    HD2  TYR  85           HD2      TYR  85  -3.486  -3.779  -0.308
  711    HE1  TYR  85           HE1      TYR  85  -2.291  -7.876   2.130
  712    HE2  TYR  85           HE2      TYR  85  -4.702  -4.382   1.742
  713    HH   TYR  85           HH       TYR  85  -5.189  -6.396   3.070
  714    H    LEU  86           HN       LEU  86  -3.544  -4.948  -3.617
  715    HA   LEU  86           HA       LEU  86  -5.605  -6.576  -2.564
  716    HB2  LEU  86           HB2      LEU  86  -5.661  -4.574  -4.808
  717    HB3  LEU  86           HB1      LEU  86  -7.080  -5.280  -4.058
  718    HG   LEU  86           HG       LEU  86  -5.064  -3.491  -2.683
  719   HD11  LEU  86          HD11      LEU  86  -7.941  -2.847  -3.140
  720   HD12  LEU  86          HD12      LEU  86  -6.754  -2.561  -4.411
  721   HD13  LEU  86          HD13      LEU  86  -6.577  -1.768  -2.846
  722   HD21  LEU  86          HD21      LEU  86  -7.541  -4.873  -1.676
  723   HD22  LEU  86          HD22      LEU  86  -6.792  -3.502  -0.858
  724   HD23  LEU  86          HD23      LEU  86  -5.894  -5.006  -1.058
  725    H    GLU  87           HN       GLU  87  -3.991  -6.367  -5.697
  726    HA   GLU  87           HA       GLU  87  -5.601  -8.205  -7.087
  727    HB2  GLU  87           HB2      GLU  87  -3.989  -6.603  -8.134
  728    HB3  GLU  87           HB1      GLU  87  -2.676  -7.637  -7.585
  729    HG2  GLU  87           HG2      GLU  87  -3.617  -9.489  -8.915
  730    HG3  GLU  87           HG1      GLU  87  -4.857  -8.391  -9.518
  731    H    LYS  88           HN       LYS  88  -2.665  -8.699  -5.146
  732    HA   LYS  88           HA       LYS  88  -2.208 -11.381  -5.838
  733    HB2  LYS  88           HB2      LYS  88  -1.569  -9.866  -3.308
  734    HB3  LYS  88           HB1      LYS  88  -1.041 -11.517  -3.599
  735    HG2  LYS  88           HG2      LYS  88   0.200 -10.779  -5.565
  736    HG3  LYS  88           HG1      LYS  88  -0.330  -9.121  -5.274
  737    HD2  LYS  88           HD2      LYS  88   0.777  -9.202  -3.062
  738    HD3  LYS  88           HD1      LYS  88   1.387 -10.811  -3.457
  739    HE2  LYS  88           HE2      LYS  88   3.146  -9.329  -3.966
  740    HE3  LYS  88           HE1      LYS  88   2.419  -9.747  -5.519
  741    HZ1  LYS  88           HZ1      LYS  88   2.442  -7.528  -5.771
  742    HZ2  LYS  88           HZ2      LYS  88   2.458  -7.207  -4.110
  743    HZ3  LYS  88           HZ3      LYS  88   1.000  -7.601  -4.887
  744    H    LEU  89           HN       LEU  89  -4.119 -10.005  -3.179
  745    HA   LEU  89           HA       LEU  89  -4.971 -12.632  -2.339
  746    HB2  LEU  89           HB2      LEU  89  -6.409 -11.351  -0.723
  747    HB3  LEU  89           HB1      LEU  89  -4.681 -11.115  -0.562
  748    HG   LEU  89           HG       LEU  89  -5.241  -9.020  -2.138
  749   HD11  LEU  89          HD11      LEU  89  -7.633  -9.578  -2.214
  750   HD12  LEU  89          HD12      LEU  89  -7.323  -8.003  -1.485
  751   HD13  LEU  89          HD13      LEU  89  -7.713  -9.386  -0.463
  752   HD21  LEU  89          HD21      LEU  89  -5.289  -7.669  -0.101
  753   HD22  LEU  89          HD22      LEU  89  -4.073  -8.943  -0.003
  754   HD23  LEU  89          HD23      LEU  89  -5.606  -9.118   0.852
  755    H    GLU  90           HN       GLU  90  -5.871 -10.416  -4.654
  756    HA   GLU  90           HA       GLU  90  -7.541 -10.219  -6.136
  757    HB2  GLU  90           HB2      GLU  90  -7.977 -13.079  -5.311
  758    HB3  GLU  90           HB1      GLU  90  -8.889 -12.311  -6.606
  759    HG2  GLU  90           HG2      GLU  90  -6.783 -11.839  -7.787
  760    HG3  GLU  90           HG1      GLU  90  -5.898 -12.646  -6.497
  Start of MODEL   18
    1    H1   MET   1           HT1      MET   1   6.322  -0.292  14.175
    2    H2   MET   1           HT2      MET   1   7.853   0.165  13.619
    3    H3   MET   1           HT3      MET   1   7.228  -1.356  13.219
    4    HA   MET   1           HA       MET   1   6.953  -0.084  11.297
    5    HB2  MET   1           HB2      MET   1   4.382  -0.051  12.896
    6    HB3  MET   1           HB1      MET   1   4.470   0.269  11.172
    7    HG2  MET   1           HG2      MET   1   5.321  -1.991  10.795
    8    HG3  MET   1           HG1      MET   1   5.235  -2.308  12.528
    9    HE1  MET   1           HE1      MET   1   1.711  -1.823   9.627
   10    HE2  MET   1           HE2      MET   1   3.407  -1.449   9.319
   11    HE3  MET   1           HE3      MET   1   2.422  -0.350  10.285
   12    H    ALA   2           HN       ALA   2   7.952   1.853  11.021
   13    HA   ALA   2           HA       ALA   2   6.842   4.205  12.403
   14    HB1  ALA   2           HB1      ALA   2   9.210   3.844  12.819
   15    HB2  ALA   2           HB2      ALA   2   8.978   5.305  11.857
   16    HB3  ALA   2           HB3      ALA   2   9.531   3.818  11.085
   17    H    THR   3           HN       THR   3   5.201   3.523  10.561
   18    HA   THR   3           HA       THR   3   5.770   4.344   7.901
   19    HB   THR   3           HB       THR   3   3.418   4.004   7.481
   20    HG1  THR   3           HG1      THR   3   3.063   5.007   9.796
   21   HG21  THR   3          HG21      THR   3   4.436   1.991   9.496
   22   HG22  THR   3          HG22      THR   3   4.718   1.956   7.756
   23   HG23  THR   3          HG23      THR   3   3.088   1.731   8.390
   24    H    THR   4           HN       THR   4   5.591   6.288   6.968
   25    HA   THR   4           HA       THR   4   4.451   8.509   8.535
   26    HB   THR   4           HB       THR   4   6.399   8.694   6.224
   27    HG1  THR   4           HG1      THR   4   7.114   7.576   8.267
   28   HG21  THR   4          HG21      THR   4   6.839  10.942   7.135
   29   HG22  THR   4          HG22      THR   4   5.593  10.682   8.356
   30   HG23  THR   4          HG23      THR   4   5.155  10.751   6.649
   31    H    THR   5           HN       THR   5   3.224  10.145   7.273
   32    HA   THR   5           HA       THR   5   1.470   8.850   5.396
   33    HB   THR   5           HB       THR   5   1.514  11.767   6.202
   34    HG1  THR   5           HG1      THR   5   1.258  10.335   8.006
   35   HG21  THR   5          HG21      THR   5   0.194  11.311   4.187
   36   HG22  THR   5          HG22      THR   5  -0.852  11.723   5.546
   37   HG23  THR   5          HG23      THR   5  -0.682  10.042   5.042
   38    H    LEU   6           HN       LEU   6   2.578   8.369   3.581
   39    HA   LEU   6           HA       LEU   6   3.816  10.572   2.067
   40    HB2  LEU   6           HB2      LEU   6   4.220   7.611   1.653
   41    HB3  LEU   6           HB1      LEU   6   5.140   8.917   0.934
   42    HG   LEU   6           HG       LEU   6   5.171   8.072   3.832
   43   HD11  LEU   6          HD11      LEU   6   7.476   8.137   1.918
   44   HD12  LEU   6          HD12      LEU   6   6.414   6.735   2.040
   45   HD13  LEU   6          HD13      LEU   6   7.328   7.274   3.449
   46   HD21  LEU   6          HD21      LEU   6   5.374  10.444   3.822
   47   HD22  LEU   6          HD22      LEU   6   6.492  10.404   2.459
   48   HD23  LEU   6          HD23      LEU   6   6.995   9.780   4.029
   49    H    GLY   7           HN       GLY   7   3.524  10.486  -0.296
   50    HA2  GLY   7           HA2      GLY   7   0.768  10.079  -0.967
   51    HA3  GLY   7           HA1      GLY   7   2.030  10.646  -2.050
   52    H    VAL   8           HN       VAL   8  -0.164   8.326  -1.719
   53    HA   VAL   8           HA       VAL   8   1.436   6.347  -3.202
   54    HB   VAL   8           HB       VAL   8  -0.408   5.899  -0.872
   55   HG11  VAL   8          HG11      VAL   8   0.358   3.816  -2.912
   56   HG12  VAL   8          HG12      VAL   8  -1.271   4.366  -2.522
   57   HG13  VAL   8          HG13      VAL   8  -0.334   3.468  -1.328
   58   HG21  VAL   8          HG21      VAL   8   1.946   6.155  -0.415
   59   HG22  VAL   8          HG22      VAL   8   2.334   4.891  -1.582
   60   HG23  VAL   8          HG23      VAL   8   1.449   4.490  -0.110
   61    H    LYS   9           HN       LYS   9   0.071   4.918  -4.578
   62    HA   LYS   9           HA       LYS   9  -2.014   6.519  -5.834
   63    HB2  LYS   9           HB2      LYS   9  -0.819   3.907  -6.766
   64    HB3  LYS   9           HB1      LYS   9  -1.760   5.046  -7.721
   65    HG2  LYS   9           HG2      LYS   9   0.962   5.582  -6.550
   66    HG3  LYS   9           HG1      LYS   9   0.630   5.161  -8.230
   67    HD2  LYS   9           HD2      LYS   9  -0.705   7.193  -8.479
   68    HD3  LYS   9           HD1      LYS   9  -0.396   7.607  -6.791
   69    HE2  LYS   9           HE2      LYS   9   1.669   7.348  -8.973
   70    HE3  LYS   9           HE1      LYS   9   1.083   8.853  -8.264
   71    HZ1  LYS   9           HZ1      LYS   9   2.729   6.755  -6.985
   72    HZ2  LYS   9           HZ2      LYS   9   1.900   7.917  -6.079
   73    HZ3  LYS   9           HZ3      LYS   9   3.086   8.398  -7.182
   74    H    LEU  10           HN       LEU  10  -3.999   6.241  -5.069
   75    HA   LEU  10           HA       LEU  10  -5.013   3.510  -4.649
   76    HB2  LEU  10           HB2      LEU  10  -4.997   5.803  -2.748
   77    HB3  LEU  10           HB1      LEU  10  -6.415   4.778  -2.777
   78    HG   LEU  10           HG       LEU  10  -3.647   3.672  -2.357
   79   HD11  LEU  10          HD11      LEU  10  -4.182   3.675   0.042
   80   HD12  LEU  10          HD12      LEU  10  -5.644   4.601  -0.296
   81   HD13  LEU  10          HD13      LEU  10  -4.060   5.308  -0.611
   82   HD21  LEU  10          HD21      LEU  10  -5.133   1.959  -2.943
   83   HD22  LEU  10          HD22      LEU  10  -6.453   2.670  -2.015
   84   HD23  LEU  10          HD23      LEU  10  -5.094   1.923  -1.180
   85    H    ASP  11           HN       ASP  11  -6.963   3.173  -5.608
   86    HA   ASP  11           HA       ASP  11  -8.245   5.358  -6.995
   87    HB2  ASP  11           HB2      ASP  11  -9.690   2.771  -6.675
   88    HB3  ASP  11           HB1      ASP  11  -9.480   3.760  -8.109
   89    H    ASP  12           HN       ASP  12 -10.297   6.255  -6.466
   90    HA   ASP  12           HA       ASP  12 -10.896   6.682  -3.815
   91    HB2  ASP  12           HB2      ASP  12 -12.511   6.940  -6.315
   92    HB3  ASP  12           HB1      ASP  12 -13.343   7.081  -4.772
   93    HA   PRO  13           HA       PRO  13 -14.301   3.222  -3.866
   94    HB2  PRO  13           HB2      PRO  13 -14.031   1.293  -5.796
   95    HB3  PRO  13           HB1      PRO  13 -15.103   2.689  -5.938
   96    HG2  PRO  13           HG2      PRO  13 -12.367   2.277  -7.073
   97    HG3  PRO  13           HG1      PRO  13 -13.796   3.008  -7.828
   98    HD2  PRO  13           HD2      PRO  13 -11.794   4.503  -6.831
   99    HD3  PRO  13           HD1      PRO  13 -13.487   5.029  -6.751
  100    H    THR  14           HN       THR  14 -11.054   2.442  -5.006
  101    HA   THR  14           HA       THR  14 -10.897  -0.037  -3.643
  102    HB   THR  14           HB       THR  14  -9.258   1.380  -5.454
  103    HG1  THR  14           HG1      THR  14  -8.193  -0.734  -5.452
  104   HG21  THR  14          HG21      THR  14  -7.745   0.560  -2.973
  105   HG22  THR  14          HG22      THR  14  -7.916   2.201  -3.596
  106   HG23  THR  14          HG23      THR  14  -7.018   0.997  -4.519
  107    H    ARG  15           HN       ARG  15 -10.024   3.297  -2.767
  108    HA   ARG  15           HA       ARG  15  -8.688   2.681  -0.364
  109    HB2  ARG  15           HB2      ARG  15  -8.783   4.964  -1.423
  110    HB3  ARG  15           HB1      ARG  15 -10.440   5.101  -0.844
  111    HG2  ARG  15           HG2      ARG  15  -9.659   4.865   1.458
  112    HG3  ARG  15           HG1      ARG  15  -8.000   4.728   0.879
  113    HD2  ARG  15           HD2      ARG  15  -8.196   6.983  -0.106
  114    HD3  ARG  15           HD1      ARG  15  -9.818   7.114   0.574
  115    HE   ARG  15           HE       ARG  15  -7.340   7.463   1.948
  116   HH11  ARG  15          HH21      ARG  15 -10.667   6.440   2.352
  117   HH12  ARG  15          HH22      ARG  15 -10.718   6.826   4.039
  118   HH21  ARG  15          HH11      ARG  15  -7.400   7.971   4.179
  119   HH22  ARG  15          HH12      ARG  15  -8.854   7.706   5.080
  120    H    GLU  16           HN       GLU  16 -12.071   3.200  -1.153
  121    HA   GLU  16           HA       GLU  16 -13.128   2.903   1.429
  122    HB2  GLU  16           HB2      GLU  16 -14.311   2.358  -1.298
  123    HB3  GLU  16           HB1      GLU  16 -15.241   2.243   0.191
  124    HG2  GLU  16           HG2      GLU  16 -13.918   4.695  -0.946
  125    HG3  GLU  16           HG1      GLU  16 -15.647   4.381  -0.793
  126    H    ARG  17           HN       ARG  17 -12.314   0.602  -1.108
  127    HA   ARG  17           HA       ARG  17 -13.290  -1.729   0.135
  128    HB2  ARG  17           HB2      ARG  17 -12.624  -1.653  -2.250
  129    HB3  ARG  17           HB1      ARG  17 -10.942  -1.483  -1.763
  130    HG2  ARG  17           HG2      ARG  17 -11.026  -3.678  -0.689
  131    HG3  ARG  17           HG1      ARG  17 -12.714  -3.849  -1.171
  132    HD2  ARG  17           HD2      ARG  17 -12.027  -3.701  -3.532
  133    HD3  ARG  17           HD1      ARG  17 -10.343  -3.598  -3.020
  134    HE   ARG  17           HE       ARG  17 -11.573  -5.911  -1.931
  135   HH11  ARG  17          HH21      ARG  17 -10.279  -4.640  -4.924
  136   HH12  ARG  17          HH22      ARG  17  -9.914  -6.203  -5.581
  137   HH21  ARG  17          HH11      ARG  17 -11.086  -7.991  -2.778
  138   HH22  ARG  17          HH12      ARG  17 -10.366  -8.101  -4.359
  139    H    LEU  18           HN       LEU  18 -10.281   0.067   0.442
  140    HA   LEU  18           HA       LEU  18  -8.832  -1.801   1.946
  141    HB2  LEU  18           HB2      LEU  18  -8.703   1.112   1.497
  142    HB3  LEU  18           HB1      LEU  18  -8.017   0.576   3.017
  143    HG   LEU  18           HG       LEU  18  -6.607  -1.050   1.666
  144   HD11  LEU  18          HD11      LEU  18  -6.301  -0.681  -0.654
  145   HD12  LEU  18          HD12      LEU  18  -7.345   0.740  -0.632
  146   HD13  LEU  18          HD13      LEU  18  -8.034  -0.865  -0.386
  147   HD21  LEU  18          HD21      LEU  18  -6.288   1.929   1.411
  148   HD22  LEU  18          HD22      LEU  18  -5.044   0.779   0.922
  149   HD23  LEU  18          HD23      LEU  18  -5.563   0.853   2.606
  150    H    LYS  19           HN       LYS  19 -11.222   0.650   2.899
  151    HA   LYS  19           HA       LYS  19 -11.041   0.226   5.672
  152    HB2  LYS  19           HB2      LYS  19 -12.295   2.117   4.740
  153    HB3  LYS  19           HB1      LYS  19 -13.476   1.003   4.064
  154    HG2  LYS  19           HG2      LYS  19 -14.174   0.330   6.272
  155    HG3  LYS  19           HG1      LYS  19 -12.911   1.315   7.006
  156    HD2  LYS  19           HD2      LYS  19 -15.061   2.436   7.159
  157    HD3  LYS  19           HD1      LYS  19 -13.974   3.336   6.103
  158    HE2  LYS  19           HE2      LYS  19 -15.912   1.350   4.970
  159    HE3  LYS  19           HE1      LYS  19 -16.436   2.982   5.380
  160    HZ1  LYS  19           HZ1      LYS  19 -15.774   3.420   3.284
  161    HZ2  LYS  19           HZ2      LYS  19 -14.751   2.076   3.205
  162    HZ3  LYS  19           HZ3      LYS  19 -14.230   3.487   3.968
  163    H    ALA  20           HN       ALA  20 -12.887  -1.375   3.190
  164    HA   ALA  20           HA       ALA  20 -14.325  -3.156   4.835
  165    HB1  ALA  20           HB1      ALA  20 -14.999  -2.768   2.532
  166    HB2  ALA  20           HB2      ALA  20 -14.658  -4.481   2.776
  167    HB3  ALA  20           HB3      ALA  20 -13.485  -3.458   1.948
  168    H    ALA  21           HN       ALA  21 -11.194  -3.322   3.222
  169    HA   ALA  21           HA       ALA  21 -10.517  -5.962   3.938
  170    HB1  ALA  21           HB1      ALA  21  -9.332  -4.548   2.231
  171    HB2  ALA  21           HB2      ALA  21  -8.267  -5.394   3.353
  172    HB3  ALA  21           HB3      ALA  21  -8.585  -3.673   3.568
  173    H    ALA  22           HN       ALA  22 -10.134  -2.850   5.505
  174    HA   ALA  22           HA       ALA  22  -8.665  -3.609   7.758
  175    HB1  ALA  22           HB1      ALA  22 -10.830  -1.516   7.692
  176    HB2  ALA  22           HB2      ALA  22  -9.214  -1.260   7.035
  177    HB3  ALA  22           HB3      ALA  22  -9.426  -1.574   8.758
  178    H    GLN  23           HN       GLN  23 -12.091  -3.441   7.182
  179    HA   GLN  23           HA       GLN  23 -12.964  -4.371   9.685
  180    HB2  GLN  23           HB2      GLN  23 -14.279  -4.561   6.965
  181    HB3  GLN  23           HB1      GLN  23 -15.094  -4.840   8.500
  182    HG2  GLN  23           HG2      GLN  23 -13.731  -2.261   7.784
  183    HG3  GLN  23           HG1      GLN  23 -15.442  -2.568   7.499
  184   HE21  GLN  23          HE21      GLN  23 -13.417  -1.073   9.508
  185   HE22  GLN  23          HE22      GLN  23 -14.300  -1.162  10.987
  186    H    SER  24           HN       SER  24 -12.136  -5.986   6.685
  187    HA   SER  24           HA       SER  24 -12.876  -8.600   7.342
  188    HB2  SER  24           HB2      SER  24 -10.631  -7.645   5.544
  189    HB3  SER  24           HB1      SER  24 -11.297  -9.278   5.562
  190    HG   SER  24           HG       SER  24 -12.827  -6.943   5.035
  191    H    ILE  25           HN       ILE  25  -9.962  -6.754   8.077
  192    HA   ILE  25           HA       ILE  25  -8.765  -9.106   9.354
  193    HB   ILE  25           HB       ILE  25  -7.431  -7.764   7.708
  194   HG12  ILE  25          HG12      ILE  25  -6.230  -7.722  10.480
  195   HG13  ILE  25          HG11      ILE  25  -6.399  -9.183   9.511
  196   HG21  ILE  25          HG21      ILE  25  -7.524  -5.663   9.860
  197   HG22  ILE  25          HG22      ILE  25  -8.232  -5.556   8.249
  198   HG23  ILE  25          HG23      ILE  25  -6.480  -5.625   8.439
  199   HD11  ILE  25          HD11      ILE  25  -4.960  -8.216   7.798
  200   HD12  ILE  25          HD12      ILE  25  -4.151  -8.272   9.364
  201   HD13  ILE  25          HD13      ILE  25  -4.798  -6.747   8.759
  202    H    ASP  26           HN       ASP  26 -10.859  -6.848  10.157
  203    HA   ASP  26           HA       ASP  26 -11.675  -5.957  12.053
  204    HB2  ASP  26           HB2      ASP  26 -11.240  -8.367  12.820
  205    HB3  ASP  26           HB1      ASP  26  -9.834  -7.716  13.656
  206    H    ARG  27           HN       ARG  27  -9.765  -4.441  10.877
  207    HA   ARG  27           HA       ARG  27  -8.540  -3.157  13.234
  208    HB2  ARG  27           HB2      ARG  27  -7.183  -3.571  10.557
  209    HB3  ARG  27           HB1      ARG  27  -6.530  -2.624  11.889
  210    HG2  ARG  27           HG2      ARG  27  -6.470  -4.625  13.288
  211    HG3  ARG  27           HG1      ARG  27  -7.126  -5.577  11.959
  212    HD2  ARG  27           HD2      ARG  27  -5.104  -4.823  10.620
  213    HD3  ARG  27           HD1      ARG  27  -4.440  -4.242  12.149
  214    HE   ARG  27           HE       ARG  27  -5.295  -6.934  12.390
  215   HH11  ARG  27          HH21      ARG  27  -2.721  -4.985  11.064
  216   HH12  ARG  27          HH22      ARG  27  -1.553  -6.266  11.074
  217   HH21  ARG  27          HH11      ARG  27  -3.757  -8.642  12.411
  218   HH22  ARG  27          HH12      ARG  27  -2.144  -8.347  11.851
  219    H    THR  28           HN       THR  28  -8.052  -0.840  12.866
  220    HA   THR  28           HA       THR  28 -10.252   0.454  11.582
  221    HB   THR  28           HB       THR  28  -9.647   1.704  13.408
  222    HG1  THR  28           HG1      THR  28  -8.297   2.742  11.175
  223   HG21  THR  28          HG21      THR  28  -7.277   2.156  14.072
  224   HG22  THR  28          HG22      THR  28  -6.766   1.076  12.774
  225   HG23  THR  28          HG23      THR  28  -7.732   0.453  14.112
  226    HA   PRO  29           HA       PRO  29  -8.886   1.099   7.440
  227    HB2  PRO  29           HB2      PRO  29  -9.367   3.869   7.274
  228    HB3  PRO  29           HB1      PRO  29 -10.489   2.575   6.847
  229    HG2  PRO  29           HG2      PRO  29 -10.300   4.172   9.353
  230    HG3  PRO  29           HG1      PRO  29 -11.732   3.513   8.541
  231    HD2  PRO  29           HD2      PRO  29 -10.765   2.383  10.760
  232    HD3  PRO  29           HD1      PRO  29 -11.414   1.389   9.438
  233    H    HIS  30           HN       HIS  30  -7.838   3.666   9.697
  234    HA   HIS  30           HA       HIS  30  -5.646   4.516   8.160
  235    HB2  HIS  30           HB2      HIS  30  -6.390   4.794  11.042
  236    HB3  HIS  30           HB1      HIS  30  -4.769   5.255  10.527
  237    HD1  HIS  30           HD1      HIS  30  -7.579   6.978  11.345
  238    HD2  HIS  30           HD2      HIS  30  -5.394   6.822   7.805
  239    HE1  HIS  30           HE1      HIS  30  -8.152   9.091  10.109
  240    HE2  HIS  30           HE2      HIS  30  -6.696   9.062   8.056
  241    H    TRP  31           HN       TRP  31  -5.802   2.149  10.818
  242    HA   TRP  31           HA       TRP  31  -3.054   1.507  10.709
  243    HB2  TRP  31           HB2      TRP  31  -4.500   0.955  12.669
  244    HB3  TRP  31           HB1      TRP  31  -5.302  -0.267  11.686
  245    HD1  TRP  31           HD1      TRP  31  -3.972  -2.518  11.192
  246    HE1  TRP  31           HE1      TRP  31  -1.875  -3.572  12.258
  247    HE3  TRP  31           HE3      TRP  31  -2.226   1.540  13.769
  248    HZ2  TRP  31           HZ2      TRP  31   0.226  -2.798  13.955
  249    HZ3  TRP  31           HZ3      TRP  31  -0.166   1.295  15.093
  250    HH2  TRP  31           HH2      TRP  31   1.034  -0.830  15.183
  251    H    LEU  32           HN       LEU  32  -5.913   0.288   9.170
  252    HA   LEU  32           HA       LEU  32  -4.807  -1.927   7.886
  253    HB2  LEU  32           HB2      LEU  32  -7.232  -1.507   8.022
  254    HB3  LEU  32           HB1      LEU  32  -7.045  -0.178   6.897
  255    HG   LEU  32           HG       LEU  32  -7.928  -2.424   5.997
  256   HD11  LEU  32          HD11      LEU  32  -7.011  -0.432   4.679
  257   HD12  LEU  32          HD12      LEU  32  -7.102  -1.995   3.870
  258   HD13  LEU  32          HD13      LEU  32  -5.556  -1.409   4.482
  259   HD21  LEU  32          HD21      LEU  32  -6.300  -4.073   5.363
  260   HD22  LEU  32          HD22      LEU  32  -6.210  -3.814   7.105
  261   HD23  LEU  32          HD23      LEU  32  -4.994  -3.103   6.043
  262    H    ILE  33           HN       ILE  33  -4.963   1.447   6.935
  263    HA   ILE  33           HA       ILE  33  -3.989   1.146   4.329
  264    HB   ILE  33           HB       ILE  33  -3.626   3.426   6.284
  265   HG12  ILE  33          HG12      ILE  33  -5.319   3.247   3.785
  266   HG13  ILE  33          HG11      ILE  33  -5.923   2.897   5.402
  267   HG21  ILE  33          HG21      ILE  33  -1.768   3.545   4.779
  268   HG22  ILE  33          HG22      ILE  33  -2.940   4.780   4.315
  269   HG23  ILE  33          HG23      ILE  33  -2.819   3.285   3.386
  270   HD11  ILE  33          HD11      ILE  33  -6.558   5.115   4.850
  271   HD12  ILE  33          HD12      ILE  33  -4.917   5.526   4.351
  272   HD13  ILE  33          HD13      ILE  33  -5.271   5.219   6.051
  273    H    LYS  34           HN       LYS  34  -2.351   1.513   7.430
  274    HA   LYS  34           HA       LYS  34   0.310   1.427   6.524
  275    HB2  LYS  34           HB2      LYS  34  -0.743   0.135   9.056
  276    HB3  LYS  34           HB1      LYS  34   0.902   0.668   8.756
  277    HG2  LYS  34           HG2      LYS  34   0.293   2.941   8.898
  278    HG3  LYS  34           HG1      LYS  34  -1.429   2.558   8.823
  279    HD2  LYS  34           HD2      LYS  34  -1.066   2.979  11.088
  280    HD3  LYS  34           HD1      LYS  34  -1.008   1.219  10.982
  281    HE2  LYS  34           HE2      LYS  34   0.863   1.568  12.229
  282    HE3  LYS  34           HE1      LYS  34   1.572   1.699  10.621
  283    HZ1  LYS  34           HZ1      LYS  34   1.962   3.517  12.465
  284    HZ2  LYS  34           HZ2      LYS  34   0.522   4.140  11.835
  285    HZ3  LYS  34           HZ3      LYS  34   1.863   3.919  10.822
  286    H    GLN  35           HN       GLN  35  -1.872  -1.155   7.572
  287    HA   GLN  35           HA       GLN  35  -0.113  -3.294   7.049
  288    HB2  GLN  35           HB2      GLN  35  -3.116  -3.263   7.325
  289    HB3  GLN  35           HB1      GLN  35  -2.126  -4.717   7.295
  290    HG2  GLN  35           HG2      GLN  35  -1.871  -2.509   9.323
  291    HG3  GLN  35           HG1      GLN  35  -2.759  -4.012   9.565
  292   HE21  GLN  35          HE21      GLN  35  -0.261  -2.745  10.765
  293   HE22  GLN  35          HE22      GLN  35   0.902  -4.025  10.738
  294    H    ALA  36           HN       ALA  36  -2.640  -1.818   5.040
  295    HA   ALA  36           HA       ALA  36  -2.778  -3.762   3.071
  296    HB1  ALA  36           HB1      ALA  36  -3.259  -1.730   1.538
  297    HB2  ALA  36           HB2      ALA  36  -3.167  -0.797   3.033
  298    HB3  ALA  36           HB3      ALA  36  -4.360  -2.086   2.867
  299    H    ILE  37           HN       ILE  37  -0.472  -1.106   3.471
  300    HA   ILE  37           HA       ILE  37   0.974  -2.040   1.131
  301    HB   ILE  37           HB       ILE  37   0.583   0.422   1.796
  302   HG12  ILE  37          HG12      ILE  37   3.076   0.926   1.055
  303   HG13  ILE  37          HG11      ILE  37   3.068  -0.803   0.725
  304   HG21  ILE  37          HG21      ILE  37   2.959  -0.150   3.547
  305   HG22  ILE  37          HG22      ILE  37   1.345   0.313   4.085
  306   HG23  ILE  37          HG23      ILE  37   2.327   1.450   3.160
  307   HD11  ILE  37          HD11      ILE  37   1.147  -0.519  -0.739
  308   HD12  ILE  37          HD12      ILE  37   2.496   0.498  -1.248
  309   HD13  ILE  37          HD13      ILE  37   1.130   1.210  -0.389
  310    H    PHE  38           HN       PHE  38   1.479  -1.893   4.634
  311    HA   PHE  38           HA       PHE  38   4.117  -2.978   4.570
  312    HB2  PHE  38           HB2      PHE  38   3.548  -1.629   6.437
  313    HB3  PHE  38           HB1      PHE  38   2.067  -2.525   6.736
  314    HD1  PHE  38           HD2      PHE  38   5.697  -2.483   7.160
  315    HD2  PHE  38           HD1      PHE  38   2.088  -4.598   7.934
  316    HE1  PHE  38           HE2      PHE  38   6.862  -3.853   8.840
  317    HE2  PHE  38           HE1      PHE  38   3.239  -5.967   9.615
  318    HZ   PHE  38           HZ       PHE  38   5.633  -5.599  10.071
  319    H    ASN  39           HN       ASN  39   0.901  -4.351   5.125
  320    HA   ASN  39           HA       ASN  39   1.865  -6.935   5.749
  321    HB2  ASN  39           HB2      ASN  39  -0.511  -6.016   6.184
  322    HB3  ASN  39           HB1      ASN  39  -0.827  -6.417   4.504
  323   HD21  ASN  39          HD21      ASN  39   1.226  -8.751   5.259
  324   HD22  ASN  39          HD22      ASN  39   0.167  -9.929   5.939
  325    H    TYR  40           HN       TYR  40   1.183  -5.148   2.799
  326    HA   TYR  40           HA       TYR  40   1.222  -7.342   1.043
  327    HB2  TYR  40           HB2      TYR  40   0.625  -5.076   0.262
  328    HB3  TYR  40           HB1      TYR  40   2.282  -4.544   0.543
  329    HD1  TYR  40           HD2      TYR  40   0.416  -7.196  -1.309
  330    HD2  TYR  40           HD1      TYR  40   3.751  -4.558  -1.247
  331    HE1  TYR  40           HE2      TYR  40   1.053  -7.960  -3.555
  332    HE2  TYR  40           HE1      TYR  40   4.402  -5.319  -3.494
  333    HH   TYR  40           HH       TYR  40   2.391  -7.059  -5.518
  334    H    LEU  41           HN       LEU  41   3.695  -5.357   2.501
  335    HA   LEU  41           HA       LEU  41   5.927  -6.566   1.288
  336    HB2  LEU  41           HB2      LEU  41   5.697  -5.134   3.928
  337    HB3  LEU  41           HB1      LEU  41   7.211  -5.565   3.155
  338    HG   LEU  41           HG       LEU  41   5.150  -3.662   2.040
  339   HD11  LEU  41          HD11      LEU  41   6.931  -1.979   2.423
  340   HD12  LEU  41          HD12      LEU  41   7.840  -3.205   3.308
  341   HD13  LEU  41          HD13      LEU  41   6.269  -2.669   3.904
  342   HD21  LEU  41          HD21      LEU  41   6.212  -4.699   0.199
  343   HD22  LEU  41          HD22      LEU  41   7.793  -4.631   0.979
  344   HD23  LEU  41          HD23      LEU  41   7.021  -3.147   0.421
  345    H    GLU  42           HN       GLU  42   4.140  -7.218   4.242
  346    HA   GLU  42           HA       GLU  42   5.772  -9.269   5.287
  347    HB2  GLU  42           HB2      GLU  42   4.027  -8.059   6.567
  348    HB3  GLU  42           HB1      GLU  42   2.793  -8.850   5.605
  349    HG2  GLU  42           HG2      GLU  42   3.481 -11.019   6.501
  350    HG3  GLU  42           HG1      GLU  42   4.720 -10.219   7.468
  351    H    LYS  43           HN       LYS  43   3.084  -9.286   3.004
  352    HA   LYS  43           HA       LYS  43   2.696 -12.078   2.862
  353    HB2  LYS  43           HB2      LYS  43   2.141  -9.933   0.803
  354    HB3  LYS  43           HB1      LYS  43   1.576 -11.590   0.685
  355    HG2  LYS  43           HG2      LYS  43   0.847  -9.732   2.937
  356    HG3  LYS  43           HG1      LYS  43  -0.118  -9.941   1.477
  357    HD2  LYS  43           HD2      LYS  43  -0.294 -12.359   1.998
  358    HD3  LYS  43           HD1      LYS  43   0.568 -12.062   3.508
  359    HE2  LYS  43           HE2      LYS  43  -1.791 -12.129   3.967
  360    HE3  LYS  43           HE1      LYS  43  -1.222 -10.472   4.162
  361    HZ1  LYS  43           HZ1      LYS  43  -2.758  -9.837   2.721
  362    HZ2  LYS  43           HZ2      LYS  43  -3.258 -11.436   2.488
  363    HZ3  LYS  43           HZ3      LYS  43  -2.041 -10.783   1.513
  364    H    LEU  44           HN       LEU  44   4.732  -9.886   0.944
  365    HA   LEU  44           HA       LEU  44   5.645 -12.093  -0.701
  366    HB2  LEU  44           HB2      LEU  44   6.957 -10.399  -1.906
  367    HB3  LEU  44           HB1      LEU  44   5.252 -10.009  -1.823
  368    HG   LEU  44           HG       LEU  44   6.200  -8.630   0.328
  369   HD11  LEU  44          HD11      LEU  44   8.530  -9.279  -0.348
  370   HD12  LEU  44          HD12      LEU  44   8.239  -7.544  -0.221
  371   HD13  LEU  44          HD13      LEU  44   8.298  -8.314  -1.807
  372   HD21  LEU  44          HD21      LEU  44   6.040  -7.686  -2.528
  373   HD22  LEU  44          HD22      LEU  44   6.007  -6.657  -1.096
  374   HD23  LEU  44          HD23      LEU  44   4.695  -7.797  -1.394
  375    H    GLU  45           HN       GLU  45   6.969  -9.917   1.719
  376    HA   GLU  45           HA       GLU  45   8.898  -9.801   2.841
  377    HB2  GLU  45           HB2      GLU  45   8.197 -12.693   2.947
  378    HB3  GLU  45           HB1      GLU  45   9.723 -12.157   3.644
  379    HG2  GLU  45           HG2      GLU  45   8.441 -10.489   4.986
  380    HG3  GLU  45           HG1      GLU  45   6.958 -11.220   4.381
  381    H1   MET  46           HT1      MET  46  -6.928   0.507 -14.189
  382    H2   MET  46           HT2      MET  46  -8.400   0.943 -13.483
  383    H3   MET  46           HT3      MET  46  -7.746  -0.584 -13.183
  384    HA   MET  46           HA       MET  46  -7.330   0.670 -11.266
  385    HB2  MET  46           HB2      MET  46  -4.863   0.663 -13.021
  386    HB3  MET  46           HB1      MET  46  -4.846   0.923 -11.285
  387    HG2  MET  46           HG2      MET  46  -5.746  -1.322 -10.940
  388    HG3  MET  46           HG1      MET  46  -5.758  -1.579 -12.685
  389    HE1  MET  46           HE1      MET  46  -2.107  -1.338  -9.929
  390    HE2  MET  46           HE2      MET  46  -3.775  -0.907  -9.546
  391    HE3  MET  46           HE3      MET  46  -2.774   0.194 -10.492
  392    H    ALA  47           HN       ALA  47  -8.308   2.620 -10.985
  393    HA   ALA  47           HA       ALA  47  -7.129   4.962 -12.331
  394    HB1  ALA  47           HB1      ALA  47  -9.506   4.707 -12.757
  395    HB2  ALA  47           HB2      ALA  47  -9.231   6.121 -11.739
  396    HB3  ALA  47           HB3      ALA  47  -9.833   4.625 -11.026
  397    H    THR  48           HN       THR  48  -5.528   4.141 -10.503
  398    HA   THR  48           HA       THR  48  -6.048   4.880  -7.819
  399    HB   THR  48           HB       THR  48  -3.709   4.460  -7.426
  400    HG1  THR  48           HG1      THR  48  -3.319   5.583  -9.672
  401   HG21  THR  48          HG21      THR  48  -4.767   2.578  -9.544
  402   HG22  THR  48          HG22      THR  48  -5.052   2.457  -7.808
  403   HG23  THR  48          HG23      THR  48  -3.426   2.232  -8.452
  404    H    THR  49           HN       THR  49  -5.812   6.766  -6.798
  405    HA   THR  49           HA       THR  49  -4.615   9.027  -8.261
  406    HB   THR  49           HB       THR  49  -6.593   9.143  -5.970
  407    HG1  THR  49           HG1      THR  49  -7.367   8.167  -8.010
  408   HG21  THR  49          HG21      THR  49  -6.939  11.458  -6.731
  409   HG22  THR  49          HG22      THR  49  -5.689  11.239  -7.955
  410   HG23  THR  49          HG23      THR  49  -5.267  11.181  -6.244
  411    H    THR  50           HN       THR  50  -3.322  10.544  -6.954
  412    HA   THR  50           HA       THR  50  -1.632   9.136  -5.111
  413    HB   THR  50           HB       THR  50  -1.589  12.081  -5.804
  414    HG1  THR  50           HG1      THR  50  -1.369  10.726  -7.662
  415   HG21  THR  50          HG21      THR  50  -0.288  11.499  -3.802
  416   HG22  THR  50          HG22      THR  50   0.768  11.951  -5.140
  417   HG23  THR  50          HG23      THR  50   0.561  10.252  -4.716
  418    H    LEU  51           HN       LEU  51  -2.752   8.611  -3.324
  419    HA   LEU  51           HA       LEU  51  -3.934  10.773  -1.709
  420    HB2  LEU  51           HB2      LEU  51  -4.418   7.808  -1.433
  421    HB3  LEU  51           HB1      LEU  51  -5.303   9.103  -0.655
  422    HG   LEU  51           HG       LEU  51  -5.353   8.397  -3.589
  423   HD11  LEU  51          HD11      LEU  51  -7.656   8.424  -1.671
  424   HD12  LEU  51          HD12      LEU  51  -6.628   7.005  -1.862
  425   HD13  LEU  51          HD13      LEU  51  -7.529   7.632  -3.242
  426   HD21  LEU  51          HD21      LEU  51  -5.501  10.771  -3.463
  427   HD22  LEU  51          HD22      LEU  51  -6.621  10.690  -2.103
  428   HD23  LEU  51          HD23      LEU  51  -7.136  10.155  -3.703
  429    H    GLY  52           HN       GLY  52  -3.651  10.560   0.651
  430    HA2  GLY  52           HA2      GLY  52  -0.904  10.047   1.300
  431    HA3  GLY  52           HA1      GLY  52  -2.151  10.592   2.410
  432    H    VAL  53           HN       VAL  53  -0.018   8.235   1.969
  433    HA   VAL  53           HA       VAL  53  -1.669   6.225   3.353
  434    HB   VAL  53           HB       VAL  53   0.159   5.848   0.997
  435   HG11  VAL  53          HG11      VAL  53  -0.660   3.684   2.930
  436   HG12  VAL  53          HG12      VAL  53   0.982   4.211   2.565
  437   HG13  VAL  53          HG13      VAL  53   0.021   3.400   1.328
  438   HG21  VAL  53          HG21      VAL  53  -2.187   6.190   0.559
  439   HG22  VAL  53          HG22      VAL  53  -2.610   4.880   1.661
  440   HG23  VAL  53          HG23      VAL  53  -1.737   4.530   0.170
  441    H    LYS  54           HN       LYS  54  -0.342   4.694   4.654
  442    HA   LYS  54           HA       LYS  54   1.793   6.169   5.979
  443    HB2  LYS  54           HB2      LYS  54   0.532   3.546   6.783
  444    HB3  LYS  54           HB1      LYS  54   1.509   4.607   7.787
  445    HG2  LYS  54           HG2      LYS  54  -1.202   5.279   6.665
  446    HG3  LYS  54           HG1      LYS  54  -0.872   4.764   8.319
  447    HD2  LYS  54           HD2      LYS  54   0.535   6.739   8.652
  448    HD3  LYS  54           HD1      LYS  54   0.207   7.252   6.995
  449    HE2  LYS  54           HE2      LYS  54  -1.806   6.949   9.219
  450    HE3  LYS  54           HE1      LYS  54  -1.218   8.463   8.530
  451    HZ1  LYS  54           HZ1      LYS  54  -2.919   6.418   7.235
  452    HZ2  LYS  54           HZ2      LYS  54  -2.123   7.621   6.354
  453    HZ3  LYS  54           HZ3      LYS  54  -3.273   8.049   7.517
  454    H    LEU  55           HN       LEU  55   3.771   5.876   5.216
  455    HA   LEU  55           HA       LEU  55   4.713   3.145   4.653
  456    HB2  LEU  55           HB2      LEU  55   4.764   5.533   2.870
  457    HB3  LEU  55           HB1      LEU  55   6.149   4.463   2.844
  458    HG   LEU  55           HG       LEU  55   3.349   3.462   2.377
  459   HD11  LEU  55          HD11      LEU  55   3.875   3.580  -0.023
  460   HD12  LEU  55          HD12      LEU  55   5.361   4.450   0.358
  461   HD13  LEU  55          HD13      LEU  55   3.795   5.178   0.719
  462   HD21  LEU  55          HD21      LEU  55   4.788   1.680   2.859
  463   HD22  LEU  55          HD22      LEU  55   6.125   2.406   1.968
  464   HD23  LEU  55          HD23      LEU  55   4.746   1.743   1.097
  465    H    ASP  56           HN       ASP  56   6.659   2.712   5.596
  466    HA   ASP  56           HA       ASP  56   7.990   4.802   7.082
  467    HB2  ASP  56           HB2      ASP  56   9.386   2.205   6.636
  468    HB3  ASP  56           HB1      ASP  56   9.206   3.133   8.113
  469    H    ASP  57           HN       ASP  57  10.058   5.682   6.586
  470    HA   ASP  57           HA       ASP  57  10.659   6.213   3.955
  471    HB2  ASP  57           HB2      ASP  57  12.230   6.376   6.475
  472    HB3  ASP  57           HB1      ASP  57  13.134   6.466   4.969
  473    HA   PRO  58           HA       PRO  58  13.990   2.684   3.831
  474    HB2  PRO  58           HB2      PRO  58  13.685   0.677   5.674
  475    HB3  PRO  58           HB1      PRO  58  14.791   2.041   5.872
  476    HG2  PRO  58           HG2      PRO  58  12.050   1.644   7.002
  477    HG3  PRO  58           HG1      PRO  58  13.500   2.302   7.783
  478    HD2  PRO  58           HD2      PRO  58  11.536   3.894   6.868
  479    HD3  PRO  58           HD1      PRO  58  13.242   4.378   6.795
  480    H    THR  59           HN       THR  59  10.721   1.955   4.933
  481    HA   THR  59           HA       THR  59  10.507  -0.470   3.474
  482    HB   THR  59           HB       THR  59   8.899   0.904   5.347
  483    HG1  THR  59           HG1      THR  59   7.761  -1.202   5.189
  484   HG21  THR  59          HG21      THR  59   7.372   0.224   2.832
  485   HG22  THR  59          HG22      THR  59   7.573   1.831   3.529
  486   HG23  THR  59          HG23      THR  59   6.651   0.604   4.397
  487    H    ARG  60           HN       ARG  60   9.708   2.918   2.746
  488    HA   ARG  60           HA       ARG  60   8.359   2.441   0.320
  489    HB2  ARG  60           HB2      ARG  60   8.506   4.674   1.469
  490    HB3  ARG  60           HB1      ARG  60  10.171   4.793   0.908
  491    HG2  ARG  60           HG2      ARG  60   9.405   4.671  -1.407
  492    HG3  ARG  60           HG1      ARG  60   7.737   4.554  -0.847
  493    HD2  ARG  60           HD2      ARG  60   7.976   6.762   0.223
  494    HD3  ARG  60           HD1      ARG  60   9.611   6.877  -0.428
  495    HE   ARG  60           HE       ARG  60   7.160   7.331  -1.828
  496   HH11  ARG  60          HH21      ARG  60  10.485   6.284  -2.221
  497   HH12  ARG  60          HH22      ARG  60  10.570   6.750  -3.889
  498   HH21  ARG  60          HH11      ARG  60   7.273   7.935  -4.036
  499   HH22  ARG  60          HH12      ARG  60   8.743   7.688  -4.918
  500    H    GLU  61           HN       GLU  61  11.751   2.835   1.130
  501    HA   GLU  61           HA       GLU  61  12.803   2.649  -1.466
  502    HB2  GLU  61           HB2      GLU  61  13.981   1.909   1.219
  503    HB3  GLU  61           HB1      GLU  61  14.902   1.900  -0.280
  504    HG2  GLU  61           HG2      GLU  61  13.593   4.277   1.025
  505    HG3  GLU  61           HG1      GLU  61  15.321   3.950   0.897
  506    H    ARG  62           HN       ARG  62  11.939   0.242   0.953
  507    HA   ARG  62           HA       ARG  62  12.855  -2.046  -0.409
  508    HB2  ARG  62           HB2      ARG  62  12.190  -2.073   1.981
  509    HB3  ARG  62           HB1      ARG  62  10.512  -1.847   1.501
  510    HG2  ARG  62           HG2      ARG  62  10.558  -3.983   0.313
  511    HG3  ARG  62           HG1      ARG  62  12.241  -4.212   0.789
  512    HD2  ARG  62           HD2      ARG  62  11.542  -4.162   3.157
  513    HD3  ARG  62           HD1      ARG  62   9.863  -4.026   2.636
  514    HE   ARG  62           HE       ARG  62  11.149  -6.293   1.472
  515   HH11  ARG  62          HH21      ARG  62   9.628  -5.145   4.408
  516   HH12  ARG  62          HH22      ARG  62   9.208  -6.732   4.965
  517   HH21  ARG  62          HH11      ARG  62  10.589  -8.404   2.190
  518   HH22  ARG  62          HH12      ARG  62   9.754  -8.578   3.705
  519    H    LEU  63           HN       LEU  63   9.891  -0.164  -0.617
  520    HA   LEU  63           HA       LEU  63   8.397  -1.918  -2.212
  521    HB2  LEU  63           HB2      LEU  63   8.340   0.972  -1.618
  522    HB3  LEU  63           HB1      LEU  63   7.640   0.530  -3.162
  523    HG   LEU  63           HG       LEU  63   6.192  -1.126  -1.890
  524   HD11  LEU  63          HD11      LEU  63   5.896  -0.864   0.447
  525   HD12  LEU  63          HD12      LEU  63   6.975   0.530   0.492
  526   HD13  LEU  63          HD13      LEU  63   7.625  -1.076   0.166
  527   HD21  LEU  63          HD21      LEU  63   5.944   1.843  -1.489
  528   HD22  LEU  63          HD22      LEU  63   4.673   0.700  -1.056
  529   HD23  LEU  63          HD23      LEU  63   5.195   0.845  -2.735
  530    H    LYS  64           HN       LYS  64  10.846   0.520  -3.045
  531    HA   LYS  64           HA       LYS  64  10.658   0.244  -5.834
  532    HB2  LYS  64           HB2      LYS  64  11.965   2.048  -4.803
  533    HB3  LYS  64           HB1      LYS  64  13.112   0.867  -4.186
  534    HG2  LYS  64           HG2      LYS  64  13.808   0.298  -6.419
  535    HG3  LYS  64           HG1      LYS  64  12.563   1.336  -7.110
  536    HD2  LYS  64           HD2      LYS  64  14.717   2.442  -7.212
  537    HD3  LYS  64           HD1      LYS  64  13.657   3.294  -6.091
  538    HE2  LYS  64           HE2      LYS  64  15.589   1.219  -5.113
  539    HE3  LYS  64           HE1      LYS  64  16.116   2.873  -5.415
  540    HZ1  LYS  64           HZ1      LYS  64  15.480   3.176  -3.291
  541    HZ2  LYS  64           HZ2      LYS  64  14.466   1.824  -3.282
  542    HZ3  LYS  64           HZ3      LYS  64  13.924   3.279  -3.943
  543    H    ALA  65           HN       ALA  65  12.470  -1.526  -3.441
  544    HA   ALA  65           HA       ALA  65  13.846  -3.269  -5.173
  545    HB1  ALA  65           HB1      ALA  65  14.529  -3.012  -2.852
  546    HB2  ALA  65           HB2      ALA  65  14.142  -4.701  -3.181
  547    HB3  ALA  65           HB3      ALA  65  12.996  -3.689  -2.303
  548    H    ALA  66           HN       ALA  66  10.708  -3.425  -3.563
  549    HA   ALA  66           HA       ALA  66   9.964  -6.008  -4.407
  550    HB1  ALA  66           HB1      ALA  66   8.809  -4.645  -2.637
  551    HB2  ALA  66           HB2      ALA  66   7.726  -5.408  -3.801
  552    HB3  ALA  66           HB3      ALA  66   8.091  -3.687  -3.932
  553    H    ALA  67           HN       ALA  67   9.661  -2.814  -5.824
  554    HA   ALA  67           HA       ALA  67   8.186  -3.427  -8.118
  555    HB1  ALA  67           HB1      ALA  67  10.399  -1.392  -7.945
  556    HB2  ALA  67           HB2      ALA  67   8.789  -1.131  -7.276
  557    HB3  ALA  67           HB3      ALA  67   8.995  -1.365  -9.012
  558    H    GLN  68           HN       GLN  68  11.612  -3.378  -7.518
  559    HA   GLN  68           HA       GLN  68  12.469  -4.203 -10.066
  560    HB2  GLN  68           HB2      GLN  68  13.782  -4.547  -7.360
  561    HB3  GLN  68           HB1      GLN  68  14.588  -4.775  -8.907
  562    HG2  GLN  68           HG2      GLN  68  13.304  -2.198  -8.049
  563    HG3  GLN  68           HG1      GLN  68  15.009  -2.567  -7.813
  564   HE21  GLN  68          HE21      GLN  68  12.863  -1.052  -9.774
  565   HE22  GLN  68          HE22      GLN  68  13.765  -1.028 -11.245
  566    H    SER  69           HN       SER  69  11.557  -5.932  -7.159
  567    HA   SER  69           HA       SER  69  12.266  -8.529  -7.955
  568    HB2  SER  69           HB2      SER  69  10.079  -7.627  -6.063
  569    HB3  SER  69           HB1      SER  69  10.717  -9.268  -6.177
  570    HG   SER  69           HG       SER  69  12.276  -6.975  -5.550
  571    H    ILE  70           HN       ILE  70   9.431  -6.561  -8.613
  572    HA   ILE  70           HA       ILE  70   8.144  -8.832  -9.953
  573    HB   ILE  70           HB       ILE  70   6.845  -7.529  -8.251
  574   HG12  ILE  70          HG12      ILE  70   5.650  -7.332 -11.020
  575   HG13  ILE  70          HG11      ILE  70   5.775  -8.837 -10.114
  576   HG21  ILE  70          HG21      ILE  70   6.995  -5.337 -10.307
  577   HG22  ILE  70          HG22      ILE  70   7.707  -5.320  -8.694
  578   HG23  ILE  70          HG23      ILE  70   5.953  -5.334  -8.884
  579   HD11  ILE  70          HD11      ILE  70   4.356  -7.907  -8.366
  580   HD12  ILE  70          HD12      ILE  70   3.553  -7.868  -9.936
  581   HD13  ILE  70          HD13      ILE  70   4.242  -6.391  -9.260
  582    H    ASP  71           HN       ASP  71  10.288  -6.590 -10.673
  583    HA   ASP  71           HA       ASP  71  11.123  -5.653 -12.539
  584    HB2  ASP  71           HB2      ASP  71  10.588  -8.013 -13.407
  585    HB3  ASP  71           HB1      ASP  71   9.204  -7.267 -14.200
  586    H    ARG  72           HN       ARG  72   9.276  -4.122 -11.276
  587    HA   ARG  72           HA       ARG  72   8.085  -2.696 -13.563
  588    HB2  ARG  72           HB2      ARG  72   6.701  -3.209 -10.919
  589    HB3  ARG  72           HB1      ARG  72   6.085  -2.174 -12.202
  590    HG2  ARG  72           HG2      ARG  72   5.972  -4.096 -13.706
  591    HG3  ARG  72           HG1      ARG  72   6.596  -5.135 -12.426
  592    HD2  ARG  72           HD2      ARG  72   4.594  -4.427 -11.053
  593    HD3  ARG  72           HD1      ARG  72   3.957  -3.697 -12.528
  594    HE   ARG  72           HE       ARG  72   4.690  -6.370 -13.038
  595   HH11  ARG  72          HH21      ARG  72   2.237  -4.501 -11.400
  596   HH12  ARG  72          HH22      ARG  72   1.035  -5.748 -11.473
  597   HH21  ARG  72          HH11      ARG  72   3.108  -8.035 -13.141
  598   HH22  ARG  72          HH12      ARG  72   1.533  -7.761 -12.469
  599    H    THR  73           HN       THR  73   7.645  -0.390 -13.075
  600    HA   THR  73           HA       THR  73   9.874   0.786 -11.732
  601    HB   THR  73           HB       THR  73   9.290   2.153 -13.477
  602    HG1  THR  73           HG1      THR  73   7.910   3.086 -11.207
  603   HG21  THR  73          HG21      THR  73   6.932   2.674 -14.122
  604   HG22  THR  73          HG22      THR  73   6.398   1.540 -12.882
  605   HG23  THR  73          HG23      THR  73   7.355   0.967 -14.248
  606    HA   PRO  74           HA       PRO  74   8.538   1.249  -7.554
  607    HB2  PRO  74           HB2      PRO  74   9.080   3.995  -7.247
  608    HB3  PRO  74           HB1      PRO  74  10.176   2.658  -6.895
  609    HG2  PRO  74           HG2      PRO  74  10.009   4.387  -9.312
  610    HG3  PRO  74           HG1      PRO  74  11.431   3.658  -8.544
  611    HD2  PRO  74           HD2      PRO  74  10.429   2.667 -10.815
  612    HD3  PRO  74           HD1      PRO  74  11.067   1.592  -9.551
  613    H    HIS  75           HN       HIS  75   7.548   3.960  -9.666
  614    HA   HIS  75           HA       HIS  75   5.374   4.773  -8.089
  615    HB2  HIS  75           HB2      HIS  75   6.121   5.178 -10.953
  616    HB3  HIS  75           HB1      HIS  75   4.510   5.645 -10.414
  617    HD1  HIS  75           HD1      HIS  75   7.364   7.336 -11.143
  618    HD2  HIS  75           HD2      HIS  75   5.157   7.072  -7.625
  619    HE1  HIS  75           HE1      HIS  75   7.968   9.386  -9.817
  620    HE2  HIS  75           HE2      HIS  75   6.487   9.303  -7.780
  621    H    TRP  76           HN       TRP  76   5.466   2.548 -10.870
  622    HA   TRP  76           HA       TRP  76   2.705   1.965 -10.787
  623    HB2  TRP  76           HB2      TRP  76   4.139   1.478 -12.774
  624    HB3  TRP  76           HB1      TRP  76   4.908   0.187 -11.853
  625    HD1  TRP  76           HD1      TRP  76   3.525  -2.053 -11.480
  626    HE1  TRP  76           HE1      TRP  76   1.404  -2.999 -12.598
  627    HE3  TRP  76           HE3      TRP  76   1.878   2.176 -13.835
  628    HZ2  TRP  76           HZ2      TRP  76  -0.679  -2.084 -14.249
  629    HZ3  TRP  76           HZ3      TRP  76  -0.187   2.052 -15.168
  630    HH2  TRP  76           HH2      TRP  76  -1.438  -0.036 -15.370
  631    H    LEU  77           HN       LEU  77   5.531   0.604  -9.309
  632    HA   LEU  77           HA       LEU  77   4.368  -1.647  -8.142
  633    HB2  LEU  77           HB2      LEU  77   6.803  -1.281  -8.260
  634    HB3  LEU  77           HB1      LEU  77   6.650  -0.008  -7.067
  635    HG   LEU  77           HG       LEU  77   7.476  -2.318  -6.286
  636   HD11  LEU  77          HD11      LEU  77   6.610  -0.374  -4.867
  637   HD12  LEU  77          HD12      LEU  77   6.662  -1.978  -4.138
  638   HD13  LEU  77          HD13      LEU  77   5.131  -1.322  -4.717
  639   HD21  LEU  77          HD21      LEU  77   5.807  -3.956  -5.734
  640   HD22  LEU  77          HD22      LEU  77   5.723  -3.607  -7.460
  641   HD23  LEU  77          HD23      LEU  77   4.526  -2.920  -6.363
  642    H    ILE  78           HN       ILE  78   4.610   1.670  -7.024
  643    HA   ILE  78           HA       ILE  78   3.627   1.268  -4.436
  644    HB   ILE  78           HB       ILE  78   3.321   3.647  -6.279
  645   HG12  ILE  78          HG12      ILE  78   5.010   3.302  -3.794
  646   HG13  ILE  78          HG11      ILE  78   5.605   3.019  -5.427
  647   HG21  ILE  78          HG21      ILE  78   1.468   3.740  -4.766
  648   HG22  ILE  78          HG22      ILE  78   2.671   4.920  -4.244
  649   HG23  ILE  78          HG23      ILE  78   2.512   3.385  -3.390
  650   HD11  ILE  78          HD11      ILE  78   6.296   5.189  -4.766
  651   HD12  ILE  78          HD12      ILE  78   4.666   5.616  -4.245
  652   HD13  ILE  78          HD13      ILE  78   5.012   5.386  -5.959
  653    H    LYS  79           HN       LYS  79   1.997   1.823  -7.514
  654    HA   LYS  79           HA       LYS  79  -0.664   1.762  -6.610
  655    HB2  LYS  79           HB2      LYS  79   0.354   0.569  -9.202
  656    HB3  LYS  79           HB1      LYS  79  -1.276   1.133  -8.875
  657    HG2  LYS  79           HG2      LYS  79  -0.603   3.393  -8.907
  658    HG3  LYS  79           HG1      LYS  79   1.108   2.957  -8.852
  659    HD2  LYS  79           HD2      LYS  79   0.761   3.497 -11.093
  660    HD3  LYS  79           HD1      LYS  79   0.648   1.738 -11.074
  661    HE2  LYS  79           HE2      LYS  79  -1.203   2.228 -12.314
  662    HE3  LYS  79           HE1      LYS  79  -1.912   2.254 -10.700
  663    HZ1  LYS  79           HZ1      LYS  79  -2.269   4.211 -12.399
  664    HZ2  LYS  79           HZ2      LYS  79  -0.812   4.755 -11.736
  665    HZ3  LYS  79           HZ3      LYS  79  -2.152   4.491 -10.733
  666    H    GLN  80           HN       GLN  80   1.451  -0.820  -7.789
  667    HA   GLN  80           HA       GLN  80  -0.364  -2.935  -7.367
  668    HB2  GLN  80           HB2      GLN  80   2.638  -2.975  -7.639
  669    HB3  GLN  80           HB1      GLN  80   1.601  -4.396  -7.701
  670    HG2  GLN  80           HG2      GLN  80   1.418  -2.062  -9.587
  671    HG3  GLN  80           HG1      GLN  80   2.277  -3.565  -9.921
  672   HE21  GLN  80          HE21      GLN  80  -0.174  -2.183 -11.066
  673   HE22  GLN  80          HE22      GLN  80  -1.365  -3.436 -11.121
  674    H    ALA  81           HN       ALA  81   2.202  -1.625  -5.292
  675    HA   ALA  81           HA       ALA  81   2.292  -3.668  -3.424
  676    HB1  ALA  81           HB1      ALA  81   2.823  -1.726  -1.792
  677    HB2  ALA  81           HB2      ALA  81   2.756  -0.719  -3.239
  678    HB3  ALA  81           HB3      ALA  81   3.916  -2.044  -3.138
  679    H    ILE  82           HN       ILE  82   0.054  -0.940  -3.692
  680    HA   ILE  82           HA       ILE  82  -1.419  -1.951  -1.401
  681    HB   ILE  82           HB       ILE  82  -0.965   0.531  -1.945
  682   HG12  ILE  82          HG12      ILE  82  -3.446   1.058  -1.178
  683   HG13  ILE  82          HG11      ILE  82  -3.479  -0.684  -0.932
  684   HG21  ILE  82          HG21      ILE  82  -3.355   0.105  -3.719
  685   HG22  ILE  82          HG22      ILE  82  -1.730   0.555  -4.237
  686   HG23  ILE  82          HG23      ILE  82  -2.683   1.668  -3.255
  687   HD11  ILE  82          HD11      ILE  82  -1.553  -0.517   0.542
  688   HD12  ILE  82          HD12      ILE  82  -2.876   0.507   1.101
  689   HD13  ILE  82          HD13      ILE  82  -1.493   1.225   0.276
  690    H    PHE  83           HN       PHE  83  -1.914  -1.621  -4.894
  691    HA   PHE  83           HA       PHE  83  -4.578  -2.640  -4.882
  692    HB2  PHE  83           HB2      PHE  83  -3.973  -1.213  -6.678
  693    HB3  PHE  83           HB1      PHE  83  -2.517  -2.133  -7.026
  694    HD1  PHE  83           HD2      PHE  83  -6.147  -1.973  -7.436
  695    HD2  PHE  83           HD1      PHE  83  -2.595  -4.138  -8.329
  696    HE1  PHE  83           HE2      PHE  83  -7.350  -3.225  -9.179
  697    HE2  PHE  83           HE1      PHE  83  -3.785  -5.390 -10.073
  698    HZ   PHE  83           HZ       PHE  83  -6.170  -4.937 -10.501
  699    H    ASN  84           HN       ASN  84  -1.399  -4.066  -5.515
  700    HA   ASN  84           HA       ASN  84  -2.425  -6.592  -6.264
  701    HB2  ASN  84           HB2      ASN  84  -0.033  -5.709  -6.662
  702    HB3  ASN  84           HB1      ASN  84   0.278  -6.186  -5.001
  703   HD21  ASN  84          HD21      ASN  84  -1.822  -8.453  -5.889
  704   HD22  ASN  84          HD22      ASN  84  -0.770  -9.618  -6.603
  705    H    TYR  85           HN       TYR  85  -1.702  -4.967  -3.233
  706    HA   TYR  85           HA       TYR  85  -1.794  -7.240  -1.581
  707    HB2  TYR  85           HB2      TYR  85  -1.140  -5.029  -0.696
  708    HB3  TYR  85           HB1      TYR  85  -2.782  -4.442  -0.954
  709    HD1  TYR  85           HD2      TYR  85  -0.984  -7.215   0.782
  710    HD2  TYR  85           HD1      TYR  85  -4.260  -4.504   0.829
  711    HE1  TYR  85           HE2      TYR  85  -1.642  -8.061   2.992
  712    HE2  TYR  85           HE1      TYR  85  -4.932  -5.347   3.040
  713    HH   TYR  85           HH       TYR  85  -2.978  -7.171   5.002
  714    H    LEU  86           HN       LEU  86  -4.217  -5.127  -2.935
  715    HA   LEU  86           HA       LEU  86  -6.478  -6.338  -1.783
  716    HB2  LEU  86           HB2      LEU  86  -6.215  -4.781  -4.349
  717    HB3  LEU  86           HB1      LEU  86  -7.739  -5.213  -3.594
  718    HG   LEU  86           HG       LEU  86  -5.628  -3.423  -2.385
  719   HD11  LEU  86          HD11      LEU  86  -7.363  -1.676  -2.683
  720   HD12  LEU  86          HD12      LEU  86  -8.303  -2.830  -3.630
  721   HD13  LEU  86          HD13      LEU  86  -6.717  -2.307  -4.197
  722   HD21  LEU  86          HD21      LEU  86  -6.722  -4.523  -0.601
  723   HD22  LEU  86          HD22      LEU  86  -8.298  -4.375  -1.377
  724   HD23  LEU  86          HD23      LEU  86  -7.489  -2.942  -0.744
  725    H    GLU  87           HN       GLU  87  -4.710  -6.887  -4.769
  726    HA   GLU  87           HA       GLU  87  -6.391  -8.841  -5.911
  727    HB2  GLU  87           HB2      GLU  87  -4.615  -7.637  -7.142
  728    HB3  GLU  87           HB1      GLU  87  -3.401  -8.484  -6.201
  729    HG2  GLU  87           HG2      GLU  87  -4.130 -10.610  -7.168
  730    HG3  GLU  87           HG1      GLU  87  -5.348  -9.753  -8.113
  731    H    LYS  88           HN       LYS  88  -3.703  -9.050  -3.634
  732    HA   LYS  88           HA       LYS  88  -3.410 -11.855  -3.629
  733    HB2  LYS  88           HB2      LYS  88  -2.798  -9.854  -1.444
  734    HB3  LYS  88           HB1      LYS  88  -2.265 -11.526  -1.445
  735    HG2  LYS  88           HG2      LYS  88  -1.517  -9.530  -3.569
  736    HG3  LYS  88           HG1      LYS  88  -0.543  -9.858  -2.136
  737    HD2  LYS  88           HD2      LYS  88  -0.421 -12.239  -2.828
  738    HD3  LYS  88           HD1      LYS  88  -1.283 -11.815  -4.309
  739    HE2  LYS  88           HE2      LYS  88   1.030 -11.856  -4.849
  740    HE3  LYS  88           HE1      LYS  88   0.549 -10.162  -4.784
  741    HZ1  LYS  88           HZ1      LYS  88   2.279  -9.912  -3.427
  742    HZ2  LYS  88           HZ2      LYS  88   2.461 -11.576  -3.191
  743    HZ3  LYS  88           HZ3      LYS  88   1.365 -10.708  -2.246
  744    H    LEU  89           HN       LEU  89  -5.349  -9.702  -1.565
  745    HA   LEU  89           HA       LEU  89  -6.364 -11.962  -0.064
  746    HB2  LEU  89           HB2      LEU  89  -7.627 -10.293   1.221
  747    HB3  LEU  89           HB1      LEU  89  -5.911  -9.949   1.165
  748    HG   LEU  89           HG       LEU  89  -6.811  -8.442  -0.923
  749   HD11  LEU  89          HD11      LEU  89  -9.158  -9.050  -0.279
  750   HD12  LEU  89          HD12      LEU  89  -8.817  -7.321  -0.320
  751   HD13  LEU  89          HD13      LEU  89  -8.901  -8.167   1.226
  752   HD21  LEU  89          HD21      LEU  89  -6.620  -7.639   1.975
  753   HD22  LEU  89          HD22      LEU  89  -6.561  -6.545   0.593
  754   HD23  LEU  89          HD23      LEU  89  -5.282  -7.735   0.831
  755    H    GLU  90           HN       GLU  90  -7.599  -9.630  -2.391
  756    HA   GLU  90           HA       GLU  90  -9.510  -9.409  -3.532
  757    HB2  GLU  90           HB2      GLU  90  -8.991 -12.343  -3.669
  758    HB3  GLU  90           HB1      GLU  90 -10.465 -11.690  -4.377
  759    HG2  GLU  90           HG2      GLU  90  -9.126 -10.179  -5.764
  760    HG3  GLU  90           HG1      GLU  90  -7.654 -10.843  -5.058
  Start of MODEL   19
    1    H1   MET   1           HT1      MET   1   3.249   3.100  14.603
    2    H2   MET   1           HT2      MET   1   4.593   2.562  15.474
    3    H3   MET   1           HT3      MET   1   3.579   1.440  14.715
    4    HA   MET   1           HA       MET   1   5.659   1.775  13.504
    5    HB2  MET   1           HB2      MET   1   3.431   2.995  11.879
    6    HB3  MET   1           HB1      MET   1   4.709   1.919  11.342
    7    HG2  MET   1           HG2      MET   1   2.210   1.264  12.848
    8    HG3  MET   1           HG1      MET   1   2.777   0.626  11.307
    9    HE1  MET   1           HE1      MET   1   2.089  -1.789  12.208
   10    HE2  MET   1           HE2      MET   1   3.504  -2.756  12.624
   11    HE3  MET   1           HE3      MET   1   3.518  -1.751  11.174
   12    H    ALA   2           HN       ALA   2   6.640   3.324  11.809
   13    HA   ALA   2           HA       ALA   2   6.564   6.056  12.923
   14    HB1  ALA   2           HB1      ALA   2   8.864   4.573  11.636
   15    HB2  ALA   2           HB2      ALA   2   8.704   4.971  13.346
   16    HB3  ALA   2           HB3      ALA   2   8.907   6.257  12.157
   17    H    THR   3           HN       THR   3   4.819   4.994  10.965
   18    HA   THR   3           HA       THR   3   5.699   5.674   8.346
   19    HB   THR   3           HB       THR   3   3.259   5.340   7.786
   20    HG1  THR   3           HG1      THR   3   2.352   4.054   9.774
   21   HG21  THR   3          HG21      THR   3   4.884   3.542   7.580
   22   HG22  THR   3          HG22      THR   3   3.340   2.919   8.161
   23   HG23  THR   3          HG23      THR   3   4.680   3.143   9.286
   24    H    THR   4           HN       THR   4   5.169   7.363   7.089
   25    HA   THR   4           HA       THR   4   3.898   9.682   8.393
   26    HB   THR   4           HB       THR   4   5.884   9.810   6.115
   27    HG1  THR   4           HG1      THR   4   6.433   9.029   8.551
   28   HG21  THR   4          HG21      THR   4   4.505  11.800   6.421
   29   HG22  THR   4          HG22      THR   4   6.173  12.131   6.890
   30   HG23  THR   4          HG23      THR   4   4.946  11.861   8.128
   31    H    THR   5           HN       THR   5   2.538  10.997   6.978
   32    HA   THR   5           HA       THR   5   0.998   9.416   5.167
   33    HB   THR   5           HB       THR   5  -0.058  11.762   4.697
   34    HG1  THR   5           HG1      THR   5   1.437  13.128   5.569
   35   HG21  THR   5          HG21      THR   5  -0.163  10.543   7.460
   36   HG22  THR   5          HG22      THR   5  -1.097  10.000   6.066
   37   HG23  THR   5          HG23      THR   5  -1.379  11.603   6.746
   38    H    LEU   6           HN       LEU   6   2.378   8.783   3.507
   39    HA   LEU   6           HA       LEU   6   3.551  10.893   1.834
   40    HB2  LEU   6           HB2      LEU   6   4.000   7.915   1.656
   41    HB3  LEU   6           HB1      LEU   6   4.922   9.172   0.857
   42    HG   LEU   6           HG       LEU   6   4.884   8.574   3.817
   43   HD11  LEU   6          HD11      LEU   6   7.047   7.760   3.565
   44   HD12  LEU   6          HD12      LEU   6   7.248   8.509   1.981
   45   HD13  LEU   6          HD13      LEU   6   6.192   7.109   2.166
   46   HD21  LEU   6          HD21      LEU   6   6.674  10.315   3.922
   47   HD22  LEU   6          HD22      LEU   6   5.060  10.942   3.589
   48   HD23  LEU   6          HD23      LEU   6   6.233  10.787   2.281
   49    H    GLY   7           HN       GLY   7   3.172  10.958  -0.399
   50    HA2  GLY   7           HA2      GLY   7   0.520  10.343  -1.189
   51    HA3  GLY   7           HA1      GLY   7   1.790  10.965  -2.228
   52    H    VAL   8           HN       VAL   8  -0.162   8.349  -1.511
   53    HA   VAL   8           HA       VAL   8   1.493   6.522  -3.126
   54    HB   VAL   8           HB       VAL   8  -0.390   6.035  -0.847
   55   HG11  VAL   8          HG11      VAL   8  -1.277   4.549  -2.517
   56   HG12  VAL   8          HG12      VAL   8  -0.353   3.612  -1.344
   57   HG13  VAL   8          HG13      VAL   8   0.340   3.978  -2.923
   58   HG21  VAL   8          HG21      VAL   8   1.976   6.249  -0.395
   59   HG22  VAL   8          HG22      VAL   8   2.336   4.982  -1.567
   60   HG23  VAL   8          HG23      VAL   8   1.443   4.595  -0.096
   61    H    LYS   9           HN       LYS   9   0.277   5.120  -4.627
   62    HA   LYS   9           HA       LYS   9  -1.811   6.693  -5.905
   63    HB2  LYS   9           HB2      LYS   9  -0.179   4.323  -6.809
   64    HB3  LYS   9           HB1      LYS   9  -1.478   5.016  -7.770
   65    HG2  LYS   9           HG2      LYS   9   0.314   6.107  -8.662
   66    HG3  LYS   9           HG1      LYS   9  -0.141   7.244  -7.392
   67    HD2  LYS   9           HD2      LYS   9   1.537   5.684  -5.998
   68    HD3  LYS   9           HD1      LYS   9   2.229   5.478  -7.607
   69    HE2  LYS   9           HE2      LYS   9   3.391   7.317  -6.898
   70    HE3  LYS   9           HE1      LYS   9   2.014   8.099  -7.673
   71    HZ1  LYS   9           HZ1      LYS   9   2.442   7.658  -4.767
   72    HZ2  LYS   9           HZ2      LYS   9   0.961   8.152  -5.417
   73    HZ3  LYS   9           HZ3      LYS   9   2.326   9.135  -5.584
   74    H    LEU  10           HN       LEU  10  -3.797   6.347  -5.275
   75    HA   LEU  10           HA       LEU  10  -4.797   3.589  -5.066
   76    HB2  LEU  10           HB2      LEU  10  -5.077   5.823  -3.076
   77    HB3  LEU  10           HB1      LEU  10  -6.306   4.582  -3.193
   78    HG   LEU  10           HG       LEU  10  -3.423   3.889  -2.693
   79   HD11  LEU  10          HD11      LEU  10  -4.083   5.471  -0.971
   80   HD12  LEU  10          HD12      LEU  10  -3.969   3.842  -0.304
   81   HD13  LEU  10          HD13      LEU  10  -5.549   4.543  -0.657
   82   HD21  LEU  10          HD21      LEU  10  -4.642   1.983  -3.275
   83   HD22  LEU  10          HD22      LEU  10  -6.072   2.519  -2.392
   84   HD23  LEU  10          HD23      LEU  10  -4.647   1.976  -1.511
   85    H    ASP  11           HN       ASP  11  -6.667   3.322  -6.217
   86    HA   ASP  11           HA       ASP  11  -7.960   5.747  -7.220
   87    HB2  ASP  11           HB2      ASP  11  -9.234   4.246  -8.740
   88    HB3  ASP  11           HB1      ASP  11  -7.507   4.235  -9.002
   89    H    ASP  12           HN       ASP  12 -10.498   5.185  -7.526
   90    HA   ASP  12           HA       ASP  12 -11.557   5.280  -4.922
   91    HB2  ASP  12           HB2      ASP  12 -12.670   5.240  -7.643
   92    HB3  ASP  12           HB1      ASP  12 -13.734   4.555  -6.418
   93    HA   PRO  13           HA       PRO  13 -13.057   0.606  -5.876
   94    HB2  PRO  13           HB2      PRO  13 -10.601   0.010  -7.474
   95    HB3  PRO  13           HB1      PRO  13 -12.208  -0.719  -7.570
   96    HG2  PRO  13           HG2      PRO  13 -11.418   1.097  -9.354
   97    HG3  PRO  13           HG1      PRO  13 -13.089   1.052  -8.763
   98    HD2  PRO  13           HD2      PRO  13 -10.924   2.982  -8.153
   99    HD3  PRO  13           HD1      PRO  13 -12.680   3.208  -8.150
  100    H    THR  14           HN       THR  14  -9.526   1.353  -5.807
  101    HA   THR  14           HA       THR  14  -8.990  -0.738  -3.958
  102    HB   THR  14           HB       THR  14  -6.795   0.339  -3.611
  103    HG1  THR  14           HG1      THR  14  -6.682   2.404  -3.986
  104   HG21  THR  14          HG21      THR  14  -7.904  -0.550  -6.139
  105   HG22  THR  14          HG22      THR  14  -6.359  -0.941  -5.383
  106   HG23  THR  14          HG23      THR  14  -6.520   0.520  -6.358
  107    H    ARG  15           HN       ARG  15  -9.469   2.784  -3.490
  108    HA   ARG  15           HA       ARG  15  -8.926   2.757  -0.723
  109    HB2  ARG  15           HB2      ARG  15  -9.409   4.739  -2.437
  110    HB3  ARG  15           HB1      ARG  15 -11.026   4.605  -1.762
  111    HG2  ARG  15           HG2      ARG  15  -8.552   4.980  -0.087
  112    HG3  ARG  15           HG1      ARG  15  -9.544   6.311  -0.683
  113    HD2  ARG  15           HD2      ARG  15 -11.476   5.402   0.509
  114    HD3  ARG  15           HD1      ARG  15 -10.488   4.067   1.099
  115    HE   ARG  15           HE       ARG  15  -9.513   6.712   1.766
  116   HH11  ARG  15          HH21      ARG  15 -11.456   3.976   2.754
  117   HH12  ARG  15          HH22      ARG  15 -11.450   4.407   4.432
  118   HH21  ARG  15          HH11      ARG  15  -9.488   7.295   3.982
  119   HH22  ARG  15          HH12      ARG  15 -10.324   6.307   5.135
  120    H    GLU  16           HN       GLU  16 -11.938   2.325  -2.522
  121    HA   GLU  16           HA       GLU  16 -13.578   1.931  -0.239
  122    HB2  GLU  16           HB2      GLU  16 -13.939   1.126  -3.130
  123    HB3  GLU  16           HB1      GLU  16 -15.179   0.919  -1.899
  124    HG2  GLU  16           HG2      GLU  16 -13.987   3.516  -2.842
  125    HG3  GLU  16           HG1      GLU  16 -15.618   2.920  -3.153
  126    H    ARG  17           HN       ARG  17 -11.819  -0.251  -2.393
  127    HA   ARG  17           HA       ARG  17 -12.742  -2.655  -1.270
  128    HB2  ARG  17           HB2      ARG  17 -11.559  -2.643  -3.414
  129    HB3  ARG  17           HB1      ARG  17 -10.084  -2.119  -2.606
  130    HG2  ARG  17           HG2      ARG  17 -10.035  -4.503  -3.079
  131    HG3  ARG  17           HG1      ARG  17 -10.019  -4.200  -1.339
  132    HD2  ARG  17           HD2      ARG  17 -12.433  -4.635  -1.258
  133    HD3  ARG  17           HD1      ARG  17 -12.429  -4.955  -2.991
  134    HE   ARG  17           HE       ARG  17 -11.403  -6.996  -2.619
  135   HH11  ARG  17          HH21      ARG  17 -11.598  -5.179   0.386
  136   HH12  ARG  17          HH22      ARG  17 -11.337  -6.573   1.381
  137   HH21  ARG  17          HH11      ARG  17 -11.048  -8.795  -1.334
  138   HH22  ARG  17          HH12      ARG  17 -11.022  -8.653   0.397
  139    H    LEU  18           HN       LEU  18 -10.062  -0.533  -0.479
  140    HA   LEU  18           HA       LEU  18  -8.914  -2.130   1.507
  141    HB2  LEU  18           HB2      LEU  18  -8.775   0.706   0.728
  142    HB3  LEU  18           HB1      LEU  18  -8.449   0.406   2.425
  143    HG   LEU  18           HG       LEU  18  -6.719  -1.302   1.662
  144   HD11  LEU  18          HD11      LEU  18  -6.949   0.125  -0.971
  145   HD12  LEU  18          HD12      LEU  18  -7.604  -1.482  -0.660
  146   HD13  LEU  18          HD13      LEU  18  -5.866  -1.202  -0.547
  147   HD21  LEU  18          HD21      LEU  18  -5.059   0.480   1.094
  148   HD22  LEU  18          HD22      LEU  18  -6.004   0.783   2.551
  149   HD23  LEU  18          HD23      LEU  18  -6.397   1.628   1.054
  150    H    LYS  19           HN       LYS  19 -11.689   0.100   1.603
  151    HA   LYS  19           HA       LYS  19 -12.006   0.095   4.396
  152    HB2  LYS  19           HB2      LYS  19 -13.317   1.429   2.562
  153    HB3  LYS  19           HB1      LYS  19 -14.389   0.037   2.565
  154    HG2  LYS  19           HG2      LYS  19 -13.726   1.638   5.029
  155    HG3  LYS  19           HG1      LYS  19 -15.117   1.956   3.995
  156    HD2  LYS  19           HD2      LYS  19 -15.889  -0.374   4.417
  157    HD3  LYS  19           HD1      LYS  19 -14.557  -0.565   5.559
  158    HE2  LYS  19           HE2      LYS  19 -15.466   1.391   6.825
  159    HE3  LYS  19           HE1      LYS  19 -16.862   1.373   5.750
  160    HZ1  LYS  19           HZ1      LYS  19 -17.362  -0.880   6.505
  161    HZ2  LYS  19           HZ2      LYS  19 -17.331   0.198   7.809
  162    HZ3  LYS  19           HZ3      LYS  19 -16.028  -0.848   7.547
  163    H    ALA  20           HN       ALA  20 -13.242  -2.038   1.924
  164    HA   ALA  20           HA       ALA  20 -14.548  -3.869   3.629
  165    HB1  ALA  20           HB1      ALA  20 -15.103  -3.784   1.281
  166    HB2  ALA  20           HB2      ALA  20 -14.495  -5.393   1.672
  167    HB3  ALA  20           HB3      ALA  20 -13.457  -4.236   0.838
  168    H    ALA  21           HN       ALA  21 -11.282  -3.676   2.323
  169    HA   ALA  21           HA       ALA  21 -10.344  -6.179   3.236
  170    HB1  ALA  21           HB1      ALA  21  -8.651  -3.708   2.915
  171    HB2  ALA  21           HB2      ALA  21  -9.224  -4.663   1.547
  172    HB3  ALA  21           HB3      ALA  21  -8.160  -5.394   2.748
  173    H    ALA  22           HN       ALA  22 -10.431  -2.968   4.657
  174    HA   ALA  22           HA       ALA  22  -9.048  -3.484   7.021
  175    HB1  ALA  22           HB1      ALA  22 -11.401  -1.628   6.881
  176    HB2  ALA  22           HB2      ALA  22  -9.891  -1.249   6.053
  177    HB3  ALA  22           HB3      ALA  22  -9.908  -1.451   7.805
  178    H    GLN  23           HN       GLN  23 -12.366  -3.889   6.118
  179    HA   GLN  23           HA       GLN  23 -13.341  -4.740   8.637
  180    HB2  GLN  23           HB2      GLN  23 -14.385  -5.259   5.842
  181    HB3  GLN  23           HB1      GLN  23 -15.276  -5.583   7.327
  182    HG2  GLN  23           HG2      GLN  23 -14.237  -2.864   6.598
  183    HG3  GLN  23           HG1      GLN  23 -15.839  -3.435   6.134
  184   HE21  GLN  23          HE21      GLN  23 -13.806  -2.361   8.734
  185   HE22  GLN  23          HE22      GLN  23 -15.049  -2.227   9.930
  186    H    SER  24           HN       SER  24 -11.950  -6.346   5.865
  187    HA   SER  24           HA       SER  24 -12.394  -9.013   6.627
  188    HB2  SER  24           HB2      SER  24 -11.707  -8.253   4.347
  189    HB3  SER  24           HB1      SER  24 -10.097  -7.922   4.981
  190    HG   SER  24           HG       SER  24 -10.252 -10.257   5.699
  191    H    ILE  25           HN       ILE  25  -9.945  -6.679   7.545
  192    HA   ILE  25           HA       ILE  25  -8.547  -8.746   9.096
  193    HB   ILE  25           HB       ILE  25  -7.155  -7.448   7.516
  194   HG12  ILE  25          HG12      ILE  25  -5.351  -6.850   9.067
  195   HG13  ILE  25          HG11      ILE  25  -6.487  -6.858  10.411
  196   HG21  ILE  25          HG21      ILE  25  -8.175  -5.351   7.399
  197   HG22  ILE  25          HG22      ILE  25  -6.628  -5.056   8.196
  198   HG23  ILE  25          HG23      ILE  25  -8.113  -5.124   9.147
  199   HD11  ILE  25          HD11      ILE  25  -5.055  -8.883  10.233
  200   HD12  ILE  25          HD12      ILE  25  -5.882  -9.270   8.723
  201   HD13  ILE  25          HD13      ILE  25  -6.788  -9.211  10.235
  202    H    ASP  26           HN       ASP  26 -10.987  -6.733   9.482
  203    HA   ASP  26           HA       ASP  26 -12.083  -5.804  11.215
  204    HB2  ASP  26           HB2      ASP  26 -10.204  -7.574  12.777
  205    HB3  ASP  26           HB1      ASP  26 -11.520  -6.668  13.518
  206    H    ARG  27           HN       ARG  27 -10.145  -4.203  10.111
  207    HA   ARG  27           HA       ARG  27  -9.293  -2.646  12.468
  208    HB2  ARG  27           HB2      ARG  27  -7.693  -3.084   9.941
  209    HB3  ARG  27           HB1      ARG  27  -7.273  -1.934  11.202
  210    HG2  ARG  27           HG2      ARG  27  -7.436  -4.925  11.511
  211    HG3  ARG  27           HG1      ARG  27  -5.962  -3.962  11.405
  212    HD2  ARG  27           HD2      ARG  27  -8.001  -4.028  13.612
  213    HD3  ARG  27           HD1      ARG  27  -6.279  -4.397  13.698
  214    HE   ARG  27           HE       ARG  27  -6.268  -1.818  12.958
  215   HH11  ARG  27          HH21      ARG  27  -7.903  -3.534  15.512
  216   HH12  ARG  27          HH22      ARG  27  -7.998  -2.163  16.570
  217   HH21  ARG  27          HH11      ARG  27  -6.386   0.026  14.342
  218   HH22  ARG  27          HH12      ARG  27  -7.136  -0.122  15.894
  219    H    THR  28           HN       THR  28  -8.982  -0.333  12.019
  220    HA   THR  28           HA       THR  28 -11.090   0.674  10.330
  221    HB   THR  28           HB       THR  28 -10.411   1.569  12.667
  222    HG1  THR  28           HG1      THR  28 -11.783   3.006  11.971
  223   HG21  THR  28          HG21      THR  28  -8.002   1.868  12.092
  224   HG22  THR  28          HG22      THR  28  -8.767   3.320  12.736
  225   HG23  THR  28          HG23      THR  28  -8.471   3.175  11.004
  226    HA   PRO  29           HA       PRO  29  -9.077   1.560   6.497
  227    HB2  PRO  29           HB2      PRO  29  -9.793   4.407   7.123
  228    HB3  PRO  29           HB1      PRO  29  -9.961   3.514   5.605
  229    HG2  PRO  29           HG2      PRO  29 -12.064   3.870   7.194
  230    HG3  PRO  29           HG1      PRO  29 -11.814   2.331   6.349
  231    HD2  PRO  29           HD2      PRO  29 -11.492   2.981   9.222
  232    HD3  PRO  29           HD1      PRO  29 -11.883   1.434   8.448
  233    H    HIS  30           HN       HIS  30  -8.348   4.151   8.907
  234    HA   HIS  30           HA       HIS  30  -5.889   4.929   7.788
  235    HB2  HIS  30           HB2      HIS  30  -7.056   6.262   9.489
  236    HB3  HIS  30           HB1      HIS  30  -6.796   4.998  10.682
  237    HD1  HIS  30           HD1      HIS  30  -5.340   8.078   9.415
  238    HD2  HIS  30           HD2      HIS  30  -3.948   4.687  11.377
  239    HE1  HIS  30           HE1      HIS  30  -3.102   8.718  10.369
  240    HE2  HIS  30           HE2      HIS  30  -2.430   6.747  11.779
  241    H    TRP  31           HN       TRP  31  -6.582   2.646  10.408
  242    HA   TRP  31           HA       TRP  31  -3.909   1.919  10.868
  243    HB2  TRP  31           HB2      TRP  31  -5.712   1.458  12.503
  244    HB3  TRP  31           HB1      TRP  31  -6.382   0.262  11.394
  245    HD1  TRP  31           HD1      TRP  31  -4.880  -1.983  10.989
  246    HE1  TRP  31           HE1      TRP  31  -3.185  -3.161  12.525
  247    HE3  TRP  31           HE3      TRP  31  -3.986   1.821  14.285
  248    HZ2  TRP  31           HZ2      TRP  31  -1.672  -2.561  14.822
  249    HZ3  TRP  31           HZ3      TRP  31  -2.399   1.433  16.125
  250    HH2  TRP  31           HH2      TRP  31  -1.268  -0.713  16.387
  251    H    LEU  32           HN       LEU  32  -6.438   0.631   8.846
  252    HA   LEU  32           HA       LEU  32  -5.023  -1.593   7.929
  253    HB2  LEU  32           HB2      LEU  32  -7.361  -1.575   7.491
  254    HB3  LEU  32           HB1      LEU  32  -7.223  -0.086   6.558
  255    HG   LEU  32           HG       LEU  32  -5.587  -1.432   5.072
  256   HD11  LEU  32          HD11      LEU  32  -6.187  -3.846   4.950
  257   HD12  LEU  32          HD12      LEU  32  -7.008  -3.657   6.499
  258   HD13  LEU  32          HD13      LEU  32  -5.272  -3.371   6.380
  259   HD21  LEU  32          HD21      LEU  32  -7.306  -2.039   3.613
  260   HD22  LEU  32          HD22      LEU  32  -7.879  -0.624   4.498
  261   HD23  LEU  32          HD23      LEU  32  -8.461  -2.233   4.929
  262    H    ILE  33           HN       ILE  33  -5.148   1.700   6.707
  263    HA   ILE  33           HA       ILE  33  -3.833   1.238   4.306
  264    HB   ILE  33           HB       ILE  33  -3.661   3.644   6.130
  265   HG12  ILE  33          HG12      ILE  33  -5.037   3.292   3.459
  266   HG13  ILE  33          HG11      ILE  33  -5.842   3.065   5.007
  267   HG21  ILE  33          HG21      ILE  33  -2.679   4.845   4.222
  268   HG22  ILE  33          HG22      ILE  33  -2.567   3.321   3.340
  269   HG23  ILE  33          HG23      ILE  33  -1.630   3.557   4.816
  270   HD11  ILE  33          HD11      ILE  33  -5.513   5.366   5.576
  271   HD12  ILE  33          HD12      ILE  33  -6.254   5.266   3.979
  272   HD13  ILE  33          HD13      ILE  33  -4.534   5.625   4.132
  273    H    LYS  34           HN       LYS  34  -2.521   1.768   7.560
  274    HA   LYS  34           HA       LYS  34   0.210   1.525   6.833
  275    HB2  LYS  34           HB2      LYS  34  -0.961   0.550   9.441
  276    HB3  LYS  34           HB1      LYS  34   0.681   1.095   9.142
  277    HG2  LYS  34           HG2      LYS  34  -0.342   3.367   8.633
  278    HG3  LYS  34           HG1      LYS  34  -1.819   2.730   9.356
  279    HD2  LYS  34           HD2      LYS  34   0.856   3.200  10.640
  280    HD3  LYS  34           HD1      LYS  34  -0.721   3.833  11.113
  281    HE2  LYS  34           HE2      LYS  34   0.323   1.026  11.422
  282    HE3  LYS  34           HE1      LYS  34  -0.145   2.155  12.690
  283    HZ1  LYS  34           HZ1      LYS  34  -2.410   1.935  12.097
  284    HZ2  LYS  34           HZ2      LYS  34  -1.785   0.369  12.215
  285    HZ3  LYS  34           HZ3      LYS  34  -2.044   1.061  10.694
  286    H    GLN  35           HN       GLN  35  -2.139  -0.859   8.010
  287    HA   GLN  35           HA       GLN  35  -0.412  -3.088   7.939
  288    HB2  GLN  35           HB2      GLN  35  -3.421  -2.930   7.882
  289    HB3  GLN  35           HB1      GLN  35  -2.525  -4.434   8.024
  290    HG2  GLN  35           HG2      GLN  35  -2.591  -2.149   9.967
  291    HG3  GLN  35           HG1      GLN  35  -3.235  -3.774  10.192
  292   HE21  GLN  35          HE21      GLN  35  -1.713  -5.526  10.364
  293   HE22  GLN  35          HE22      GLN  35  -0.114  -5.230  10.946
  294    H    ALA  36           HN       ALA  36  -2.594  -1.753   5.527
  295    HA   ALA  36           HA       ALA  36  -2.672  -3.894   3.758
  296    HB1  ALA  36           HB1      ALA  36  -4.161  -2.023   3.493
  297    HB2  ALA  36           HB2      ALA  36  -3.190  -2.188   2.030
  298    HB3  ALA  36           HB3      ALA  36  -2.805  -0.932   3.207
  299    H    ILE  37           HN       ILE  37  -0.442  -1.131   3.901
  300    HA   ILE  37           HA       ILE  37   1.122  -2.264   1.779
  301    HB   ILE  37           HB       ILE  37   0.858   0.211   2.210
  302   HG12  ILE  37          HG12      ILE  37   3.255   0.681   1.588
  303   HG13  ILE  37          HG11      ILE  37   3.589  -1.025   1.862
  304   HG21  ILE  37          HG21      ILE  37   3.042  -0.188   4.236
  305   HG22  ILE  37          HG22      ILE  37   1.347   0.051   4.662
  306   HG23  ILE  37          HG23      ILE  37   2.227   1.314   3.800
  307   HD11  ILE  37          HD11      ILE  37   2.317  -1.687   0.042
  308   HD12  ILE  37          HD12      ILE  37   3.127  -0.227  -0.526
  309   HD13  ILE  37          HD13      ILE  37   1.438  -0.160  -0.024
  310    H    PHE  38           HN       PHE  38   1.344  -2.220   5.303
  311    HA   PHE  38           HA       PHE  38   3.988  -3.314   5.410
  312    HB2  PHE  38           HB2      PHE  38   1.774  -2.922   7.401
  313    HB3  PHE  38           HB1      PHE  38   3.116  -3.980   7.810
  314    HD1  PHE  38           HD2      PHE  38   2.704  -0.601   6.262
  315    HD2  PHE  38           HD1      PHE  38   4.702  -3.022   9.130
  316    HE1  PHE  38           HE2      PHE  38   3.996   1.348   7.002
  317    HE2  PHE  38           HE1      PHE  38   5.995  -1.070   9.879
  318    HZ   PHE  38           HZ       PHE  38   5.641   1.117   8.815
  319    H    ASN  39           HN       ASN  39   0.728  -4.667   5.620
  320    HA   ASN  39           HA       ASN  39   1.552  -7.319   6.075
  321    HB2  ASN  39           HB2      ASN  39  -0.776  -6.463   6.476
  322    HB3  ASN  39           HB1      ASN  39  -1.008  -6.440   4.734
  323   HD21  ASN  39          HD21      ASN  39  -2.831  -7.832   5.605
  324   HD22  ASN  39          HD22      ASN  39  -2.534  -9.534   5.683
  325    H    TYR  40           HN       TYR  40   1.106  -5.317   3.259
  326    HA   TYR  40           HA       TYR  40   1.274  -7.328   1.318
  327    HB2  TYR  40           HB2      TYR  40   0.715  -5.039   0.671
  328    HB3  TYR  40           HB1      TYR  40   2.298  -4.478   1.203
  329    HD1  TYR  40           HD2      TYR  40   0.867  -7.061  -1.085
  330    HD2  TYR  40           HD1      TYR  40   3.884  -4.135  -0.437
  331    HE1  TYR  40           HE2      TYR  40   1.781  -7.518  -3.317
  332    HE2  TYR  40           HE1      TYR  40   4.811  -4.588  -2.670
  333    HH   TYR  40           HH       TYR  40   4.554  -5.706  -4.582
  334    H    LEU  41           HN       LEU  41   3.652  -5.473   3.076
  335    HA   LEU  41           HA       LEU  41   5.926  -6.613   1.862
  336    HB2  LEU  41           HB2      LEU  41   5.559  -5.171   4.469
  337    HB3  LEU  41           HB1      LEU  41   7.120  -5.717   3.886
  338    HG   LEU  41           HG       LEU  41   5.330  -3.722   2.485
  339   HD11  LEU  41          HD11      LEU  41   6.924  -2.068   3.128
  340   HD12  LEU  41          HD12      LEU  41   7.978  -3.285   3.846
  341   HD13  LEU  41          HD13      LEU  41   6.416  -2.928   4.582
  342   HD21  LEU  41          HD21      LEU  41   6.513  -4.814   0.786
  343   HD22  LEU  41          HD22      LEU  41   7.973  -4.949   1.765
  344   HD23  LEU  41          HD23      LEU  41   7.473  -3.378   1.140
  345    H    GLU  42           HN       GLU  42   4.088  -7.338   4.788
  346    HA   GLU  42           HA       GLU  42   5.736  -9.354   5.844
  347    HB2  GLU  42           HB2      GLU  42   2.768  -8.858   6.096
  348    HB3  GLU  42           HB1      GLU  42   3.613 -10.103   7.004
  349    HG2  GLU  42           HG2      GLU  42   5.005  -8.418   8.066
  350    HG3  GLU  42           HG1      GLU  42   4.215  -7.152   7.130
  351    H    LYS  43           HN       LYS  43   3.074  -9.486   3.532
  352    HA   LYS  43           HA       LYS  43   2.929 -12.303   3.347
  353    HB2  LYS  43           HB2      LYS  43   2.092 -10.127   1.431
  354    HB3  LYS  43           HB1      LYS  43   1.786 -11.833   1.131
  355    HG2  LYS  43           HG2      LYS  43   0.481 -11.962   3.199
  356    HG3  LYS  43           HG1      LYS  43   0.785 -10.248   3.482
  357    HD2  LYS  43           HD2      LYS  43  -0.380  -9.687   1.407
  358    HD3  LYS  43           HD1      LYS  43  -0.677 -11.403   1.113
  359    HE2  LYS  43           HE2      LYS  43  -1.999 -11.543   3.148
  360    HE3  LYS  43           HE1      LYS  43  -1.658  -9.851   3.505
  361    HZ1  LYS  43           HZ1      LYS  43  -3.718  -9.736   2.526
  362    HZ2  LYS  43           HZ2      LYS  43  -3.414 -10.998   1.441
  363    HZ3  LYS  43           HZ3      LYS  43  -2.721  -9.475   1.183
  364    H    LEU  44           HN       LEU  44   4.801  -9.915   1.546
  365    HA   LEU  44           HA       LEU  44   5.910 -11.995  -0.140
  366    HB2  LEU  44           HB2      LEU  44   7.181 -10.201  -1.233
  367    HB3  LEU  44           HB1      LEU  44   5.452  -9.931  -1.243
  368    HG   LEU  44           HG       LEU  44   6.054  -8.483   0.916
  369   HD11  LEU  44          HD11      LEU  44   8.136  -7.396   0.784
  370   HD12  LEU  44          HD12      LEU  44   8.497  -8.106  -0.790
  371   HD13  LEU  44          HD13      LEU  44   8.481  -9.120   0.654
  372   HD21  LEU  44          HD21      LEU  44   6.127  -6.525  -0.566
  373   HD22  LEU  44          HD22      LEU  44   4.871  -7.671  -1.031
  374   HD23  LEU  44          HD23      LEU  44   6.377  -7.594  -1.946
  375    H    GLU  45           HN       GLU  45   6.522 -10.927   2.923
  376    HA   GLU  45           HA       GLU  45   9.059 -12.272   3.007
  377    HB2  GLU  45           HB2      GLU  45   9.731 -10.019   2.267
  378    HB3  GLU  45           HB1      GLU  45   8.923  -9.325   3.665
  379    HG2  GLU  45           HG2      GLU  45  10.467 -10.500   5.148
  380    HG3  GLU  45           HG1      GLU  45  11.283 -11.197   3.747
  381    H1   MET  46           HT1      MET  46  -3.345   3.335 -14.548
  382    H2   MET  46           HT2      MET  46  -4.682   2.810 -15.436
  383    H3   MET  46           HT3      MET  46  -3.669   1.678 -14.691
  384    HA   MET  46           HA       MET  46  -5.746   1.971 -13.474
  385    HB2  MET  46           HB2      MET  46  -3.551   3.217 -11.826
  386    HB3  MET  46           HB1      MET  46  -4.809   2.108 -11.308
  387    HG2  MET  46           HG2      MET  46  -2.270   1.533 -12.769
  388    HG3  MET  46           HG1      MET  46  -2.889   0.823 -11.280
  389    HE1  MET  46           HE1      MET  46  -2.145  -1.557 -12.250
  390    HE2  MET  46           HE2      MET  46  -3.543  -2.509 -12.748
  391    HE3  MET  46           HE3      MET  46  -3.609  -1.554 -11.267
  392    H    ALA  47           HN       ALA  47  -6.737   3.479 -11.736
  393    HA   ALA  47           HA       ALA  47  -6.725   6.233 -12.799
  394    HB1  ALA  47           HB1      ALA  47  -9.000   4.673 -11.557
  395    HB2  ALA  47           HB2      ALA  47  -8.843   5.114 -13.257
  396    HB3  ALA  47           HB3      ALA  47  -9.076   6.368 -12.039
  397    H    THR  48           HN       THR  48  -4.963   5.164 -10.864
  398    HA   THR  48           HA       THR  48  -5.866   5.759  -8.232
  399    HB   THR  48           HB       THR  48  -3.410   5.462  -7.684
  400    HG1  THR  48           HG1      THR  48  -2.325   4.319  -9.526
  401   HG21  THR  48          HG21      THR  48  -5.017   3.650  -7.470
  402   HG22  THR  48          HG22      THR  48  -3.475   3.042  -8.073
  403   HG23  THR  48          HG23      THR  48  -4.829   3.263  -9.181
  404    H    THR  49           HN       THR  49  -5.361   7.424  -6.930
  405    HA   THR  49           HA       THR  49  -4.117   9.789  -8.172
  406    HB   THR  49           HB       THR  49  -6.163   9.822  -5.942
  407    HG1  THR  49           HG1      THR  49  -6.656   9.091  -8.373
  408   HG21  THR  49          HG21      THR  49  -4.780  11.834  -6.130
  409   HG22  THR  49          HG22      THR  49  -6.443  12.170  -6.612
  410   HG23  THR  49          HG23      THR  49  -5.193  11.967  -7.839
  411    H    THR  50           HN       THR  50  -2.771  11.069  -6.760
  412    HA   THR  50           HA       THR  50  -1.218   9.524  -4.947
  413    HB   THR  50           HB       THR  50  -0.226  11.873  -4.427
  414    HG1  THR  50           HG1      THR  50  -1.894  13.143  -5.241
  415   HG21  THR  50          HG21      THR  50  -0.121  10.771  -7.240
  416   HG22  THR  50          HG22      THR  50   0.840  10.193  -5.879
  417   HG23  THR  50          HG23      THR  50   1.076  11.829  -6.492
  418    H    LEU  51           HN       LEU  51  -2.586   8.817  -3.297
  419    HA   LEU  51           HA       LEU  51  -3.807  10.872  -1.588
  420    HB2  LEU  51           HB2      LEU  51  -4.213   7.884  -1.472
  421    HB3  LEU  51           HB1      LEU  51  -5.155   9.112  -0.651
  422    HG   LEU  51           HG       LEU  51  -5.098   8.580  -3.623
  423   HD11  LEU  51          HD11      LEU  51  -7.248   7.727  -3.397
  424   HD12  LEU  51          HD12      LEU  51  -7.466   8.434  -1.797
  425   HD13  LEU  51          HD13      LEU  51  -6.386   7.056  -2.012
  426   HD21  LEU  51          HD21      LEU  51  -6.915  10.294  -3.695
  427   HD22  LEU  51          HD22      LEU  51  -5.313  10.939  -3.341
  428   HD23  LEU  51          HD23      LEU  51  -6.487  10.734  -2.041
  429    H    GLY  52           HN       GLY  52  -3.438  10.885   0.651
  430    HA2  GLY  52           HA2      GLY  52  -0.773  10.305   1.426
  431    HA3  GLY  52           HA1      GLY  52  -2.053  10.880   2.479
  432    H    VAL  53           HN       VAL  53  -0.054   8.316   1.703
  433    HA   VAL  53           HA       VAL  53  -1.678   6.425   3.276
  434    HB   VAL  53           HB       VAL  53   0.205   6.021   0.981
  435   HG11  VAL  53          HG11      VAL  53   1.122   4.513   2.614
  436   HG12  VAL  53          HG12      VAL  53   0.208   3.586   1.424
  437   HG13  VAL  53          HG13      VAL  53  -0.485   3.907   3.014
  438   HG21  VAL  53          HG21      VAL  53  -2.165   6.207   0.540
  439   HG22  VAL  53          HG22      VAL  53  -2.501   4.907   1.684
  440   HG23  VAL  53          HG23      VAL  53  -1.606   4.569   0.203
  441    H    LYS  54           HN       LYS  54  -0.447   5.017   4.749
  442    HA   LYS  54           HA       LYS  54   1.623   6.587   6.055
  443    HB2  LYS  54           HB2      LYS  54   0.033   4.171   6.907
  444    HB3  LYS  54           HB1      LYS  54   1.320   4.868   7.883
  445    HG2  LYS  54           HG2      LYS  54  -0.500   5.901   8.796
  446    HG3  LYS  54           HG1      LYS  54  -0.056   7.078   7.558
  447    HD2  LYS  54           HD2      LYS  54  -1.701   5.532   6.113
  448    HD3  LYS  54           HD1      LYS  54  -2.397   5.265   7.711
  449    HE2  LYS  54           HE2      LYS  54  -3.587   7.106   7.080
  450    HE3  LYS  54           HE1      LYS  54  -2.208   7.898   7.840
  451    HZ1  LYS  54           HZ1      LYS  54  -2.664   7.481   4.932
  452    HZ2  LYS  54           HZ2      LYS  54  -1.200   8.030   5.579
  453    HZ3  LYS  54           HZ3      LYS  54  -2.604   8.954   5.764
  454    H    LEU  55           HN       LEU  55   3.610   6.289   5.419
  455    HA   LEU  55           HA       LEU  55   4.660   3.555   5.144
  456    HB2  LEU  55           HB2      LEU  55   4.899   5.839   3.206
  457    HB3  LEU  55           HB1      LEU  55   6.149   4.618   3.295
  458    HG   LEU  55           HG       LEU  55   3.277   3.887   2.780
  459   HD11  LEU  55          HD11      LEU  55   3.910   5.515   1.092
  460   HD12  LEU  55          HD12      LEU  55   3.824   3.900   0.390
  461   HD13  LEU  55          HD13      LEU  55   5.391   4.619   0.759
  462   HD21  LEU  55          HD21      LEU  55   4.523   1.987   3.318
  463   HD22  LEU  55          HD22      LEU  55   5.948   2.566   2.455
  464   HD23  LEU  55          HD23      LEU  55   4.536   2.021   1.555
  465    H    ASP  56           HN       ASP  56   6.537   3.296   6.280
  466    HA   ASP  56           HA       ASP  56   7.784   5.717   7.351
  467    HB2  ASP  56           HB2      ASP  56   9.079   4.188   8.831
  468    HB3  ASP  56           HB1      ASP  56   7.352   4.156   9.092
  469    H    ASP  57           HN       ASP  57  10.327   5.181   7.660
  470    HA   ASP  57           HA       ASP  57  11.415   5.372   5.075
  471    HB2  ASP  57           HB2      ASP  57  12.506   5.202   7.812
  472    HB3  ASP  57           HB1      ASP  57  13.590   4.638   6.544
  473    HA   PRO  58           HA       PRO  58  12.959   0.689   5.887
  474    HB2  PRO  58           HB2      PRO  58  10.517   0.000   7.469
  475    HB3  PRO  58           HB1      PRO  58  12.139  -0.700   7.543
  476    HG2  PRO  58           HG2      PRO  58  11.319   1.042   9.382
  477    HG3  PRO  58           HG1      PRO  58  12.987   1.059   8.780
  478    HD2  PRO  58           HD2      PRO  58  10.762   2.942   8.227
  479    HD3  PRO  58           HD1      PRO  58  12.509   3.225   8.247
  480    H    THR  59           HN       THR  59   9.418   1.384   5.833
  481    HA   THR  59           HA       THR  59   8.915  -0.672   3.937
  482    HB   THR  59           HB       THR  59   6.705   0.380   3.611
  483    HG1  THR  59           HG1      THR  59   6.506   2.417   4.076
  484   HG21  THR  59          HG21      THR  59   7.822  -0.552   6.120
  485   HG22  THR  59          HG22      THR  59   6.285  -0.949   5.351
  486   HG23  THR  59          HG23      THR  59   6.421   0.491   6.360
  487    H    ARG  60           HN       ARG  60   9.333   2.868   3.551
  488    HA   ARG  60           HA       ARG  60   8.797   2.892   0.784
  489    HB2  ARG  60           HB2      ARG  60   9.235   4.851   2.530
  490    HB3  ARG  60           HB1      ARG  60  10.863   4.753   1.875
  491    HG2  ARG  60           HG2      ARG  60   8.409   5.113   0.168
  492    HG3  ARG  60           HG1      ARG  60   9.363   6.453   0.804
  493    HD2  ARG  60           HD2      ARG  60  11.324   5.648  -0.382
  494    HD3  ARG  60           HD1      ARG  60  10.420   4.253  -0.967
  495    HE   ARG  60           HE       ARG  60   9.330   6.843  -1.683
  496   HH11  ARG  60          HH21      ARG  60  11.374   4.160  -2.607
  497   HH12  ARG  60          HH22      ARG  60  11.343   4.541  -4.297
  498   HH21  ARG  60          HH11      ARG  60   9.276   7.359  -3.927
  499   HH22  ARG  60          HH12      ARG  60  10.145   6.371  -5.053
  500    H    GLU  61           HN       GLU  61  11.813   2.456   2.576
  501    HA   GLU  61           HA       GLU  61  13.448   2.148   0.273
  502    HB2  GLU  61           HB2      GLU  61  13.867   1.255   3.132
  503    HB3  GLU  61           HB1      GLU  61  15.099   1.178   1.879
  504    HG2  GLU  61           HG2      GLU  61  13.764   3.680   2.894
  505    HG3  GLU  61           HG1      GLU  61  15.394   3.136   3.289
  506    H    ARG  62           HN       ARG  62  11.740  -0.104   2.387
  507    HA   ARG  62           HA       ARG  62  12.697  -2.468   1.213
  508    HB2  ARG  62           HB2      ARG  62  11.518  -2.529   3.355
  509    HB3  ARG  62           HB1      ARG  62  10.032  -2.016   2.562
  510    HG2  ARG  62           HG2      ARG  62  10.029  -4.412   2.973
  511    HG3  ARG  62           HG1      ARG  62  10.012  -4.066   1.241
  512    HD2  ARG  62           HD2      ARG  62  12.433  -4.454   1.152
  513    HD3  ARG  62           HD1      ARG  62  12.436  -4.811   2.879
  514    HE   ARG  62           HE       ARG  62  11.475  -6.870   2.459
  515   HH11  ARG  62          HH21      ARG  62  11.562  -4.971  -0.501
  516   HH12  ARG  62          HH22      ARG  62  11.313  -6.346  -1.525
  517   HH21  ARG  62          HH11      ARG  62  11.140  -8.639   1.142
  518   HH22  ARG  62          HH12      ARG  62  11.066  -8.458  -0.584
  519    H    LEU  63           HN       LEU  63   9.983  -0.378   0.469
  520    HA   LEU  63           HA       LEU  63   8.863  -1.947  -1.554
  521    HB2  LEU  63           HB2      LEU  63   8.679   0.870  -0.716
  522    HB3  LEU  63           HB1      LEU  63   8.359   0.599  -2.418
  523    HG   LEU  63           HG       LEU  63   6.654  -1.148  -1.693
  524   HD11  LEU  63          HD11      LEU  63   6.862   0.221   0.971
  525   HD12  LEU  63          HD12      LEU  63   7.544  -1.366   0.622
  526   HD13  LEU  63          HD13      LEU  63   5.802  -1.113   0.515
  527   HD21  LEU  63          HD21      LEU  63   4.967   0.595  -1.087
  528   HD22  LEU  63          HD22      LEU  63   5.907   0.947  -2.536
  529   HD23  LEU  63          HD23      LEU  63   6.287   1.763  -1.019
  530    H    LYS  64           HN       LYS  64  11.599   0.326  -1.590
  531    HA   LYS  64           HA       LYS  64  11.924   0.396  -4.381
  532    HB2  LYS  64           HB2      LYS  64  13.200   1.694  -2.486
  533    HB3  LYS  64           HB1      LYS  64  14.306   0.331  -2.555
  534    HG2  LYS  64           HG2      LYS  64  13.588   2.006  -4.951
  535    HG3  LYS  64           HG1      LYS  64  14.967   2.336  -3.904
  536    HD2  LYS  64           HD2      LYS  64  15.798   0.033  -4.400
  537    HD3  LYS  64           HD1      LYS  64  14.494  -0.129  -5.577
  538    HE2  LYS  64           HE2      LYS  64  15.373   1.873  -6.752
  539    HE3  LYS  64           HE1      LYS  64  16.726   1.903  -5.621
  540    HZ1  LYS  64           HZ1      LYS  64  17.311  -0.352  -6.395
  541    HZ2  LYS  64           HZ2      LYS  64  17.399   0.805  -7.626
  542    HZ3  LYS  64           HZ3      LYS  64  16.086  -0.258  -7.559
  543    H    ALA  65           HN       ALA  65  13.168  -1.779  -1.952
  544    HA   ALA  65           HA       ALA  65  14.526  -3.542  -3.693
  545    HB1  ALA  65           HB1      ALA  65  15.072  -3.499  -1.344
  546    HB2  ALA  65           HB2      ALA  65  14.494  -5.110  -1.770
  547    HB3  ALA  65           HB3      ALA  65  13.434  -3.989  -0.915
  548    H    ALA  66           HN       ALA  66  11.250  -3.429  -2.414
  549    HA   ALA  66           HA       ALA  66  10.363  -5.935  -3.374
  550    HB1  ALA  66           HB1      ALA  66   8.625  -3.499  -3.014
  551    HB2  ALA  66           HB2      ALA  66   9.203  -4.475  -1.664
  552    HB3  ALA  66           HB3      ALA  66   8.160  -5.197  -2.889
  553    H    ALA  67           HN       ALA  67  10.404  -2.698  -4.727
  554    HA   ALA  67           HA       ALA  67   9.046  -3.178  -7.113
  555    HB1  ALA  67           HB1      ALA  67  11.368  -1.291  -6.920
  556    HB2  ALA  67           HB2      ALA  67   9.852  -0.956  -6.085
  557    HB3  ALA  67           HB3      ALA  67   9.873  -1.116  -7.841
  558    H    GLN  68           HN       GLN  68  12.364  -3.558  -6.202
  559    HA   GLN  68           HA       GLN  68  13.360  -4.335  -8.736
  560    HB2  GLN  68           HB2      GLN  68  14.408  -4.922  -5.955
  561    HB3  GLN  68           HB1      GLN  68  15.308  -5.169  -7.448
  562    HG2  GLN  68           HG2      GLN  68  14.206  -2.498  -6.644
  563    HG3  GLN  68           HG1      GLN  68  15.804  -3.053  -6.151
  564   HE21  GLN  68          HE21      GLN  68  13.810  -2.016  -8.810
  565   HE22  GLN  68          HE22      GLN  68  15.093  -1.793  -9.949
  566    H    SER  69           HN       SER  69  11.969  -6.019  -6.011
  567    HA   SER  69           HA       SER  69  12.465  -8.661  -6.850
  568    HB2  SER  69           HB2      SER  69  11.807  -8.018  -4.537
  569    HB3  SER  69           HB1      SER  69  10.189  -7.646  -5.128
  570    HG   SER  69           HG       SER  69  10.491  -9.994  -6.000
  571    H    ILE  70           HN       ILE  70  10.044  -6.323  -7.757
  572    HA   ILE  70           HA       ILE  70   8.643  -8.379  -9.324
  573    HB   ILE  70           HB       ILE  70   7.236  -7.149  -7.706
  574   HG12  ILE  70          HG12      ILE  70   5.416  -6.533  -9.237
  575   HG13  ILE  70          HG11      ILE  70   6.549  -6.503 -10.584
  576   HG21  ILE  70          HG21      ILE  70   8.211  -5.039  -7.530
  577   HG22  ILE  70          HG22      ILE  70   6.663  -4.749  -8.327
  578   HG23  ILE  70          HG23      ILE  70   8.153  -4.767  -9.271
  579   HD11  ILE  70          HD11      ILE  70   5.142  -8.548 -10.442
  580   HD12  ILE  70          HD12      ILE  70   5.973  -8.952  -8.939
  581   HD13  ILE  70          HD13      ILE  70   6.878  -8.856 -10.450
  582    H    ASP  71           HN       ASP  71  11.057  -6.327  -9.671
  583    HA   ASP  71           HA       ASP  71  12.130  -5.343 -11.389
  584    HB2  ASP  71           HB2      ASP  71  10.259  -7.107 -12.960
  585    HB3  ASP  71           HB1      ASP  71  11.501  -6.124 -13.726
  586    H    ARG  72           HN       ARG  72  10.158  -3.804 -10.225
  587    HA   ARG  72           HA       ARG  72   9.273  -2.195 -12.532
  588    HB2  ARG  72           HB2      ARG  72   7.696  -2.734 -10.010
  589    HB3  ARG  72           HB1      ARG  72   7.249  -1.553 -11.233
  590    HG2  ARG  72           HG2      ARG  72   7.458  -4.531 -11.629
  591    HG3  ARG  72           HG1      ARG  72   5.970  -3.594 -11.490
  592    HD2  ARG  72           HD2      ARG  72   7.985  -3.609 -13.713
  593    HD3  ARG  72           HD1      ARG  72   6.254  -3.932 -13.790
  594    HE   ARG  72           HE       ARG  72   6.411  -1.349 -12.950
  595   HH11  ARG  72          HH21      ARG  72   7.614  -3.138 -15.694
  596   HH12  ARG  72          HH22      ARG  72   7.647  -1.764 -16.751
  597   HH21  ARG  72          HH11      ARG  72   6.450   0.491 -14.340
  598   HH22  ARG  72          HH12      ARG  72   6.988   0.308 -15.974
  599    H    THR  73           HN       THR  73   8.931   0.095 -12.033
  600    HA   THR  73           HA       THR  73  11.012   1.109 -10.321
  601    HB   THR  73           HB       THR  73  10.267   2.040 -12.634
  602    HG1  THR  73           HG1      THR  73  11.463   3.685 -12.062
  603   HG21  THR  73          HG21      THR  73   7.873   2.307 -11.997
  604   HG22  THR  73          HG22      THR  73   8.613   3.784 -12.613
  605   HG23  THR  73          HG23      THR  73   8.358   3.583 -10.879
  606    HA   PRO  74           HA       PRO  74   8.984   1.828  -6.461
  607    HB2  PRO  74           HB2      PRO  74   9.648   4.709  -6.965
  608    HB3  PRO  74           HB1      PRO  74   9.846   3.752  -5.491
  609    HG2  PRO  74           HG2      PRO  74  11.930   4.223  -7.068
  610    HG3  PRO  74           HG1      PRO  74  11.714   2.637  -6.305
  611    HD2  PRO  74           HD2      PRO  74  11.339   3.439  -9.138
  612    HD3  PRO  74           HD1      PRO  74  11.801   1.868  -8.458
  613    H    HIS  75           HN       HIS  75   8.226   4.465  -8.792
  614    HA   HIS  75           HA       HIS  75   5.759   5.190  -7.657
  615    HB2  HIS  75           HB2      HIS  75   6.928   6.577  -9.305
  616    HB3  HIS  75           HB1      HIS  75   6.681   5.352 -10.541
  617    HD1  HIS  75           HD1      HIS  75   5.201   8.376  -9.162
  618    HD2  HIS  75           HD2      HIS  75   3.854   5.056 -11.272
  619    HE1  HIS  75           HE1      HIS  75   2.966   9.037 -10.112
  620    HE2  HIS  75           HE2      HIS  75   2.324   7.114 -11.603
  621    H    TRP  76           HN       TRP  76   6.475   3.001 -10.342
  622    HA   TRP  76           HA       TRP  76   3.818   2.247 -10.827
  623    HB2  TRP  76           HB2      TRP  76   5.627   1.850 -12.469
  624    HB3  TRP  76           HB1      TRP  76   6.320   0.644 -11.387
  625    HD1  TRP  76           HD1      TRP  76   4.881  -1.648 -11.048
  626    HE1  TRP  76           HE1      TRP  76   3.212  -2.827 -12.613
  627    HE3  TRP  76           HE3      TRP  76   3.873   2.225 -14.228
  628    HZ2  TRP  76           HZ2      TRP  76   1.672  -2.198 -14.885
  629    HZ3  TRP  76           HZ3      TRP  76   2.289   1.850 -16.073
  630    HH2  TRP  76           HH2      TRP  76   1.213  -0.317 -16.393
  631    H    LEU  77           HN       LEU  77   6.358   0.945  -8.831
  632    HA   LEU  77           HA       LEU  77   4.975  -1.322  -7.972
  633    HB2  LEU  77           HB2      LEU  77   7.312  -1.279  -7.529
  634    HB3  LEU  77           HB1      LEU  77   7.151   0.186  -6.563
  635    HG   LEU  77           HG       LEU  77   5.539  -1.218  -5.106
  636   HD11  LEU  77          HD11      LEU  77   6.172  -3.625  -5.039
  637   HD12  LEU  77          HD12      LEU  77   6.990  -3.389  -6.584
  638   HD13  LEU  77          HD13      LEU  77   5.250  -3.132  -6.459
  639   HD21  LEU  77          HD21      LEU  77   7.270  -1.834  -3.665
  640   HD22  LEU  77          HD22      LEU  77   7.820  -0.391  -4.517
  641   HD23  LEU  77          HD23      LEU  77   8.425  -1.980  -4.988
  642    H    ILE  78           HN       ILE  78   5.052   1.941  -6.663
  643    HA   ILE  78           HA       ILE  78   3.737   1.402  -4.279
  644    HB   ILE  78           HB       ILE  78   3.528   3.847  -6.047
  645   HG12  ILE  78          HG12      ILE  78   4.909   3.453  -3.382
  646   HG13  ILE  78          HG11      ILE  78   5.718   3.277  -4.936
  647   HG21  ILE  78          HG21      ILE  78   2.524   4.986  -4.111
  648   HG22  ILE  78          HG22      ILE  78   2.438   3.441  -3.265
  649   HG23  ILE  78          HG23      ILE  78   1.496   3.696  -4.734
  650   HD11  ILE  78          HD11      ILE  78   5.351   5.585  -5.449
  651   HD12  ILE  78          HD12      ILE  78   6.093   5.460  -3.854
  652   HD13  ILE  78          HD13      ILE  78   4.367   5.792  -4.000
  653    H    LYS  79           HN       LYS  79   2.423   1.985  -7.524
  654    HA   LYS  79           HA       LYS  79  -0.306   1.686  -6.806
  655    HB2  LYS  79           HB2      LYS  79   0.883   0.789  -9.432
  656    HB3  LYS  79           HB1      LYS  79  -0.768   1.297  -9.125
  657    HG2  LYS  79           HG2      LYS  79   0.202   3.575  -8.571
  658    HG3  LYS  79           HG1      LYS  79   1.701   2.984  -9.286
  659    HD2  LYS  79           HD2      LYS  79  -0.963   3.437 -10.595
  660    HD3  LYS  79           HD1      LYS  79   0.615   4.084 -11.044
  661    HE2  LYS  79           HE2      LYS  79  -0.395   1.267 -11.384
  662    HE3  LYS  79           HE1      LYS  79   0.046   2.416 -12.644
  663    HZ1  LYS  79           HZ1      LYS  79   2.320   2.238 -12.047
  664    HZ2  LYS  79           HZ2      LYS  79   1.723   0.665 -12.207
  665    HZ3  LYS  79           HZ3      LYS  79   1.968   1.321 -10.668
  666    H    GLN  80           HN       GLN  80   2.076  -0.637  -8.035
  667    HA   GLN  80           HA       GLN  80   0.374  -2.886  -8.013
  668    HB2  GLN  80           HB2      GLN  80   3.383  -2.706  -7.968
  669    HB3  GLN  80           HB1      GLN  80   2.491  -4.208  -8.165
  670    HG2  GLN  80           HG2      GLN  80   2.507  -1.843 -10.016
  671    HG3  GLN  80           HG1      GLN  80   3.206  -3.435 -10.307
  672   HE21  GLN  80          HE21      GLN  80   1.767  -5.219 -10.607
  673   HE22  GLN  80          HE22      GLN  80   0.148  -4.959 -11.149
  674    H    ALA  81           HN       ALA  81   2.540  -1.575  -5.576
  675    HA   ALA  81           HA       ALA  81   2.657  -3.763  -3.865
  676    HB1  ALA  81           HB1      ALA  81   4.122  -1.880  -3.554
  677    HB2  ALA  81           HB2      ALA  81   3.155  -2.094  -2.094
  678    HB3  ALA  81           HB3      ALA  81   2.752  -0.815  -3.239
  679    H    ILE  82           HN       ILE  82   0.388  -1.028  -3.932
  680    HA   ILE  82           HA       ILE  82  -1.156  -2.232  -1.834
  681    HB   ILE  82           HB       ILE  82  -0.930   0.254  -2.208
  682   HG12  ILE  82          HG12      ILE  82  -3.332   0.675  -1.576
  683   HG13  ILE  82          HG11      ILE  82  -3.644  -1.027  -1.894
  684   HG21  ILE  82          HG21      ILE  82  -3.107  -0.129  -4.244
  685   HG22  ILE  82          HG22      ILE  82  -1.415   0.143  -4.664
  686   HG23  ILE  82          HG23      ILE  82  -2.313   1.374  -3.773
  687   HD11  ILE  82          HD11      ILE  82  -2.364  -1.720  -0.090
  688   HD12  ILE  82          HD12      ILE  82  -3.197  -0.287   0.514
  689   HD13  ILE  82          HD13      ILE  82  -1.508  -0.183   0.018
  690    H    PHE  83           HN       PHE  83  -1.380  -2.109  -5.356
  691    HA   PHE  83           HA       PHE  83  -4.008  -3.242  -5.488
  692    HB2  PHE  83           HB2      PHE  83  -1.802  -2.766  -7.470
  693    HB3  PHE  83           HB1      PHE  83  -3.124  -3.841  -7.902
  694    HD1  PHE  83           HD2      PHE  83  -2.781  -0.493  -6.276
  695    HD2  PHE  83           HD1      PHE  83  -4.725  -2.884  -9.204
  696    HE1  PHE  83           HE2      PHE  83  -4.111   1.447  -6.971
  697    HE2  PHE  83           HE1      PHE  83  -6.057  -0.942  -9.909
  698    HZ   PHE  83           HZ       PHE  83  -5.749   1.225  -8.792
  699    H    ASN  84           HN       ASN  84  -0.727  -4.535  -5.720
  700    HA   ASN  84           HA       ASN  84  -1.510  -7.189  -6.244
  701    HB2  ASN  84           HB2      ASN  84   0.809  -6.281  -6.619
  702    HB3  ASN  84           HB1      ASN  84   1.036  -6.309  -4.876
  703   HD21  ASN  84          HD21      ASN  84   2.882  -7.649  -5.766
  704   HD22  ASN  84          HD22      ASN  84   2.608  -9.352  -5.903
  705    H    TYR  85           HN       TYR  85  -1.101  -5.247  -3.377
  706    HA   TYR  85           HA       TYR  85  -1.238  -7.309  -1.487
  707    HB2  TYR  85           HB2      TYR  85  -0.714  -5.028  -0.785
  708    HB3  TYR  85           HB1      TYR  85  -2.307  -4.479  -1.299
  709    HD1  TYR  85           HD2      TYR  85  -0.833  -7.103   0.912
  710    HD2  TYR  85           HD1      TYR  85  -3.892  -4.203   0.353
  711    HE1  TYR  85           HE2      TYR  85  -1.732  -7.634   3.134
  712    HE2  TYR  85           HE1      TYR  85  -4.805  -4.730   2.576
  713    HH   TYR  85           HH       TYR  85  -4.502  -5.871   4.470
  714    H    LEU  86           HN       LEU  86  -3.646  -5.458  -3.215
  715    HA   LEU  86           HA       LEU  86  -5.900  -6.667  -2.030
  716    HB2  LEU  86           HB2      LEU  86  -5.550  -5.154  -4.601
  717    HB3  LEU  86           HB1      LEU  86  -7.104  -5.740  -4.040
  718    HG   LEU  86           HG       LEU  86  -5.355  -3.741  -2.589
  719   HD11  LEU  86          HD11      LEU  86  -6.982  -2.108  -3.202
  720   HD12  LEU  86          HD12      LEU  86  -8.012  -3.333  -3.941
  721   HD13  LEU  86          HD13      LEU  86  -6.458  -2.931  -4.671
  722   HD21  LEU  86          HD21      LEU  86  -6.513  -4.900  -0.920
  723   HD22  LEU  86          HD22      LEU  86  -7.971  -5.038  -1.901
  724   HD23  LEU  86          HD23      LEU  86  -7.502  -3.475  -1.235
  725    H    GLU  87           HN       GLU  87  -4.055  -7.284  -4.975
  726    HA   GLU  87           HA       GLU  87  -5.654  -9.318  -6.058
  727    HB2  GLU  87           HB2      GLU  87  -2.696  -8.753  -6.321
  728    HB3  GLU  87           HB1      GLU  87  -3.510 -10.014  -7.234
  729    HG2  GLU  87           HG2      GLU  87  -4.971  -8.333  -8.253
  730    HG3  GLU  87           HG1      GLU  87  -4.150  -7.071  -7.337
  731    H    LYS  88           HN       LYS  88  -3.006  -9.440  -3.733
  732    HA   LYS  88           HA       LYS  88  -2.805 -12.263  -3.621
  733    HB2  LYS  88           HB2      LYS  88  -2.000 -10.110  -1.661
  734    HB3  LYS  88           HB1      LYS  88  -1.666 -11.817  -1.401
  735    HG2  LYS  88           HG2      LYS  88  -0.360 -11.881  -3.464
  736    HG3  LYS  88           HG1      LYS  88  -0.699 -10.169  -3.725
  737    HD2  LYS  88           HD2      LYS  88   0.453  -9.622  -1.639
  738    HD3  LYS  88           HD1      LYS  88   0.792 -11.334  -1.374
  739    HE2  LYS  88           HE2      LYS  88   2.135 -11.417  -3.380
  740    HE3  LYS  88           HE1      LYS  88   1.720  -9.748  -3.765
  741    HZ1  LYS  88           HZ1      LYS  88   3.741  -9.470  -2.773
  742    HZ2  LYS  88           HZ2      LYS  88   3.555 -10.787  -1.729
  743    HZ3  LYS  88           HZ3      LYS  88   2.749  -9.335  -1.407
  744    H    LEU  89           HN       LEU  89  -4.717  -9.943  -1.760
  745    HA   LEU  89           HA       LEU  89  -5.769 -12.074  -0.104
  746    HB2  LEU  89           HB2      LEU  89  -7.080 -10.326   1.018
  747    HB3  LEU  89           HB1      LEU  89  -5.357 -10.017   1.028
  748    HG   LEU  89           HG       LEU  89  -5.996  -8.551  -1.109
  749   HD11  LEU  89          HD11      LEU  89  -8.102  -7.511  -0.957
  750   HD12  LEU  89          HD12      LEU  89  -8.447  -8.260   0.602
  751   HD13  LEU  89          HD13      LEU  89  -8.406  -9.245  -0.860
  752   HD21  LEU  89          HD21      LEU  89  -6.114  -6.616   0.397
  753   HD22  LEU  89          HD22      LEU  89  -4.833  -7.738   0.850
  754   HD23  LEU  89          HD23      LEU  89  -6.341  -7.707   1.764
  755    H    GLU  90           HN       GLU  90  -6.440 -10.893  -3.125
  756    HA   GLU  90           HA       GLU  90  -8.933 -12.317  -3.265
  757    HB2  GLU  90           HB2      GLU  90  -9.643 -10.082  -2.450
  758    HB3  GLU  90           HB1      GLU  90  -8.868  -9.348  -3.847
  759    HG2  GLU  90           HG2      GLU  90 -10.410 -10.564  -5.325
  760    HG3  GLU  90           HG1      GLU  90 -11.212 -11.242  -3.905
  Start of MODEL   20
    1    H1   MET   1           HT1      MET   1   5.922  -0.938  14.129
    2    H2   MET   1           HT2      MET   1   5.647   0.405  15.116
    3    H3   MET   1           HT3      MET   1   6.917   0.425  14.000
    4    HA   MET   1           HA       MET   1   5.344   0.327  12.167
    5    HB2  MET   1           HB2      MET   1   3.562  -0.848  13.519
    6    HB3  MET   1           HB1      MET   1   3.229   0.685  14.310
    7    HG2  MET   1           HG2      MET   1   2.762   1.627  12.011
    8    HG3  MET   1           HG1      MET   1   2.820  -0.031  11.419
    9    HE1  MET   1           HE1      MET   1   1.286  -1.611  13.985
   10    HE2  MET   1           HE2      MET   1   1.305  -1.919  12.249
   11    HE3  MET   1           HE3      MET   1  -0.231  -1.710  13.090
   12    H    ALA   2           HN       ALA   2   6.661   2.224  11.909
   13    HA   ALA   2           HA       ALA   2   5.491   4.649  13.114
   14    HB1  ALA   2           HB1      ALA   2   8.337   4.107  12.267
   15    HB2  ALA   2           HB2      ALA   2   7.737   4.328  13.911
   16    HB3  ALA   2           HB3      ALA   2   7.731   5.682  12.781
   17    H    THR   3           HN       THR   3   4.187   3.773  10.978
   18    HA   THR   3           HA       THR   3   5.213   4.558   8.461
   19    HB   THR   3           HB       THR   3   2.842   4.351   7.704
   20    HG1  THR   3           HG1      THR   3   2.186   4.945  10.051
   21   HG21  THR   3          HG21      THR   3   3.794   2.063   9.434
   22   HG22  THR   3          HG22      THR   3   4.341   2.389   7.789
   23   HG23  THR   3          HG23      THR   3   2.658   1.957   8.089
   24    H    THR   4           HN       THR   4   5.234   6.457   7.461
   25    HA   THR   4           HA       THR   4   3.944   8.775   8.741
   26    HB   THR   4           HB       THR   4   6.234   8.755   6.763
   27    HG1  THR   4           HG1      THR   4   6.753   7.724   8.796
   28   HG21  THR   4          HG21      THR   4   5.062  10.878   6.832
   29   HG22  THR   4          HG22      THR   4   6.627  11.041   7.629
   30   HG23  THR   4          HG23      THR   4   5.156  10.903   8.593
   31    H    THR   5           HN       THR   5   2.854  10.334   7.369
   32    HA   THR   5           HA       THR   5   1.346   9.156   5.279
   33    HB   THR   5           HB       THR   5   1.623  12.126   5.700
   34    HG1  THR   5           HG1      THR   5   0.805  11.830   7.623
   35   HG21  THR   5          HG21      THR   5   0.332  11.450   3.755
   36   HG22  THR   5          HG22      THR   5  -0.745  12.107   4.988
   37   HG23  THR   5          HG23      THR   5  -0.639  10.362   4.748
   38    H    LEU   6           HN       LEU   6   2.311   8.542   3.463
   39    HA   LEU   6           HA       LEU   6   3.940  10.515   2.004
   40    HB2  LEU   6           HB2      LEU   6   4.257   7.509   1.899
   41    HB3  LEU   6           HB1      LEU   6   5.249   8.692   1.071
   42    HG   LEU   6           HG       LEU   6   5.135   8.216   4.053
   43   HD11  LEU   6          HD11      LEU   6   6.398   6.635   2.436
   44   HD12  LEU   6          HD12      LEU   6   7.207   7.222   3.888
   45   HD13  LEU   6          HD13      LEU   6   7.556   7.961   2.325
   46   HD21  LEU   6          HD21      LEU   6   5.454  10.561   3.717
   47   HD22  LEU   6          HD22      LEU   6   6.652  10.270   2.456
   48   HD23  LEU   6          HD23      LEU   6   7.015   9.851   4.131
   49    H    GLY   7           HN       GLY   7   3.635  10.537  -0.280
   50    HA2  GLY   7           HA2      GLY   7   0.951  10.032  -1.082
   51    HA3  GLY   7           HA1      GLY   7   2.248  10.605  -2.115
   52    H    VAL   8           HN       VAL   8   0.053   8.291  -1.890
   53    HA   VAL   8           HA       VAL   8   1.709   6.316  -3.318
   54    HB   VAL   8           HB       VAL   8  -0.351   5.801  -1.166
   55   HG11  VAL   8          HG11      VAL   8  -0.057   3.378  -1.635
   56   HG12  VAL   8          HG12      VAL   8   0.789   3.810  -3.121
   57   HG13  VAL   8          HG13      VAL   8  -0.906   4.248  -2.912
   58   HG21  VAL   8          HG21      VAL   8   1.456   4.484  -0.158
   59   HG22  VAL   8          HG22      VAL   8   1.915   6.171  -0.393
   60   HG23  VAL   8          HG23      VAL   8   2.514   4.933  -1.496
   61    H    LYS   9           HN       LYS   9   0.378   4.948  -4.822
   62    HA   LYS   9           HA       LYS   9  -1.730   6.603  -5.999
   63    HB2  LYS   9           HB2      LYS   9  -0.169   4.284  -7.147
   64    HB3  LYS   9           HB1      LYS   9  -1.391   5.205  -8.012
   65    HG2  LYS   9           HG2      LYS   9   1.051   6.495  -6.839
   66    HG3  LYS   9           HG1      LYS   9   1.028   5.802  -8.461
   67    HD2  LYS   9           HD2      LYS   9  -0.810   7.289  -9.076
   68    HD3  LYS   9           HD1      LYS   9  -0.808   7.972  -7.449
   69    HE2  LYS   9           HE2      LYS   9   1.681   7.996  -9.112
   70    HE3  LYS   9           HE1      LYS   9   0.433   9.218  -9.355
   71    HZ1  LYS   9           HZ1      LYS   9   0.634   9.881  -7.072
   72    HZ2  LYS   9           HZ2      LYS   9   2.163   9.934  -7.792
   73    HZ3  LYS   9           HZ3      LYS   9   1.761   8.656  -6.756
   74    H    LEU  10           HN       LEU  10  -3.740   6.109  -5.589
   75    HA   LEU  10           HA       LEU  10  -4.565   3.304  -5.344
   76    HB2  LEU  10           HB2      LEU  10  -4.983   5.533  -3.404
   77    HB3  LEU  10           HB1      LEU  10  -6.259   4.350  -3.603
   78    HG   LEU  10           HG       LEU  10  -3.442   3.529  -2.942
   79   HD11  LEU  10          HD11      LEU  10  -5.663   4.249  -1.032
   80   HD12  LEU  10          HD12      LEU  10  -4.131   5.102  -1.226
   81   HD13  LEU  10          HD13      LEU  10  -4.151   3.457  -0.589
   82   HD21  LEU  10          HD21      LEU  10  -4.715   1.694  -3.654
   83   HD22  LEU  10          HD22      LEU  10  -6.161   2.264  -2.822
   84   HD23  LEU  10          HD23      LEU  10  -4.802   1.634  -1.893
   85    H    ASP  11           HN       ASP  11  -6.412   2.854  -6.375
   86    HA   ASP  11           HA       ASP  11  -7.609   4.890  -8.071
   87    HB2  ASP  11           HB2      ASP  11  -7.040   2.423  -8.701
   88    HB3  ASP  11           HB1      ASP  11  -8.500   2.018  -7.814
   89    H    ASP  12           HN       ASP  12 -10.065   4.951  -8.138
   90    HA   ASP  12           HA       ASP  12 -11.114   5.668  -5.640
   91    HB2  ASP  12           HB2      ASP  12 -12.181   5.346  -8.360
   92    HB3  ASP  12           HB1      ASP  12 -13.367   5.022  -7.104
   93    HA   PRO  13           HA       PRO  13 -13.337   1.345  -5.547
   94    HB2  PRO  13           HB2      PRO  13 -12.245  -0.598  -7.136
   95    HB3  PRO  13           HB1      PRO  13 -13.642   0.384  -7.594
   96    HG2  PRO  13           HG2      PRO  13 -10.763   0.721  -8.337
   97    HG3  PRO  13           HG1      PRO  13 -12.209   0.878  -9.354
   98    HD2  PRO  13           HD2      PRO  13 -10.938   3.030  -8.384
   99    HD3  PRO  13           HD1      PRO  13 -12.706   2.988  -8.541
  100    H    THR  14           HN       THR  14  -9.821   1.568  -6.053
  101    HA   THR  14           HA       THR  14  -9.283  -0.725  -4.442
  102    HB   THR  14           HB       THR  14  -6.967  -0.071  -4.375
  103    HG1  THR  14           HG1      THR  14  -7.739   2.326  -4.286
  104   HG21  THR  14          HG21      THR  14  -8.454  -0.011  -6.913
  105   HG22  THR  14          HG22      THR  14  -7.104  -1.028  -6.411
  106   HG23  THR  14          HG23      THR  14  -6.807   0.613  -6.984
  107    H    ARG  15           HN       ARG  15  -9.501   2.770  -3.777
  108    HA   ARG  15           HA       ARG  15  -8.658   2.549  -1.076
  109    HB2  ARG  15           HB2      ARG  15  -8.692   4.717  -2.194
  110    HB3  ARG  15           HB1      ARG  15 -10.442   4.621  -2.373
  111    HG2  ARG  15           HG2      ARG  15 -10.807   4.856  -0.056
  112    HG3  ARG  15           HG1      ARG  15  -9.111   4.560   0.319
  113    HD2  ARG  15           HD2      ARG  15  -9.843   6.896  -1.386
  114    HD3  ARG  15           HD1      ARG  15 -10.088   6.990   0.358
  115    HE   ARG  15           HE       ARG  15  -7.558   6.906  -1.056
  116   HH11  ARG  15          HH21      ARG  15  -9.218   6.674   2.012
  117   HH12  ARG  15          HH22      ARG  15  -7.792   6.942   2.955
  118   HH21  ARG  15          HH11      ARG  15  -5.659   7.252   0.179
  119   HH22  ARG  15          HH12      ARG  15  -5.752   7.274   1.907
  120    H    GLU  16           HN       GLU  16 -11.800   2.401  -2.661
  121    HA   GLU  16           HA       GLU  16 -13.342   2.095  -0.314
  122    HB2  GLU  16           HB2      GLU  16 -13.850   1.213  -3.165
  123    HB3  GLU  16           HB1      GLU  16 -15.052   1.129  -1.885
  124    HG2  GLU  16           HG2      GLU  16 -14.938   3.556  -1.616
  125    HG3  GLU  16           HG1      GLU  16 -13.732   3.638  -2.900
  126    H    ARG  17           HN       ARG  17 -11.739  -0.171  -2.493
  127    HA   ARG  17           HA       ARG  17 -12.639  -2.540  -1.237
  128    HB2  ARG  17           HB2      ARG  17 -11.644  -2.451  -3.537
  129    HB3  ARG  17           HB1      ARG  17 -10.070  -2.188  -2.795
  130    HG2  ARG  17           HG2      ARG  17 -10.244  -4.335  -1.649
  131    HG3  ARG  17           HG1      ARG  17 -11.824  -4.600  -2.383
  132    HD2  ARG  17           HD2      ARG  17 -10.794  -4.571  -4.604
  133    HD3  ARG  17           HD1      ARG  17  -9.214  -4.307  -3.865
  134    HE   ARG  17           HE       ARG  17 -10.389  -6.603  -2.751
  135   HH11  ARG  17          HH21      ARG  17  -8.989  -5.543  -5.789
  136   HH12  ARG  17          HH22      ARG  17  -8.440  -7.131  -6.229
  137   HH21  ARG  17          HH11      ARG  17  -9.654  -8.679  -3.333
  138   HH22  ARG  17          HH12      ARG  17  -8.809  -8.902  -4.829
  139    H    LEU  18           HN       LEU  18  -9.995  -0.335  -0.637
  140    HA   LEU  18           HA       LEU  18  -8.511  -1.925   1.126
  141    HB2  LEU  18           HB2      LEU  18  -8.686   0.917   0.475
  142    HB3  LEU  18           HB1      LEU  18  -8.321   0.641   2.166
  143    HG   LEU  18           HG       LEU  18  -6.407  -0.839   1.391
  144   HD11  LEU  18          HD11      LEU  18  -5.593  -0.633  -0.829
  145   HD12  LEU  18          HD12      LEU  18  -6.839   0.545  -1.240
  146   HD13  LEU  18          HD13      LEU  18  -7.282  -1.131  -0.922
  147   HD21  LEU  18          HD21      LEU  18  -4.997   1.158   0.759
  148   HD22  LEU  18          HD22      LEU  18  -5.895   1.288   2.270
  149   HD23  LEU  18          HD23      LEU  18  -6.480   2.111   0.824
  150    H    LYS  19           HN       LYS  19 -11.357   0.150   1.601
  151    HA   LYS  19           HA       LYS  19 -11.534  -0.239   4.379
  152    HB2  LYS  19           HB2      LYS  19 -12.889   1.484   3.318
  153    HB3  LYS  19           HB1      LYS  19 -13.787   0.259   2.428
  154    HG2  LYS  19           HG2      LYS  19 -14.646  -0.646   4.530
  155    HG3  LYS  19           HG1      LYS  19 -13.741   0.569   5.428
  156    HD2  LYS  19           HD2      LYS  19 -15.042   2.336   4.353
  157    HD3  LYS  19           HD1      LYS  19 -15.935   1.124   3.431
  158    HE2  LYS  19           HE2      LYS  19 -17.293   1.764   5.289
  159    HE3  LYS  19           HE1      LYS  19 -16.688   0.140   5.603
  160    HZ1  LYS  19           HZ1      LYS  19 -15.788   2.684   6.830
  161    HZ2  LYS  19           HZ2      LYS  19 -14.900   1.251   6.958
  162    HZ3  LYS  19           HZ3      LYS  19 -16.462   1.335   7.600
  163    H    ALA  20           HN       ALA  20 -12.738  -2.089   1.679
  164    HA   ALA  20           HA       ALA  20 -14.152  -4.046   3.113
  165    HB1  ALA  20           HB1      ALA  20 -14.293  -3.756   0.653
  166    HB2  ALA  20           HB2      ALA  20 -13.988  -5.425   1.132
  167    HB3  ALA  20           HB3      ALA  20 -12.671  -4.432   0.509
  168    H    ALA  21           HN       ALA  21 -10.756  -3.783   2.155
  169    HA   ALA  21           HA       ALA  21  -9.895  -6.263   3.212
  170    HB1  ALA  21           HB1      ALA  21  -8.514  -4.993   1.645
  171    HB2  ALA  21           HB2      ALA  21  -7.634  -5.290   3.145
  172    HB3  ALA  21           HB3      ALA  21  -8.334  -3.701   2.832
  173    H    ALA  22           HN       ALA  22 -10.236  -3.029   4.500
  174    HA   ALA  22           HA       ALA  22  -9.165  -3.411   7.051
  175    HB1  ALA  22           HB1      ALA  22 -10.381  -1.442   7.698
  176    HB2  ALA  22           HB2      ALA  22 -11.497  -1.635   6.347
  177    HB3  ALA  22           HB3      ALA  22  -9.813  -1.210   6.043
  178    H    GLN  23           HN       GLN  23 -12.370  -3.834   5.773
  179    HA   GLN  23           HA       GLN  23 -13.634  -4.611   8.168
  180    HB2  GLN  23           HB2      GLN  23 -14.342  -5.150   5.281
  181    HB3  GLN  23           HB1      GLN  23 -15.395  -5.530   6.639
  182    HG2  GLN  23           HG2      GLN  23 -14.366  -2.774   6.019
  183    HG3  GLN  23           HG1      GLN  23 -15.926  -3.389   5.482
  184   HE21  GLN  23          HE21      GLN  23 -14.064  -2.203   8.140
  185   HE22  GLN  23          HE22      GLN  23 -15.356  -2.106   9.284
  186    H    SER  24           HN       SER  24 -12.040  -6.458   5.594
  187    HA   SER  24           HA       SER  24 -12.689  -8.994   6.693
  188    HB2  SER  24           HB2      SER  24 -10.954  -9.875   5.154
  189    HB3  SER  24           HB1      SER  24 -12.093  -8.803   4.343
  190    HG   SER  24           HG       SER  24  -9.935  -7.462   5.334
  191    H    ILE  25           HN       ILE  25 -10.359  -6.618   7.523
  192    HA   ILE  25           HA       ILE  25  -8.878  -8.580   9.131
  193    HB   ILE  25           HB       ILE  25  -7.846  -6.874   7.316
  194   HG12  ILE  25          HG12      ILE  25  -6.691  -8.739   8.462
  195   HG13  ILE  25          HG11      ILE  25  -5.673  -7.320   8.264
  196   HG21  ILE  25          HG21      ILE  25  -7.448  -5.413   9.906
  197   HG22  ILE  25          HG22      ILE  25  -8.525  -4.896   8.609
  198   HG23  ILE  25          HG23      ILE  25  -6.786  -4.990   8.328
  199   HD11  ILE  25          HD11      ILE  25  -5.279  -8.250  10.419
  200   HD12  ILE  25          HD12      ILE  25  -7.004  -8.271  10.786
  201   HD13  ILE  25          HD13      ILE  25  -6.155  -6.733  10.632
  202    H    ASP  26           HN       ASP  26 -11.370  -6.640   9.408
  203    HA   ASP  26           HA       ASP  26 -12.523  -5.674  11.083
  204    HB2  ASP  26           HB2      ASP  26 -10.591  -7.312  12.720
  205    HB3  ASP  26           HB1      ASP  26 -11.909  -6.393  13.438
  206    H    ARG  27           HN       ARG  27 -10.724  -3.993   9.932
  207    HA   ARG  27           HA       ARG  27  -9.934  -2.300  12.218
  208    HB2  ARG  27           HB2      ARG  27  -8.339  -2.836   9.714
  209    HB3  ARG  27           HB1      ARG  27  -8.020  -1.479  10.781
  210    HG2  ARG  27           HG2      ARG  27  -7.864  -4.388  11.529
  211    HG3  ARG  27           HG1      ARG  27  -6.499  -3.324  11.196
  212    HD2  ARG  27           HD2      ARG  27  -7.525  -1.863  13.086
  213    HD3  ARG  27           HD1      ARG  27  -8.363  -3.348  13.534
  214    HE   ARG  27           HE       ARG  27  -5.675  -2.719  14.076
  215   HH11  ARG  27          HH21      ARG  27  -7.668  -5.423  13.067
  216   HH12  ARG  27          HH22      ARG  27  -6.573  -6.620  13.678
  217   HH21  ARG  27          HH11      ARG  27  -4.232  -4.299  14.896
  218   HH22  ARG  27          HH12      ARG  27  -4.617  -5.979  14.730
  219    H    THR  28           HN       THR  28  -9.702  -0.004  11.640
  220    HA   THR  28           HA       THR  28 -11.866   0.868   9.953
  221    HB   THR  28           HB       THR  28 -11.557   2.081  12.022
  222    HG1  THR  28           HG1      THR  28 -10.788   4.235  10.864
  223   HG21  THR  28          HG21      THR  28  -9.203   1.695  12.428
  224   HG22  THR  28          HG22      THR  28  -9.527   3.430  12.441
  225   HG23  THR  28          HG23      THR  28  -8.775   2.684  11.032
  226    HA   PRO  29           HA       PRO  29 -10.010   1.511   5.991
  227    HB2  PRO  29           HB2      PRO  29 -10.723   4.372   6.515
  228    HB3  PRO  29           HB1      PRO  29 -10.959   3.409   5.052
  229    HG2  PRO  29           HG2      PRO  29 -12.954   3.868   6.800
  230    HG3  PRO  29           HG1      PRO  29 -12.826   2.361   5.881
  231    HD2  PRO  29           HD2      PRO  29 -12.446   2.824   8.749
  232    HD3  PRO  29           HD1      PRO  29 -12.699   1.300   7.881
  233    H    HIS  30           HN       HIS  30  -9.333   4.316   8.114
  234    HA   HIS  30           HA       HIS  30  -6.903   5.004   6.903
  235    HB2  HIS  30           HB2      HIS  30  -8.126   6.548   8.349
  236    HB3  HIS  30           HB1      HIS  30  -7.816   5.514   9.740
  237    HD1  HIS  30           HD1      HIS  30  -5.721   5.962  11.019
  238    HD2  HIS  30           HD2      HIS  30  -5.707   7.761   7.277
  239    HE1  HIS  30           HE1      HIS  30  -3.645   7.374  10.962
  240    HE2  HIS  30           HE2      HIS  30  -3.879   8.703   8.842
  241    H    TRP  31           HN       TRP  31  -7.510   3.039   9.804
  242    HA   TRP  31           HA       TRP  31  -4.801   2.578  10.400
  243    HB2  TRP  31           HB2      TRP  31  -6.665   2.159  12.018
  244    HB3  TRP  31           HB1      TRP  31  -7.120   0.752  11.058
  245    HD1  TRP  31           HD1      TRP  31  -5.501  -1.376  11.153
  246    HE1  TRP  31           HE1      TRP  31  -3.673  -2.082  12.815
  247    HE3  TRP  31           HE3      TRP  31  -4.878   3.062  13.609
  248    HZ2  TRP  31           HZ2      TRP  31  -2.170  -0.921  14.898
  249    HZ3  TRP  31           HZ3      TRP  31  -3.223   3.179  15.427
  250    HH2  TRP  31           HH2      TRP  31  -1.898   1.227  16.058
  251    H    LEU  32           HN       LEU  32  -7.158   0.936   8.462
  252    HA   LEU  32           HA       LEU  32  -5.637  -1.306   7.767
  253    HB2  LEU  32           HB2      LEU  32  -8.046  -1.197   7.387
  254    HB3  LEU  32           HB1      LEU  32  -7.809   0.068   6.201
  255    HG   LEU  32           HG       LEU  32  -8.272  -2.317   5.361
  256   HD11  LEU  32          HD11      LEU  32  -5.843  -0.922   4.263
  257   HD12  LEU  32          HD12      LEU  32  -7.511  -0.447   3.944
  258   HD13  LEU  32          HD13      LEU  32  -6.924  -2.019   3.403
  259   HD21  LEU  32          HD21      LEU  32  -6.640  -3.410   6.864
  260   HD22  LEU  32          HD22      LEU  32  -5.338  -2.648   5.950
  261   HD23  LEU  32          HD23      LEU  32  -6.408  -3.809   5.163
  262    H    ILE  33           HN       ILE  33  -5.883   1.885   6.331
  263    HA   ILE  33           HA       ILE  33  -4.485   1.429   3.979
  264    HB   ILE  33           HB       ILE  33  -4.511   3.881   5.743
  265   HG12  ILE  33          HG12      ILE  33  -5.835   3.379   3.073
  266   HG13  ILE  33          HG11      ILE  33  -6.633   3.133   4.624
  267   HG21  ILE  33          HG21      ILE  33  -3.663   5.086   3.707
  268   HG22  ILE  33          HG22      ILE  33  -3.256   3.507   3.035
  269   HG23  ILE  33          HG23      ILE  33  -2.486   4.056   4.523
  270   HD11  ILE  33          HD11      ILE  33  -5.793   5.674   3.311
  271   HD12  ILE  33          HD12      ILE  33  -5.982   5.599   5.062
  272   HD13  ILE  33          HD13      ILE  33  -7.350   5.231   4.010
  273    H    LYS  34           HN       LYS  34  -3.261   2.262   7.197
  274    HA   LYS  34           HA       LYS  34  -0.518   2.229   6.534
  275    HB2  LYS  34           HB2      LYS  34  -1.542   1.271   9.193
  276    HB3  LYS  34           HB1      LYS  34  -0.073   2.167   8.842
  277    HG2  LYS  34           HG2      LYS  34  -1.759   4.025   8.082
  278    HG3  LYS  34           HG1      LYS  34  -2.866   3.142   9.133
  279    HD2  LYS  34           HD2      LYS  34  -0.261   4.458   9.864
  280    HD3  LYS  34           HD1      LYS  34  -1.875   4.826  10.474
  281    HE2  LYS  34           HE2      LYS  34  -0.176   2.409  11.043
  282    HE3  LYS  34           HE1      LYS  34  -0.752   3.625  12.182
  283    HZ1  LYS  34           HZ1      LYS  34  -2.486   1.725  10.702
  284    HZ2  LYS  34           HZ2      LYS  34  -2.989   2.841  11.869
  285    HZ3  LYS  34           HZ3      LYS  34  -1.997   1.547  12.312
  286    H    GLN  35           HN       GLN  35  -2.737  -0.295   7.606
  287    HA   GLN  35           HA       GLN  35  -0.818  -2.374   7.749
  288    HB2  GLN  35           HB2      GLN  35  -3.816  -2.355   7.586
  289    HB3  GLN  35           HB1      GLN  35  -2.902  -3.856   7.609
  290    HG2  GLN  35           HG2      GLN  35  -1.943  -3.241   9.761
  291    HG3  GLN  35           HG1      GLN  35  -2.854  -1.732   9.742
  292   HE21  GLN  35          HE21      GLN  35  -2.919  -3.962  11.637
  293   HE22  GLN  35          HE22      GLN  35  -4.562  -4.502  11.670
  294    H    ALA  36           HN       ALA  36  -3.225  -1.574   5.260
  295    HA   ALA  36           HA       ALA  36  -2.859  -3.637   3.528
  296    HB1  ALA  36           HB1      ALA  36  -4.569  -2.114   3.041
  297    HB2  ALA  36           HB2      ALA  36  -3.421  -1.953   1.711
  298    HB3  ALA  36           HB3      ALA  36  -3.455  -0.748   2.999
  299    H    ILE  37           HN       ILE  37  -0.831  -0.750   3.829
  300    HA   ILE  37           HA       ILE  37   0.841  -1.765   1.696
  301    HB   ILE  37           HB       ILE  37   0.317   0.656   1.900
  302   HG12  ILE  37          HG12      ILE  37   2.690   1.426   1.510
  303   HG13  ILE  37          HG11      ILE  37   3.202  -0.209   1.917
  304   HG21  ILE  37          HG21      ILE  37   1.441   2.042   3.508
  305   HG22  ILE  37          HG22      ILE  37   2.242   0.637   4.211
  306   HG23  ILE  37          HG23      ILE  37   0.494   0.816   4.352
  307   HD11  ILE  37          HD11      ILE  37   2.776   0.563  -0.571
  308   HD12  ILE  37          HD12      ILE  37   1.123   0.098  -0.166
  309   HD13  ILE  37          HD13      ILE  37   2.430  -1.078  -0.027
  310    H    PHE  38           HN       PHE  38   1.268  -1.209   5.220
  311    HA   PHE  38           HA       PHE  38   3.951  -2.257   5.105
  312    HB2  PHE  38           HB2      PHE  38   4.167  -1.306   7.130
  313    HB3  PHE  38           HB1      PHE  38   2.523  -0.713   6.953
  314    HD1  PHE  38           HD1      PHE  38   4.534  -3.529   8.289
  315    HD2  PHE  38           HD2      PHE  38   0.831  -1.437   8.388
  316    HE1  PHE  38           HE1      PHE  38   3.853  -4.838  10.256
  317    HE2  PHE  38           HE2      PHE  38   0.142  -2.743  10.354
  318    HZ   PHE  38           HZ       PHE  38   1.653  -4.448  11.290
  319    H    ASN  39           HN       ASN  39   0.787  -3.495   6.019
  320    HA   ASN  39           HA       ASN  39   1.732  -6.007   6.938
  321    HB2  ASN  39           HB2      ASN  39  -0.622  -4.949   7.303
  322    HB3  ASN  39           HB1      ASN  39  -0.989  -5.611   5.718
  323   HD21  ASN  39          HD21      ASN  39  -2.141  -6.215   8.311
  324   HD22  ASN  39          HD22      ASN  39  -1.901  -7.902   8.585
  325    H    TYR  40           HN       TYR  40   1.038  -4.553   3.838
  326    HA   TYR  40           HA       TYR  40   0.918  -6.894   2.285
  327    HB2  TYR  40           HB2      TYR  40   0.408  -4.947   1.085
  328    HB3  TYR  40           HB1      TYR  40   1.766  -4.060   1.762
  329    HD1  TYR  40           HD1      TYR  40   1.001  -6.883  -0.565
  330    HD2  TYR  40           HD2      TYR  40   3.685  -3.764   0.516
  331    HE1  TYR  40           HE1      TYR  40   2.316  -7.311  -2.599
  332    HE2  TYR  40           HE2      TYR  40   5.005  -4.186  -1.511
  333    HH   TYR  40           HH       TYR  40   5.337  -5.587  -3.226
  334    H    LEU  41           HN       LEU  41   3.525  -4.890   3.479
  335    HA   LEU  41           HA       LEU  41   5.646  -6.369   2.358
  336    HB2  LEU  41           HB2      LEU  41   5.614  -4.611   4.805
  337    HB3  LEU  41           HB1      LEU  41   7.059  -5.190   3.998
  338    HG   LEU  41           HG       LEU  41   4.996  -3.372   2.737
  339   HD11  LEU  41          HD11      LEU  41   7.780  -2.656   3.607
  340   HD12  LEU  41          HD12      LEU  41   6.360  -2.393   4.618
  341   HD13  LEU  41          HD13      LEU  41   6.494  -1.583   3.058
  342   HD21  LEU  41          HD21      LEU  41   7.637  -4.444   1.773
  343   HD22  LEU  41          HD22      LEU  41   6.818  -3.066   1.041
  344   HD23  LEU  41          HD23      LEU  41   6.047  -4.651   1.038
  345    H    GLU  42           HN       GLU  42   3.976  -6.508   5.455
  346    HA   GLU  42           HA       GLU  42   5.545  -8.491   6.697
  347    HB2  GLU  42           HB2      GLU  42   3.917  -6.992   7.856
  348    HB3  GLU  42           HB1      GLU  42   2.606  -7.904   7.124
  349    HG2  GLU  42           HG2      GLU  42   3.371  -9.918   8.305
  350    HG3  GLU  42           HG1      GLU  42   4.648  -8.970   9.065
  351    H    LYS  43           HN       LYS  43   2.687  -8.689   4.627
  352    HA   LYS  43           HA       LYS  43   2.257 -11.471   4.931
  353    HB2  LYS  43           HB2      LYS  43   1.405  -9.535   2.786
  354    HB3  LYS  43           HB1      LYS  43   0.894 -11.218   2.830
  355    HG2  LYS  43           HG2      LYS  43  -0.135 -10.850   5.011
  356    HG3  LYS  43           HG1      LYS  43   0.378  -9.162   4.963
  357    HD2  LYS  43           HD2      LYS  43  -0.964  -8.854   2.909
  358    HD3  LYS  43           HD1      LYS  43  -1.528 -10.520   3.062
  359    HE2  LYS  43           HE2      LYS  43  -2.197  -8.125   4.692
  360    HE3  LYS  43           HE1      LYS  43  -3.243  -9.417   4.105
  361    HZ1  LYS  43           HZ1      LYS  43  -3.026  -9.635   6.452
  362    HZ2  LYS  43           HZ2      LYS  43  -1.335  -9.546   6.378
  363    HZ3  LYS  43           HZ3      LYS  43  -2.143 -10.897   5.750
  364    H    LEU  44           HN       LEU  44   4.073  -9.571   2.541
  365    HA   LEU  44           HA       LEU  44   4.715 -11.924   1.037
  366    HB2  LEU  44           HB2      LEU  44   6.203 -10.520  -0.276
  367    HB3  LEU  44           HB1      LEU  44   4.630  -9.776  -0.100
  368    HG   LEU  44           HG       LEU  44   5.920  -8.548   1.919
  369   HD11  LEU  44          HD11      LEU  44   8.044  -8.820  -0.192
  370   HD12  LEU  44          HD12      LEU  44   8.022  -9.803   1.272
  371   HD13  LEU  44          HD13      LEU  44   8.165  -8.049   1.390
  372   HD21  LEU  44          HD21      LEU  44   5.871  -7.817  -1.002
  373   HD22  LEU  44          HD22      LEU  44   6.322  -6.699   0.284
  374   HD23  LEU  44          HD23      LEU  44   4.695  -7.379   0.237
  375    H    GLU  45           HN       GLU  45   5.782 -10.571   3.910
  376    HA   GLU  45           HA       GLU  45   8.486 -11.537   3.866
  377    HB2  GLU  45           HB2      GLU  45   7.634  -9.610   5.248
  378    HB3  GLU  45           HB1      GLU  45   6.830 -10.781   6.278
  379    HG2  GLU  45           HG2      GLU  45   8.979 -11.799   6.812
  380    HG3  GLU  45           HG1      GLU  45   9.795 -10.627   5.776
  381    H1   MET  46           HT1      MET  46  -5.881  -1.393 -14.160
  382    H2   MET  46           HT2      MET  46  -5.779  -0.030 -15.156
  383    H3   MET  46           HT3      MET  46  -6.995  -0.131 -13.986
  384    HA   MET  46           HA       MET  46  -5.403  -0.006 -12.218
  385    HB2  MET  46           HB2      MET  46  -3.606  -1.196 -13.536
  386    HB3  MET  46           HB1      MET  46  -3.315   0.312 -14.390
  387    HG2  MET  46           HG2      MET  46  -2.832   1.362 -12.158
  388    HG3  MET  46           HG1      MET  46  -2.891  -0.258 -11.467
  389    HE1  MET  46           HE1      MET  46  -1.408  -1.896 -14.082
  390    HE2  MET  46           HE2      MET  46  -1.431  -2.224 -12.350
  391    HE3  MET  46           HE3      MET  46   0.108  -2.041 -13.192
  392    H    ALA  47           HN       ALA  47  -6.754   1.861 -12.010
  393    HA   ALA  47           HA       ALA  47  -5.672   4.272 -13.325
  394    HB1  ALA  47           HB1      ALA  47  -8.503   3.674 -12.462
  395    HB2  ALA  47           HB2      ALA  47  -7.910   3.862 -14.112
  396    HB3  ALA  47           HB3      ALA  47  -7.945   5.250 -13.025
  397    H    THR  48           HN       THR  48  -4.366   3.475 -11.153
  398    HA   THR  48           HA       THR  48  -5.414   4.316  -8.666
  399    HB   THR  48           HB       THR  48  -3.040   4.160  -7.900
  400    HG1  THR  48           HG1      THR  48  -2.396   4.676 -10.279
  401   HG21  THR  48          HG21      THR  48  -3.975   1.812  -9.558
  402   HG22  THR  48          HG22      THR  48  -4.525   2.185  -7.924
  403   HG23  THR  48          HG23      THR  48  -2.839   1.756  -8.210
  404    H    THR  49           HN       THR  49  -5.455   6.231  -7.706
  405    HA   THR  49           HA       THR  49  -4.196   8.538  -9.033
  406    HB   THR  49           HB       THR  49  -6.484   8.527  -7.052
  407    HG1  THR  49           HG1      THR  49  -6.954   7.444  -9.087
  408   HG21  THR  49          HG21      THR  49  -5.345  10.665  -7.167
  409   HG22  THR  49          HG22      THR  49  -6.910  10.788  -7.970
  410   HG23  THR  49          HG23      THR  49  -5.436  10.651  -8.928
  411    H    THR  50           HN       THR  50  -3.109  10.120  -7.713
  412    HA   THR  50           HA       THR  50  -1.585   9.023  -5.595
  413    HB   THR  50           HB       THR  50  -1.904  11.977  -6.080
  414    HG1  THR  50           HG1      THR  50  -1.103  11.658  -8.007
  415   HG21  THR  50          HG21      THR  50  -0.579  11.361  -4.141
  416   HG22  THR  50          HG22      THR  50   0.477  11.994  -5.403
  417   HG23  THR  50          HG23      THR  50   0.387  10.256  -5.119
  418    H    LEU  51           HN       LEU  51  -2.557   8.431  -3.769
  419    HA   LEU  51           HA       LEU  51  -4.185  10.431  -2.345
  420    HB2  LEU  51           HB2      LEU  51  -4.482   7.427  -2.164
  421    HB3  LEU  51           HB1      LEU  51  -5.479   8.625  -1.364
  422    HG   LEU  51           HG       LEU  51  -5.369   8.083  -4.335
  423   HD11  LEU  51          HD11      LEU  51  -6.613   6.524  -2.678
  424   HD12  LEU  51          HD12      LEU  51  -7.426   7.067  -4.145
  425   HD13  LEU  51          HD13      LEU  51  -7.785   7.840  -2.600
  426   HD21  LEU  51          HD21      LEU  51  -5.710  10.431  -4.043
  427   HD22  LEU  51          HD22      LEU  51  -6.904  10.153  -2.775
  428   HD23  LEU  51          HD23      LEU  51  -7.264   9.697  -4.441
  429    H    GLY  52           HN       GLY  52  -3.868  10.507  -0.062
  430    HA2  GLY  52           HA2      GLY  52  -1.176  10.038   0.735
  431    HA3  GLY  52           HA1      GLY  52  -2.469  10.634   1.761
  432    H    VAL  53           HN       VAL  53  -0.266   8.326   1.599
  433    HA   VAL  53           HA       VAL  53  -1.917   6.381   3.072
  434    HB   VAL  53           HB       VAL  53   0.142   5.822   0.932
  435   HG11  VAL  53          HG11      VAL  53  -0.136   3.410   1.462
  436   HG12  VAL  53          HG12      VAL  53  -0.983   3.873   2.938
  437   HG13  VAL  53          HG13      VAL  53   0.709   4.317   2.717
  438   HG21  VAL  53          HG21      VAL  53  -1.658   4.472  -0.040
  439   HG22  VAL  53          HG22      VAL  53  -2.129   6.161   0.157
  440   HG23  VAL  53          HG23      VAL  53  -2.717   4.944   1.290
  441    H    LYS  54           HN       LYS  54  -0.583   5.057   4.610
  442    HA   LYS  54           HA       LYS  54   1.512   6.751   5.752
  443    HB2  LYS  54           HB2      LYS  54  -0.035   4.446   6.942
  444    HB3  LYS  54           HB1      LYS  54   1.183   5.386   7.791
  445    HG2  LYS  54           HG2      LYS  54  -1.257   6.654   6.594
  446    HG3  LYS  54           HG1      LYS  54  -1.245   5.976   8.222
  447    HD2  LYS  54           HD2      LYS  54   0.600   7.471   8.828
  448    HD3  LYS  54           HD1      LYS  54   0.582   8.147   7.198
  449    HE2  LYS  54           HE2      LYS  54  -1.884   8.164   8.897
  450    HE3  LYS  54           HE1      LYS  54  -0.649   9.406   9.090
  451    HZ1  LYS  54           HZ1      LYS  54  -0.911  10.023   6.801
  452    HZ2  LYS  54           HZ2      LYS  54  -2.423  10.069   7.556
  453    HZ3  LYS  54           HZ3      LYS  54  -2.028   8.778   6.533
  454    H    LEU  55           HN       LEU  55   3.527   6.267   5.349
  455    HA   LEU  55           HA       LEU  55   4.379   3.464   5.168
  456    HB2  LEU  55           HB2      LEU  55   4.772   5.652   3.178
  457    HB3  LEU  55           HB1      LEU  55   6.062   4.488   3.402
  458    HG   LEU  55           HG       LEU  55   3.252   3.625   2.760
  459   HD11  LEU  55          HD11      LEU  55   5.469   4.316   0.835
  460   HD12  LEU  55          HD12      LEU  55   3.931   5.161   1.006
  461   HD13  LEU  55          HD13      LEU  55   3.964   3.501   0.410
  462   HD21  LEU  55          HD21      LEU  55   4.540   1.819   3.519
  463   HD22  LEU  55          HD22      LEU  55   5.981   2.379   2.672
  464   HD23  LEU  55          HD23      LEU  55   4.626   1.715   1.761
  465    H    ASP  56           HN       ASP  56   6.235   3.053   6.203
  466    HA   ASP  56           HA       ASP  56   7.422   5.137   7.849
  467    HB2  ASP  56           HB2      ASP  56   6.875   2.680   8.539
  468    HB3  ASP  56           HB1      ASP  56   8.336   2.269   7.656
  469    H    ASP  57           HN       ASP  57   9.877   5.226   7.900
  470    HA   ASP  57           HA       ASP  57  10.905   5.871   5.373
  471    HB2  ASP  57           HB2      ASP  57  12.001   5.630   8.095
  472    HB3  ASP  57           HB1      ASP  57  13.177   5.323   6.824
  473    HA   PRO  58           HA       PRO  58  13.174   1.575   5.414
  474    HB2  PRO  58           HB2      PRO  58  12.096  -0.330   7.059
  475    HB3  PRO  58           HB1      PRO  58  13.486   0.674   7.486
  476    HG2  PRO  58           HG2      PRO  58  10.607   1.011   8.226
  477    HG3  PRO  58           HG1      PRO  58  12.054   1.211   9.233
  478    HD2  PRO  58           HD2      PRO  58  10.760   3.321   8.200
  479    HD3  PRO  58           HD1      PRO  58  12.529   3.301   8.356
  480    H    THR  59           HN       THR  59   9.658   1.802   5.895
  481    HA   THR  59           HA       THR  59   9.134  -0.544   4.351
  482    HB   THR  59           HB       THR  59   6.814   0.090   4.272
  483    HG1  THR  59           HG1      THR  59   7.509   2.470   4.068
  484   HG21  THR  59          HG21      THR  59   8.303   0.233   6.806
  485   HG22  THR  59          HG22      THR  59   6.964  -0.813   6.332
  486   HG23  THR  59          HG23      THR  59   6.649   0.840   6.860
  487    H    ARG  60           HN       ARG  60   9.283   2.942   3.596
  488    HA   ARG  60           HA       ARG  60   8.460   2.645   0.900
  489    HB2  ARG  60           HB2      ARG  60   8.477   4.839   1.971
  490    HB3  ARG  60           HB1      ARG  60  10.229   4.761   2.143
  491    HG2  ARG  60           HG2      ARG  60  10.578   4.939  -0.184
  492    HG3  ARG  60           HG1      ARG  60   8.880   4.630  -0.538
  493    HD2  ARG  60           HD2      ARG  60   9.615   7.004   1.111
  494    HD3  ARG  60           HD1      ARG  60   9.855   7.062  -0.636
  495    HE   ARG  60           HE       ARG  60   7.327   6.996   0.787
  496   HH11  ARG  60          HH21      ARG  60   8.984   6.712  -2.279
  497   HH12  ARG  60          HH22      ARG  60   7.562   6.984  -3.226
  498   HH21  ARG  60          HH11      ARG  60   5.429   7.344  -0.455
  499   HH22  ARG  60          HH12      ARG  60   5.524   7.344  -2.183
  500    H    GLU  61           HN       GLU  61  11.591   2.564   2.493
  501    HA   GLU  61           HA       GLU  61  13.167   2.226   0.177
  502    HB2  GLU  61           HB2      GLU  61  13.594   1.440   3.065
  503    HB3  GLU  61           HB1      GLU  61  14.824   1.244   1.825
  504    HG2  GLU  61           HG2      GLU  61  14.805   3.654   1.422
  505    HG3  GLU  61           HG1      GLU  61  13.570   3.848   2.664
  506    H    ARG  62           HN       ARG  62  11.553  -0.007   2.377
  507    HA   ARG  62           HA       ARG  62  12.489  -2.396   1.187
  508    HB2  ARG  62           HB2      ARG  62  11.471  -2.261   3.474
  509    HB3  ARG  62           HB1      ARG  62   9.904  -2.030   2.707
  510    HG2  ARG  62           HG2      ARG  62  10.116  -4.192   1.603
  511    HG3  ARG  62           HG1      ARG  62  11.687  -4.429   2.364
  512    HD2  ARG  62           HD2      ARG  62  10.621  -4.369   4.568
  513    HD3  ARG  62           HD1      ARG  62   9.048  -4.151   3.796
  514    HE   ARG  62           HE       ARG  62  10.241  -6.423   2.708
  515   HH11  ARG  62          HH21      ARG  62   8.895  -5.392   5.782
  516   HH12  ARG  62          HH22      ARG  62   8.481  -7.006   6.278
  517   HH21  ARG  62          HH11      ARG  62   9.682  -8.525   3.361
  518   HH22  ARG  62          HH12      ARG  62   8.929  -8.772   4.900
  519    H    LEU  63           HN       LEU  63   9.829  -0.236   0.524
  520    HA   LEU  63           HA       LEU  63   8.372  -1.875  -1.212
  521    HB2  LEU  63           HB2      LEU  63   8.526   0.988  -0.632
  522    HB3  LEU  63           HB1      LEU  63   8.142   0.655  -2.308
  523    HG   LEU  63           HG       LEU  63   6.253  -0.817  -1.465
  524   HD11  LEU  63          HD11      LEU  63   5.463  -0.550   0.759
  525   HD12  LEU  63          HD12      LEU  63   6.705   0.650   1.118
  526   HD13  LEU  63          HD13      LEU  63   7.157  -1.032   0.845
  527   HD21  LEU  63          HD21      LEU  63   4.829   1.182  -0.883
  528   HD22  LEU  63          HD22      LEU  63   5.719   1.284  -2.401
  529   HD23  LEU  63          HD23      LEU  63   6.301   2.149  -0.979
  530    H    LYS  64           HN       LYS  64  11.200   0.218  -1.723
  531    HA   LYS  64           HA       LYS  64  11.386  -0.228  -4.493
  532    HB2  LYS  64           HB2      LYS  64  12.719   1.532  -3.475
  533    HB3  LYS  64           HB1      LYS  64  13.619   0.343  -2.540
  534    HG2  LYS  64           HG2      LYS  64  14.514  -0.610  -4.608
  535    HG3  LYS  64           HG1      LYS  64  13.609   0.573  -5.548
  536    HD2  LYS  64           HD2      LYS  64  14.880   2.380  -4.511
  537    HD3  LYS  64           HD1      LYS  64  15.763   1.208  -3.530
  538    HE2  LYS  64           HE2      LYS  64  17.182   1.752  -5.347
  539    HE3  LYS  64           HE1      LYS  64  16.530   0.153  -5.693
  540    HZ1  LYS  64           HZ1      LYS  64  15.712   2.735  -6.906
  541    HZ2  LYS  64           HZ2      LYS  64  14.848   1.296  -7.118
  542    HZ3  LYS  64           HZ3      LYS  64  16.440   1.416  -7.679
  543    H    ALA  65           HN       ALA  65  12.609  -2.002  -1.751
  544    HA   ALA  65           HA       ALA  65  14.041  -3.980  -3.135
  545    HB1  ALA  65           HB1      ALA  65  14.174  -3.626  -0.684
  546    HB2  ALA  65           HB2      ALA  65  13.887  -5.311  -1.119
  547    HB3  ALA  65           HB3      ALA  65  12.558  -4.315  -0.524
  548    H    ALA  66           HN       ALA  66  10.639  -3.726  -2.190
  549    HA   ALA  66           HA       ALA  66   9.805  -6.241  -3.189
  550    HB1  ALA  66           HB1      ALA  66   8.408  -4.948  -1.652
  551    HB2  ALA  66           HB2      ALA  66   7.534  -5.288  -3.147
  552    HB3  ALA  66           HB3      ALA  66   8.219  -3.686  -2.870
  553    H    ALA  67           HN       ALA  67  10.104  -3.028  -4.548
  554    HA   ALA  67           HA       ALA  67   9.043  -3.481  -7.087
  555    HB1  ALA  67           HB1      ALA  67  10.236  -1.517  -7.783
  556    HB2  ALA  67           HB2      ALA  67  11.357  -1.667  -6.430
  557    HB3  ALA  67           HB3      ALA  67   9.670  -1.251  -6.133
  558    H    GLN  68           HN       GLN  68  12.251  -3.855  -5.801
  559    HA   GLN  68           HA       GLN  68  13.515  -4.668  -8.186
  560    HB2  GLN  68           HB2      GLN  68  14.233  -5.132  -5.286
  561    HB3  GLN  68           HB1      GLN  68  15.288  -5.537  -6.635
  562    HG2  GLN  68           HG2      GLN  68  14.234  -2.776  -6.081
  563    HG3  GLN  68           HG1      GLN  68  15.803  -3.361  -5.537
  564   HE21  GLN  68          HE21      GLN  68  13.904  -2.305  -8.231
  565   HE22  GLN  68          HE22      GLN  68  15.191  -2.215  -9.381
  566    H    SER  69           HN       SER  69  11.940  -6.468  -5.567
  567    HA   SER  69           HA       SER  69  12.595  -9.027  -6.612
  568    HB2  SER  69           HB2      SER  69  10.886  -9.887  -5.045
  569    HB3  SER  69           HB1      SER  69  11.997  -8.767  -4.261
  570    HG   SER  69           HG       SER  69   9.837  -7.478  -5.289
  571    H    ILE  70           HN       ILE  70  10.255  -6.683  -7.495
  572    HA   ILE  70           HA       ILE  70   8.780  -8.690  -9.051
  573    HB   ILE  70           HB       ILE  70   7.741  -6.947  -7.275
  574   HG12  ILE  70          HG12      ILE  70   6.597  -8.848  -8.370
  575   HG13  ILE  70          HG11      ILE  70   5.570  -7.432  -8.209
  576   HG21  ILE  70          HG21      ILE  70   7.330  -5.555  -9.901
  577   HG22  ILE  70          HG22      ILE  70   8.402  -4.997  -8.619
  578   HG23  ILE  70          HG23      ILE  70   6.664  -5.098  -8.335
  579   HD11  ILE  70          HD11      ILE  70   5.183  -8.426 -10.339
  580   HD12  ILE  70          HD12      ILE  70   6.908  -8.437 -10.706
  581   HD13  ILE  70          HD13      ILE  70   6.041  -6.905 -10.591
  582    H    ASP  71           HN       ASP  71  11.259  -6.737  -9.376
  583    HA   ASP  71           HA       ASP  71  12.406  -5.813 -11.078
  584    HB2  ASP  71           HB2      ASP  71  10.466  -7.481 -12.675
  585    HB3  ASP  71           HB1      ASP  71  11.786  -6.582 -13.415
  586    H    ARG  72           HN       ARG  72  10.581  -4.118  -9.959
  587    HA   ARG  72           HA       ARG  72   9.795  -2.480 -12.285
  588    HB2  ARG  72           HB2      ARG  72   8.194  -2.966  -9.776
  589    HB3  ARG  72           HB1      ARG  72   7.873  -1.634 -10.873
  590    HG2  ARG  72           HG2      ARG  72   7.732  -4.562 -11.554
  591    HG3  ARG  72           HG1      ARG  72   6.361  -3.492 -11.259
  592    HD2  ARG  72           HD2      ARG  72   7.380  -2.076 -13.178
  593    HD3  ARG  72           HD1      ARG  72   8.255  -3.555 -13.576
  594    HE   ARG  72           HE       ARG  72   5.567  -2.994 -14.179
  595   HH11  ARG  72          HH21      ARG  72   7.589  -5.638 -13.062
  596   HH12  ARG  72          HH22      ARG  72   6.525  -6.868 -13.662
  597   HH21  ARG  72          HH11      ARG  72   4.164  -4.628 -14.974
  598   HH22  ARG  72          HH12      ARG  72   4.583  -6.295 -14.758
  599    H    THR  73           HN       THR  73   9.532  -0.175 -11.756
  600    HA   THR  73           HA       THR  73  11.700   0.749 -10.099
  601    HB   THR  73           HB       THR  73  11.365   1.876 -12.215
  602    HG1  THR  73           HG1      THR  73  10.539   3.599 -10.102
  603   HG21  THR  73          HG21      THR  73   9.020   1.507 -12.595
  604   HG22  THR  73          HG22      THR  73   9.328   3.244 -12.629
  605   HG23  THR  73          HG23      THR  73   8.594   2.505 -11.206
  606    HA   PRO  74           HA       PRO  74   9.837   1.460  -6.151
  607    HB2  PRO  74           HB2      PRO  74  10.525   4.320  -6.706
  608    HB3  PRO  74           HB1      PRO  74  10.771   3.373  -5.234
  609    HG2  PRO  74           HG2      PRO  74  12.760   3.835  -6.990
  610    HG3  PRO  74           HG1      PRO  74  12.648   2.337  -6.053
  611    HD2  PRO  74           HD2      PRO  74  12.259   2.766  -8.927
  612    HD3  PRO  74           HD1      PRO  74  12.537   1.254  -8.044
  613    H    HIS  75           HN       HIS  75   9.136   4.220  -8.318
  614    HA   HIS  75           HA       HIS  75   6.704   4.921  -7.133
  615    HB2  HIS  75           HB2      HIS  75   7.929   6.425  -8.621
  616    HB3  HIS  75           HB1      HIS  75   7.623   5.350  -9.981
  617    HD1  HIS  75           HD1      HIS  75   5.582   5.821 -11.315
  618    HD2  HIS  75           HD2      HIS  75   5.473   7.615  -7.567
  619    HE1  HIS  75           HE1      HIS  75   3.476   7.195 -11.285
  620    HE2  HIS  75           HE2      HIS  75   3.649   8.520  -9.155
  621    H    TRP  76           HN       TRP  76   7.314   2.898  -9.996
  622    HA   TRP  76           HA       TRP  76   4.611   2.390 -10.568
  623    HB2  TRP  76           HB2      TRP  76   6.481   1.950 -12.174
  624    HB3  TRP  76           HB1      TRP  76   6.947   0.571 -11.180
  625    HD1  TRP  76           HD1      TRP  76   5.361  -1.579 -11.237
  626    HE1  TRP  76           HE1      TRP  76   3.542  -2.341 -12.884
  627    HE3  TRP  76           HE3      TRP  76   4.675   2.805 -13.772
  628    HZ2  TRP  76           HZ2      TRP  76   2.017  -1.237 -14.984
  629    HZ3  TRP  76           HZ3      TRP  76   3.015   2.867 -15.587
  630    HH2  TRP  76           HH2      TRP  76   1.716   0.887 -16.180
  631    H    LEU  77           HN       LEU  77   6.988   0.810  -8.598
  632    HA   LEU  77           HA       LEU  77   5.490  -1.427  -7.846
  633    HB2  LEU  77           HB2      LEU  77   7.899  -1.286  -7.470
  634    HB3  LEU  77           HB1      LEU  77   7.648   0.002  -6.312
  635    HG   LEU  77           HG       LEU  77   8.136  -2.358  -5.420
  636   HD11  LEU  77          HD11      LEU  77   5.692  -0.968  -4.353
  637   HD12  LEU  77          HD12      LEU  77   7.354  -0.463  -4.048
  638   HD13  LEU  77          HD13      LEU  77   6.789  -2.030  -3.469
  639   HD21  LEU  77          HD21      LEU  77   6.515  -3.501  -6.898
  640   HD22  LEU  77          HD22      LEU  77   5.206  -2.732  -6.000
  641   HD23  LEU  77          HD23      LEU  77   6.288  -3.865  -5.188
  642    H    ILE  78           HN       ILE  78   5.702   1.799  -6.490
  643    HA   ILE  78           HA       ILE  78   4.314   1.382  -4.124
  644    HB   ILE  78           HB       ILE  78   4.317   3.793  -5.942
  645   HG12  ILE  78          HG12      ILE  78   5.651   3.348  -3.266
  646   HG13  ILE  78          HG11      ILE  78   6.448   3.101  -4.817
  647   HG21  ILE  78          HG21      ILE  78   3.459   5.036  -3.933
  648   HG22  ILE  78          HG22      ILE  78   3.066   3.469  -3.225
  649   HG23  ILE  78          HG23      ILE  78   2.291   3.979  -4.725
  650   HD11  ILE  78          HD11      ILE  78   5.566   5.641  -3.530
  651   HD12  ILE  78          HD12      ILE  78   5.767   5.549  -5.279
  652   HD13  ILE  78          HD13      ILE  78   7.134   5.215  -4.215
  653    H    LYS  79           HN       LYS  79   3.082   2.125  -7.360
  654    HA   LYS  79           HA       LYS  79   0.339   2.086  -6.695
  655    HB2  LYS  79           HB2      LYS  79   1.374   1.081  -9.333
  656    HB3  LYS  79           HB1      LYS  79  -0.104   1.969  -9.002
  657    HG2  LYS  79           HG2      LYS  79   1.575   3.853  -8.273
  658    HG3  LYS  79           HG1      LYS  79   2.677   2.964  -9.323
  659    HD2  LYS  79           HD2      LYS  79   0.052   4.248 -10.046
  660    HD3  LYS  79           HD1      LYS  79   1.656   4.630 -10.670
  661    HE2  LYS  79           HE2      LYS  79  -0.019   2.191 -11.208
  662    HE3  LYS  79           HE1      LYS  79   0.543   3.400 -12.361
  663    HZ1  LYS  79           HZ1      LYS  79   2.326   1.569 -10.855
  664    HZ2  LYS  79           HZ2      LYS  79   2.772   2.632 -12.094
  665    HZ3  LYS  79           HZ3      LYS  79   1.792   1.299 -12.438
  666    H    GLN  80           HN       GLN  80   2.582  -0.441  -7.705
  667    HA   GLN  80           HA       GLN  80   0.683  -2.541  -7.803
  668    HB2  GLN  80           HB2      GLN  80   3.681  -2.489  -7.635
  669    HB3  GLN  80           HB1      GLN  80   2.782  -3.999  -7.629
  670    HG2  GLN  80           HG2      GLN  80   1.823  -3.438  -9.799
  671    HG3  GLN  80           HG1      GLN  80   2.719  -1.919  -9.804
  672   HE21  GLN  80          HE21      GLN  80   2.816  -4.183 -11.657
  673   HE22  GLN  80          HE22      GLN  80   4.463  -4.707 -11.676
  674    H    ALA  81           HN       ALA  81   3.086  -1.667  -5.332
  675    HA   ALA  81           HA       ALA  81   2.735  -3.692  -3.554
  676    HB1  ALA  81           HB1      ALA  81   4.433  -2.145  -3.102
  677    HB2  ALA  81           HB2      ALA  81   3.285  -1.967  -1.775
  678    HB3  ALA  81           HB3      ALA  81   3.308  -0.788  -3.086
  679    H    ILE  82           HN       ILE  82   0.683  -0.828  -3.919
  680    HA   ILE  82           HA       ILE  82  -0.981  -1.812  -1.766
  681    HB   ILE  82           HB       ILE  82  -0.477   0.610  -2.022
  682   HG12  ILE  82          HG12      ILE  82  -2.858   1.364  -1.644
  683   HG13  ILE  82          HG11      ILE  82  -3.354  -0.284  -2.017
  684   HG21  ILE  82          HG21      ILE  82  -1.617   1.949  -3.657
  685   HG22  ILE  82          HG22      ILE  82  -2.406   0.522  -4.328
  686   HG23  ILE  82          HG23      ILE  82  -0.660   0.715  -4.476
  687   HD11  ILE  82          HD11      ILE  82  -2.934   0.543   0.454
  688   HD12  ILE  82          HD12      ILE  82  -1.276   0.088   0.058
  689   HD13  ILE  82          HD13      ILE  82  -2.570  -1.104  -0.056
  690    H    PHE  83           HN       PHE  83  -1.409  -1.338  -5.302
  691    HA   PHE  83           HA       PHE  83  -4.085  -2.403  -5.166
  692    HB2  PHE  83           HB2      PHE  83  -4.307  -1.496  -7.210
  693    HB3  PHE  83           HB1      PHE  83  -2.667  -0.889  -7.046
  694    HD1  PHE  83           HD1      PHE  83  -4.657  -3.751  -8.317
  695    HD2  PHE  83           HD2      PHE  83  -0.972  -1.629  -8.467
  696    HE1  PHE  83           HE1      PHE  83  -3.966  -5.098 -10.254
  697    HE2  PHE  83           HE2      PHE  83  -0.274  -2.974 -10.404
  698    HZ   PHE  83           HZ       PHE  83  -1.770  -4.712 -11.299
  699    H    ASN  84           HN       ASN  84  -0.910  -3.634  -6.050
  700    HA   ASN  84           HA       ASN  84  -1.833  -6.173  -6.918
  701    HB2  ASN  84           HB2      ASN  84   0.514  -5.102  -7.303
  702    HB3  ASN  84           HB1      ASN  84   0.884  -5.734  -5.705
  703   HD21  ASN  84          HD21      ASN  84   2.059  -6.382  -8.269
  704   HD22  ASN  84          HD22      ASN  84   1.828  -8.075  -8.515
  705    H    TYR  85           HN       TYR  85  -1.144  -4.648  -3.849
  706    HA   TYR  85           HA       TYR  85  -1.016  -6.952  -2.246
  707    HB2  TYR  85           HB2      TYR  85  -0.515  -4.975  -1.091
  708    HB3  TYR  85           HB1      TYR  85  -1.879  -4.112  -1.786
  709    HD1  TYR  85           HD1      TYR  85  -1.094  -6.879   0.603
  710    HD2  TYR  85           HD2      TYR  85  -3.794  -3.795  -0.540
  711    HE1  TYR  85           HE1      TYR  85  -2.398  -7.263   2.653
  712    HE2  TYR  85           HE2      TYR  85  -5.103  -4.173   1.503
  713    HH   TYR  85           HH       TYR  85  -5.410  -5.507   3.268
  714    H    LEU  86           HN       LEU  86  -3.635  -4.989  -3.483
  715    HA   LEU  86           HA       LEU  86  -5.746  -6.458  -2.327
  716    HB2  LEU  86           HB2      LEU  86  -5.726  -4.744  -4.806
  717    HB3  LEU  86           HB1      LEU  86  -7.169  -5.322  -3.994
  718    HG   LEU  86           HG       LEU  86  -5.126  -3.459  -2.766
  719   HD11  LEU  86          HD11      LEU  86  -7.923  -2.803  -3.642
  720   HD12  LEU  86          HD12      LEU  86  -6.507  -2.530  -4.656
  721   HD13  LEU  86          HD13      LEU  86  -6.656  -1.699  -3.108
  722   HD21  LEU  86          HD21      LEU  86  -7.746  -4.553  -1.771
  723   HD22  LEU  86          HD22      LEU  86  -6.946  -3.148  -1.069
  724   HD23  LEU  86          HD23      LEU  86  -6.150  -4.720  -1.039
  725    H    GLU  87           HN       GLU  87  -4.049  -6.660  -5.404
  726    HA   GLU  87           HA       GLU  87  -5.615  -8.669  -6.615
  727    HB2  GLU  87           HB2      GLU  87  -4.012  -7.228  -7.839
  728    HB3  GLU  87           HB1      GLU  87  -2.681  -8.041  -7.031
  729    HG2  GLU  87           HG2      GLU  87  -3.401 -10.164  -8.090
  730    HG3  GLU  87           HG1      GLU  87  -4.629  -9.261  -8.974
  731    H    LYS  88           HN       LYS  88  -2.772  -8.817  -4.521
  732    HA   LYS  88           HA       LYS  88  -2.363 -11.614  -4.764
  733    HB2  LYS  88           HB2      LYS  88  -1.455  -9.654  -2.653
  734    HB3  LYS  88           HB1      LYS  88  -0.940 -11.334  -2.722
  735    HG2  LYS  88           HG2      LYS  88   0.035 -10.953  -4.917
  736    HG3  LYS  88           HG1      LYS  88  -0.481  -9.269  -4.864
  737    HD2  LYS  88           HD2      LYS  88   0.925  -8.921  -2.876
  738    HD3  LYS  88           HD1      LYS  88   1.463 -10.599  -2.980
  739    HE2  LYS  88           HE2      LYS  88   2.130  -8.277  -4.710
  740    HE3  LYS  88           HE1      LYS  88   3.172  -9.561  -4.098
  741    HZ1  LYS  88           HZ1      LYS  88   2.896  -9.857  -6.436
  742    HZ2  LYS  88           HZ2      LYS  88   1.210  -9.752  -6.321
  743    HZ3  LYS  88           HZ3      LYS  88   2.023 -11.086  -5.667
  744    H    LEU  89           HN       LEU  89  -4.139  -9.636  -2.417
  745    HA   LEU  89           HA       LEU  89  -4.783 -11.938  -0.809
  746    HB2  LEU  89           HB2      LEU  89  -6.103 -10.452   0.549
  747    HB3  LEU  89           HB1      LEU  89  -4.562  -9.700   0.201
  748    HG   LEU  89           HG       LEU  89  -5.991  -8.572  -1.755
  749   HD11  LEU  89          HD11      LEU  89  -8.031  -8.835   0.442
  750   HD12  LEU  89          HD12      LEU  89  -8.037  -9.857  -0.995
  751   HD13  LEU  89          HD13      LEU  89  -8.229  -8.111  -1.154
  752   HD21  LEU  89          HD21      LEU  89  -5.881  -7.736   1.133
  753   HD22  LEU  89          HD22      LEU  89  -6.377  -6.681  -0.189
  754   HD23  LEU  89          HD23      LEU  89  -4.737  -7.329  -0.146
  755    H    GLU  90           HN       GLU  90  -5.939 -10.657  -3.687
  756    HA   GLU  90           HA       GLU  90  -8.694 -11.108  -3.522
  757    HB2  GLU  90           HB2      GLU  90  -7.531  -9.857  -5.331
  758    HB3  GLU  90           HB1      GLU  90  -6.920 -11.385  -5.947
  759    HG2  GLU  90           HG2      GLU  90  -9.123 -12.131  -6.482
  760    HG3  GLU  90           HG1      GLU  90  -9.840 -10.733  -5.686
  Start of MODEL   21
    1    H1   MET   1           HT1      MET   1   6.720  -1.640  12.808
    2    H2   MET   1           HT2      MET   1   6.757  -0.372  13.930
    3    H3   MET   1           HT3      MET   1   7.764  -0.330  12.572
    4    HA   MET   1           HA       MET   1   5.873  -0.164  11.113
    5    HB2  MET   1           HB2      MET   1   4.316  -1.409  12.621
    6    HB3  MET   1           HB1      MET   1   4.254   0.001  13.671
    7    HG2  MET   1           HG2      MET   1   3.394   1.299  11.701
    8    HG3  MET   1           HG1      MET   1   3.257  -0.236  10.846
    9    HE1  MET   1           HE1      MET   1   2.216   1.949  13.744
   10    HE2  MET   1           HE2      MET   1   2.255   0.529  14.789
   11    HE3  MET   1           HE3      MET   1   0.711   1.258  14.351
   12    H    ALA   2           HN       ALA   2   7.289   1.634  10.833
   13    HA   ALA   2           HA       ALA   2   6.446   4.060  12.290
   14    HB1  ALA   2           HB1      ALA   2   8.719   4.942  11.967
   15    HB2  ALA   2           HB2      ALA   2   9.202   3.411  11.237
   16    HB3  ALA   2           HB3      ALA   2   8.721   3.467  12.933
   17    H    THR   3           HN       THR   3   4.930   3.525  10.331
   18    HA   THR   3           HA       THR   3   5.775   4.138   7.712
   19    HB   THR   3           HB       THR   3   3.377   4.253   7.195
   20    HG1  THR   3           HG1      THR   3   3.150   5.109   9.650
   21   HG21  THR   3          HG21      THR   3   3.992   2.030   9.148
   22   HG22  THR   3          HG22      THR   3   4.428   2.033   7.439
   23   HG23  THR   3          HG23      THR   3   2.729   2.008   7.918
   24    H    THR   4           HN       THR   4   6.084   6.039   6.728
   25    HA   THR   4           HA       THR   4   5.339   8.513   8.137
   26    HB   THR   4           HB       THR   4   7.335   8.172   5.885
   27    HG1  THR   4           HG1      THR   4   7.628   7.167   8.196
   28   HG21  THR   4          HG21      THR   4   6.782  10.420   7.823
   29   HG22  THR   4          HG22      THR   4   6.612  10.451   6.068
   30   HG23  THR   4          HG23      THR   4   8.214  10.338   6.797
   31    H    THR   5           HN       THR   5   4.085  10.077   7.091
   32    HA   THR   5           HA       THR   5   2.308   9.197   5.095
   33    HB   THR   5           HB       THR   5   2.867  12.081   5.785
   34    HG1  THR   5           HG1      THR   5   1.351  11.753   7.481
   35   HG21  THR   5          HG21      THR   5   0.504  12.390   5.263
   36   HG22  THR   5          HG22      THR   5   0.335  10.667   4.930
   37   HG23  THR   5          HG23      THR   5   1.344  11.671   3.889
   38    H    LEU   6           HN       LEU   6   2.882   8.746   3.098
   39    HA   LEU   6           HA       LEU   6   4.487  10.691   1.583
   40    HB2  LEU   6           HB2      LEU   6   4.684   7.682   1.337
   41    HB3  LEU   6           HB1      LEU   6   5.592   8.860   0.410
   42    HG   LEU   6           HG       LEU   6   5.860   8.353   3.380
   43   HD11  LEU   6          HD11      LEU   6   8.041   7.971   1.392
   44   HD12  LEU   6          HD12      LEU   6   6.807   6.725   1.560
   45   HD13  LEU   6          HD13      LEU   6   7.785   7.190   2.952
   46   HD21  LEU   6          HD21      LEU   6   7.857   9.860   3.137
   47   HD22  LEU   6          HD22      LEU   6   6.291  10.661   3.022
   48   HD23  LEU   6          HD23      LEU   6   7.221  10.329   1.561
   49    H    GLY   7           HN       GLY   7   3.942  10.796  -0.676
   50    HA2  GLY   7           HA2      GLY   7   1.171  10.417  -1.200
   51    HA3  GLY   7           HA1      GLY   7   2.379  10.945  -2.361
   52    H    VAL   8           HN       VAL   8   0.157   8.646  -1.811
   53    HA   VAL   8           HA       VAL   8   1.554   6.675  -3.493
   54    HB   VAL   8           HB       VAL   8  -0.227   6.040  -1.123
   55   HG11  VAL   8          HG11      VAL   8   1.065   4.211  -3.136
   56   HG12  VAL   8          HG12      VAL   8  -0.654   4.384  -2.785
   57   HG13  VAL   8          HG13      VAL   8   0.423   3.667  -1.587
   58   HG21  VAL   8          HG21      VAL   8   1.975   6.707  -0.406
   59   HG22  VAL   8          HG22      VAL   8   2.722   5.606  -1.563
   60   HG23  VAL   8          HG23      VAL   8   1.801   4.963  -0.204
   61    H    LYS   9           HN       LYS   9  -0.134   5.222  -4.627
   62    HA   LYS   9           HA       LYS   9  -2.420   6.934  -5.324
   63    HB2  LYS   9           HB2      LYS   9  -1.006   4.863  -7.003
   64    HB3  LYS   9           HB1      LYS   9  -2.391   5.821  -7.513
   65    HG2  LYS   9           HG2      LYS   9  -1.089   7.858  -7.261
   66    HG3  LYS   9           HG1      LYS   9   0.303   6.902  -6.751
   67    HD2  LYS   9           HD2      LYS   9  -0.072   5.659  -9.007
   68    HD3  LYS   9           HD1      LYS   9  -0.963   7.120  -9.447
   69    HE2  LYS   9           HE2      LYS   9   1.399   7.224 -10.127
   70    HE3  LYS   9           HE1      LYS   9   0.976   8.483  -8.964
   71    HZ1  LYS   9           HZ1      LYS   9   2.323   5.921  -8.291
   72    HZ2  LYS   9           HZ2      LYS   9   1.951   7.165  -7.206
   73    HZ3  LYS   9           HZ3      LYS   9   3.090   7.423  -8.426
   74    H    LEU  10           HN       LEU  10  -4.364   6.237  -4.909
   75    HA   LEU  10           HA       LEU  10  -4.893   3.359  -4.568
   76    HB2  LEU  10           HB2      LEU  10  -5.280   5.599  -2.692
   77    HB3  LEU  10           HB1      LEU  10  -6.677   4.559  -2.891
   78    HG   LEU  10           HG       LEU  10  -4.038   3.298  -2.302
   79   HD11  LEU  10          HD11      LEU  10  -5.813   4.620  -0.249
   80   HD12  LEU  10          HD12      LEU  10  -4.188   5.139  -0.699
   81   HD13  LEU  10          HD13      LEU  10  -4.429   3.583   0.095
   82   HD21  LEU  10          HD21      LEU  10  -6.746   2.636  -1.201
   83   HD22  LEU  10          HD22      LEU  10  -5.349   1.583  -1.420
   84   HD23  LEU  10          HD23      LEU  10  -6.272   2.127  -2.820
   85    H    ASP  11           HN       ASP  11  -6.682   2.698  -5.674
   86    HA   ASP  11           HA       ASP  11  -8.089   4.648  -7.284
   87    HB2  ASP  11           HB2      ASP  11  -9.099   1.839  -7.121
   88    HB3  ASP  11           HB1      ASP  11  -8.952   2.889  -8.518
   89    H    ASP  12           HN       ASP  12 -10.427   4.955  -7.173
   90    HA   ASP  12           HA       ASP  12 -11.412   5.377  -4.621
   91    HB2  ASP  12           HB2      ASP  12 -12.683   5.238  -7.305
   92    HB3  ASP  12           HB1      ASP  12 -13.753   5.112  -5.913
   93    HA   PRO  13           HA       PRO  13 -13.826   1.178  -4.780
   94    HB2  PRO  13           HB2      PRO  13 -12.937  -0.682  -6.576
   95    HB3  PRO  13           HB1      PRO  13 -14.277   0.423  -6.899
   96    HG2  PRO  13           HG2      PRO  13 -11.411   0.626  -7.734
   97    HG3  PRO  13           HG1      PRO  13 -12.877   0.962  -8.674
   98    HD2  PRO  13           HD2      PRO  13 -11.407   2.932  -7.578
   99    HD3  PRO  13           HD1      PRO  13 -13.175   3.041  -7.704
  100    H    THR  14           HN       THR  14 -10.406   1.365  -5.504
  101    HA   THR  14           HA       THR  14  -9.623  -0.994  -4.150
  102    HB   THR  14           HB       THR  14  -8.077   1.507  -4.849
  103    HG1  THR  14           HG1      THR  14  -7.368   0.234  -6.569
  104   HG21  THR  14          HG21      THR  14  -6.059   0.432  -4.296
  105   HG22  THR  14          HG22      THR  14  -6.843  -1.136  -4.124
  106   HG23  THR  14          HG23      THR  14  -7.115   0.120  -2.918
  107    H    ARG  15           HN       ARG  15  -9.942   2.405  -3.158
  108    HA   ARG  15           HA       ARG  15  -8.974   2.051  -0.527
  109    HB2  ARG  15           HB2      ARG  15  -9.246   4.277  -1.523
  110    HB3  ARG  15           HB1      ARG  15 -10.995   4.054  -1.563
  111    HG2  ARG  15           HG2      ARG  15 -11.051   3.936   0.879
  112    HG3  ARG  15           HG1      ARG  15  -9.302   4.156   0.930
  113    HD2  ARG  15           HD2      ARG  15 -11.071   6.159  -0.429
  114    HD3  ARG  15           HD1      ARG  15 -10.831   6.203   1.318
  115    HE   ARG  15           HE       ARG  15  -8.817   6.713  -0.743
  116   HH11  ARG  15          HH21      ARG  15  -9.688   6.550   2.637
  117   HH12  ARG  15          HH22      ARG  15  -8.275   7.384   3.185
  118   HH21  ARG  15          HH11      ARG  15  -6.927   7.813  -0.026
  119   HH22  ARG  15          HH12      ARG  15  -6.696   8.101   1.665
  120    H    GLU  16           HN       GLU  16 -12.165   1.754  -1.976
  121    HA   GLU  16           HA       GLU  16 -13.625   1.197   0.369
  122    HB2  GLU  16           HB2      GLU  16 -14.072   0.390  -2.516
  123    HB3  GLU  16           HB1      GLU  16 -15.253   0.137  -1.238
  124    HG2  GLU  16           HG2      GLU  16 -15.373   2.544  -0.858
  125    HG3  GLU  16           HG1      GLU  16 -14.178   2.804  -2.129
  126    H    ARG  17           HN       ARG  17 -11.872  -0.807  -1.926
  127    HA   ARG  17           HA       ARG  17 -12.503  -3.328  -0.888
  128    HB2  ARG  17           HB2      ARG  17 -11.388  -3.020  -3.060
  129    HB3  ARG  17           HB1      ARG  17  -9.953  -2.414  -2.248
  130    HG2  ARG  17           HG2      ARG  17  -9.531  -4.666  -2.860
  131    HG3  ARG  17           HG1      ARG  17  -9.765  -4.634  -1.109
  132    HD2  ARG  17           HD2      ARG  17 -12.139  -5.296  -1.487
  133    HD3  ARG  17           HD1      ARG  17 -11.768  -5.477  -3.200
  134    HE   ARG  17           HE       ARG  17 -10.716  -7.468  -2.738
  135   HH11  ARG  17          HH21      ARG  17 -11.176  -5.712   0.260
  136   HH12  ARG  17          HH22      ARG  17 -10.831  -7.082   1.260
  137   HH21  ARG  17          HH11      ARG  17 -10.259  -9.265  -1.452
  138   HH22  ARG  17          HH12      ARG  17 -10.312  -9.120   0.285
  139    H    LEU  18           HN       LEU  18 -10.036  -0.971  -0.028
  140    HA   LEU  18           HA       LEU  18  -8.658  -2.506   1.875
  141    HB2  LEU  18           HB2      LEU  18  -8.878   0.361   1.225
  142    HB3  LEU  18           HB1      LEU  18  -8.440   0.010   2.886
  143    HG   LEU  18           HG       LEU  18  -6.616  -1.512   1.844
  144   HD11  LEU  18          HD11      LEU  18  -7.067   0.352  -0.468
  145   HD12  LEU  18          HD12      LEU  18  -7.557  -1.342  -0.448
  146   HD13  LEU  18          HD13      LEU  18  -5.850  -0.916  -0.327
  147   HD21  LEU  18          HD21      LEU  18  -5.064   0.277   1.885
  148   HD22  LEU  18          HD22      LEU  18  -6.313   0.656   3.070
  149   HD23  LEU  18          HD23      LEU  18  -6.314   1.459   1.499
  150    H    LYS  19           HN       LYS  19 -11.636  -0.627   2.064
  151    HA   LYS  19           HA       LYS  19 -11.928  -0.625   4.854
  152    HB2  LYS  19           HB2      LYS  19 -13.358   0.734   3.404
  153    HB3  LYS  19           HB1      LYS  19 -14.073  -0.720   2.728
  154    HG2  LYS  19           HG2      LYS  19 -15.596   0.262   4.301
  155    HG3  LYS  19           HG1      LYS  19 -15.002  -1.267   4.946
  156    HD2  LYS  19           HD2      LYS  19 -13.508  -0.117   6.439
  157    HD3  LYS  19           HD1      LYS  19 -13.886   1.438   5.692
  158    HE2  LYS  19           HE2      LYS  19 -16.192   1.260   6.461
  159    HE3  LYS  19           HE1      LYS  19 -15.851  -0.318   7.166
  160    HZ1  LYS  19           HZ1      LYS  19 -14.427   0.666   8.768
  161    HZ2  LYS  19           HZ2      LYS  19 -15.849   1.579   8.762
  162    HZ3  LYS  19           HZ3      LYS  19 -14.464   2.171   7.996
  163    H    ALA  20           HN       ALA  20 -12.871  -2.959   2.424
  164    HA   ALA  20           HA       ALA  20 -14.127  -4.816   4.120
  165    HB1  ALA  20           HB1      ALA  20 -14.366  -4.964   1.718
  166    HB2  ALA  20           HB2      ALA  20 -13.685  -6.469   2.335
  167    HB3  ALA  20           HB3      ALA  20 -12.643  -5.291   1.536
  168    H    ALA  21           HN       ALA  21 -10.740  -4.438   3.152
  169    HA   ALA  21           HA       ALA  21  -9.777  -6.724   4.555
  170    HB1  ALA  21           HB1      ALA  21  -7.542  -5.595   4.290
  171    HB2  ALA  21           HB2      ALA  21  -8.394  -4.257   3.518
  172    HB3  ALA  21           HB3      ALA  21  -8.431  -5.862   2.790
  173    H    ALA  22           HN       ALA  22 -10.222  -3.341   5.314
  174    HA   ALA  22           HA       ALA  22  -8.983  -3.227   7.822
  175    HB1  ALA  22           HB1      ALA  22  -9.897  -1.321   6.392
  176    HB2  ALA  22           HB2      ALA  22 -10.145  -1.201   8.133
  177    HB3  ALA  22           HB3      ALA  22 -11.470  -1.711   7.088
  178    H    GLN  23           HN       GLN  23 -12.130  -4.207   6.800
  179    HA   GLN  23           HA       GLN  23 -13.283  -4.618   9.332
  180    HB2  GLN  23           HB2      GLN  23 -13.878  -5.806   6.620
  181    HB3  GLN  23           HB1      GLN  23 -14.869  -6.104   8.045
  182    HG2  GLN  23           HG2      GLN  23 -14.281  -3.358   6.976
  183    HG3  GLN  23           HG1      GLN  23 -15.697  -4.299   6.509
  184   HE21  GLN  23          HE21      GLN  23 -14.150  -2.477   9.018
  185   HE22  GLN  23          HE22      GLN  23 -15.500  -2.407  10.096
  186    H    SER  24           HN       SER  24 -11.362  -6.694   7.200
  187    HA   SER  24           HA       SER  24 -11.717  -9.071   8.680
  188    HB2  SER  24           HB2      SER  24  -9.999 -10.033   7.359
  189    HB3  SER  24           HB1      SER  24 -10.813  -8.883   6.304
  190    HG   SER  24           HG       SER  24  -9.048  -7.391   7.083
  191    H    ILE  25           HN       ILE  25  -9.610  -6.315   9.144
  192    HA   ILE  25           HA       ILE  25  -8.222  -7.774  11.291
  193    HB   ILE  25           HB       ILE  25  -6.822  -6.604   9.575
  194   HG12  ILE  25          HG12      ILE  25  -6.473  -5.436  12.343
  195   HG13  ILE  25          HG11      ILE  25  -6.060  -7.097  11.931
  196   HG21  ILE  25          HG21      ILE  25  -6.607  -4.152   9.734
  197   HG22  ILE  25          HG22      ILE  25  -7.994  -4.127  10.824
  198   HG23  ILE  25          HG23      ILE  25  -8.191  -4.671   9.158
  199   HD11  ILE  25          HD11      ILE  25  -4.383  -6.353  10.393
  200   HD12  ILE  25          HD12      ILE  25  -4.132  -5.558  11.947
  201   HD13  ILE  25          HD13      ILE  25  -4.869  -4.672  10.611
  202    H    ASP  26           HN       ASP  26 -10.873  -6.013  10.900
  203    HA   ASP  26           HA       ASP  26 -12.306  -4.900  12.225
  204    HB2  ASP  26           HB2      ASP  26 -11.648  -6.813  13.790
  205    HB3  ASP  26           HB1      ASP  26 -10.613  -5.645  14.605
  206    H    ARG  27           HN       ARG  27 -10.398  -3.338  11.005
  207    HA   ARG  27           HA       ARG  27 -10.204  -1.169  12.989
  208    HB2  ARG  27           HB2      ARG  27  -7.974  -1.987  11.116
  209    HB3  ARG  27           HB1      ARG  27  -7.972  -0.528  12.100
  210    HG2  ARG  27           HG2      ARG  27  -8.064  -1.904  14.128
  211    HG3  ARG  27           HG1      ARG  27  -8.058  -3.357  13.131
  212    HD2  ARG  27           HD2      ARG  27  -5.864  -2.575  12.189
  213    HD3  ARG  27           HD1      ARG  27  -5.866  -1.319  13.427
  214    HE   ARG  27           HE       ARG  27  -6.277  -3.759  14.705
  215   HH11  ARG  27          HH21      ARG  27  -3.748  -2.115  12.931
  216   HH12  ARG  27          HH22      ARG  27  -2.464  -3.007  13.670
  217   HH21  ARG  27          HH11      ARG  27  -4.572  -4.934  15.694
  218   HH22  ARG  27          HH12      ARG  27  -2.930  -4.598  15.257
  219    H    THR  28           HN       THR  28  -9.828   0.991  11.881
  220    HA   THR  28           HA       THR  28 -11.677   1.171   9.676
  221    HB   THR  28           HB       THR  28 -11.254   2.807  11.768
  222    HG1  THR  28           HG1      THR  28 -12.454   4.363  10.527
  223   HG21  THR  28          HG21      THR  28 -10.059   4.764  11.247
  224   HG22  THR  28          HG22      THR  28  -9.917   4.327   9.546
  225   HG23  THR  28          HG23      THR  28  -8.992   3.445  10.761
  226    HA   PRO  29           HA       PRO  29  -9.114   1.341   6.083
  227    HB2  PRO  29           HB2      PRO  29 -10.002   4.171   5.719
  228    HB3  PRO  29           HB1      PRO  29  -9.952   2.845   4.549
  229    HG2  PRO  29           HG2      PRO  29 -12.251   3.552   5.657
  230    HG3  PRO  29           HG1      PRO  29 -11.861   1.840   5.408
  231    HD2  PRO  29           HD2      PRO  29 -11.855   3.440   7.922
  232    HD3  PRO  29           HD1      PRO  29 -12.264   1.732   7.670
  233    H    HIS  30           HN       HIS  30  -8.827   4.134   8.246
  234    HA   HIS  30           HA       HIS  30  -6.475   5.244   7.222
  235    HB2  HIS  30           HB2      HIS  30  -7.831   6.323   8.962
  236    HB3  HIS  30           HB1      HIS  30  -7.403   5.054  10.101
  237    HD1  HIS  30           HD1      HIS  30  -5.355   5.424  11.476
  238    HD2  HIS  30           HD2      HIS  30  -5.576   8.017   8.242
  239    HE1  HIS  30           HE1      HIS  30  -3.505   7.084  11.820
  240    HE2  HIS  30           HE2      HIS  30  -3.918   8.830  10.059
  241    H    TRP  31           HN       TRP  31  -6.973   2.709   9.606
  242    HA   TRP  31           HA       TRP  31  -4.222   2.206  10.069
  243    HB2  TRP  31           HB2      TRP  31  -6.669   0.526  10.621
  244    HB3  TRP  31           HB1      TRP  31  -5.048   0.158  11.208
  245    HD1  TRP  31           HD1      TRP  31  -8.118   1.999  12.143
  246    HE1  TRP  31           HE1      TRP  31  -7.690   3.465  14.220
  247    HE3  TRP  31           HE3      TRP  31  -3.017   1.721  12.292
  248    HZ2  TRP  31           HZ2      TRP  31  -5.483   4.375  15.715
  249    HZ3  TRP  31           HZ3      TRP  31  -1.823   2.919  14.077
  250    HH2  TRP  31           HH2      TRP  31  -3.032   4.218  15.753
  251    H    LEU  32           HN       LEU  32  -6.724   0.786   8.103
  252    HA   LEU  32           HA       LEU  32  -5.169  -1.343   7.141
  253    HB2  LEU  32           HB2      LEU  32  -7.776  -0.837   6.992
  254    HB3  LEU  32           HB1      LEU  32  -7.305  -0.272   5.400
  255    HG   LEU  32           HG       LEU  32  -8.097  -2.662   5.503
  256   HD11  LEU  32          HD11      LEU  32  -6.524  -1.643   3.756
  257   HD12  LEU  32          HD12      LEU  32  -6.631  -3.400   3.858
  258   HD13  LEU  32          HD13      LEU  32  -5.257  -2.557   4.572
  259   HD21  LEU  32          HD21      LEU  32  -6.890  -4.328   6.546
  260   HD22  LEU  32          HD22      LEU  32  -6.753  -3.005   7.705
  261   HD23  LEU  32          HD23      LEU  32  -5.416  -3.364   6.613
  262    H    ILE  33           HN       ILE  33  -5.597   1.932   5.987
  263    HA   ILE  33           HA       ILE  33  -4.347   1.602   3.496
  264    HB   ILE  33           HB       ILE  33  -4.520   4.001   5.321
  265   HG12  ILE  33          HG12      ILE  33  -5.838   3.522   2.647
  266   HG13  ILE  33          HG11      ILE  33  -6.583   3.071   4.178
  267   HG21  ILE  33          HG21      ILE  33  -2.554   4.418   4.090
  268   HG22  ILE  33          HG22      ILE  33  -3.835   5.329   3.290
  269   HG23  ILE  33          HG23      ILE  33  -3.268   3.809   2.597
  270   HD11  ILE  33          HD11      ILE  33  -7.512   5.138   3.645
  271   HD12  ILE  33          HD12      ILE  33  -5.963   5.804   3.129
  272   HD13  ILE  33          HD13      ILE  33  -6.271   5.513   4.841
  273    H    LYS  34           HN       LYS  34  -2.943   2.800   6.556
  274    HA   LYS  34           HA       LYS  34  -0.285   2.805   5.582
  275    HB2  LYS  34           HB2      LYS  34   0.386   2.965   7.965
  276    HB3  LYS  34           HB1      LYS  34  -0.856   4.127   7.520
  277    HG2  LYS  34           HG2      LYS  34  -2.556   2.673   8.533
  278    HG3  LYS  34           HG1      LYS  34  -1.284   1.549   9.012
  279    HD2  LYS  34           HD2      LYS  34  -1.479   4.430   9.887
  280    HD3  LYS  34           HD1      LYS  34  -1.976   3.040  10.851
  281    HE2  LYS  34           HE2      LYS  34   0.785   3.862  10.013
  282    HE3  LYS  34           HE1      LYS  34   0.168   3.560  11.636
  283    HZ1  LYS  34           HZ1      LYS  34   0.722   1.547   9.530
  284    HZ2  LYS  34           HZ2      LYS  34  -0.070   1.192  10.982
  285    HZ3  LYS  34           HZ3      LYS  34   1.527   1.738  11.004
  286    H    GLN  35           HN       GLN  35  -2.195   0.377   7.280
  287    HA   GLN  35           HA       GLN  35  -0.032  -1.449   7.554
  288    HB2  GLN  35           HB2      GLN  35  -3.009  -1.836   7.745
  289    HB3  GLN  35           HB1      GLN  35  -1.852  -3.139   7.978
  290    HG2  GLN  35           HG2      GLN  35  -0.821  -1.819   9.807
  291    HG3  GLN  35           HG1      GLN  35  -2.121  -0.640   9.624
  292   HE21  GLN  35          HE21      GLN  35  -4.325  -1.467   9.853
  293   HE22  GLN  35          HE22      GLN  35  -4.619  -2.748  10.974
  294    H    ALA  36           HN       ALA  36  -2.581  -1.006   5.130
  295    HA   ALA  36           HA       ALA  36  -2.341  -3.389   3.760
  296    HB1  ALA  36           HB1      ALA  36  -2.988  -2.098   1.708
  297    HB2  ALA  36           HB2      ALA  36  -2.889  -0.635   2.688
  298    HB3  ALA  36           HB3      ALA  36  -4.054  -1.893   3.096
  299    H    ILE  37           HN       ILE  37  -0.386  -0.450   3.408
  300    HA   ILE  37           HA       ILE  37   1.181  -1.701   1.371
  301    HB   ILE  37           HB       ILE  37   1.004   0.665   1.273
  302   HG12  ILE  37          HG12      ILE  37   3.389   1.386   1.324
  303   HG13  ILE  37          HG11      ILE  37   3.790  -0.131   2.122
  304   HG21  ILE  37          HG21      ILE  37   2.242   0.781   4.011
  305   HG22  ILE  37          HG22      ILE  37   0.558   1.121   3.611
  306   HG23  ILE  37          HG23      ILE  37   1.838   2.167   2.997
  307   HD11  ILE  37          HD11      ILE  37   3.316  -1.385   0.225
  308   HD12  ILE  37          HD12      ILE  37   4.146   0.043  -0.393
  309   HD13  ILE  37          HD13      ILE  37   2.392  -0.081  -0.520
  310    H    PHE  38           HN       PHE  38   1.935  -0.999   4.824
  311    HA   PHE  38           HA       PHE  38   4.474  -2.310   4.544
  312    HB2  PHE  38           HB2      PHE  38   4.957  -1.265   6.466
  313    HB3  PHE  38           HB1      PHE  38   3.352  -0.556   6.414
  314    HD1  PHE  38           HD2      PHE  38   5.257  -3.473   7.703
  315    HD2  PHE  38           HD1      PHE  38   1.792  -1.030   8.071
  316    HE1  PHE  38           HE2      PHE  38   4.699  -4.589   9.822
  317    HE2  PHE  38           HE1      PHE  38   1.232  -2.141  10.193
  318    HZ   PHE  38           HZ       PHE  38   2.685  -3.923  11.069
  319    H    ASN  39           HN       ASN  39   1.308  -3.250   5.769
  320    HA   ASN  39           HA       ASN  39   2.148  -5.758   6.770
  321    HB2  ASN  39           HB2      ASN  39  -0.024  -4.618   7.387
  322    HB3  ASN  39           HB1      ASN  39  -0.626  -5.069   5.799
  323   HD21  ASN  39          HD21      ASN  39  -2.185  -5.960   7.563
  324   HD22  ASN  39          HD22      ASN  39  -1.929  -7.612   7.994
  325    H    TYR  40           HN       TYR  40   1.253  -4.504   3.608
  326    HA   TYR  40           HA       TYR  40   0.869  -6.973   2.313
  327    HB2  TYR  40           HB2      TYR  40   0.360  -5.059   1.010
  328    HB3  TYR  40           HB1      TYR  40   1.893  -4.288   1.395
  329    HD1  TYR  40           HD2      TYR  40   1.035  -7.636  -0.049
  330    HD2  TYR  40           HD1      TYR  40   3.085  -3.942  -0.531
  331    HE1  TYR  40           HE2      TYR  40   1.978  -8.443  -2.167
  332    HE2  TYR  40           HE1      TYR  40   4.035  -4.741  -2.652
  333    HH   TYR  40           HH       TYR  40   3.868  -6.332  -4.258
  334    H    LEU  41           HN       LEU  41   3.648  -5.009   3.070
  335    HA   LEU  41           HA       LEU  41   5.570  -6.759   1.970
  336    HB2  LEU  41           HB2      LEU  41   5.885  -4.604   4.034
  337    HB3  LEU  41           HB1      LEU  41   7.209  -5.432   3.231
  338    HG   LEU  41           HG       LEU  41   5.190  -3.565   1.992
  339   HD11  LEU  41          HD11      LEU  41   7.502  -3.004   3.253
  340   HD12  LEU  41          HD12      LEU  41   6.830  -2.043   1.936
  341   HD13  LEU  41          HD13      LEU  41   8.081  -3.241   1.604
  342   HD21  LEU  41          HD21      LEU  41   6.480  -3.971  -0.125
  343   HD22  LEU  41          HD22      LEU  41   5.463  -5.314   0.396
  344   HD23  LEU  41          HD23      LEU  41   7.206  -5.372   0.664
  345    H    GLU  42           HN       GLU  42   4.219  -6.341   5.204
  346    HA   GLU  42           HA       GLU  42   5.929  -8.091   6.576
  347    HB2  GLU  42           HB2      GLU  42   4.366  -6.500   7.669
  348    HB3  GLU  42           HB1      GLU  42   3.019  -7.511   7.167
  349    HG2  GLU  42           HG2      GLU  42   3.913  -9.354   8.511
  350    HG3  GLU  42           HG1      GLU  42   5.241  -8.319   9.029
  351    H    LYS  43           HN       LYS  43   2.897  -8.702   4.842
  352    HA   LYS  43           HA       LYS  43   2.607 -11.384   5.629
  353    HB2  LYS  43           HB2      LYS  43   1.602  -9.903   3.205
  354    HB3  LYS  43           HB1      LYS  43   1.182 -11.579   3.543
  355    HG2  LYS  43           HG2      LYS  43   0.192 -10.907   5.667
  356    HG3  LYS  43           HG1      LYS  43   0.621  -9.227   5.336
  357    HD2  LYS  43           HD2      LYS  43  -0.814  -9.266   3.356
  358    HD3  LYS  43           HD1      LYS  43  -1.240 -10.949   3.682
  359    HE2  LYS  43           HE2      LYS  43  -2.049 -10.132   5.956
  360    HE3  LYS  43           HE1      LYS  43  -1.912  -8.500   5.303
  361    HZ1  LYS  43           HZ1      LYS  43  -3.585  -8.886   3.762
  362    HZ2  LYS  43           HZ2      LYS  43  -4.156  -9.678   5.149
  363    HZ3  LYS  43           HZ3      LYS  43  -3.462 -10.572   3.896
  364    H    LEU  44           HN       LEU  44   4.084 -10.047   2.669
  365    HA   LEU  44           HA       LEU  44   4.917 -12.656   1.810
  366    HB2  LEU  44           HB2      LEU  44   6.059 -11.525  -0.007
  367    HB3  LEU  44           HB1      LEU  44   4.431 -10.908   0.169
  368    HG   LEU  44           HG       LEU  44   5.846  -9.109   1.656
  369   HD11  LEU  44          HD11      LEU  44   7.957 -10.218   0.903
  370   HD12  LEU  44          HD12      LEU  44   7.835  -8.507   0.497
  371   HD13  LEU  44          HD13      LEU  44   7.554  -9.728  -0.743
  372   HD21  LEU  44          HD21      LEU  44   4.154  -8.544   0.033
  373   HD22  LEU  44          HD22      LEU  44   5.209  -9.041  -1.290
  374   HD23  LEU  44          HD23      LEU  44   5.624  -7.633  -0.313
  375    H    GLU  45           HN       GLU  45   6.345  -9.917   3.372
  376    HA   GLU  45           HA       GLU  45   8.230  -9.449   4.444
  377    HB2  GLU  45           HB2      GLU  45   7.284 -11.315   5.856
  378    HB3  GLU  45           HB1      GLU  45   8.452 -12.380   5.088
  379    HG2  GLU  45           HG2      GLU  45  10.287 -11.170   5.995
  380    HG3  GLU  45           HG1      GLU  45   9.239  -9.837   6.479
  381    H1   MET  46           HT1      MET  46  -6.682  -1.667 -13.119
  382    H2   MET  46           HT2      MET  46  -6.787  -0.367 -14.196
  383    H3   MET  46           HT3      MET  46  -7.748  -0.392 -12.804
  384    HA   MET  46           HA       MET  46  -5.848  -0.178 -11.397
  385    HB2  MET  46           HB2      MET  46  -4.300  -1.442 -12.903
  386    HB3  MET  46           HB1      MET  46  -4.231  -0.035 -13.957
  387    HG2  MET  46           HG2      MET  46  -3.370   1.266 -11.991
  388    HG3  MET  46           HG1      MET  46  -3.239  -0.264 -11.129
  389    HE1  MET  46           HE1      MET  46  -2.170   1.919 -14.016
  390    HE2  MET  46           HE2      MET  46  -2.217   0.503 -15.066
  391    HE3  MET  46           HE3      MET  46  -0.668   1.218 -14.618
  392    H    ALA  47           HN       ALA  47  -7.232   1.627 -11.102
  393    HA   ALA  47           HA       ALA  47  -6.392   4.036 -12.589
  394    HB1  ALA  47           HB1      ALA  47  -8.656   4.936 -12.247
  395    HB2  ALA  47           HB2      ALA  47  -9.142   3.411 -11.507
  396    HB3  ALA  47           HB3      ALA  47  -8.676   3.457 -13.207
  397    H    THR  48           HN       THR  48  -4.866   3.486 -10.629
  398    HA   THR  48           HA       THR  48  -5.686   4.134  -8.014
  399    HB   THR  48           HB       THR  48  -3.288   4.233  -7.507
  400    HG1  THR  48           HG1      THR  48  -3.063   5.067  -9.977
  401   HG21  THR  48          HG21      THR  48  -3.918   2.004  -9.446
  402   HG22  THR  48          HG22      THR  48  -4.349   2.019  -7.737
  403   HG23  THR  48          HG23      THR  48  -2.651   1.982  -8.220
  404    H    THR  49           HN       THR  49  -5.965   6.037  -7.035
  405    HA   THR  49           HA       THR  49  -5.207   8.498  -8.459
  406    HB   THR  49           HB       THR  49  -7.232   8.152  -6.233
  407    HG1  THR  49           HG1      THR  49  -7.594   7.110  -8.432
  408   HG21  THR  49          HG21      THR  49  -6.632  10.436  -8.115
  409   HG22  THR  49          HG22      THR  49  -6.476  10.429  -6.359
  410   HG23  THR  49          HG23      THR  49  -8.073  10.347  -7.102
  411    H    THR  50           HN       THR  50  -3.934  10.048  -7.423
  412    HA   THR  50           HA       THR  50  -2.183   9.179  -5.408
  413    HB   THR  50           HB       THR  50  -2.729  12.062  -6.113
  414    HG1  THR  50           HG1      THR  50  -1.166  11.717  -7.779
  415   HG21  THR  50          HG21      THR  50  -0.372  12.369  -5.567
  416   HG22  THR  50          HG22      THR  50  -0.209  10.647  -5.228
  417   HG23  THR  50          HG23      THR  50  -1.227  11.655  -4.199
  418    H    LEU  51           HN       LEU  51  -2.772   8.737  -3.415
  419    HA   LEU  51           HA       LEU  51  -4.374  10.694  -1.912
  420    HB2  LEU  51           HB2      LEU  51  -4.583   7.685  -1.662
  421    HB3  LEU  51           HB1      LEU  51  -5.485   8.867  -0.735
  422    HG   LEU  51           HG       LEU  51  -5.757   8.363  -3.705
  423   HD11  LEU  51          HD11      LEU  51  -7.946   7.990  -1.726
  424   HD12  LEU  51          HD12      LEU  51  -6.712   6.741  -1.877
  425   HD13  LEU  51          HD13      LEU  51  -7.677   7.199  -3.280
  426   HD21  LEU  51          HD21      LEU  51  -7.748   9.879  -3.461
  427   HD22  LEU  51          HD22      LEU  51  -6.178  10.673  -3.346
  428   HD23  LEU  51          HD23      LEU  51  -7.109  10.344  -1.884
  429    H    GLY  52           HN       GLY  52  -3.836  10.798   0.349
  430    HA2  GLY  52           HA2      GLY  52  -1.064  10.419   0.877
  431    HA3  GLY  52           HA1      GLY  52  -2.273  10.954   2.034
  432    H    VAL  53           HN       VAL  53  -0.054   8.648   1.495
  433    HA   VAL  53           HA       VAL  53  -1.455   6.687   3.183
  434    HB   VAL  53           HB       VAL  53   0.322   6.040   0.814
  435   HG11  VAL  53          HG11      VAL  53  -0.975   4.221   2.833
  436   HG12  VAL  53          HG12      VAL  53   0.745   4.388   2.481
  437   HG13  VAL  53          HG13      VAL  53  -0.335   3.669   1.286
  438   HG21  VAL  53          HG21      VAL  53  -1.878   6.711   0.096
  439   HG22  VAL  53          HG22      VAL  53  -2.627   5.615   1.256
  440   HG23  VAL  53          HG23      VAL  53  -1.709   4.967  -0.102
  441    H    LYS  54           HN       LYS  54   0.227   5.237   4.322
  442    HA   LYS  54           HA       LYS  54   2.520   6.942   5.009
  443    HB2  LYS  54           HB2      LYS  54   1.110   4.879   6.700
  444    HB3  LYS  54           HB1      LYS  54   2.487   5.852   7.204
  445    HG2  LYS  54           HG2      LYS  54   1.166   7.878   6.934
  446    HG3  LYS  54           HG1      LYS  54  -0.216   6.905   6.429
  447    HD2  LYS  54           HD2      LYS  54   0.137   5.686   8.689
  448    HD3  LYS  54           HD1      LYS  54   1.054   7.130   9.125
  449    HE2  LYS  54           HE2      LYS  54  -1.299   7.284   9.814
  450    HE3  LYS  54           HE1      LYS  54  -0.861   8.528   8.641
  451    HZ1  LYS  54           HZ1      LYS  54  -2.217   5.979   7.945
  452    HZ2  LYS  54           HZ2      LYS  54  -1.903   7.276   6.905
  453    HZ3  LYS  54           HZ3      LYS  54  -3.012   7.456   8.167
  454    H    LEU  55           HN       LEU  55   4.468   6.235   4.609
  455    HA   LEU  55           HA       LEU  55   4.987   3.354   4.270
  456    HB2  LEU  55           HB2      LEU  55   5.375   5.588   2.386
  457    HB3  LEU  55           HB1      LEU  55   6.770   4.547   2.584
  458    HG   LEU  55           HG       LEU  55   4.129   3.288   2.004
  459   HD11  LEU  55          HD11      LEU  55   5.903   4.602  -0.055
  460   HD12  LEU  55          HD12      LEU  55   4.279   5.125   0.395
  461   HD13  LEU  55          HD13      LEU  55   4.517   3.566  -0.395
  462   HD21  LEU  55          HD21      LEU  55   6.835   2.619   0.903
  463   HD22  LEU  55          HD22      LEU  55   5.436   1.568   1.123
  464   HD23  LEU  55          HD23      LEU  55   6.359   2.114   2.523
  465    H    ASP  56           HN       ASP  56   6.791   2.694   5.373
  466    HA   ASP  56           HA       ASP  56   8.199   4.658   6.967
  467    HB2  ASP  56           HB2      ASP  56   9.216   1.848   6.805
  468    HB3  ASP  56           HB1      ASP  56   9.114   2.914   8.193
  469    H    ASP  57           HN       ASP  57  10.541   4.949   6.861
  470    HA   ASP  57           HA       ASP  57  11.532   5.377   4.311
  471    HB2  ASP  57           HB2      ASP  57  12.824   5.182   6.993
  472    HB3  ASP  57           HB1      ASP  57  13.868   5.134   5.578
  473    HA   PRO  58           HA       PRO  58  13.922   1.163   4.467
  474    HB2  PRO  58           HB2      PRO  58  13.030  -0.693   6.264
  475    HB3  PRO  58           HB1      PRO  58  14.374   0.407   6.585
  476    HG2  PRO  58           HG2      PRO  58  11.511   0.619   7.426
  477    HG3  PRO  58           HG1      PRO  58  12.980   0.951   8.362
  478    HD2  PRO  58           HD2      PRO  58  11.513   2.925   7.269
  479    HD3  PRO  58           HD1      PRO  58  13.282   3.028   7.393
  480    H    THR  59           HN       THR  59  10.507   1.360   5.205
  481    HA   THR  59           HA       THR  59   9.705  -0.995   3.859
  482    HB   THR  59           HB       THR  59   8.171   1.523   4.526
  483    HG1  THR  59           HG1      THR  59   7.440   0.243   6.264
  484   HG21  THR  59          HG21      THR  59   6.151   0.417   4.033
  485   HG22  THR  59          HG22      THR  59   6.949  -1.145   3.871
  486   HG23  THR  59          HG23      THR  59   7.191   0.098   2.645
  487    H    ARG  60           HN       ARG  60  10.040   2.396   2.852
  488    HA   ARG  60           HA       ARG  60   9.068   2.028   0.225
  489    HB2  ARG  60           HB2      ARG  60   9.335   4.256   1.199
  490    HB3  ARG  60           HB1      ARG  60  11.085   4.039   1.244
  491    HG2  ARG  60           HG2      ARG  60  11.140   3.896  -1.196
  492    HG3  ARG  60           HG1      ARG  60   9.391   4.112  -1.253
  493    HD2  ARG  60           HD2      ARG  60  11.161   6.129   0.086
  494    HD3  ARG  60           HD1      ARG  60  10.915   6.156  -1.660
  495    HE   ARG  60           HE       ARG  60   8.910   6.691   0.404
  496   HH11  ARG  60          HH21      ARG  60   9.759   6.481  -2.982
  497   HH12  ARG  60          HH22      ARG  60   8.332   7.292  -3.531
  498   HH21  ARG  60          HH11      ARG  60   7.010   7.769  -0.315
  499   HH22  ARG  60          HH12      ARG  60   6.764   8.031  -2.009
  500    H    GLU  61           HN       GLU  61  12.266   1.728   1.661
  501    HA   GLU  61           HA       GLU  61  13.701   1.157  -0.697
  502    HB2  GLU  61           HB2      GLU  61  14.211   0.253   2.147
  503    HB3  GLU  61           HB1      GLU  61  15.368   0.127   0.832
  504    HG2  GLU  61           HG2      GLU  61  15.403   2.555   0.620
  505    HG3  GLU  61           HG1      GLU  61  14.238   2.687   1.938
  506    H    ARG  62           HN       ARG  62  11.949  -0.829   1.610
  507    HA   ARG  62           HA       ARG  62  12.574  -3.356   0.586
  508    HB2  ARG  62           HB2      ARG  62  11.469  -3.011   2.767
  509    HB3  ARG  62           HB1      ARG  62  10.023  -2.441   1.945
  510    HG2  ARG  62           HG2      ARG  62   9.655  -4.693   2.615
  511    HG3  ARG  62           HG1      ARG  62   9.843  -4.675   0.858
  512    HD2  ARG  62           HD2      ARG  62  12.221  -5.317   1.160
  513    HD3  ARG  62           HD1      ARG  62  11.932  -5.444   2.893
  514    HE   ARG  62           HE       ARG  62  10.887  -7.456   2.551
  515   HH11  ARG  62          HH21      ARG  62  11.201  -5.804  -0.531
  516   HH12  ARG  62          HH22      ARG  62  10.777  -7.202  -1.460
  517   HH21  ARG  62          HH11      ARG  62  10.335  -9.285   1.350
  518   HH22  ARG  62          HH12      ARG  62  10.284  -9.191  -0.392
  519    H    LEU  63           HN       LEU  63  10.113  -0.993  -0.278
  520    HA   LEU  63           HA       LEU  63   8.724  -2.534  -2.172
  521    HB2  LEU  63           HB2      LEU  63   8.958   0.337  -1.539
  522    HB3  LEU  63           HB1      LEU  63   8.508  -0.025  -3.195
  523    HG   LEU  63           HG       LEU  63   6.685  -1.533  -2.132
  524   HD11  LEU  63          HD11      LEU  63   7.159   0.342   0.167
  525   HD12  LEU  63          HD12      LEU  63   7.640  -1.354   0.153
  526   HD13  LEU  63          HD13      LEU  63   5.935  -0.921   0.041
  527   HD21  LEU  63          HD21      LEU  63   5.139   0.261  -2.178
  528   HD22  LEU  63          HD22      LEU  63   6.386   0.633  -3.368
  529   HD23  LEU  63          HD23      LEU  63   6.393   1.440  -1.800
  530    H    LYS  64           HN       LYS  64  11.706  -0.661  -2.370
  531    HA   LYS  64           HA       LYS  64  12.000  -0.670  -5.161
  532    HB2  LYS  64           HB2      LYS  64  13.430   0.695  -3.718
  533    HB3  LYS  64           HB1      LYS  64  14.140  -0.755  -3.029
  534    HG2  LYS  64           HG2      LYS  64  15.678   0.191  -4.595
  535    HG3  LYS  64           HG1      LYS  64  15.056  -1.318  -5.261
  536    HD2  LYS  64           HD2      LYS  64  13.609  -0.137  -6.758
  537    HD3  LYS  64           HD1      LYS  64  13.969   1.404  -5.974
  538    HE2  LYS  64           HE2      LYS  64  16.301   1.230  -6.699
  539    HE3  LYS  64           HE1      LYS  64  15.950  -0.314  -7.471
  540    HZ1  LYS  64           HZ1      LYS  64  14.571   0.745  -9.055
  541    HZ2  LYS  64           HZ2      LYS  64  15.992   1.659  -8.983
  542    HZ3  LYS  64           HZ3      LYS  64  14.591   2.214  -8.217
  543    H    ALA  65           HN       ALA  65  12.910  -2.999  -2.719
  544    HA   ALA  65           HA       ALA  65  14.183  -4.862  -4.405
  545    HB1  ALA  65           HB1      ALA  65  14.417  -5.003  -2.001
  546    HB2  ALA  65           HB2      ALA  65  13.733  -6.508  -2.615
  547    HB3  ALA  65           HB3      ALA  65  12.692  -5.326  -1.821
  548    H    ALA  66           HN       ALA  66  10.796  -4.473  -3.450
  549    HA   ALA  66           HA       ALA  66   9.832  -6.764  -4.845
  550    HB1  ALA  66           HB1      ALA  66   7.599  -5.624  -4.592
  551    HB2  ALA  66           HB2      ALA  66   8.454  -4.288  -3.820
  552    HB3  ALA  66           HB3      ALA  66   8.481  -5.892  -3.089
  553    H    ALA  67           HN       ALA  67  10.292  -3.387  -5.618
  554    HA   ALA  67           HA       ALA  67   9.057  -3.278  -8.128
  555    HB1  ALA  67           HB1      ALA  67   9.973  -1.370  -6.702
  556    HB2  ALA  67           HB2      ALA  67  10.220  -1.255  -8.443
  557    HB3  ALA  67           HB3      ALA  67  11.546  -1.763  -7.398
  558    H    GLN  68           HN       GLN  68  12.199  -4.272  -7.099
  559    HA   GLN  68           HA       GLN  68  13.346  -4.686  -9.640
  560    HB2  GLN  68           HB2      GLN  68  13.961  -5.888  -6.936
  561    HB3  GLN  68           HB1      GLN  68  14.952  -6.145  -8.367
  562    HG2  GLN  68           HG2      GLN  68  14.320  -3.413  -7.298
  563    HG3  GLN  68           HG1      GLN  68  15.721  -4.343  -6.766
  564   HE21  GLN  68          HE21      GLN  68  14.253  -2.607  -9.402
  565   HE22  GLN  68          HE22      GLN  68  15.666  -2.517 -10.394
  566    H    SER  69           HN       SER  69  11.426  -6.738  -7.490
  567    HA   SER  69           HA       SER  69  11.771  -9.130  -8.949
  568    HB2  SER  69           HB2      SER  69  10.073 -10.078  -7.607
  569    HB3  SER  69           HB1      SER  69  10.859  -8.893  -6.570
  570    HG   SER  69           HG       SER  69   9.085  -7.441  -7.368
  571    H    ILE  70           HN       ILE  70   9.686  -6.365  -9.437
  572    HA   ILE  70           HA       ILE  70   8.283  -7.833 -11.568
  573    HB   ILE  70           HB       ILE  70   6.890  -6.651  -9.853
  574   HG12  ILE  70          HG12      ILE  70   6.536  -5.495 -12.624
  575   HG13  ILE  70          HG11      ILE  70   6.122  -7.154 -12.205
  576   HG21  ILE  70          HG21      ILE  70   6.681  -4.199 -10.025
  577   HG22  ILE  70          HG22      ILE  70   8.065  -4.184 -11.118
  578   HG23  ILE  70          HG23      ILE  70   8.265  -4.719  -9.450
  579   HD11  ILE  70          HD11      ILE  70   4.452  -6.400 -10.663
  580   HD12  ILE  70          HD12      ILE  70   4.195  -5.614 -12.221
  581   HD13  ILE  70          HD13      ILE  70   4.938  -4.720 -10.894
  582    H    ASP  71           HN       ASP  71  10.941  -6.071 -11.192
  583    HA   ASP  71           HA       ASP  71  12.366  -4.965 -12.532
  584    HB2  ASP  71           HB2      ASP  71  11.745  -6.887 -14.073
  585    HB3  ASP  71           HB1      ASP  71  10.645  -5.773 -14.875
  586    H    ARG  72           HN       ARG  72  10.469  -3.390 -11.311
  587    HA   ARG  72           HA       ARG  72  10.272  -1.233 -13.309
  588    HB2  ARG  72           HB2      ARG  72   8.035  -2.037 -11.436
  589    HB3  ARG  72           HB1      ARG  72   8.039  -0.584 -12.428
  590    HG2  ARG  72           HG2      ARG  72   8.130  -1.968 -14.448
  591    HG3  ARG  72           HG1      ARG  72   8.123  -3.419 -13.446
  592    HD2  ARG  72           HD2      ARG  72   5.928  -2.604 -12.504
  593    HD3  ARG  72           HD1      ARG  72   5.931  -1.385 -13.779
  594    HE   ARG  72           HE       ARG  72   6.336  -3.853 -14.997
  595   HH11  ARG  72          HH21      ARG  72   3.816  -2.185 -13.237
  596   HH12  ARG  72          HH22      ARG  72   2.532  -3.121 -13.920
  597   HH21  ARG  72          HH11      ARG  72   4.633  -5.089 -15.920
  598   HH22  ARG  72          HH12      ARG  72   2.994  -4.763 -15.459
  599    H    THR  73           HN       THR  73   9.895   0.937 -12.207
  600    HA   THR  73           HA       THR  73  11.747   1.122 -10.004
  601    HB   THR  73           HB       THR  73  11.321   2.754 -12.097
  602    HG1  THR  73           HG1      THR  73  12.461   4.358 -10.799
  603   HG21  THR  73          HG21      THR  73  10.120   4.705 -11.586
  604   HG22  THR  73          HG22      THR  73   9.981   4.277  -9.882
  605   HG23  THR  73          HG23      THR  73   9.058   3.386 -11.092
  606    HA   PRO  74           HA       PRO  74   9.192   1.295  -6.403
  607    HB2  PRO  74           HB2      PRO  74  10.090   4.121  -6.037
  608    HB3  PRO  74           HB1      PRO  74  10.042   2.793  -4.870
  609    HG2  PRO  74           HG2      PRO  74  12.338   3.499  -5.985
  610    HG3  PRO  74           HG1      PRO  74  11.946   1.787  -5.738
  611    HD2  PRO  74           HD2      PRO  74  11.932   3.390  -8.249
  612    HD3  PRO  74           HD1      PRO  74  12.342   1.682  -8.001
  613    H    HIS  75           HN       HIS  75   8.907   4.075  -8.579
  614    HA   HIS  75           HA       HIS  75   6.565   5.202  -7.538
  615    HB2  HIS  75           HB2      HIS  75   7.923   6.273  -9.285
  616    HB3  HIS  75           HB1      HIS  75   7.480   5.007 -10.421
  617    HD1  HIS  75           HD1      HIS  75   5.447   5.406 -11.802
  618    HD2  HIS  75           HD2      HIS  75   5.665   7.967  -8.538
  619    HE1  HIS  75           HE1      HIS  75   3.607   7.081 -12.140
  620    HE2  HIS  75           HE2      HIS  75   3.992   8.796 -10.336
  621    H    TRP  76           HN       TRP  76   7.052   2.656  -9.913
  622    HA   TRP  76           HA       TRP  76   4.298   2.161 -10.374
  623    HB2  TRP  76           HB2      TRP  76   6.735   0.461 -10.908
  624    HB3  TRP  76           HB1      TRP  76   5.112   0.102 -11.497
  625    HD1  TRP  76           HD1      TRP  76   8.202   1.886 -12.449
  626    HE1  TRP  76           HE1      TRP  76   7.799   3.337 -14.536
  627    HE3  TRP  76           HE3      TRP  76   3.097   1.700 -12.582
  628    HZ2  TRP  76           HZ2      TRP  76   5.601   4.278 -16.036
  629    HZ3  TRP  76           HZ3      TRP  76   1.919   2.905 -14.374
  630    HH2  TRP  76           HH2      TRP  76   3.147   4.167 -16.064
  631    H    LEU  77           HN       LEU  77   6.800   0.738  -8.409
  632    HA   LEU  77           HA       LEU  77   5.242  -1.378  -7.431
  633    HB2  LEU  77           HB2      LEU  77   7.851  -0.877  -7.288
  634    HB3  LEU  77           HB1      LEU  77   7.382  -0.305  -5.698
  635    HG   LEU  77           HG       LEU  77   8.169  -2.697  -5.792
  636   HD11  LEU  77          HD11      LEU  77   6.599  -1.672  -4.048
  637   HD12  LEU  77          HD12      LEU  77   6.697  -3.429  -4.148
  638   HD13  LEU  77          HD13      LEU  77   5.327  -2.580  -4.864
  639   HD21  LEU  77          HD21      LEU  77   6.961  -4.364  -6.832
  640   HD22  LEU  77          HD22      LEU  77   6.826  -3.044  -7.994
  641   HD23  LEU  77          HD23      LEU  77   5.488  -3.399  -6.902
  642    H    ILE  78           HN       ILE  78   5.675   1.902  -6.297
  643    HA   ILE  78           HA       ILE  78   4.427   1.583  -3.802
  644    HB   ILE  78           HB       ILE  78   4.602   3.976  -5.634
  645   HG12  ILE  78          HG12      ILE  78   5.921   3.506  -2.960
  646   HG13  ILE  78          HG11      ILE  78   6.663   3.043  -4.488
  647   HG21  ILE  78          HG21      ILE  78   2.638   4.399  -4.402
  648   HG22  ILE  78          HG22      ILE  78   3.921   5.311  -3.606
  649   HG23  ILE  78          HG23      ILE  78   3.353   3.794  -2.907
  650   HD11  ILE  78          HD11      ILE  78   7.599   5.110  -3.970
  651   HD12  ILE  78          HD12      ILE  78   6.053   5.784  -3.455
  652   HD13  ILE  78          HD13      ILE  78   6.357   5.482  -5.166
  653    H    LYS  79           HN       LYS  79   3.025   2.768  -6.866
  654    HA   LYS  79           HA       LYS  79   0.368   2.786  -5.889
  655    HB2  LYS  79           HB2      LYS  79  -0.310   2.948  -8.266
  656    HB3  LYS  79           HB1      LYS  79   0.947   4.098  -7.836
  657    HG2  LYS  79           HG2      LYS  79   2.622   2.606  -8.850
  658    HG3  LYS  79           HG1      LYS  79   1.323   1.515  -9.332
  659    HD2  LYS  79           HD2      LYS  79   1.578   4.397 -10.189
  660    HD3  LYS  79           HD1      LYS  79   2.052   3.005 -11.162
  661    HE2  LYS  79           HE2      LYS  79  -0.698   3.859 -10.316
  662    HE3  LYS  79           HE1      LYS  79  -0.083   3.583 -11.945
  663    HZ1  LYS  79           HZ1      LYS  79  -0.666   1.534  -9.881
  664    HZ2  LYS  79           HZ2      LYS  79   0.121   1.200 -11.340
  665    HZ3  LYS  79           HZ3      LYS  79  -1.468   1.767 -11.351
  666    H    GLN  80           HN       GLN  80   2.273   0.347  -7.579
  667    HA   GLN  80           HA       GLN  80   0.105  -1.476  -7.843
  668    HB2  GLN  80           HB2      GLN  80   3.081  -1.865  -8.032
  669    HB3  GLN  80           HB1      GLN  80   1.926  -3.171  -8.257
  670    HG2  GLN  80           HG2      GLN  80   0.898  -1.868 -10.098
  671    HG3  GLN  80           HG1      GLN  80   2.189  -0.680  -9.916
  672   HE21  GLN  80          HE21      GLN  80   4.391  -1.470 -10.159
  673   HE22  GLN  80          HE22      GLN  80   4.702  -2.761 -11.264
  674    H    ALA  81           HN       ALA  81   2.667  -1.038  -5.429
  675    HA   ALA  81           HA       ALA  81   2.418  -3.408  -4.042
  676    HB1  ALA  81           HB1      ALA  81   3.065  -2.104  -1.996
  677    HB2  ALA  81           HB2      ALA  81   2.965  -0.645  -2.983
  678    HB3  ALA  81           HB3      ALA  81   4.132  -1.905  -3.384
  679    H    ILE  82           HN       ILE  82   0.466  -0.462  -3.701
  680    HA   ILE  82           HA       ILE  82  -1.104  -1.705  -1.660
  681    HB   ILE  82           HB       ILE  82  -0.921   0.661  -1.568
  682   HG12  ILE  82          HG12      ILE  82  -3.305   1.389  -1.621
  683   HG13  ILE  82          HG11      ILE  82  -3.709  -0.131  -2.413
  684   HG21  ILE  82          HG21      ILE  82  -2.161   0.775  -4.305
  685   HG22  ILE  82          HG22      ILE  82  -0.477   1.112  -3.908
  686   HG23  ILE  82          HG23      ILE  82  -1.754   2.162  -3.294
  687   HD11  ILE  82          HD11      ILE  82  -3.238  -1.378  -0.512
  688   HD12  ILE  82          HD12      ILE  82  -4.063   0.055   0.102
  689   HD13  ILE  82          HD13      ILE  82  -2.309  -0.075   0.228
  690    H    PHE  83           HN       PHE  83  -1.856  -1.009  -5.113
  691    HA   PHE  83           HA       PHE  83  -4.399  -2.312  -4.831
  692    HB2  PHE  83           HB2      PHE  83  -4.881  -1.269  -6.754
  693    HB3  PHE  83           HB1      PHE  83  -3.273  -0.565  -6.706
  694    HD1  PHE  83           HD2      PHE  83  -5.190  -3.479  -7.985
  695    HD2  PHE  83           HD1      PHE  83  -1.716  -1.051  -8.363
  696    HE1  PHE  83           HE2      PHE  83  -4.637  -4.605 -10.100
  697    HE2  PHE  83           HE1      PHE  83  -1.161  -2.172 -10.480
  698    HZ   PHE  83           HZ       PHE  83  -2.620  -3.952 -11.350
  699    H    ASN  84           HN       ASN  84  -1.234  -3.264  -6.044
  700    HA   ASN  84           HA       ASN  84  -2.087  -5.769  -7.046
  701    HB2  ASN  84           HB2      ASN  84   0.073  -4.638  -7.694
  702    HB3  ASN  84           HB1      ASN  84   0.694  -5.067  -6.105
  703   HD21  ASN  84          HD21      ASN  84   2.303  -6.038  -7.650
  704   HD22  ASN  84          HD22      ASN  84   2.031  -7.672  -8.137
  705    H    TYR  85           HN       TYR  85  -1.178  -4.515  -3.889
  706    HA   TYR  85           HA       TYR  85  -0.792  -6.986  -2.592
  707    HB2  TYR  85           HB2      TYR  85  -0.280  -5.071  -1.288
  708    HB3  TYR  85           HB1      TYR  85  -1.808  -4.295  -1.680
  709    HD1  TYR  85           HD2      TYR  85  -0.969  -7.640  -0.219
  710    HD2  TYR  85           HD1      TYR  85  -3.001  -3.934   0.241
  711    HE1  TYR  85           HE2      TYR  85  -1.919  -8.431   1.902
  712    HE2  TYR  85           HE1      TYR  85  -3.959  -4.716   2.365
  713    HH   TYR  85           HH       TYR  85  -3.844  -6.303   3.960
  714    H    LEU  86           HN       LEU  86  -3.560  -5.013  -3.348
  715    HA   LEU  86           HA       LEU  86  -5.494  -6.752  -2.257
  716    HB2  LEU  86           HB2      LEU  86  -5.791  -4.591  -4.317
  717    HB3  LEU  86           HB1      LEU  86  -7.123  -5.418  -3.525
  718    HG   LEU  86           HG       LEU  86  -5.105  -3.559  -2.271
  719   HD11  LEU  86          HD11      LEU  86  -7.416  -2.995  -3.536
  720   HD12  LEU  86          HD12      LEU  86  -6.741  -2.035  -2.220
  721   HD13  LEU  86          HD13      LEU  86  -7.994  -3.231  -1.886
  722   HD21  LEU  86          HD21      LEU  86  -6.399  -3.969  -0.159
  723   HD22  LEU  86          HD22      LEU  86  -5.385  -5.313  -0.681
  724   HD23  LEU  86          HD23      LEU  86  -7.128  -5.366  -0.952
  725    H    GLU  87           HN       GLU  87  -4.126  -6.349  -5.492
  726    HA   GLU  87           HA       GLU  87  -5.852  -8.086  -6.868
  727    HB2  GLU  87           HB2      GLU  87  -4.268  -6.514  -7.962
  728    HB3  GLU  87           HB1      GLU  87  -2.934  -7.534  -7.447
  729    HG2  GLU  87           HG2      GLU  87  -3.847  -9.379  -8.787
  730    HG3  GLU  87           HG1      GLU  87  -5.142  -8.320  -9.333
  731    H    LYS  88           HN       LYS  88  -2.841  -8.712  -5.114
  732    HA   LYS  88           HA       LYS  88  -2.565 -11.407  -5.872
  733    HB2  LYS  88           HB2      LYS  88  -1.560  -9.896  -3.466
  734    HB3  LYS  88           HB1      LYS  88  -1.148 -11.578  -3.779
  735    HG2  LYS  88           HG2      LYS  88  -0.146 -10.943  -5.907
  736    HG3  LYS  88           HG1      LYS  88  -0.561  -9.254  -5.604
  737    HD2  LYS  88           HD2      LYS  88   0.856  -9.275  -3.612
  738    HD3  LYS  88           HD1      LYS  88   1.266 -10.965  -3.914
  739    HE2  LYS  88           HE2      LYS  88   2.105 -10.181  -6.188
  740    HE3  LYS  88           HE1      LYS  88   1.987  -8.544  -5.545
  741    HZ1  LYS  88           HZ1      LYS  88   3.636  -8.938  -3.996
  742    HZ2  LYS  88           HZ2      LYS  88   4.207  -9.774  -5.356
  743    HZ3  LYS  88           HZ3      LYS  88   3.480 -10.624  -4.089
  744    H    LEU  89           HN       LEU  89  -4.053 -10.013  -2.938
  745    HA   LEU  89           HA       LEU  89  -4.898 -12.611  -2.050
  746    HB2  LEU  89           HB2      LEU  89  -5.987 -11.476  -0.224
  747    HB3  LEU  89           HB1      LEU  89  -4.365 -10.852  -0.433
  748    HG   LEU  89           HG       LEU  89  -5.817  -9.060  -1.899
  749   HD11  LEU  89          HD11      LEU  89  -7.909 -10.185  -1.109
  750   HD12  LEU  89          HD12      LEU  89  -7.792  -8.471  -0.709
  751   HD13  LEU  89          HD13      LEU  89  -7.482  -9.686   0.530
  752   HD21  LEU  89          HD21      LEU  89  -4.099  -8.488  -0.300
  753   HD22  LEU  89          HD22      LEU  89  -5.136  -8.982   1.038
  754   HD23  LEU  89          HD23      LEU  89  -5.565  -7.577   0.062
  755    H    GLU  90           HN       GLU  90  -6.286  -9.902  -3.684
  756    HA   GLU  90           HA       GLU  90  -8.212  -9.410  -4.690
  757    HB2  GLU  90           HB2      GLU  90  -7.273 -11.188  -6.176
  758    HB3  GLU  90           HB1      GLU  90  -8.326 -12.345  -5.370
  759    HG2  GLU  90           HG2      GLU  90 -10.277 -11.238  -6.165
  760    HG3  GLU  90           HG1      GLU  90  -9.335  -9.861  -6.725
  Start of MODEL   22
    1    H1   MET   1           HT1      MET   1   3.057   0.941  11.073
    2    H2   MET   1           HT2      MET   1   3.391  -0.717  11.065
    3    H3   MET   1           HT3      MET   1   4.446   0.366  10.301
    4    HA   MET   1           HA       MET   1   3.910   0.181  13.208
    5    HB2  MET   1           HB2      MET   1   6.577  -0.166  12.901
    6    HB3  MET   1           HB1      MET   1   5.429  -1.500  12.941
    7    HG2  MET   1           HG2      MET   1   5.320  -1.444  10.484
    8    HG3  MET   1           HG1      MET   1   6.523  -0.158  10.481
    9    HE1  MET   1           HE1      MET   1   6.874  -2.238   8.698
   10    HE2  MET   1           HE2      MET   1   8.207  -3.351   9.009
   11    HE3  MET   1           HE3      MET   1   8.505  -1.613   8.950
   12    H    ALA   2           HN       ALA   2   6.801   1.341  11.604
   13    HA   ALA   2           HA       ALA   2   6.373   3.979  12.812
   14    HB1  ALA   2           HB1      ALA   2   8.495   2.862  13.329
   15    HB2  ALA   2           HB2      ALA   2   8.778   4.317  12.373
   16    HB3  ALA   2           HB3      ALA   2   8.857   2.730  11.608
   17    H    THR   3           HN       THR   3   4.748   3.425  10.775
   18    HA   THR   3           HA       THR   3   5.681   4.054   8.186
   19    HB   THR   3           HB       THR   3   3.206   4.317   7.730
   20    HG1  THR   3           HG1      THR   3   2.969   4.800  10.177
   21   HG21  THR   3          HG21      THR   3   4.025   1.781   9.155
   22   HG22  THR   3          HG22      THR   3   4.361   2.149   7.464
   23   HG23  THR   3          HG23      THR   3   2.696   1.948   8.008
   24    H    THR   4           HN       THR   4   5.939   5.954   7.206
   25    HA   THR   4           HA       THR   4   5.140   8.410   8.624
   26    HB   THR   4           HB       THR   4   7.227   8.120   6.449
   27    HG1  THR   4           HG1      THR   4   7.509   7.037   8.672
   28   HG21  THR   4          HG21      THR   4   6.688  10.328   8.444
   29   HG22  THR   4          HG22      THR   4   6.359  10.392   6.712
   30   HG23  THR   4          HG23      THR   4   8.022  10.292   7.291
   31    H    THR   5           HN       THR   5   4.022  10.036   7.462
   32    HA   THR   5           HA       THR   5   2.273   9.154   5.439
   33    HB   THR   5           HB       THR   5   2.896  12.043   6.028
   34    HG1  THR   5           HG1      THR   5   1.924  11.843   7.924
   35   HG21  THR   5          HG21      THR   5   0.354  10.622   5.219
   36   HG22  THR   5          HG22      THR   5   1.366  11.610   4.166
   37   HG23  THR   5          HG23      THR   5   0.517  12.352   5.521
   38    H    LEU   6           HN       LEU   6   2.911   8.633   3.471
   39    HA   LEU   6           HA       LEU   6   4.651  10.475   1.973
   40    HB2  LEU   6           HB2      LEU   6   4.596   7.466   1.676
   41    HB3  LEU   6           HB1      LEU   6   5.634   8.583   0.816
   42    HG   LEU   6           HG       LEU   6   5.776   7.916   3.762
   43   HD11  LEU   6          HD11      LEU   6   7.884   7.473   1.679
   44   HD12  LEU   6          HD12      LEU   6   6.636   6.274   2.005
   45   HD13  LEU   6          HD13      LEU   6   7.747   6.758   3.286
   46   HD21  LEU   6          HD21      LEU   6   6.351  10.227   3.520
   47   HD22  LEU   6          HD22      LEU   6   7.360   9.882   2.115
   48   HD23  LEU   6          HD23      LEU   6   7.846   9.311   3.712
   49    H    GLY   7           HN       GLY   7   4.156  10.643  -0.277
   50    HA2  GLY   7           HA2      GLY   7   1.372  10.392  -0.880
   51    HA3  GLY   7           HA1      GLY   7   2.630  10.937  -1.981
   52    H    VAL   8           HN       VAL   8   0.347   8.647  -1.580
   53    HA   VAL   8           HA       VAL   8   1.825   6.694  -3.221
   54    HB   VAL   8           HB       VAL   8  -0.057   6.105  -0.923
   55   HG11  VAL   8          HG11      VAL   8  -0.583   4.521  -2.636
   56   HG12  VAL   8          HG12      VAL   8   0.370   3.711  -1.393
   57   HG13  VAL   8          HG13      VAL   8   1.125   4.183  -2.915
   58   HG21  VAL   8          HG21      VAL   8   2.850   5.448  -1.351
   59   HG22  VAL   8          HG22      VAL   8   1.868   4.889   0.003
   60   HG23  VAL   8          HG23      VAL   8   2.186   6.611  -0.204
   61    H    LYS   9           HN       LYS   9   0.366   5.342  -4.581
   62    HA   LYS   9           HA       LYS   9  -1.952   6.928  -5.432
   63    HB2  LYS   9           HB2      LYS   9  -0.448   4.797  -6.971
   64    HB3  LYS   9           HB1      LYS   9  -1.740   5.809  -7.593
   65    HG2  LYS   9           HG2      LYS   9   0.141   6.815  -8.443
   66    HG3  LYS   9           HG1      LYS   9  -0.191   7.777  -7.001
   67    HD2  LYS   9           HD2      LYS   9   1.497   6.564  -5.761
   68    HD3  LYS   9           HD1      LYS   9   1.776   5.492  -7.135
   69    HE2  LYS   9           HE2      LYS   9   2.793   7.170  -8.392
   70    HE3  LYS   9           HE1      LYS   9   2.101   8.455  -7.403
   71    HZ1  LYS   9           HZ1      LYS   9   4.211   6.555  -6.547
   72    HZ2  LYS   9           HZ2      LYS   9   3.531   7.766  -5.580
   73    HZ3  LYS   9           HZ3      LYS   9   4.438   8.186  -6.946
   74    H    LEU  10           HN       LEU  10  -3.922   6.158  -5.047
   75    HA   LEU  10           HA       LEU  10  -4.294   3.265  -4.626
   76    HB2  LEU  10           HB2      LEU  10  -4.706   5.465  -2.758
   77    HB3  LEU  10           HB1      LEU  10  -6.153   4.503  -2.986
   78    HG   LEU  10           HG       LEU  10  -3.537   3.193  -2.326
   79   HD11  LEU  10          HD11      LEU  10  -4.187   3.292   0.033
   80   HD12  LEU  10          HD12      LEU  10  -5.530   4.356  -0.391
   81   HD13  LEU  10          HD13      LEU  10  -3.868   4.892  -0.636
   82   HD21  LEU  10          HD21      LEU  10  -6.442   2.487  -1.998
   83   HD22  LEU  10          HD22      LEU  10  -5.118   1.559  -1.294
   84   HD23  LEU  10          HD23      LEU  10  -5.254   1.713  -3.046
   85    H    ASP  11           HN       ASP  11  -6.146   2.429  -5.532
   86    HA   ASP  11           HA       ASP  11  -7.648   4.125  -7.331
   87    HB2  ASP  11           HB2      ASP  11  -8.337   1.267  -6.620
   88    HB3  ASP  11           HB1      ASP  11  -8.709   2.124  -8.107
   89    H    ASP  12           HN       ASP  12  -9.806   4.775  -7.088
   90    HA   ASP  12           HA       ASP  12 -10.792   5.280  -4.550
   91    HB2  ASP  12           HB2      ASP  12 -11.875   5.444  -7.277
   92    HB3  ASP  12           HB1      ASP  12 -13.100   5.251  -6.027
   93    HA   PRO  13           HA       PRO  13 -13.833   1.492  -4.916
   94    HB2  PRO  13           HB2      PRO  13 -12.994  -0.506  -6.607
   95    HB3  PRO  13           HB1      PRO  13 -14.191   0.721  -7.029
   96    HG2  PRO  13           HG2      PRO  13 -11.273   0.622  -7.673
   97    HG3  PRO  13           HG1      PRO  13 -12.634   1.110  -8.700
   98    HD2  PRO  13           HD2      PRO  13 -11.044   2.922  -7.533
   99    HD3  PRO  13           HD1      PRO  13 -12.787   3.201  -7.726
  100    H    THR  14           HN       THR  14 -10.373   0.963  -5.438
  101    HA   THR  14           HA       THR  14 -10.274  -1.370  -3.825
  102    HB   THR  14           HB       THR  14  -8.540  -0.383  -5.618
  103    HG1  THR  14           HG1      THR  14  -7.088  -1.967  -4.749
  104   HG21  THR  14          HG21      THR  14  -7.831   1.455  -4.099
  105   HG22  THR  14          HG22      THR  14  -6.512   0.387  -4.578
  106   HG23  THR  14          HG23      THR  14  -7.229   0.238  -2.973
  107    H    ARG  15           HN       ARG  15  -9.990   2.083  -3.171
  108    HA   ARG  15           HA       ARG  15  -8.935   1.847  -0.552
  109    HB2  ARG  15           HB2      ARG  15  -9.065   4.004  -1.828
  110    HB3  ARG  15           HB1      ARG  15 -10.806   4.012  -1.569
  111    HG2  ARG  15           HG2      ARG  15 -10.439   4.093   0.848
  112    HG3  ARG  15           HG1      ARG  15  -8.695   4.096   0.582
  113    HD2  ARG  15           HD2      ARG  15  -8.926   6.201  -0.693
  114    HD3  ARG  15           HD1      ARG  15 -10.651   6.205  -0.320
  115    HE   ARG  15           HE       ARG  15  -9.551   6.044   2.118
  116   HH11  ARG  15          HH21      ARG  15  -8.981   8.205  -0.582
  117   HH12  ARG  15          HH22      ARG  15  -8.502   9.541   0.415
  118   HH21  ARG  15          HH11      ARG  15  -8.906   7.810   3.443
  119   HH22  ARG  15          HH12      ARG  15  -8.462   9.313   2.707
  120    H    GLU  16           HN       GLU  16 -12.189   1.837  -1.877
  121    HA   GLU  16           HA       GLU  16 -13.597   1.626   0.553
  122    HB2  GLU  16           HB2      GLU  16 -14.798   2.203  -1.441
  123    HB3  GLU  16           HB1      GLU  16 -14.252   0.751  -2.264
  124    HG2  GLU  16           HG2      GLU  16 -16.599   0.638  -1.592
  125    HG3  GLU  16           HG1      GLU  16 -15.616  -0.625  -0.860
  126    H    ARG  17           HN       ARG  17 -12.180  -0.748  -1.618
  127    HA   ARG  17           HA       ARG  17 -13.066  -3.054  -0.282
  128    HB2  ARG  17           HB2      ARG  17 -11.669  -2.632  -2.570
  129    HB3  ARG  17           HB1      ARG  17 -10.364  -3.140  -1.511
  130    HG2  ARG  17           HG2      ARG  17 -12.882  -4.714  -2.033
  131    HG3  ARG  17           HG1      ARG  17 -11.325  -4.996  -2.809
  132    HD2  ARG  17           HD2      ARG  17 -12.087  -5.390   0.067
  133    HD3  ARG  17           HD1      ARG  17 -11.453  -6.573  -1.078
  134    HE   ARG  17           HE       ARG  17  -9.538  -4.593  -0.818
  135   HH11  ARG  17          HH21      ARG  17 -11.056  -7.034   1.181
  136   HH12  ARG  17          HH22      ARG  17  -9.709  -7.169   2.262
  137   HH21  ARG  17          HH11      ARG  17  -7.762  -4.752   0.612
  138   HH22  ARG  17          HH12      ARG  17  -7.830  -5.868   1.935
  139    H    LEU  18           HN       LEU  18 -10.273  -0.944   0.149
  140    HA   LEU  18           HA       LEU  18  -8.924  -2.433   2.102
  141    HB2  LEU  18           HB2      LEU  18  -8.923   0.382   1.216
  142    HB3  LEU  18           HB1      LEU  18  -8.423   0.136   2.877
  143    HG   LEU  18           HG       LEU  18  -6.888  -1.721   1.663
  144   HD11  LEU  18          HD11      LEU  18  -6.035  -0.946  -0.403
  145   HD12  LEU  18          HD12      LEU  18  -6.971   0.547  -0.307
  146   HD13  LEU  18          HD13      LEU  18  -7.791  -0.994  -0.560
  147   HD21  LEU  18          HD21      LEU  18  -6.106   1.180   1.782
  148   HD22  LEU  18          HD22      LEU  18  -5.080  -0.239   1.997
  149   HD23  LEU  18          HD23      LEU  18  -6.285   0.170   3.217
  150    H    LYS  19           HN       LYS  19 -11.645  -0.216   2.282
  151    HA   LYS  19           HA       LYS  19 -11.790   0.037   5.065
  152    HB2  LYS  19           HB2      LYS  19 -13.245   0.997   2.936
  153    HB3  LYS  19           HB1      LYS  19 -14.389  -0.081   3.722
  154    HG2  LYS  19           HG2      LYS  19 -12.880   2.034   5.221
  155    HG3  LYS  19           HG1      LYS  19 -14.423   2.347   4.427
  156    HD2  LYS  19           HD2      LYS  19 -14.017   0.163   6.462
  157    HD3  LYS  19           HD1      LYS  19 -14.547   1.792   6.883
  158    HE2  LYS  19           HE2      LYS  19 -16.416   1.442   5.187
  159    HE3  LYS  19           HE1      LYS  19 -15.958  -0.259   5.202
  160    HZ1  LYS  19           HZ1      LYS  19 -17.746   0.092   6.741
  161    HZ2  LYS  19           HZ2      LYS  19 -16.909   1.332   7.527
  162    HZ3  LYS  19           HZ3      LYS  19 -16.349  -0.259   7.627
  163    H    ALA  20           HN       ALA  20 -13.136  -2.327   2.872
  164    HA   ALA  20           HA       ALA  20 -14.569  -3.853   4.748
  165    HB1  ALA  20           HB1      ALA  20 -14.827  -4.047   2.285
  166    HB2  ALA  20           HB2      ALA  20 -14.609  -5.603   3.088
  167    HB3  ALA  20           HB3      ALA  20 -13.264  -4.862   2.220
  168    H    ALA  21           HN       ALA  21 -11.227  -4.006   3.615
  169    HA   ALA  21           HA       ALA  21 -10.487  -6.300   5.125
  170    HB1  ALA  21           HB1      ALA  21  -9.098  -5.704   3.293
  171    HB2  ALA  21           HB2      ALA  21  -8.143  -5.448   4.754
  172    HB3  ALA  21           HB3      ALA  21  -8.861  -4.071   3.916
  173    H    ALA  22           HN       ALA  22 -10.486  -2.849   5.706
  174    HA   ALA  22           HA       ALA  22  -9.184  -2.824   8.191
  175    HB1  ALA  22           HB1      ALA  22 -10.039  -0.643   8.460
  176    HB2  ALA  22           HB2      ALA  22 -11.438  -0.982   7.441
  177    HB3  ALA  22           HB3      ALA  22  -9.834  -0.842   6.720
  178    H    GLN  23           HN       GLN  23 -12.461  -3.339   7.239
  179    HA   GLN  23           HA       GLN  23 -13.587  -3.520   9.817
  180    HB2  GLN  23           HB2      GLN  23 -14.502  -4.639   7.158
  181    HB3  GLN  23           HB1      GLN  23 -15.472  -4.674   8.627
  182    HG2  GLN  23           HG2      GLN  23 -14.405  -2.169   7.361
  183    HG3  GLN  23           HG1      GLN  23 -16.016  -2.815   7.069
  184   HE21  GLN  23          HE21      GLN  23 -13.933  -1.180   9.302
  185   HE22  GLN  23          HE22      GLN  23 -15.146  -0.781  10.470
  186    H    SER  24           HN       SER  24 -12.184  -5.940   7.615
  187    HA   SER  24           HA       SER  24 -12.818  -8.141   9.294
  188    HB2  SER  24           HB2      SER  24 -11.284  -9.445   7.883
  189    HB3  SER  24           HB1      SER  24 -12.382  -8.471   6.909
  190    HG   SER  24           HG       SER  24  -9.620  -8.183   7.324
  191    H    ILE  25           HN       ILE  25 -10.423  -5.725   9.411
  192    HA   ILE  25           HA       ILE  25  -8.805  -7.285  11.291
  193    HB   ILE  25           HB       ILE  25  -7.988  -5.742   9.198
  194   HG12  ILE  25          HG12      ILE  25  -6.612  -7.388  10.314
  195   HG13  ILE  25          HG11      ILE  25  -5.723  -5.878  10.173
  196   HG21  ILE  25          HG21      ILE  25  -7.675  -4.000  11.628
  197   HG22  ILE  25          HG22      ILE  25  -8.655  -3.656  10.204
  198   HG23  ILE  25          HG23      ILE  25  -6.899  -3.735  10.067
  199   HD11  ILE  25          HD11      ILE  25  -5.321  -6.876  12.318
  200   HD12  ILE  25          HD12      ILE  25  -7.053  -6.961  12.642
  201   HD13  ILE  25          HD13      ILE  25  -6.253  -5.393  12.531
  202    H    ASP  26           HN       ASP  26 -11.385  -5.351  11.264
  203    HA   ASP  26           HA       ASP  26 -12.581  -4.208  12.778
  204    HB2  ASP  26           HB2      ASP  26 -11.898  -6.218  14.190
  205    HB3  ASP  26           HB1      ASP  26 -10.674  -5.176  14.904
  206    H    ARG  27           HN       ARG  27 -10.616  -2.770  11.409
  207    HA   ARG  27           HA       ARG  27 -10.226  -0.636  13.384
  208    HB2  ARG  27           HB2      ARG  27  -8.031  -1.704  11.599
  209    HB3  ARG  27           HB1      ARG  27  -7.939  -0.165  12.450
  210    HG2  ARG  27           HG2      ARG  27  -8.195  -1.355  14.590
  211    HG3  ARG  27           HG1      ARG  27  -8.224  -2.885  13.715
  212    HD2  ARG  27           HD2      ARG  27  -5.944  -0.916  13.775
  213    HD3  ARG  27           HD1      ARG  27  -6.026  -2.433  14.667
  214    HE   ARG  27           HE       ARG  27  -6.253  -2.601  11.773
  215   HH11  ARG  27          HH21      ARG  27  -4.247  -2.959  14.628
  216   HH12  ARG  27          HH22      ARG  27  -3.052  -3.930  13.830
  217   HH21  ARG  27          HH11      ARG  27  -4.626  -3.842  10.697
  218   HH22  ARG  27          HH12      ARG  27  -3.264  -4.421  11.598
  219    H    THR  28           HN       THR  28  -9.547   1.445  12.234
  220    HA   THR  28           HA       THR  28 -11.443   1.924  10.133
  221    HB   THR  28           HB       THR  28 -11.264   4.104  10.708
  222    HG1  THR  28           HG1      THR  28  -8.542   4.331  11.124
  223   HG21  THR  28          HG21      THR  28 -11.040   2.987  12.929
  224   HG22  THR  28          HG22      THR  28 -10.345   4.607  12.868
  225   HG23  THR  28          HG23      THR  28  -9.292   3.194  12.799
  226    HA   PRO  29           HA       PRO  29  -8.977   1.427   6.505
  227    HB2  PRO  29           HB2      PRO  29  -9.200   3.934   5.296
  228    HB3  PRO  29           HB1      PRO  29 -10.314   2.579   5.093
  229    HG2  PRO  29           HG2      PRO  29 -10.539   4.963   6.863
  230    HG3  PRO  29           HG1      PRO  29 -11.803   4.094   5.973
  231    HD2  PRO  29           HD2      PRO  29 -11.492   3.788   8.616
  232    HD3  PRO  29           HD1      PRO  29 -11.962   2.428   7.576
  233    H    HIS  30           HN       HIS  30  -8.347   4.115   8.631
  234    HA   HIS  30           HA       HIS  30  -5.943   5.039   7.488
  235    HB2  HIS  30           HB2      HIS  30  -6.904   5.028  10.355
  236    HB3  HIS  30           HB1      HIS  30  -5.391   5.781   9.863
  237    HD1  HIS  30           HD1      HIS  30  -8.554   6.835  10.739
  238    HD2  HIS  30           HD2      HIS  30  -6.204   7.505   7.378
  239    HE1  HIS  30           HE1      HIS  30  -9.462   8.939   9.705
  240    HE2  HIS  30           HE2      HIS  30  -7.938   9.406   7.750
  241    H    TRP  31           HN       TRP  31  -6.641   2.492   9.800
  242    HA   TRP  31           HA       TRP  31  -3.936   1.741  10.179
  243    HB2  TRP  31           HB2      TRP  31  -6.571   0.491  10.827
  244    HB3  TRP  31           HB1      TRP  31  -5.100  -0.469  10.946
  245    HD1  TRP  31           HD1      TRP  31  -6.894   2.479  12.582
  246    HE1  TRP  31           HE1      TRP  31  -5.820   2.928  14.880
  247    HE3  TRP  31           HE3      TRP  31  -2.917  -0.720  12.250
  248    HZ2  TRP  31           HZ2      TRP  31  -3.561   2.032  16.353
  249    HZ3  TRP  31           HZ3      TRP  31  -1.355  -0.866  14.140
  250    HH2  TRP  31           HH2      TRP  31  -1.670   0.480  16.145
  251    H    LEU  32           HN       LEU  32  -6.598   0.486   8.273
  252    HA   LEU  32           HA       LEU  32  -5.162  -1.622   7.132
  253    HB2  LEU  32           HB2      LEU  32  -7.758  -0.928   7.072
  254    HB3  LEU  32           HB1      LEU  32  -7.273  -0.432   5.463
  255    HG   LEU  32           HG       LEU  32  -8.235  -2.736   5.602
  256   HD11  LEU  32          HD11      LEU  32  -5.373  -2.720   4.692
  257   HD12  LEU  32          HD12      LEU  32  -6.703  -1.997   3.787
  258   HD13  LEU  32          HD13      LEU  32  -6.688  -3.734   4.095
  259   HD21  LEU  32          HD21      LEU  32  -7.233  -4.450   6.738
  260   HD22  LEU  32          HD22      LEU  32  -6.922  -3.100   7.831
  261   HD23  LEU  32          HD23      LEU  32  -5.653  -3.667   6.745
  262    H    ILE  33           HN       ILE  33  -5.454   1.717   6.142
  263    HA   ILE  33           HA       ILE  33  -4.310   1.397   3.595
  264    HB   ILE  33           HB       ILE  33  -4.425   3.749   5.475
  265   HG12  ILE  33          HG12      ILE  33  -5.635   3.417   2.728
  266   HG13  ILE  33          HG11      ILE  33  -6.459   2.923   4.202
  267   HG21  ILE  33          HG21      ILE  33  -3.084   3.653   2.791
  268   HG22  ILE  33          HG22      ILE  33  -2.387   4.123   4.342
  269   HG23  ILE  33          HG23      ILE  33  -3.602   5.145   3.576
  270   HD11  ILE  33          HD11      ILE  33  -5.566   5.713   3.530
  271   HD12  ILE  33          HD12      ILE  33  -6.401   5.220   5.004
  272   HD13  ILE  33          HD13      ILE  33  -7.214   5.092   3.445
  273    H    LYS  34           HN       LYS  34  -2.765   2.458   6.644
  274    HA   LYS  34           HA       LYS  34  -0.142   2.258   5.594
  275    HB2  LYS  34           HB2      LYS  34   0.656   2.653   7.794
  276    HB3  LYS  34           HB1      LYS  34  -0.818   3.592   7.620
  277    HG2  LYS  34           HG2      LYS  34  -2.023   1.739   8.805
  278    HG3  LYS  34           HG1      LYS  34  -0.442   1.027   9.138
  279    HD2  LYS  34           HD2      LYS  34   0.190   3.260  10.157
  280    HD3  LYS  34           HD1      LYS  34  -1.522   3.676  10.066
  281    HE2  LYS  34           HE2      LYS  34  -1.151   2.856  12.245
  282    HE3  LYS  34           HE1      LYS  34  -1.976   1.566  11.369
  283    HZ1  LYS  34           HZ1      LYS  34   0.952   1.730  11.806
  284    HZ2  LYS  34           HZ2      LYS  34   0.127   0.462  11.047
  285    HZ3  LYS  34           HZ3      LYS  34  -0.105   0.756  12.699
  286    H    GLN  35           HN       GLN  35  -2.213  -0.011   7.309
  287    HA   GLN  35           HA       GLN  35  -0.217  -2.005   7.661
  288    HB2  GLN  35           HB2      GLN  35  -3.229  -2.173   7.698
  289    HB3  GLN  35           HB1      GLN  35  -2.181  -3.556   7.986
  290    HG2  GLN  35           HG2      GLN  35  -2.117  -1.037   9.631
  291    HG3  GLN  35           HG1      GLN  35  -3.074  -2.457  10.042
  292   HE21  GLN  35          HE21      GLN  35  -1.146  -1.390  11.723
  293   HE22  GLN  35          HE22      GLN  35   0.142  -2.533  11.883
  294    H    ALA  36           HN       ALA  36  -2.631  -1.364   5.114
  295    HA   ALA  36           HA       ALA  36  -2.364  -3.783   3.755
  296    HB1  ALA  36           HB1      ALA  36  -2.922  -1.039   2.648
  297    HB2  ALA  36           HB2      ALA  36  -4.098  -2.271   3.106
  298    HB3  ALA  36           HB3      ALA  36  -3.045  -2.530   1.716
  299    H    ILE  37           HN       ILE  37  -0.458  -0.808   3.516
  300    HA   ILE  37           HA       ILE  37   1.243  -2.028   1.550
  301    HB   ILE  37           HB       ILE  37   0.928   0.345   1.402
  302   HG12  ILE  37          HG12      ILE  37   3.280   1.149   1.423
  303   HG13  ILE  37          HG11      ILE  37   3.738  -0.314   2.289
  304   HG21  ILE  37          HG21      ILE  37   2.135   0.542   4.149
  305   HG22  ILE  37          HG22      ILE  37   0.454   0.851   3.714
  306   HG23  ILE  37          HG23      ILE  37   1.731   1.904   3.104
  307   HD11  ILE  37          HD11      ILE  37   4.155  -0.299  -0.181
  308   HD12  ILE  37          HD12      ILE  37   2.405  -0.374  -0.391
  309   HD13  ILE  37          HD13      ILE  37   3.252  -1.674   0.448
  310    H    PHE  38           HN       PHE  38   1.646  -1.294   5.012
  311    HA   PHE  38           HA       PHE  38   4.301  -2.363   5.034
  312    HB2  PHE  38           HB2      PHE  38   4.242  -0.997   6.831
  313    HB3  PHE  38           HB1      PHE  38   2.491  -1.061   6.934
  314    HD1  PHE  38           HD2      PHE  38   5.327  -3.447   7.553
  315    HD2  PHE  38           HD1      PHE  38   1.699  -1.721   8.961
  316    HE1  PHE  38           HE2      PHE  38   5.482  -4.789   9.605
  317    HE2  PHE  38           HE1      PHE  38   1.863  -3.062  11.013
  318    HZ   PHE  38           HZ       PHE  38   3.750  -4.597  11.333
  319    H    ASN  39           HN       ASN  39   1.110  -3.615   5.935
  320    HA   ASN  39           HA       ASN  39   2.144  -6.055   6.924
  321    HB2  ASN  39           HB2      ASN  39  -0.129  -5.133   7.510
  322    HB3  ASN  39           HB1      ASN  39  -0.660  -5.623   5.908
  323   HD21  ASN  39          HD21      ASN  39   1.550  -7.408   8.020
  324   HD22  ASN  39          HD22      ASN  39   0.490  -8.750   8.263
  325    H    TYR  40           HN       TYR  40   1.152  -4.875   3.732
  326    HA   TYR  40           HA       TYR  40   1.139  -7.406   2.485
  327    HB2  TYR  40           HB2      TYR  40   0.343  -5.559   1.175
  328    HB3  TYR  40           HB1      TYR  40   1.848  -4.673   1.402
  329    HD1  TYR  40           HD2      TYR  40   1.028  -8.137   0.213
  330    HD2  TYR  40           HD1      TYR  40   2.992  -4.451  -0.581
  331    HE1  TYR  40           HE2      TYR  40   1.914  -9.067  -1.882
  332    HE2  TYR  40           HE1      TYR  40   3.887  -5.372  -2.679
  333    HH   TYR  40           HH       TYR  40   4.368  -7.529  -3.696
  334    H    LEU  41           HN       LEU  41   3.588  -5.058   3.206
  335    HA   LEU  41           HA       LEU  41   5.768  -6.375   2.038
  336    HB2  LEU  41           HB2      LEU  41   5.443  -4.244   4.096
  337    HB3  LEU  41           HB1      LEU  41   7.022  -4.959   3.850
  338    HG   LEU  41           HG       LEU  41   6.154  -2.755   2.553
  339   HD11  LEU  41          HD11      LEU  41   8.032  -4.899   1.604
  340   HD12  LEU  41          HD12      LEU  41   8.417  -3.481   2.581
  341   HD13  LEU  41          HD13      LEU  41   7.938  -3.288   0.894
  342   HD21  LEU  41          HD21      LEU  41   5.683  -4.997   0.594
  343   HD22  LEU  41          HD22      LEU  41   5.557  -3.266   0.287
  344   HD23  LEU  41          HD23      LEU  41   4.402  -4.059   1.358
  345    H    GLU  42           HN       GLU  42   4.437  -6.367   5.298
  346    HA   GLU  42           HA       GLU  42   6.259  -8.090   6.534
  347    HB2  GLU  42           HB2      GLU  42   4.619  -6.666   7.714
  348    HB3  GLU  42           HB1      GLU  42   3.321  -7.695   7.131
  349    HG2  GLU  42           HG2      GLU  42   4.393  -9.594   8.354
  350    HG3  GLU  42           HG1      GLU  42   5.510  -8.420   9.052
  351    H    LYS  43           HN       LYS  43   3.305  -8.781   4.709
  352    HA   LYS  43           HA       LYS  43   3.260 -11.555   5.317
  353    HB2  LYS  43           HB2      LYS  43   2.000  -9.978   3.073
  354    HB3  LYS  43           HB1      LYS  43   1.727 -11.696   3.322
  355    HG2  LYS  43           HG2      LYS  43   0.763 -11.212   5.530
  356    HG3  LYS  43           HG1      LYS  43   1.016  -9.487   5.250
  357    HD2  LYS  43           HD2      LYS  43  -0.414  -9.668   3.224
  358    HD3  LYS  43           HD1      LYS  43  -0.756 -11.341   3.660
  359    HE2  LYS  43           HE2      LYS  43  -1.507  -8.835   5.149
  360    HE3  LYS  43           HE1      LYS  43  -2.578 -10.039   4.436
  361    HZ1  LYS  43           HZ1      LYS  43  -0.826 -10.416   6.798
  362    HZ2  LYS  43           HZ2      LYS  43  -1.729 -11.646   6.069
  363    HZ3  LYS  43           HZ3      LYS  43  -2.516 -10.333   6.789
  364    H    LEU  44           HN       LEU  44   4.542  -9.725   2.536
  365    HA   LEU  44           HA       LEU  44   5.290 -12.104   1.167
  366    HB2  LEU  44           HB2      LEU  44   6.342 -10.721  -0.456
  367    HB3  LEU  44           HB1      LEU  44   4.827  -9.983   0.006
  368    HG   LEU  44           HG       LEU  44   6.484  -8.620   1.642
  369   HD11  LEU  44          HD11      LEU  44   8.430  -9.868   0.719
  370   HD12  LEU  44          HD12      LEU  44   8.545  -8.114   0.581
  371   HD13  LEU  44          HD13      LEU  44   8.129  -9.085  -0.834
  372   HD21  LEU  44          HD21      LEU  44   6.479  -6.855  -0.115
  373   HD22  LEU  44          HD22      LEU  44   4.902  -7.590   0.174
  374   HD23  LEU  44          HD23      LEU  44   5.841  -8.051  -1.245
  375    H    GLU  45           HN       GLU  45   6.917  -9.998   3.457
  376    HA   GLU  45           HA       GLU  45   9.479 -11.199   3.015
  377    HB2  GLU  45           HB2      GLU  45  10.378  -9.692   4.568
  378    HB3  GLU  45           HB1      GLU  45   9.074  -8.801   3.800
  379    HG2  GLU  45           HG2      GLU  45   8.244  -8.338   5.794
  380    HG3  GLU  45           HG1      GLU  45   7.958 -10.056   6.051
  381    H1   MET  46           HT1      MET  46  -2.872   1.118 -10.973
  382    H2   MET  46           HT2      MET  46  -3.220  -0.538 -10.958
  383    H3   MET  46           HT3      MET  46  -4.276   0.558 -10.215
  384    HA   MET  46           HA       MET  46  -3.713   0.331 -13.113
  385    HB2  MET  46           HB2      MET  46  -6.393   0.051 -12.818
  386    HB3  MET  46           HB1      MET  46  -5.273  -1.307 -12.844
  387    HG2  MET  46           HG2      MET  46  -5.174  -1.246 -10.391
  388    HG3  MET  46           HG1      MET  46  -6.336   0.075 -10.391
  389    HE1  MET  46           HE1      MET  46  -6.745  -1.997  -8.607
  390    HE2  MET  46           HE2      MET  46  -8.106  -3.074  -8.918
  391    HE3  MET  46           HE3      MET  46  -8.359  -1.329  -8.853
  392    H    ALA  47           HN       ALA  47  -6.525   1.604 -11.418
  393    HA   ALA  47           HA       ALA  47  -6.056   4.209 -12.694
  394    HB1  ALA  47           HB1      ALA  47  -8.202   3.149 -13.222
  395    HB2  ALA  47           HB2      ALA  47  -8.455   4.609 -12.266
  396    HB3  ALA  47           HB3      ALA  47  -8.576   3.024 -11.503
  397    H    THR  48           HN       THR  48  -4.461   3.606 -10.652
  398    HA   THR  48           HA       THR  48  -5.379   4.249  -8.064
  399    HB   THR  48           HB       THR  48  -2.885   4.449  -7.623
  400    HG1  THR  48           HG1      THR  48  -2.623   4.900 -10.060
  401   HG21  THR  48          HG21      THR  48  -3.808   1.923  -8.998
  402   HG22  THR  48          HG22      THR  48  -4.124   2.334  -7.313
  403   HG23  THR  48          HG23      THR  48  -2.469   2.063  -7.858
  404    H    THR  49           HN       THR  49  -5.593   6.147  -7.081
  405    HA   THR  49           HA       THR  49  -4.720   8.587  -8.480
  406    HB   THR  49           HB       THR  49  -6.829   8.328  -6.321
  407    HG1  THR  49           HG1      THR  49  -7.205   7.243  -8.460
  408   HG21  THR  49          HG21      THR  49  -6.210  10.557  -8.269
  409   HG22  THR  49          HG22      THR  49  -5.891  10.578  -6.534
  410   HG23  THR  49          HG23      THR  49  -7.552  10.537  -7.125
  411    H    THR  50           HN       THR  50  -3.564  10.176  -7.312
  412    HA   THR  50           HA       THR  50  -1.837   9.243  -5.296
  413    HB   THR  50           HB       THR  50  -2.392  12.153  -5.839
  414    HG1  THR  50           HG1      THR  50  -1.244  11.996  -7.697
  415   HG21  THR  50          HG21      THR  50   0.122  10.639  -5.117
  416   HG22  THR  50          HG22      THR  50  -0.831  11.644  -4.025
  417   HG23  THR  50          HG23      THR  50   0.011  12.378  -5.391
  418    H    LEU  51           HN       LEU  51  -2.485   8.721  -3.328
  419    HA   LEU  51           HA       LEU  51  -4.180  10.595  -1.818
  420    HB2  LEU  51           HB2      LEU  51  -4.204   7.583  -1.551
  421    HB3  LEU  51           HB1      LEU  51  -5.206   8.717  -0.670
  422    HG   LEU  51           HG       LEU  51  -5.386   8.083  -3.622
  423   HD11  LEU  51          HD11      LEU  51  -7.498   7.691  -1.532
  424   HD12  LEU  51          HD12      LEU  51  -6.287   6.456  -1.867
  425   HD13  LEU  51          HD13      LEU  51  -7.386   6.979  -3.143
  426   HD21  LEU  51          HD21      LEU  51  -5.887  10.410  -3.355
  427   HD22  LEU  51          HD22      LEU  51  -6.902  10.082  -1.950
  428   HD23  LEU  51          HD23      LEU  51  -7.410   9.541  -3.551
  429    H    GLY  52           HN       GLY  52  -3.675  10.740   0.425
  430    HA2  GLY  52           HA2      GLY  52  -0.900  10.411   1.026
  431    HA3  GLY  52           HA1      GLY  52  -2.141  10.986   2.131
  432    H    VAL  53           HN       VAL  53   0.077   8.632   1.716
  433    HA   VAL  53           HA       VAL  53  -1.458   6.718   3.351
  434    HB   VAL  53           HB       VAL  53   0.406   6.084   1.053
  435   HG11  VAL  53          HG11      VAL  53   0.888   4.480   2.759
  436   HG12  VAL  53          HG12      VAL  53  -0.088   3.702   1.513
  437   HG13  VAL  53          HG13      VAL  53  -0.829   4.189   3.038
  438   HG21  VAL  53          HG21      VAL  53  -2.518   5.506   1.479
  439   HG22  VAL  53          HG22      VAL  53  -1.551   4.929   0.121
  440   HG23  VAL  53          HG23      VAL  53  -1.822   6.658   0.340
  441    H    LYS  54           HN       LYS  54  -0.041   5.318   4.704
  442    HA   LYS  54           HA       LYS  54   2.317   6.833   5.571
  443    HB2  LYS  54           HB2      LYS  54   0.734   4.740   7.081
  444    HB3  LYS  54           HB1      LYS  54   2.068   5.685   7.719
  445    HG2  LYS  54           HG2      LYS  54   0.240   6.770   8.579
  446    HG3  LYS  54           HG1      LYS  54   0.604   7.726   7.142
  447    HD2  LYS  54           HD2      LYS  54  -1.147   6.622   5.906
  448    HD3  LYS  54           HD1      LYS  54  -1.447   5.515   7.248
  449    HE2  LYS  54           HE2      LYS  54  -2.357   7.209   8.587
  450    HE3  LYS  54           HE1      LYS  54  -1.684   8.486   7.576
  451    HZ1  LYS  54           HZ1      LYS  54  -3.879   6.638   6.831
  452    HZ2  LYS  54           HZ2      LYS  54  -3.200   7.800   5.806
  453    HZ3  LYS  54           HZ3      LYS  54  -4.030   8.285   7.201
  454    H    LEU  55           HN       LEU  55   4.266   6.017   5.179
  455    HA   LEU  55           HA       LEU  55   4.566   3.118   4.742
  456    HB2  LEU  55           HB2      LEU  55   5.037   5.318   2.886
  457    HB3  LEU  55           HB1      LEU  55   6.455   4.312   3.106
  458    HG   LEU  55           HG       LEU  55   3.801   3.084   2.441
  459   HD11  LEU  55          HD11      LEU  55   4.455   3.178   0.082
  460   HD12  LEU  55          HD12      LEU  55   5.827   4.200   0.513
  461   HD13  LEU  55          HD13      LEU  55   4.181   4.782   0.760
  462   HD21  LEU  55          HD21      LEU  55   6.684   2.294   2.107
  463   HD22  LEU  55          HD22      LEU  55   5.333   1.410   1.398
  464   HD23  LEU  55          HD23      LEU  55   5.473   1.549   3.150
  465    H    ASP  56           HN       ASP  56   6.391   2.231   5.648
  466    HA   ASP  56           HA       ASP  56   7.937   3.878   7.455
  467    HB2  ASP  56           HB2      ASP  56   8.568   1.011   6.734
  468    HB3  ASP  56           HB1      ASP  56   8.933   1.852   8.232
  469    H    ASP  57           HN       ASP  57  10.099   4.486   7.212
  470    HA   ASP  57           HA       ASP  57  11.116   4.989   4.693
  471    HB2  ASP  57           HB2      ASP  57  12.238   5.013   7.427
  472    HB3  ASP  57           HB1      ASP  57  13.423   4.893   6.133
  473    HA   PRO  58           HA       PRO  58  14.038   1.101   4.996
  474    HB2  PRO  58           HB2      PRO  58  13.178  -0.887   6.684
  475    HB3  PRO  58           HB1      PRO  58  14.395   0.320   7.108
  476    HG2  PRO  58           HG2      PRO  58  11.477   0.262   7.759
  477    HG3  PRO  58           HG1      PRO  58  12.849   0.715   8.788
  478    HD2  PRO  58           HD2      PRO  58  11.290   2.567   7.639
  479    HD3  PRO  58           HD1      PRO  58  13.037   2.812   7.836
  480    H    THR  59           HN       THR  59  10.568   0.663   5.535
  481    HA   THR  59           HA       THR  59  10.403  -1.671   3.927
  482    HB   THR  59           HB       THR  59   8.699  -0.630   5.720
  483    HG1  THR  59           HG1      THR  59   7.208  -2.183   4.864
  484   HG21  THR  59          HG21      THR  59   8.029   1.212   4.195
  485   HG22  THR  59          HG22      THR  59   6.687   0.173   4.674
  486   HG23  THR  59          HG23      THR  59   7.405   0.004   3.071
  487    H    ARG  60           HN       ARG  60  10.200   1.788   3.278
  488    HA   ARG  60           HA       ARG  60   9.160   1.584   0.656
  489    HB2  ARG  60           HB2      ARG  60   9.340   3.729   1.948
  490    HB3  ARG  60           HB1      ARG  60  11.080   3.692   1.682
  491    HG2  ARG  60           HG2      ARG  60  10.721   3.792  -0.726
  492    HG3  ARG  60           HG1      ARG  60   8.976   3.836  -0.470
  493    HD2  ARG  60           HD2      ARG  60   9.258   5.921   0.820
  494    HD3  ARG  60           HD1      ARG  60  10.984   5.891   0.453
  495    HE   ARG  60           HE       ARG  60   9.861   5.770  -1.989
  496   HH11  ARG  60          HH21      ARG  60   9.370   7.906   0.740
  497   HH12  ARG  60          HH22      ARG  60   8.954   9.277  -0.235
  498   HH21  ARG  60          HH11      ARG  60   9.289   7.587  -3.293
  499   HH22  ARG  60          HH12      ARG  60   8.913   9.096  -2.531
  500    H    GLU  61           HN       GLU  61  12.405   1.491   1.988
  501    HA   GLU  61           HA       GLU  61  13.822   1.247  -0.430
  502    HB2  GLU  61           HB2      GLU  61  15.048   1.761   1.552
  503    HB3  GLU  61           HB1      GLU  61  14.417   0.356   2.395
  504    HG2  GLU  61           HG2      GLU  61  16.780   0.147   1.718
  505    HG3  GLU  61           HG1      GLU  61  15.737  -1.121   1.085
  506    H    ARG  62           HN       ARG  62  12.336  -1.104   1.722
  507    HA   ARG  62           HA       ARG  62  13.153  -3.425   0.369
  508    HB2  ARG  62           HB2      ARG  62  11.786  -2.987   2.663
  509    HB3  ARG  62           HB1      ARG  62  10.451  -3.420   1.608
  510    HG2  ARG  62           HG2      ARG  62  12.899  -5.114   2.090
  511    HG3  ARG  62           HG1      ARG  62  11.336  -5.335   2.873
  512    HD2  ARG  62           HD2      ARG  62  12.066  -5.730  -0.009
  513    HD3  ARG  62           HD1      ARG  62  11.372  -6.892   1.123
  514    HE   ARG  62           HE       ARG  62   9.575  -4.790   0.871
  515   HH11  ARG  62          HH21      ARG  62  10.911  -7.349  -1.100
  516   HH12  ARG  62          HH22      ARG  62   9.541  -7.428  -2.157
  517   HH21  ARG  62          HH11      ARG  62   7.773  -4.866  -0.534
  518   HH22  ARG  62          HH12      ARG  62   7.754  -6.008  -1.835
  519    H    LEU  63           HN       LEU  63  10.421  -1.236  -0.050
  520    HA   LEU  63           HA       LEU  63   9.031  -2.674  -2.012
  521    HB2  LEU  63           HB2      LEU  63   9.112   0.136  -1.109
  522    HB3  LEU  63           HB1      LEU  63   8.606  -0.085  -2.771
  523    HG   LEU  63           HG       LEU  63   7.019  -1.905  -1.566
  524   HD11  LEU  63          HD11      LEU  63   6.187  -1.120   0.502
  525   HD12  LEU  63          HD12      LEU  63   7.150   0.354   0.410
  526   HD13  LEU  63          HD13      LEU  63   7.942  -1.202   0.660
  527   HD21  LEU  63          HD21      LEU  63   6.315   1.015  -1.679
  528   HD22  LEU  63          HD22      LEU  63   5.252  -0.375  -1.899
  529   HD23  LEU  63          HD23      LEU  63   6.469   0.005  -3.116
  530    H    LYS  64           HN       LYS  64  11.801  -0.512  -2.188
  531    HA   LYS  64           HA       LYS  64  11.957  -0.260  -4.967
  532    HB2  LYS  64           HB2      LYS  64  13.452   0.618  -2.816
  533    HB3  LYS  64           HB1      LYS  64  14.558  -0.458  -3.655
  534    HG2  LYS  64           HG2      LYS  64  13.067   1.726  -5.071
  535    HG3  LYS  64           HG1      LYS  64  14.621   1.995  -4.283
  536    HD2  LYS  64           HD2      LYS  64  14.171  -0.134  -6.363
  537    HD3  LYS  64           HD1      LYS  64  14.714   1.498  -6.756
  538    HE2  LYS  64           HE2      LYS  64  16.569   1.051  -5.015
  539    HE3  LYS  64           HE1      LYS  64  16.124  -0.644  -5.207
  540    HZ1  LYS  64           HZ1      LYS  64  17.902  -0.180  -6.694
  541    HZ2  LYS  64           HZ2      LYS  64  17.133   1.193  -7.312
  542    HZ3  LYS  64           HZ3      LYS  64  16.507  -0.346  -7.638
  543    H    ALA  65           HN       ALA  65  13.257  -2.665  -2.791
  544    HA   ALA  65           HA       ALA  65  14.633  -4.227  -4.677
  545    HB1  ALA  65           HB1      ALA  65  14.899  -4.431  -2.215
  546    HB2  ALA  65           HB2      ALA  65  14.636  -5.978  -3.019
  547    HB3  ALA  65           HB3      ALA  65  13.315  -5.205  -2.143
  548    H    ALA  66           HN       ALA  66  11.291  -4.273  -3.542
  549    HA   ALA  66           HA       ALA  66  10.488  -6.558  -5.034
  550    HB1  ALA  66           HB1      ALA  66   9.113  -5.920  -3.208
  551    HB2  ALA  66           HB2      ALA  66   8.166  -5.636  -4.670
  552    HB3  ALA  66           HB3      ALA  66   8.925  -4.282  -3.831
  553    H    ALA  67           HN       ALA  67  10.559  -3.111  -5.618
  554    HA   ALA  67           HA       ALA  67   9.276  -3.051  -8.112
  555    HB1  ALA  67           HB1      ALA  67  10.173  -0.888  -8.365
  556    HB2  ALA  67           HB2      ALA  67  11.567  -1.259  -7.350
  557    HB3  ALA  67           HB3      ALA  67   9.967  -1.090  -6.625
  558    H    GLN  68           HN       GLN  68  12.541  -3.634  -7.156
  559    HA   GLN  68           HA       GLN  68  13.652  -3.831  -9.738
  560    HB2  GLN  68           HB2      GLN  68  14.559  -4.966  -7.083
  561    HB3  GLN  68           HB1      GLN  68  15.523  -5.024  -8.554
  562    HG2  GLN  68           HG2      GLN  68  14.517  -2.495  -7.282
  563    HG3  GLN  68           HG1      GLN  68  16.117  -3.174  -7.011
  564   HE21  GLN  68          HE21      GLN  68  14.045  -1.488  -9.212
  565   HE22  GLN  68          HE22      GLN  68  15.248  -1.117 -10.399
  566    H    SER  69           HN       SER  69  12.224  -6.229  -7.533
  567    HA   SER  69           HA       SER  69  12.783  -8.437  -9.229
  568    HB2  SER  69           HB2      SER  69  11.272  -9.725  -7.812
  569    HB3  SER  69           HB1      SER  69  12.324  -8.718  -6.819
  570    HG   SER  69           HG       SER  69   9.702  -7.918  -7.581
  571    H    ILE  70           HN       ILE  70  10.452  -5.947  -9.332
  572    HA   ILE  70           HA       ILE  70   8.779  -7.465 -11.203
  573    HB   ILE  70           HB       ILE  70   8.013  -5.896  -9.108
  574   HG12  ILE  70          HG12      ILE  70   6.595  -7.508 -10.227
  575   HG13  ILE  70          HG11      ILE  70   5.744  -5.978 -10.067
  576   HG21  ILE  70          HG21      ILE  70   7.746  -4.150 -11.542
  577   HG22  ILE  70          HG22      ILE  70   8.734  -3.830 -10.117
  578   HG23  ILE  70          HG23      ILE  70   6.976  -3.861  -9.982
  579   HD11  ILE  70          HD11      ILE  70   5.300  -6.946 -12.216
  580   HD12  ILE  70          HD12      ILE  70   7.026  -7.075 -12.555
  581   HD13  ILE  70          HD13      ILE  70   6.269  -5.487 -12.425
  582    H    ASP  71           HN       ASP  71  11.416  -5.607 -11.190
  583    HA   ASP  71           HA       ASP  71  12.638  -4.517 -12.725
  584    HB2  ASP  71           HB2      ASP  71  11.884  -6.492 -14.128
  585    HB3  ASP  71           HB1      ASP  71  10.644  -5.440 -14.797
  586    H    ARG  72           HN       ARG  72  10.736  -3.005 -11.323
  587    HA   ARG  72           HA       ARG  72  10.418  -0.852 -13.286
  588    HB2  ARG  72           HB2      ARG  72   8.175  -1.853 -11.528
  589    HB3  ARG  72           HB1      ARG  72   8.142  -0.311 -12.374
  590    HG2  ARG  72           HG2      ARG  72   8.373  -1.499 -14.515
  591    HG3  ARG  72           HG1      ARG  72   8.348  -3.033 -13.649
  592    HD2  ARG  72           HD2      ARG  72   6.132  -0.994 -13.714
  593    HD3  ARG  72           HD1      ARG  72   6.173  -2.511 -14.610
  594    HE   ARG  72           HE       ARG  72   6.379  -2.699 -11.716
  595   HH11  ARG  72          HH21      ARG  72   4.389  -2.964 -14.590
  596   HH12  ARG  72          HH22      ARG  72   3.141  -3.873 -13.804
  597   HH21  ARG  72          HH11      ARG  72   4.692  -3.871 -10.655
  598   HH22  ARG  72          HH12      ARG  72   3.311  -4.385 -11.567
  599    H    THR  73           HN       THR  73   9.787   1.239 -12.136
  600    HA   THR  73           HA       THR  73  11.674   1.658 -10.019
  601    HB   THR  73           HB       THR  73  11.578   3.833 -10.614
  602    HG1  THR  73           HG1      THR  73   8.936   4.319 -11.026
  603   HG21  THR  73          HG21      THR  73  11.278   2.739 -12.833
  604   HG22  THR  73          HG22      THR  73  10.635   4.380 -12.756
  605   HG23  THR  73          HG23      THR  73   9.540   3.000 -12.676
  606    HA   PRO  74           HA       PRO  74   9.184   1.222  -6.405
  607    HB2  PRO  74           HB2      PRO  74   9.480   3.714  -5.185
  608    HB3  PRO  74           HB1      PRO  74  10.551   2.326  -4.982
  609    HG2  PRO  74           HG2      PRO  74  10.853   4.710  -6.740
  610    HG3  PRO  74           HG1      PRO  74  12.088   3.798  -5.853
  611    HD2  PRO  74           HD2      PRO  74  11.774   3.516  -8.499
  612    HD3  PRO  74           HD1      PRO  74  12.200   2.137  -7.464
  613    H    HIS  75           HN       HIS  75   8.636   3.906  -8.548
  614    HA   HIS  75           HA       HIS  75   6.267   4.924  -7.401
  615    HB2  HIS  75           HB2      HIS  75   7.238   4.853 -10.266
  616    HB3  HIS  75           HB1      HIS  75   5.732   5.639  -9.798
  617    HD1  HIS  75           HD1      HIS  75   8.843   6.689 -10.723
  618    HD2  HIS  75           HD2      HIS  75   6.611   7.337  -7.278
  619    HE1  HIS  75           HE1      HIS  75   9.792   8.779  -9.699
  620    HE2  HIS  75           HE2      HIS  75   8.266   9.282  -7.756
  621    H    TRP  76           HN       TRP  76   6.886   2.355  -9.702
  622    HA   TRP  76           HA       TRP  76   4.162   1.676 -10.070
  623    HB2  TRP  76           HB2      TRP  76   6.759   0.360 -10.739
  624    HB3  TRP  76           HB1      TRP  76   5.259  -0.555 -10.862
  625    HD1  TRP  76           HD1      TRP  76   7.107   2.389 -12.455
  626    HE1  TRP  76           HE1      TRP  76   6.028   2.897 -14.737
  627    HE3  TRP  76           HE3      TRP  76   3.094  -0.767 -12.176
  628    HZ2  TRP  76           HZ2      TRP  76   3.764   2.056 -16.227
  629    HZ3  TRP  76           HZ3      TRP  76   1.527  -0.858 -14.067
  630    HH2  TRP  76           HH2      TRP  76   1.854   0.522 -16.046
  631    H    LEU  77           HN       LEU  77   6.794   0.345  -8.176
  632    HA   LEU  77           HA       LEU  77   5.302  -1.727  -7.044
  633    HB2  LEU  77           HB2      LEU  77   7.916  -1.107  -6.978
  634    HB3  LEU  77           HB1      LEU  77   7.443  -0.604  -5.368
  635    HG   LEU  77           HG       LEU  77   8.337  -2.934  -5.514
  636   HD11  LEU  77          HD11      LEU  77   5.476  -2.840  -4.608
  637   HD12  LEU  77          HD12      LEU  77   6.825  -2.160  -3.698
  638   HD13  LEU  77          HD13      LEU  77   6.760  -3.894  -4.015
  639   HD21  LEU  77          HD21      LEU  77   7.291  -4.614  -6.659
  640   HD22  LEU  77          HD22      LEU  77   7.016  -3.251  -7.746
  641   HD23  LEU  77          HD23      LEU  77   5.732  -3.789  -6.663
  642    H    ILE  78           HN       ILE  78   5.687   1.598  -6.031
  643    HA   ILE  78           HA       ILE  78   4.533   1.294  -3.486
  644    HB   ILE  78           HB       ILE  78   4.710   3.654  -5.354
  645   HG12  ILE  78          HG12      ILE  78   5.912   3.272  -2.610
  646   HG13  ILE  78          HG11      ILE  78   6.721   2.766  -4.089
  647   HG21  ILE  78          HG21      ILE  78   3.369   3.577  -2.668
  648   HG22  ILE  78          HG22      ILE  78   2.682   4.075  -4.216
  649   HG23  ILE  78          HG23      ILE  78   3.925   5.060  -3.445
  650   HD11  ILE  78          HD11      ILE  78   5.904   5.574  -3.397
  651   HD12  ILE  78          HD12      ILE  78   6.724   5.068  -4.875
  652   HD13  ILE  78          HD13      ILE  78   7.535   4.908  -3.317
  653    H    LYS  79           HN       LYS  79   3.023   2.411  -6.532
  654    HA   LYS  79           HA       LYS  79   0.392   2.282  -5.483
  655    HB2  LYS  79           HB2      LYS  79  -0.397   2.701  -7.684
  656    HB3  LYS  79           HB1      LYS  79   1.092   3.611  -7.496
  657    HG2  LYS  79           HG2      LYS  79   2.267   1.745  -8.688
  658    HG3  LYS  79           HG1      LYS  79   0.673   1.071  -9.037
  659    HD2  LYS  79           HD2      LYS  79   0.095   3.326 -10.037
  660    HD3  LYS  79           HD1      LYS  79   1.816   3.705  -9.937
  661    HE2  LYS  79           HE2      LYS  79   1.409   2.911 -12.129
  662    HE3  LYS  79           HE1      LYS  79   2.238   1.612 -11.269
  663    HZ1  LYS  79           HZ1      LYS  79  -0.691   1.795 -11.690
  664    HZ2  LYS  79           HZ2      LYS  79   0.124   0.522 -10.928
  665    HZ3  LYS  79           HZ3      LYS  79   0.358   0.812 -12.582
  666    H    GLN  80           HN       GLN  80   2.396  -0.034  -7.216
  667    HA   GLN  80           HA       GLN  80   0.339  -1.971  -7.569
  668    HB2  GLN  80           HB2      GLN  80   3.343  -2.219  -7.623
  669    HB3  GLN  80           HB1      GLN  80   2.268  -3.573  -7.921
  670    HG2  GLN  80           HG2      GLN  80   2.275  -1.038  -9.540
  671    HG3  GLN  80           HG1      GLN  80   3.186  -2.485  -9.961
  672   HE21  GLN  80          HE21      GLN  80   1.306  -1.360 -11.650
  673   HE22  GLN  80          HE22      GLN  80  -0.027  -2.451 -11.813
  674    H    ALA  81           HN       ALA  81   2.769  -1.408  -5.032
  675    HA   ALA  81           HA       ALA  81   2.438  -3.830  -3.684
  676    HB1  ALA  81           HB1      ALA  81   3.070  -1.105  -2.561
  677    HB2  ALA  81           HB2      ALA  81   4.213  -2.365  -3.025
  678    HB3  ALA  81           HB3      ALA  81   3.153  -2.605  -1.637
  679    H    ILE  82           HN       ILE  82   0.614  -0.803  -3.425
  680    HA   ILE  82           HA       ILE  82  -1.122  -1.988  -1.466
  681    HB   ILE  82           HB       ILE  82  -0.741   0.376  -1.306
  682   HG12  ILE  82          HG12      ILE  82  -3.070   1.242  -1.321
  683   HG13  ILE  82          HG11      ILE  82  -3.568  -0.203  -2.195
  684   HG21  ILE  82          HG21      ILE  82  -1.946   0.620  -4.051
  685   HG22  ILE  82          HG22      ILE  82  -0.257   0.883  -3.617
  686   HG23  ILE  82          HG23      ILE  82  -1.504   1.966  -2.999
  687   HD11  ILE  82          HD11      ILE  82  -3.983  -0.189   0.275
  688   HD12  ILE  82          HD12      ILE  82  -2.235  -0.313   0.483
  689   HD13  ILE  82          HD13      ILE  82  -3.118  -1.586  -0.362
  690    H    PHE  83           HN       PHE  83  -1.498  -1.224  -4.926
  691    HA   PHE  83           HA       PHE  83  -4.180  -2.220  -4.958
  692    HB2  PHE  83           HB2      PHE  83  -4.080  -0.845  -6.746
  693    HB3  PHE  83           HB1      PHE  83  -2.332  -0.962  -6.850
  694    HD1  PHE  83           HD2      PHE  83  -5.235  -3.265  -7.477
  695    HD2  PHE  83           HD1      PHE  83  -1.566  -1.627  -8.884
  696    HE1  PHE  83           HE2      PHE  83  -5.430  -4.591  -9.537
  697    HE2  PHE  83           HE1      PHE  83  -1.769  -2.951 -10.943
  698    HZ   PHE  83           HZ       PHE  83  -3.697  -4.434 -11.268
  699    H    ASN  84           HN       ASN  84  -1.026  -3.557  -5.853
  700    HA   ASN  84           HA       ASN  84  -2.127  -5.962  -6.860
  701    HB2  ASN  84           HB2      ASN  84   0.169  -5.119  -7.452
  702    HB3  ASN  84           HB1      ASN  84   0.691  -5.597  -5.844
  703   HD21  ASN  84          HD21      ASN  84  -1.582  -7.384  -7.867
  704   HD22  ASN  84          HD22      ASN  84  -0.549  -8.744  -8.115
  705    H    TYR  85           HN       TYR  85  -1.106  -4.822  -3.661
  706    HA   TYR  85           HA       TYR  85  -1.170  -7.361  -2.426
  707    HB2  TYR  85           HB2      TYR  85  -0.309  -5.554  -1.105
  708    HB3  TYR  85           HB1      TYR  85  -1.780  -4.613  -1.323
  709    HD1  TYR  85           HD2      TYR  85  -1.075  -8.109  -0.160
  710    HD2  TYR  85           HD1      TYR  85  -2.921  -4.368   0.654
  711    HE1  TYR  85           HE2      TYR  85  -1.989  -9.023   1.929
  712    HE2  TYR  85           HE1      TYR  85  -3.844  -5.272   2.747
  713    HH   TYR  85           HH       TYR  85  -4.332  -7.305   3.829
  714    H    LEU  86           HN       LEU  86  -3.541  -4.937  -3.148
  715    HA   LEU  86           HA       LEU  86  -5.755  -6.200  -1.975
  716    HB2  LEU  86           HB2      LEU  86  -5.375  -4.051  -4.007
  717    HB3  LEU  86           HB1      LEU  86  -6.972  -4.730  -3.777
  718    HG   LEU  86           HG       LEU  86  -6.068  -2.567  -2.448
  719   HD11  LEU  86          HD11      LEU  86  -7.968  -4.697  -1.507
  720   HD12  LEU  86          HD12      LEU  86  -8.342  -3.271  -2.477
  721   HD13  LEU  86          HD13      LEU  86  -7.853  -3.090  -0.791
  722   HD21  LEU  86          HD21      LEU  86  -5.624  -4.836  -0.517
  723   HD22  LEU  86          HD22      LEU  86  -5.459  -3.110  -0.197
  724   HD23  LEU  86          HD23      LEU  86  -4.330  -3.919  -1.284
  725    H    GLU  87           HN       GLU  87  -4.409  -6.225  -5.225
  726    HA   GLU  87           HA       GLU  87  -6.288  -7.871  -6.483
  727    HB2  GLU  87           HB2      GLU  87  -4.560  -6.487  -7.615
  728    HB3  GLU  87           HB1      GLU  87  -3.335  -7.626  -7.083
  729    HG2  GLU  87           HG2      GLU  87  -4.566  -9.401  -8.355
  730    HG3  GLU  87           HG1      GLU  87  -5.585  -8.119  -9.011
  731    H    LYS  88           HN       LYS  88  -3.360  -8.677  -4.663
  732    HA   LYS  88           HA       LYS  88  -3.405 -11.446  -5.258
  733    HB2  LYS  88           HB2      LYS  88  -2.127  -9.917  -2.998
  734    HB3  LYS  88           HB1      LYS  88  -1.888 -11.640  -3.265
  735    HG2  LYS  88           HG2      LYS  88  -0.904 -11.150  -5.467
  736    HG3  LYS  88           HG1      LYS  88  -1.153  -9.427  -5.175
  737    HD2  LYS  88           HD2      LYS  88   0.316  -9.560  -3.202
  738    HD3  LYS  88           HD1      LYS  88   0.571 -11.272  -3.530
  739    HE2  LYS  88           HE2      LYS  88   1.489  -8.907  -5.124
  740    HE3  LYS  88           HE1      LYS  88   2.448 -10.214  -4.429
  741    HZ1  LYS  88           HZ1      LYS  88   0.513 -10.522  -6.656
  742    HZ2  LYS  88           HZ2      LYS  88   1.509 -11.739  -6.028
  743    HZ3  LYS  88           HZ3      LYS  88   2.190 -10.415  -6.834
  744    H    LEU  89           HN       LEU  89  -4.640  -9.592  -2.474
  745    HA   LEU  89           HA       LEU  89  -5.475 -11.950  -1.115
  746    HB2  LEU  89           HB2      LEU  89  -6.467 -10.539   0.514
  747    HB3  LEU  89           HB1      LEU  89  -4.931  -9.850   0.049
  748    HG   LEU  89           HG       LEU  89  -6.554  -8.425  -1.576
  749   HD11  LEU  89          HD11      LEU  89  -8.529  -9.615  -0.645
  750   HD12  LEU  89          HD12      LEU  89  -8.591  -7.859  -0.501
  751   HD13  LEU  89          HD13      LEU  89  -8.197  -8.848   0.908
  752   HD21  LEU  89          HD21      LEU  89  -6.482  -6.664   0.186
  753   HD22  LEU  89          HD22      LEU  89  -4.931  -7.447  -0.115
  754   HD23  LEU  89          HD23      LEU  89  -5.874  -7.883   1.309
  755    H    GLU  90           HN       GLU  90  -7.023  -9.781  -3.392
  756    HA   GLU  90           HA       GLU  90  -9.634 -10.867  -2.928
  757    HB2  GLU  90           HB2      GLU  90 -10.468  -9.332  -4.502
  758    HB3  GLU  90           HB1      GLU  90  -9.152  -8.488  -3.695
  759    HG2  GLU  90           HG2      GLU  90  -8.239  -8.052  -5.659
  760    HG3  GLU  90           HG1      GLU  90  -8.040  -9.780  -5.941
  Start of MODEL   23
    1    H1   MET   1           HT1      MET   1   3.308   3.715  13.351
    2    H2   MET   1           HT2      MET   1   4.180   4.473  14.582
    3    H3   MET   1           HT3      MET   1   3.606   2.897  14.803
    4    HA   MET   1           HA       MET   1   5.851   2.631  14.361
    5    HB2  MET   1           HB2      MET   1   4.385   2.327  11.728
    6    HB3  MET   1           HB1      MET   1   5.921   1.571  12.129
    7    HG2  MET   1           HG2      MET   1   4.842   0.327  13.933
    8    HG3  MET   1           HG1      MET   1   3.302   1.081  13.526
    9    HE1  MET   1           HE1      MET   1   5.538  -2.099  11.076
   10    HE2  MET   1           HE2      MET   1   6.048  -1.410  12.619
   11    HE3  MET   1           HE3      MET   1   6.174  -0.456  11.142
   12    H    ALA   2           HN       ALA   2   7.312   2.890  12.010
   13    HA   ALA   2           HA       ALA   2   7.984   5.717  12.165
   14    HB1  ALA   2           HB1      ALA   2   9.713   3.940  12.334
   15    HB2  ALA   2           HB2      ALA   2  10.022   5.110  11.050
   16    HB3  ALA   2           HB3      ALA   2   9.380   3.515  10.655
   17    H    THR   3           HN       THR   3   5.588   4.879  10.839
   18    HA   THR   3           HA       THR   3   5.924   5.027   8.017
   19    HB   THR   3           HB       THR   3   4.148   3.703   8.941
   20    HG1  THR   3           HG1      THR   3   3.465   4.530   7.034
   21   HG21  THR   3          HG21      THR   3   2.316   4.614  10.233
   22   HG22  THR   3          HG22      THR   3   3.031   6.223  10.152
   23   HG23  THR   3          HG23      THR   3   3.850   4.939  11.041
   24    H    THR   4           HN       THR   4   6.436   6.821   7.001
   25    HA   THR   4           HA       THR   4   5.690   9.450   8.069
   26    HB   THR   4           HB       THR   4   7.603   8.825   5.809
   27    HG1  THR   4           HG1      THR   4   9.035   8.294   7.278
   28   HG21  THR   4          HG21      THR   4   7.286  11.244   7.592
   29   HG22  THR   4          HG22      THR   4   6.849  11.144   5.887
   30   HG23  THR   4          HG23      THR   4   8.541  11.032   6.371
   31    H    THR   5           HN       THR   5   4.595  10.994   6.804
   32    HA   THR   5           HA       THR   5   2.651   9.997   5.009
   33    HB   THR   5           HB       THR   5   3.444  12.891   5.318
   34    HG1  THR   5           HG1      THR   5   2.460  11.135   7.163
   35   HG21  THR   5          HG21      THR   5   0.778  11.577   4.759
   36   HG22  THR   5          HG22      THR   5   1.796  12.369   3.556
   37   HG23  THR   5          HG23      THR   5   1.084  13.311   4.866
   38    H    LEU   6           HN       LEU   6   2.909   9.435   2.968
   39    HA   LEU   6           HA       LEU   6   4.734  10.972   1.250
   40    HB2  LEU   6           HB2      LEU   6   4.448   7.959   1.273
   41    HB3  LEU   6           HB1      LEU   6   5.389   8.879   0.117
   42    HG   LEU   6           HG       LEU   6   5.960   8.652   3.076
   43   HD11  LEU   6          HD11      LEU   6   7.920   7.747   1.085
   44   HD12  LEU   6          HD12      LEU   6   6.444   6.787   1.171
   45   HD13  LEU   6          HD13      LEU   6   7.431   7.017   2.615
   46   HD21  LEU   6          HD21      LEU   6   8.099   9.794   2.432
   47   HD22  LEU   6          HD22      LEU   6   6.662  10.813   2.366
   48   HD23  LEU   6          HD23      LEU   6   7.354  10.167   0.878
   49    H    GLY   7           HN       GLY   7   4.050  11.148  -0.925
   50    HA2  GLY   7           HA2      GLY   7   1.216  11.028  -1.305
   51    HA3  GLY   7           HA1      GLY   7   2.407  11.502  -2.509
   52    H    VAL   8           HN       VAL   8   0.035   9.368  -2.006
   53    HA   VAL   8           HA       VAL   8   1.318   7.331  -3.689
   54    HB   VAL   8           HB       VAL   8  -0.445   6.769  -1.288
   55   HG11  VAL   8          HG11      VAL   8   0.045   4.370  -1.784
   56   HG12  VAL   8          HG12      VAL   8   0.707   4.883  -3.336
   57   HG13  VAL   8          HG13      VAL   8  -0.995   5.158  -2.970
   58   HG21  VAL   8          HG21      VAL   8   1.542   5.580  -0.430
   59   HG22  VAL   8          HG22      VAL   8   1.811   7.312  -0.636
   60   HG23  VAL   8          HG23      VAL   8   2.459   6.172  -1.815
   61    H    LYS   9           HN       LYS   9  -0.414   5.967  -4.793
   62    HA   LYS   9           HA       LYS   9  -2.792   7.606  -5.307
   63    HB2  LYS   9           HB2      LYS   9  -1.223   5.999  -7.336
   64    HB3  LYS   9           HB1      LYS   9  -2.708   6.876  -7.659
   65    HG2  LYS   9           HG2      LYS   9  -1.515   8.974  -7.015
   66    HG3  LYS   9           HG1      LYS   9  -0.027   8.030  -6.935
   67    HD2  LYS   9           HD2      LYS   9  -1.782   8.214  -9.382
   68    HD3  LYS   9           HD1      LYS   9  -0.381   9.245  -9.096
   69    HE2  LYS   9           HE2      LYS   9   0.547   7.591 -10.392
   70    HE3  LYS   9           HE1      LYS   9   0.861   6.967  -8.773
   71    HZ1  LYS   9           HZ1      LYS   9  -1.364   5.751  -9.092
   72    HZ2  LYS   9           HZ2      LYS   9  -0.004   5.156  -9.903
   73    HZ3  LYS   9           HZ3      LYS   9  -1.148   6.077 -10.738
   74    H    LEU  10           HN       LEU  10  -4.693   6.546  -5.177
   75    HA   LEU  10           HA       LEU  10  -4.696   3.602  -5.134
   76    HB2  LEU  10           HB2      LEU  10  -5.497   5.488  -3.008
   77    HB3  LEU  10           HB1      LEU  10  -6.611   4.171  -3.311
   78    HG   LEU  10           HG       LEU  10  -3.687   3.749  -2.726
   79   HD11  LEU  10          HD11      LEU  10  -6.050   3.779  -0.857
   80   HD12  LEU  10          HD12      LEU  10  -4.633   4.828  -0.805
   81   HD13  LEU  10          HD13      LEU  10  -4.469   3.108  -0.456
   82   HD21  LEU  10          HD21      LEU  10  -6.037   2.032  -3.245
   83   HD22  LEU  10          HD22      LEU  10  -4.939   1.514  -1.967
   84   HD23  LEU  10          HD23      LEU  10  -4.331   1.763  -3.604
   85    H    ASP  11           HN       ASP  11  -6.571   2.637  -5.918
   86    HA   ASP  11           HA       ASP  11  -8.209   4.268  -7.646
   87    HB2  ASP  11           HB2      ASP  11  -8.662   1.354  -6.986
   88    HB3  ASP  11           HB1      ASP  11  -9.158   2.221  -8.431
   89    H    ASP  12           HN       ASP  12 -10.429   4.672  -7.404
   90    HA   ASP  12           HA       ASP  12 -11.431   4.973  -4.807
   91    HB2  ASP  12           HB2      ASP  12 -12.712   5.094  -7.516
   92    HB3  ASP  12           HB1      ASP  12 -13.708   5.184  -6.069
   93    HA   PRO  13           HA       PRO  13 -14.246   1.049  -5.602
   94    HB2  PRO  13           HB2      PRO  13 -13.104  -0.752  -7.373
   95    HB3  PRO  13           HB1      PRO  13 -14.447   0.329  -7.752
   96    HG2  PRO  13           HG2      PRO  13 -11.538   0.636  -8.344
   97    HG3  PRO  13           HG1      PRO  13 -12.940   1.062  -9.344
   98    HD2  PRO  13           HD2      PRO  13 -11.547   2.926  -8.007
   99    HD3  PRO  13           HD1      PRO  13 -13.309   3.044  -8.198
  100    H    THR  14           HN       THR  14 -10.725   0.772  -6.036
  101    HA   THR  14           HA       THR  14 -10.505  -1.587  -4.465
  102    HB   THR  14           HB       THR  14  -8.791  -0.451  -6.177
  103    HG1  THR  14           HG1      THR  14  -7.154  -1.787  -4.941
  104   HG21  THR  14          HG21      THR  14  -6.892   0.533  -5.077
  105   HG22  THR  14          HG22      THR  14  -7.631   0.303  -3.493
  106   HG23  THR  14          HG23      THR  14  -8.326   1.458  -4.630
  107    H    ARG  15           HN       ARG  15 -10.601   1.825  -3.780
  108    HA   ARG  15           HA       ARG  15  -9.523   1.821  -1.190
  109    HB2  ARG  15           HB2      ARG  15  -9.989   3.887  -2.439
  110    HB3  ARG  15           HB1      ARG  15 -11.715   3.561  -2.357
  111    HG2  ARG  15           HG2      ARG  15 -11.208   5.207  -0.726
  112    HG3  ARG  15           HG1      ARG  15 -11.549   3.700   0.126
  113    HD2  ARG  15           HD2      ARG  15  -9.090   3.298   0.247
  114    HD3  ARG  15           HD1      ARG  15  -8.843   4.904  -0.439
  115    HE   ARG  15           HE       ARG  15  -9.636   5.859   1.548
  116   HH11  ARG  15          HH21      ARG  15  -9.614   2.358   1.677
  117   HH12  ARG  15          HH22      ARG  15  -9.820   2.291   3.393
  118   HH21  ARG  15          HH11      ARG  15  -9.948   5.774   3.807
  119   HH22  ARG  15          HH12      ARG  15 -10.029   4.240   4.604
  120    H    GLU  16           HN       GLU  16 -12.765   1.227  -2.432
  121    HA   GLU  16           HA       GLU  16 -14.081   0.841   0.025
  122    HB2  GLU  16           HB2      GLU  16 -14.617  -0.499  -2.639
  123    HB3  GLU  16           HB1      GLU  16 -15.738  -0.436  -1.286
  124    HG2  GLU  16           HG2      GLU  16 -14.718   1.928  -2.844
  125    HG3  GLU  16           HG1      GLU  16 -16.312   1.191  -2.996
  126    H    ARG  17           HN       ARG  17 -12.358  -1.379  -2.118
  127    HA   ARG  17           HA       ARG  17 -12.766  -3.751  -0.672
  128    HB2  ARG  17           HB2      ARG  17 -11.717  -3.409  -3.024
  129    HB3  ARG  17           HB1      ARG  17 -10.208  -3.172  -2.157
  130    HG2  ARG  17           HG2      ARG  17 -11.922  -5.639  -1.928
  131    HG3  ARG  17           HG1      ARG  17 -10.547  -5.479  -3.019
  132    HD2  ARG  17           HD2      ARG  17  -9.105  -5.034  -1.048
  133    HD3  ARG  17           HD1      ARG  17 -10.493  -5.338  -0.007
  134    HE   ARG  17           HE       ARG  17  -9.774  -7.451  -1.879
  135   HH11  ARG  17          HH21      ARG  17  -9.684  -6.244   1.414
  136   HH12  ARG  17          HH22      ARG  17  -9.226  -7.770   2.092
  137   HH21  ARG  17          HH11      ARG  17  -9.166  -9.427  -1.009
  138   HH22  ARG  17          HH12      ARG  17  -8.924  -9.598   0.701
  139    H    LEU  18           HN       LEU  18 -10.375  -1.181  -0.398
  140    HA   LEU  18           HA       LEU  18  -8.696  -2.358   1.489
  141    HB2  LEU  18           HB2      LEU  18  -9.269   0.398   0.618
  142    HB3  LEU  18           HB1      LEU  18  -8.625   0.256   2.242
  143    HG   LEU  18           HG       LEU  18  -6.761  -1.170   1.165
  144   HD11  LEU  18          HD11      LEU  18  -7.526   0.359  -1.295
  145   HD12  LEU  18          HD12      LEU  18  -8.047  -1.302  -1.023
  146   HD13  LEU  18          HD13      LEU  18  -6.327  -0.923  -1.119
  147   HD21  LEU  18          HD21      LEU  18  -7.025   1.791   0.702
  148   HD22  LEU  18          HD22      LEU  18  -5.522   0.889   0.512
  149   HD23  LEU  18          HD23      LEU  18  -6.303   0.978   2.091
  150    H    LYS  19           HN       LYS  19 -11.795  -0.652   1.903
  151    HA   LYS  19           HA       LYS  19 -11.717  -0.589   4.716
  152    HB2  LYS  19           HB2      LYS  19 -13.443   0.634   3.418
  153    HB3  LYS  19           HB1      LYS  19 -14.188  -0.910   3.008
  154    HG2  LYS  19           HG2      LYS  19 -14.514  -1.343   5.426
  155    HG3  LYS  19           HG1      LYS  19 -13.887   0.268   5.764
  156    HD2  LYS  19           HD2      LYS  19 -15.724   1.195   4.349
  157    HD3  LYS  19           HD1      LYS  19 -16.386  -0.437   4.235
  158    HE2  LYS  19           HE2      LYS  19 -16.095   1.293   6.679
  159    HE3  LYS  19           HE1      LYS  19 -17.570   0.627   5.984
  160    HZ1  LYS  19           HZ1      LYS  19 -16.960  -0.601   7.939
  161    HZ2  LYS  19           HZ2      LYS  19 -15.411  -0.906   7.335
  162    HZ3  LYS  19           HZ3      LYS  19 -16.761  -1.600   6.588
  163    H    ALA  20           HN       ALA  20 -12.850  -3.004   2.457
  164    HA   ALA  20           HA       ALA  20 -13.771  -4.900   4.315
  165    HB1  ALA  20           HB1      ALA  20 -14.328  -5.144   1.987
  166    HB2  ALA  20           HB2      ALA  20 -13.414  -6.565   2.495
  167    HB3  ALA  20           HB3      ALA  20 -12.626  -5.301   1.551
  168    H    ALA  21           HN       ALA  21 -10.577  -4.291   2.935
  169    HA   ALA  21           HA       ALA  21  -9.248  -6.477   4.154
  170    HB1  ALA  21           HB1      ALA  21  -8.301  -5.153   2.278
  171    HB2  ALA  21           HB2      ALA  21  -7.191  -5.304   3.640
  172    HB3  ALA  21           HB3      ALA  21  -8.076  -3.801   3.386
  173    H    ALA  22           HN       ALA  22  -9.891  -3.158   5.100
  174    HA   ALA  22           HA       ALA  22  -8.501  -3.099   7.515
  175    HB1  ALA  22           HB1      ALA  22 -11.110  -1.692   7.031
  176    HB2  ALA  22           HB2      ALA  22  -9.595  -1.155   6.309
  177    HB3  ALA  22           HB3      ALA  22  -9.774  -1.181   8.064
  178    H    GLN  23           HN       GLN  23 -11.757  -4.040   6.743
  179    HA   GLN  23           HA       GLN  23 -12.610  -4.669   9.360
  180    HB2  GLN  23           HB2      GLN  23 -13.596  -5.695   6.690
  181    HB3  GLN  23           HB1      GLN  23 -14.434  -5.911   8.220
  182    HG2  GLN  23           HG2      GLN  23 -13.791  -3.237   7.005
  183    HG3  GLN  23           HG1      GLN  23 -15.325  -4.075   6.798
  184   HE21  GLN  23          HE21      GLN  23 -16.608  -4.461   8.722
  185   HE22  GLN  23          HE22      GLN  23 -16.464  -3.395  10.077
  186    H    SER  24           HN       SER  24 -11.108  -6.586   6.788
  187    HA   SER  24           HA       SER  24 -11.355  -9.077   8.096
  188    HB2  SER  24           HB2      SER  24  -9.769  -9.929   6.456
  189    HB3  SER  24           HB1      SER  24 -10.923  -8.860   5.664
  190    HG   SER  24           HG       SER  24  -9.043  -7.254   6.286
  191    H    ILE  25           HN       ILE  25  -9.207  -6.420   8.615
  192    HA   ILE  25           HA       ILE  25  -7.577  -8.157  10.353
  193    HB   ILE  25           HB       ILE  25  -6.328  -7.144   8.452
  194   HG12  ILE  25          HG12      ILE  25  -5.448  -6.106  11.150
  195   HG13  ILE  25          HG11      ILE  25  -5.261  -7.774  10.623
  196   HG21  ILE  25          HG21      ILE  25  -6.869  -4.538   9.862
  197   HG22  ILE  25          HG22      ILE  25  -7.562  -5.035   8.319
  198   HG23  ILE  25          HG23      ILE  25  -5.824  -4.769   8.461
  199   HD11  ILE  25          HD11      ILE  25  -3.815  -7.048   8.816
  200   HD12  ILE  25          HD12      ILE  25  -3.203  -6.514  10.382
  201   HD13  ILE  25          HD13      ILE  25  -4.021  -5.370   9.318
  202    H    ASP  26           HN       ASP  26 -10.057  -6.206  10.507
  203    HA   ASP  26           HA       ASP  26 -11.061  -4.900  12.045
  204    HB2  ASP  26           HB2      ASP  26  -9.110  -6.352  13.834
  205    HB3  ASP  26           HB1      ASP  26 -10.395  -5.313  14.442
  206    H    ARG  27           HN       ARG  27  -9.375  -3.400  10.598
  207    HA   ARG  27           HA       ARG  27  -8.212  -1.590  12.615
  208    HB2  ARG  27           HB2      ARG  27  -7.009  -2.375   9.961
  209    HB3  ARG  27           HB1      ARG  27  -6.486  -0.963  10.869
  210    HG2  ARG  27           HG2      ARG  27  -5.875  -2.401  12.751
  211    HG3  ARG  27           HG1      ARG  27  -6.387  -3.817  11.831
  212    HD2  ARG  27           HD2      ARG  27  -4.705  -3.231  10.101
  213    HD3  ARG  27           HD1      ARG  27  -4.151  -1.917  11.137
  214    HE   ARG  27           HE       ARG  27  -3.604  -4.726  11.439
  215   HH11  ARG  27          HH21      ARG  27  -3.792  -1.659  13.114
  216   HH12  ARG  27          HH22      ARG  27  -2.675  -2.120  14.355
  217   HH21  ARG  27          HH11      ARG  27  -2.130  -5.342  13.067
  218   HH22  ARG  27          HH12      ARG  27  -1.720  -4.221  14.321
  219    H    THR  28           HN       THR  28  -8.016   0.661  11.886
  220    HA   THR  28           HA       THR  28 -10.456   1.575  10.755
  221    HB   THR  28           HB       THR  28  -7.979   3.247  11.175
  222    HG1  THR  28           HG1      THR  28  -9.753   2.128  13.081
  223   HG21  THR  28          HG21      THR  28  -9.896   4.367  10.136
  224   HG22  THR  28          HG22      THR  28  -9.590   4.998  11.754
  225   HG23  THR  28          HG23      THR  28 -10.920   3.871  11.483
  226    HA   PRO  29           HA       PRO  29  -9.711   1.395   6.367
  227    HB2  PRO  29           HB2      PRO  29 -10.875   4.150   6.561
  228    HB3  PRO  29           HB1      PRO  29 -11.227   2.863   5.401
  229    HG2  PRO  29           HG2      PRO  29 -12.853   3.314   7.460
  230    HG3  PRO  29           HG1      PRO  29 -12.505   1.662   6.918
  231    HD2  PRO  29           HD2      PRO  29 -11.592   3.080   9.350
  232    HD3  PRO  29           HD1      PRO  29 -11.793   1.342   9.063
  233    H    HIS  30           HN       HIS  30  -9.019   4.643   7.756
  234    HA   HIS  30           HA       HIS  30  -7.120   5.369   5.792
  235    HB2  HIS  30           HB2      HIS  30  -8.319   6.892   7.428
  236    HB3  HIS  30           HB1      HIS  30  -7.196   6.335   8.660
  237    HD1  HIS  30           HD1      HIS  30  -7.103   8.132   5.300
  238    HD2  HIS  30           HD2      HIS  30  -4.916   7.827   8.824
  239    HE1  HIS  30           HE1      HIS  30  -5.256   9.822   5.094
  240    HE2  HIS  30           HE2      HIS  30  -4.169   9.839   7.363
  241    H    TRP  31           HN       TRP  31  -6.765   4.000   9.022
  242    HA   TRP  31           HA       TRP  31  -3.962   3.837   9.071
  243    HB2  TRP  31           HB2      TRP  31  -5.459   3.702  11.077
  244    HB3  TRP  31           HB1      TRP  31  -5.922   2.082  10.562
  245    HD1  TRP  31           HD1      TRP  31  -4.643   0.277  11.837
  246    HE1  TRP  31           HE1      TRP  31  -2.309   0.069  12.905
  247    HE3  TRP  31           HE3      TRP  31  -2.769   4.890  10.637
  248    HZ2  TRP  31           HZ2      TRP  31   0.013   1.637  13.193
  249    HZ3  TRP  31           HZ3      TRP  31  -0.480   5.451  11.348
  250    HH2  TRP  31           HH2      TRP  31   0.880   3.857  12.599
  251    H    LEU  32           HN       LEU  32  -6.469   1.721   7.978
  252    HA   LEU  32           HA       LEU  32  -4.992  -0.581   7.477
  253    HB2  LEU  32           HB2      LEU  32  -7.441  -0.553   7.440
  254    HB3  LEU  32           HB1      LEU  32  -7.412   0.455   6.010
  255    HG   LEU  32           HG       LEU  32  -7.922  -2.048   5.722
  256   HD11  LEU  32          HD11      LEU  32  -7.097  -2.043   3.552
  257   HD12  LEU  32          HD12      LEU  32  -5.670  -1.109   3.995
  258   HD13  LEU  32          HD13      LEU  32  -7.252  -0.332   3.947
  259   HD21  LEU  32          HD21      LEU  32  -6.076  -2.862   7.138
  260   HD22  LEU  32          HD22      LEU  32  -4.924  -2.244   5.953
  261   HD23  LEU  32          HD23      LEU  32  -6.038  -3.537   5.508
  262    H    ILE  33           HN       ILE  33  -5.527   2.265   5.502
  263    HA   ILE  33           HA       ILE  33  -4.377   1.309   3.134
  264    HB   ILE  33           HB       ILE  33  -4.172   4.115   4.258
  265   HG12  ILE  33          HG12      ILE  33  -6.154   3.046   2.241
  266   HG13  ILE  33          HG11      ILE  33  -6.511   3.219   3.957
  267   HG21  ILE  33          HG21      ILE  33  -3.966   4.689   1.795
  268   HG22  ILE  33          HG22      ILE  33  -3.650   2.974   1.529
  269   HG23  ILE  33          HG23      ILE  33  -2.570   3.922   2.549
  270   HD11  ILE  33          HD11      ILE  33  -5.851   5.409   2.007
  271   HD12  ILE  33          HD12      ILE  33  -6.018   5.643   3.747
  272   HD13  ILE  33          HD13      ILE  33  -7.400   5.102   2.793
  273    H    LYS  34           HN       LYS  34  -2.973   2.997   5.901
  274    HA   LYS  34           HA       LYS  34  -0.275   2.978   5.027
  275    HB2  LYS  34           HB2      LYS  34  -1.030   2.814   7.933
  276    HB3  LYS  34           HB1      LYS  34   0.264   3.737   7.181
  277    HG2  LYS  34           HG2      LYS  34  -2.685   4.340   7.081
  278    HG3  LYS  34           HG1      LYS  34  -1.440   5.244   7.943
  279    HD2  LYS  34           HD2      LYS  34  -0.445   5.959   5.896
  280    HD3  LYS  34           HD1      LYS  34  -1.459   4.869   4.956
  281    HE2  LYS  34           HE2      LYS  34  -2.857   6.830   6.666
  282    HE3  LYS  34           HE1      LYS  34  -1.991   7.479   5.274
  283    HZ1  LYS  34           HZ1      LYS  34  -4.203   5.513   5.298
  284    HZ2  LYS  34           HZ2      LYS  34  -3.205   5.724   3.946
  285    HZ3  LYS  34           HZ3      LYS  34  -4.137   7.014   4.512
  286    H    GLN  35           HN       GLN  35  -2.096   0.826   7.125
  287    HA   GLN  35           HA       GLN  35  -0.030  -0.979   7.704
  288    HB2  GLN  35           HB2      GLN  35  -3.033  -1.243   7.752
  289    HB3  GLN  35           HB1      GLN  35  -1.952  -2.523   8.290
  290    HG2  GLN  35           HG2      GLN  35  -1.547   0.169   9.449
  291    HG3  GLN  35           HG1      GLN  35  -2.987  -0.721   9.941
  292   HE21  GLN  35          HE21      GLN  35  -0.501   0.029  11.393
  293   HE22  GLN  35          HE22      GLN  35   0.101  -1.457  12.039
  294    H    ALA  36           HN       ALA  36  -2.675  -1.161   5.341
  295    HA   ALA  36           HA       ALA  36  -2.245  -3.649   4.313
  296    HB1  ALA  36           HB1      ALA  36  -3.211  -1.149   2.975
  297    HB2  ALA  36           HB2      ALA  36  -4.147  -2.522   3.567
  298    HB3  ALA  36           HB3      ALA  36  -3.134  -2.697   2.134
  299    H    ILE  37           HN       ILE  37  -0.472  -0.672   3.415
  300    HA   ILE  37           HA       ILE  37   0.963  -2.114   1.413
  301    HB   ILE  37           HB       ILE  37   0.798   0.234   1.076
  302   HG12  ILE  37          HG12      ILE  37   3.155   0.891   0.786
  303   HG13  ILE  37          HG11      ILE  37   3.649  -0.448   1.815
  304   HG21  ILE  37          HG21      ILE  37   2.228   0.600   3.694
  305   HG22  ILE  37          HG22      ILE  37   0.544   0.992   3.347
  306   HG23  ILE  37          HG23      ILE  37   1.840   1.888   2.554
  307   HD11  ILE  37          HD11      ILE  37   2.940  -2.041   0.216
  308   HD12  ILE  37          HD12      ILE  37   3.890  -0.826  -0.639
  309   HD13  ILE  37          HD13      ILE  37   2.130  -0.807  -0.748
  310    H    PHE  38           HN       PHE  38   2.008  -1.039   4.735
  311    HA   PHE  38           HA       PHE  38   4.486  -2.502   4.348
  312    HB2  PHE  38           HB2      PHE  38   5.200  -1.667   6.366
  313    HB3  PHE  38           HB1      PHE  38   3.946  -0.485   6.018
  314    HD1  PHE  38           HD1      PHE  38   4.735  -3.525   7.971
  315    HD2  PHE  38           HD2      PHE  38   2.075  -0.248   7.427
  316    HE1  PHE  38           HE1      PHE  38   3.638  -4.071  10.101
  317    HE2  PHE  38           HE2      PHE  38   0.975  -0.791   9.556
  318    HZ   PHE  38           HZ       PHE  38   1.751  -2.705  10.893
  319    H    ASN  39           HN       ASN  39   1.400  -3.154   5.815
  320    HA   ASN  39           HA       ASN  39   2.126  -5.601   7.020
  321    HB2  ASN  39           HB2      ASN  39   0.093  -4.295   7.659
  322    HB3  ASN  39           HB1      ASN  39  -0.626  -4.752   6.117
  323   HD21  ASN  39          HD21      ASN  39  -2.300  -5.659   7.451
  324   HD22  ASN  39          HD22      ASN  39  -2.094  -7.234   8.127
  325    H    TYR  40           HN       TYR  40   1.173  -4.613   3.789
  326    HA   TYR  40           HA       TYR  40   0.595  -7.176   2.800
  327    HB2  TYR  40           HB2      TYR  40   0.165  -5.448   1.250
  328    HB3  TYR  40           HB1      TYR  40   1.721  -4.683   1.535
  329    HD1  TYR  40           HD2      TYR  40   0.860  -8.203   0.564
  330    HD2  TYR  40           HD1      TYR  40   2.808  -4.569  -0.482
  331    HE1  TYR  40           HE2      TYR  40   1.780  -9.281  -1.447
  332    HE2  TYR  40           HE1      TYR  40   3.732  -5.636  -2.489
  333    HH   TYR  40           HH       TYR  40   4.080  -7.569  -3.525
  334    H    LEU  41           HN       LEU  41   3.529  -5.339   3.294
  335    HA   LEU  41           HA       LEU  41   5.297  -7.305   2.326
  336    HB2  LEU  41           HB2      LEU  41   5.799  -5.092   4.290
  337    HB3  LEU  41           HB1      LEU  41   7.044  -6.033   3.489
  338    HG   LEU  41           HG       LEU  41   5.078  -4.166   2.164
  339   HD11  LEU  41          HD11      LEU  41   6.694  -2.837   3.155
  340   HD12  LEU  41          HD12      LEU  41   7.293  -3.060   1.511
  341   HD13  LEU  41          HD13      LEU  41   7.984  -3.995   2.836
  342   HD21  LEU  41          HD21      LEU  41   5.419  -5.924   0.620
  343   HD22  LEU  41          HD22      LEU  41   7.141  -6.017   0.989
  344   HD23  LEU  41          HD23      LEU  41   6.499  -4.621   0.122
  345    H    GLU  42           HN       GLU  42   4.256  -6.484   5.622
  346    HA   GLU  42           HA       GLU  42   5.748  -8.460   6.956
  347    HB2  GLU  42           HB2      GLU  42   4.690  -6.482   8.065
  348    HB3  GLU  42           HB1      GLU  42   3.125  -7.266   7.885
  349    HG2  GLU  42           HG2      GLU  42   3.939  -9.150   9.238
  350    HG3  GLU  42           HG1      GLU  42   5.471  -8.310   9.453
  351    H    LYS  43           HN       LYS  43   2.492  -8.538   5.585
  352    HA   LYS  43           HA       LYS  43   1.835 -11.104   6.628
  353    HB2  LYS  43           HB2      LYS  43   0.138  -9.437   5.886
  354    HB3  LYS  43           HB1      LYS  43   0.643  -9.711   4.223
  355    HG2  LYS  43           HG2      LYS  43  -0.015 -12.067   4.426
  356    HG3  LYS  43           HG1      LYS  43  -0.557 -11.764   6.076
  357    HD2  LYS  43           HD2      LYS  43  -1.640 -10.250   3.711
  358    HD3  LYS  43           HD1      LYS  43  -2.337 -11.771   4.269
  359    HE2  LYS  43           HE2      LYS  43  -2.532 -10.688   6.548
  360    HE3  LYS  43           HE1      LYS  43  -2.148  -9.162   5.750
  361    HZ1  LYS  43           HZ1      LYS  43  -4.563  -9.624   6.003
  362    HZ2  LYS  43           HZ2      LYS  43  -4.388 -10.922   4.932
  363    HZ3  LYS  43           HZ3      LYS  43  -4.074  -9.342   4.406
  364    H    LEU  44           HN       LEU  44   3.166  -9.985   3.525
  365    HA   LEU  44           HA       LEU  44   3.115 -12.603   2.389
  366    HB2  LEU  44           HB2      LEU  44   3.957 -11.692   0.456
  367    HB3  LEU  44           HB1      LEU  44   3.164 -10.307   1.172
  368    HG   LEU  44           HG       LEU  44   5.627  -9.903   2.141
  369   HD11  LEU  44          HD11      LEU  44   6.292 -12.047   0.825
  370   HD12  LEU  44          HD12      LEU  44   7.348 -10.636   0.791
  371   HD13  LEU  44          HD13      LEU  44   6.283 -10.972  -0.575
  372   HD21  LEU  44          HD21      LEU  44   4.266  -8.339   0.817
  373   HD22  LEU  44          HD22      LEU  44   4.772  -9.165  -0.657
  374   HD23  LEU  44          HD23      LEU  44   5.963  -8.327   0.338
  375    H    GLU  45           HN       GLU  45   5.466 -10.753   4.187
  376    HA   GLU  45           HA       GLU  45   7.615 -12.611   3.737
  377    HB2  GLU  45           HB2      GLU  45   7.284 -10.218   5.531
  378    HB3  GLU  45           HB1      GLU  45   8.743 -11.205   5.529
  379    HG2  GLU  45           HG2      GLU  45   9.065 -10.693   3.155
  380    HG3  GLU  45           HG1      GLU  45   7.606  -9.707   3.171
  381    H1   MET  46           HT1      MET  46  -3.439   3.067 -13.682
  382    H2   MET  46           HT2      MET  46  -4.328   3.766 -14.936
  383    H3   MET  46           HT3      MET  46  -3.762   2.179 -15.087
  384    HA   MET  46           HA       MET  46  -5.996   1.930 -14.597
  385    HB2  MET  46           HB2      MET  46  -4.491   1.792 -11.972
  386    HB3  MET  46           HB1      MET  46  -6.031   1.010 -12.301
  387    HG2  MET  46           HG2      MET  46  -4.972  -0.333 -14.051
  388    HG3  MET  46           HG1      MET  46  -3.428   0.440 -13.698
  389    HE1  MET  46           HE1      MET  46  -5.647  -2.608 -11.075
  390    HE2  MET  46           HE2      MET  46  -6.162  -2.000 -12.649
  391    HE3  MET  46           HE3      MET  46  -6.288  -0.972 -11.223
  392    H    ALA  47           HN       ALA  47  -7.445   2.332 -12.262
  393    HA   ALA  47           HA       ALA  47  -8.102   5.153 -12.565
  394    HB1  ALA  47           HB1      ALA  47  -9.843   3.384 -12.654
  395    HB2  ALA  47           HB2      ALA  47 -10.147   4.612 -11.425
  396    HB3  ALA  47           HB3      ALA  47  -9.516   3.033 -10.957
  397    H    THR  48           HN       THR  48  -5.715   4.395 -11.206
  398    HA   THR  48           HA       THR  48  -6.048   4.663  -8.391
  399    HB   THR  48           HB       THR  48  -4.269   3.302  -9.256
  400    HG1  THR  48           HG1      THR  48  -3.600   4.228  -7.384
  401   HG21  THR  48          HG21      THR  48  -2.439   4.156 -10.588
  402   HG22  THR  48          HG22      THR  48  -3.155   5.767 -10.576
  403   HG23  THR  48          HG23      THR  48  -3.973   4.446 -11.409
  404    H    THR  49           HN       THR  49  -6.549   6.498  -7.446
  405    HA   THR  49           HA       THR  49  -5.820   9.081  -8.630
  406    HB   THR  49           HB       THR  49  -7.679   8.586  -6.299
  407    HG1  THR  49           HG1      THR  49  -9.161   7.944  -7.674
  408   HG21  THR  49          HG21      THR  49  -7.424  10.860  -8.271
  409   HG22  THR  49          HG22      THR  49  -6.970  10.896  -6.567
  410   HG23  THR  49          HG23      THR  49  -8.665  10.730  -7.025
  411    H    THR  50           HN       THR  50  -4.703  10.673  -7.442
  412    HA   THR  50           HA       THR  50  -2.751   9.746  -5.617
  413    HB   THR  50           HB       THR  50  -3.523  12.630  -6.031
  414    HG1  THR  50           HG1      THR  50  -2.530  10.787  -7.817
  415   HG21  THR  50          HG21      THR  50  -0.862  11.304  -5.479
  416   HG22  THR  50          HG22      THR  50  -1.844  12.159  -4.289
  417   HG23  THR  50          HG23      THR  50  -1.146  13.037  -5.650
  418    H    LEU  51           HN       LEU  51  -3.010   9.276  -3.546
  419    HA   LEU  51           HA       LEU  51  -4.825  10.905  -1.902
  420    HB2  LEU  51           HB2      LEU  51  -4.558   7.894  -1.780
  421    HB3  LEU  51           HB1      LEU  51  -5.492   8.873  -0.668
  422    HG   LEU  51           HG       LEU  51  -6.063   8.505  -3.612
  423   HD11  LEU  51          HD11      LEU  51  -8.029   7.701  -1.583
  424   HD12  LEU  51          HD12      LEU  51  -6.556   6.734  -1.627
  425   HD13  LEU  51          HD13      LEU  51  -7.542   6.903  -3.079
  426   HD21  LEU  51          HD21      LEU  51  -8.198   9.691  -3.035
  427   HD22  LEU  51          HD22      LEU  51  -6.755  10.703  -3.014
  428   HD23  LEU  51          HD23      LEU  51  -7.457  10.139  -1.498
  429    H    GLY  52           HN       GLY  52  -4.145  11.185   0.263
  430    HA2  GLY  52           HA2      GLY  52  -1.311  11.077   0.652
  431    HA3  GLY  52           HA1      GLY  52  -2.502  11.610   1.831
  432    H    VAL  53           HN       VAL  53  -0.133   9.440   1.414
  433    HA   VAL  53           HA       VAL  53  -1.417   7.491   3.199
  434    HB   VAL  53           HB       VAL  53   0.337   6.809   0.824
  435   HG11  VAL  53          HG11      VAL  53  -0.159   4.439   1.437
  436   HG12  VAL  53          HG12      VAL  53  -0.817   5.029   2.963
  437   HG13  VAL  53          HG13      VAL  53   0.885   5.281   2.582
  438   HG21  VAL  53          HG21      VAL  53  -1.658   5.592   0.028
  439   HG22  VAL  53          HG22      VAL  53  -1.920   7.331   0.157
  440   HG23  VAL  53          HG23      VAL  53  -2.567   6.249   1.388
  441    H    LYS  54           HN       LYS  54   0.292   6.189   4.388
  442    HA   LYS  54           HA       LYS  54   2.686   7.833   4.808
  443    HB2  LYS  54           HB2      LYS  54   1.109   6.336   6.916
  444    HB3  LYS  54           HB1      LYS  54   2.602   7.215   7.194
  445    HG2  LYS  54           HG2      LYS  54   1.434   9.290   6.454
  446    HG3  LYS  54           HG1      LYS  54  -0.062   8.361   6.406
  447    HD2  LYS  54           HD2      LYS  54   1.674   8.662   8.854
  448    HD3  LYS  54           HD1      LYS  54   0.266   9.666   8.507
  449    HE2  LYS  54           HE2      LYS  54  -0.659   8.073   9.877
  450    HE3  LYS  54           HE1      LYS  54  -0.948   7.356   8.293
  451    HZ1  LYS  54           HZ1      LYS  54   1.281   6.186   8.693
  452    HZ2  LYS  54           HZ2      LYS  54  -0.072   5.626   9.541
  453    HZ3  LYS  54           HZ3      LYS  54   1.062   6.609  10.317
  454    H    LEU  55           HN       LEU  55   4.586   6.762   4.742
  455    HA   LEU  55           HA       LEU  55   4.585   3.820   4.827
  456    HB2  LEU  55           HB2      LEU  55   5.386   5.606   2.615
  457    HB3  LEU  55           HB1      LEU  55   6.499   4.302   2.977
  458    HG   LEU  55           HG       LEU  55   3.573   3.859   2.414
  459   HD11  LEU  55          HD11      LEU  55   5.934   3.800   0.544
  460   HD12  LEU  55          HD12      LEU  55   4.520   4.849   0.445
  461   HD13  LEU  55          HD13      LEU  55   4.353   3.114   0.174
  462   HD21  LEU  55          HD21      LEU  55   5.921   2.165   3.007
  463   HD22  LEU  55          HD22      LEU  55   4.822   1.590   1.756
  464   HD23  LEU  55          HD23      LEU  55   4.216   1.913   3.380
  465    H    ASP  56           HN       ASP  56   6.463   2.892   5.655
  466    HA   ASP  56           HA       ASP  56   8.106   4.605   7.299
  467    HB2  ASP  56           HB2      ASP  56   8.560   1.663   6.784
  468    HB3  ASP  56           HB1      ASP  56   9.042   2.599   8.190
  469    H    ASP  57           HN       ASP  57  10.329   4.998   7.024
  470    HA   ASP  57           HA       ASP  57  11.323   5.151   4.412
  471    HB2  ASP  57           HB2      ASP  57  12.587   5.442   7.108
  472    HB3  ASP  57           HB1      ASP  57  13.611   5.396   5.678
  473    HA   PRO  58           HA       PRO  58  14.129   1.269   5.394
  474    HB2  PRO  58           HB2      PRO  58  12.992  -0.441   7.254
  475    HB3  PRO  58           HB1      PRO  58  14.336   0.658   7.577
  476    HG2  PRO  58           HG2      PRO  58  11.428   0.992   8.160
  477    HG3  PRO  58           HG1      PRO  58  12.831   1.470   9.133
  478    HD2  PRO  58           HD2      PRO  58  11.430   3.260   7.705
  479    HD3  PRO  58           HD1      PRO  58  13.191   3.395   7.893
  480    H    THR  59           HN       THR  59  10.609   1.026   5.851
  481    HA   THR  59           HA       THR  59  10.381  -1.407   4.396
  482    HB   THR  59           HB       THR  59   8.670  -0.188   6.056
  483    HG1  THR  59           HG1      THR  59   7.044  -1.562   4.675
  484   HG21  THR  59          HG21      THR  59   6.766   0.732   4.912
  485   HG22  THR  59          HG22      THR  59   7.504   0.424   3.340
  486   HG23  THR  59          HG23      THR  59   8.197   1.637   4.416
  487    H    ARG  60           HN       ARG  60  10.475   1.970   3.548
  488    HA   ARG  60           HA       ARG  60   9.395   1.845   0.960
  489    HB2  ARG  60           HB2      ARG  60   9.864   3.966   2.107
  490    HB3  ARG  60           HB1      ARG  60  11.589   3.629   2.047
  491    HG2  ARG  60           HG2      ARG  60  11.094   5.199   0.339
  492    HG3  ARG  60           HG1      ARG  60  11.437   3.653  -0.439
  493    HD2  ARG  60           HD2      ARG  60   8.980   3.250  -0.557
  494    HD3  ARG  60           HD1      ARG  60   8.731   4.886   0.055
  495    HE   ARG  60           HE       ARG  60   9.576   5.749  -1.965
  496   HH11  ARG  60          HH21      ARG  60   9.404   2.249  -1.956
  497   HH12  ARG  60          HH22      ARG  60   9.595   2.109  -3.669
  498   HH21  ARG  60          HH11      ARG  60   9.878   5.570  -4.218
  499   HH22  ARG  60          HH12      ARG  60   9.881   4.003  -4.954
  500    H    GLU  61           HN       GLU  61  12.640   1.306   2.224
  501    HA   GLU  61           HA       GLU  61  13.943   0.808  -0.221
  502    HB2  GLU  61           HB2      GLU  61  14.511  -0.389   2.505
  503    HB3  GLU  61           HB1      GLU  61  15.623  -0.377   1.143
  504    HG2  GLU  61           HG2      GLU  61  14.582   2.046   2.598
  505    HG3  GLU  61           HG1      GLU  61  16.186   1.339   2.769
  506    H    ARG  62           HN       ARG  62  12.219  -1.303   2.035
  507    HA   ARG  62           HA       ARG  62  12.635  -3.744   0.701
  508    HB2  ARG  62           HB2      ARG  62  11.590  -3.302   3.037
  509    HB3  ARG  62           HB1      ARG  62  10.079  -3.103   2.164
  510    HG2  ARG  62           HG2      ARG  62  11.793  -5.579   2.037
  511    HG3  ARG  62           HG1      ARG  62  10.423  -5.371   3.127
  512    HD2  ARG  62           HD2      ARG  62   8.973  -5.008   1.140
  513    HD3  ARG  62           HD1      ARG  62  10.357  -5.369   0.112
  514    HE   ARG  62           HE       ARG  62   9.630  -7.390   2.081
  515   HH11  ARG  62          HH21      ARG  62   9.520  -6.326  -1.265
  516   HH12  ARG  62          HH22      ARG  62   9.044  -7.877  -1.871
  517   HH21  ARG  62          HH11      ARG  62   8.995  -9.401   1.293
  518   HH22  ARG  62          HH12      ARG  62   8.738  -9.637  -0.407
  519    H    LEU  63           HN       LEU  63  10.253  -1.185   0.306
  520    HA   LEU  63           HA       LEU  63   8.567  -2.451  -1.519
  521    HB2  LEU  63           HB2      LEU  63   9.147   0.344  -0.786
  522    HB3  LEU  63           HB1      LEU  63   8.499   0.122  -2.399
  523    HG   LEU  63           HG       LEU  63   6.634  -1.243  -1.249
  524   HD11  LEU  63          HD11      LEU  63   7.409   0.400   1.133
  525   HD12  LEU  63          HD12      LEU  63   7.926  -1.273   0.939
  526   HD13  LEU  63          HD13      LEU  63   6.207  -0.886   1.021
  527   HD21  LEU  63          HD21      LEU  63   6.904   1.737  -0.929
  528   HD22  LEU  63          HD22      LEU  63   5.400   0.847  -0.694
  529   HD23  LEU  63          HD23      LEU  63   6.178   0.861  -2.276
  530    H    LYS  64           HN       LYS  64  11.668  -0.772  -2.013
  531    HA   LYS  64           HA       LYS  64  11.595  -0.843  -4.824
  532    HB2  LYS  64           HB2      LYS  64  13.320   0.431  -3.575
  533    HB3  LYS  64           HB1      LYS  64  14.062  -1.095  -3.101
  534    HG2  LYS  64           HG2      LYS  64  14.408  -1.631  -5.488
  535    HG3  LYS  64           HG1      LYS  64  13.757  -0.049  -5.909
  536    HD2  LYS  64           HD2      LYS  64  15.575   0.985  -4.555
  537    HD3  LYS  64           HD1      LYS  64  16.258  -0.627  -4.330
  538    HE2  LYS  64           HE2      LYS  64  15.974   0.947  -6.876
  539    HE3  LYS  64           HE1      LYS  64  17.445   0.316  -6.138
  540    HZ1  LYS  64           HZ1      LYS  64  16.832  -1.020  -8.023
  541    HZ2  LYS  64           HZ2      LYS  64  15.283  -1.287  -7.400
  542    HZ3  LYS  64           HZ3      LYS  64  16.633  -1.938  -6.615
  543    H    ALA  65           HN       ALA  65  12.736  -3.151  -2.460
  544    HA   ALA  65           HA       ALA  65  13.637  -5.139  -4.223
  545    HB1  ALA  65           HB1      ALA  65  14.192  -5.270  -1.886
  546    HB2  ALA  65           HB2      ALA  65  13.275  -6.712  -2.325
  547    HB3  ALA  65           HB3      ALA  65  12.490  -5.401  -1.444
  548    H    ALA  66           HN       ALA  66  10.446  -4.448  -2.877
  549    HA   ALA  66           HA       ALA  66   9.108  -6.686  -3.989
  550    HB1  ALA  66           HB1      ALA  66   8.164  -5.270  -2.178
  551    HB2  ALA  66           HB2      ALA  66   7.054  -5.485  -3.531
  552    HB3  ALA  66           HB3      ALA  66   7.942  -3.972  -3.350
  553    H    ALA  67           HN       ALA  67   9.763  -3.418  -5.098
  554    HA   ALA  67           HA       ALA  67   8.364  -3.468  -7.511
  555    HB1  ALA  67           HB1      ALA  67  10.978  -2.049  -7.094
  556    HB2  ALA  67           HB2      ALA  67   9.467  -1.475  -6.393
  557    HB3  ALA  67           HB3      ALA  67   9.642  -1.579  -8.145
  558    H    GLN  68           HN       GLN  68  11.618  -4.378  -6.689
  559    HA   GLN  68           HA       GLN  68  12.477  -5.139  -9.265
  560    HB2  GLN  68           HB2      GLN  68  13.454  -6.036  -6.546
  561    HB3  GLN  68           HB1      GLN  68  14.288  -6.345  -8.063
  562    HG2  GLN  68           HG2      GLN  68  13.672  -3.605  -6.992
  563    HG3  GLN  68           HG1      GLN  68  15.202  -4.441  -6.750
  564   HE21  GLN  68          HE21      GLN  68  16.450  -4.961  -8.693
  565   HE22  GLN  68          HE22      GLN  68  16.300  -3.954 -10.091
  566    H    SER  69           HN       SER  69  10.965  -6.929  -6.611
  567    HA   SER  69           HA       SER  69  11.203  -9.473  -7.816
  568    HB2  SER  69           HB2      SER  69   9.612 -10.251  -6.137
  569    HB3  SER  69           HB1      SER  69  10.799  -9.180  -5.398
  570    HG   SER  69           HG       SER  69   8.903  -7.582  -6.083
  571    H    ILE  70           HN       ILE  70   9.075  -6.836  -8.458
  572    HA   ILE  70           HA       ILE  70   7.436  -8.647 -10.106
  573    HB   ILE  70           HB       ILE  70   6.192  -7.554  -8.247
  574   HG12  ILE  70          HG12      ILE  70   5.302  -6.648 -10.990
  575   HG13  ILE  70          HG11      ILE  70   5.118  -8.288 -10.378
  576   HG21  ILE  70          HG21      ILE  70   6.724  -5.012  -9.774
  577   HG22  ILE  70          HG22      ILE  70   7.418  -5.438  -8.211
  578   HG23  ILE  70          HG23      ILE  70   5.680  -5.182  -8.363
  579   HD11  ILE  70          HD11      ILE  70   3.677  -7.475  -8.607
  580   HD12  ILE  70          HD12      ILE  70   3.060  -7.016 -10.195
  581   HD13  ILE  70          HD13      ILE  70   3.882  -5.823  -9.188
  582    H    ASP  71           HN       ASP  71   9.920  -6.710 -10.365
  583    HA   ASP  71           HA       ASP  71  10.910  -5.471 -11.967
  584    HB2  ASP  71           HB2      ASP  71   8.954  -7.020 -13.665
  585    HB3  ASP  71           HB1      ASP  71  10.195  -5.973 -14.345
  586    H    ARG  72           HN       ARG  72   9.231  -3.907 -10.575
  587    HA   ARG  72           HA       ARG  72   8.056  -2.192 -12.665
  588    HB2  ARG  72           HB2      ARG  72   6.873  -2.855  -9.971
  589    HB3  ARG  72           HB1      ARG  72   6.340  -1.487 -10.938
  590    HG2  ARG  72           HG2      ARG  72   5.726  -3.020 -12.750
  591    HG3  ARG  72           HG1      ARG  72   6.228  -4.385 -11.753
  592    HD2  ARG  72           HD2      ARG  72   4.554  -3.682 -10.055
  593    HD3  ARG  72           HD1      ARG  72   4.004  -2.434 -11.171
  594    HE   ARG  72           HE       ARG  72   3.411  -5.237 -11.271
  595   HH11  ARG  72          HH21      ARG  72   3.727  -2.344 -13.214
  596   HH12  ARG  72          HH22      ARG  72   2.638  -2.896 -14.442
  597   HH21  ARG  72          HH11      ARG  72   1.968  -5.965 -12.881
  598   HH22  ARG  72          HH12      ARG  72   1.630  -4.959 -14.248
  599    H    THR  73           HN       THR  73   7.894   0.087 -12.068
  600    HA   THR  73           HA       THR  73  10.322   1.056 -10.980
  601    HB   THR  73           HB       THR  73   7.854   2.729 -11.413
  602    HG1  THR  73           HG1      THR  73   9.635   1.756 -13.424
  603   HG21  THR  73          HG21      THR  73   9.827   3.867 -10.529
  604   HG22  THR  73          HG22      THR  73   9.488   4.399 -12.176
  605   HG23  THR  73          HG23      THR  73  10.795   3.256 -11.870
  606    HA   PRO  74           HA       PRO  74   9.597   1.048  -6.583
  607    HB2  PRO  74           HB2      PRO  74  10.769   3.789  -6.890
  608    HB3  PRO  74           HB1      PRO  74  11.124   2.546  -5.683
  609    HG2  PRO  74           HG2      PRO  74  12.741   2.914  -7.766
  610    HG3  PRO  74           HG1      PRO  74  12.392   1.285  -7.160
  611    HD2  PRO  74           HD2      PRO  74  11.469   2.613  -9.639
  612    HD3  PRO  74           HD1      PRO  74  11.669   0.885  -9.288
  613    H    HIS  75           HN       HIS  75   8.891   4.221  -8.123
  614    HA   HIS  75           HA       HIS  75   7.015   5.037  -6.164
  615    HB2  HIS  75           HB2      HIS  75   8.215   6.505  -7.840
  616    HB3  HIS  75           HB1      HIS  75   7.105   5.905  -9.062
  617    HD1  HIS  75           HD1      HIS  75   6.972   7.816  -5.759
  618    HD2  HIS  75           HD2      HIS  75   4.839   7.394  -9.308
  619    HE1  HIS  75           HE1      HIS  75   5.127   9.516  -5.644
  620    HE2  HIS  75           HE2      HIS  75   4.089   9.462  -7.936
  621    H    TRP  76           HN       TRP  76   6.640   3.571  -9.349
  622    HA   TRP  76           HA       TRP  76   3.843   3.401  -9.387
  623    HB2  TRP  76           HB2      TRP  76   5.333   3.167 -11.387
  624    HB3  TRP  76           HB1      TRP  76   5.803   1.576 -10.794
  625    HD1  TRP  76           HD1      TRP  76   4.517  -0.300 -11.962
  626    HE1  TRP  76           HE1      TRP  76   2.179  -0.563 -13.010
  627    HE3  TRP  76           HE3      TRP  76   2.651   4.375 -11.012
  628    HZ2  TRP  76           HZ2      TRP  76  -0.143   0.992 -13.378
  629    HZ3  TRP  76           HZ3      TRP  76   0.360   4.899 -11.744
  630    HH2  TRP  76           HH2      TRP  76  -1.005   3.241 -12.903
  631    H    LEU  77           HN       LEU  77   6.345   1.327  -8.202
  632    HA   LEU  77           HA       LEU  77   4.861  -0.944  -7.591
  633    HB2  LEU  77           HB2      LEU  77   7.310  -0.922  -7.556
  634    HB3  LEU  77           HB1      LEU  77   7.286   0.153  -6.176
  635    HG   LEU  77           HG       LEU  77   7.790  -2.335  -5.770
  636   HD11  LEU  77          HD11      LEU  77   6.969  -2.228  -3.602
  637   HD12  LEU  77          HD12      LEU  77   5.545  -1.309  -4.084
  638   HD13  LEU  77          HD13      LEU  77   7.129  -0.536  -4.074
  639   HD21  LEU  77          HD21      LEU  77   5.938  -3.209  -7.142
  640   HD22  LEU  77          HD22      LEU  77   4.791  -2.531  -5.986
  641   HD23  LEU  77          HD23      LEU  77   5.901  -3.805  -5.483
  642    H    ILE  78           HN       ILE  78   5.405   1.992  -5.749
  643    HA   ILE  78           HA       ILE  78   4.261   1.148  -3.336
  644    HB   ILE  78           HB       ILE  78   4.055   3.898  -4.586
  645   HG12  ILE  78          HG12      ILE  78   6.037   2.923  -2.523
  646   HG13  ILE  78          HG11      ILE  78   6.392   3.015  -4.245
  647   HG21  ILE  78          HG21      ILE  78   3.854   4.586  -2.151
  648   HG22  ILE  78          HG22      ILE  78   3.538   2.885  -1.807
  649   HG23  ILE  78          HG23      ILE  78   2.454   3.787  -2.866
  650   HD11  ILE  78          HD11      ILE  78   5.739   5.295  -2.402
  651   HD12  ILE  78          HD12      ILE  78   5.904   5.448  -4.151
  652   HD13  ILE  78          HD13      ILE  78   7.286   4.948  -3.174
  653    H    LYS  79           HN       LYS  79   2.855   2.701  -6.175
  654    HA   LYS  79           HA       LYS  79   0.158   2.731  -5.295
  655    HB2  LYS  79           HB2      LYS  79   0.903   2.437  -8.194
  656    HB3  LYS  79           HB1      LYS  79  -0.383   3.400  -7.477
  657    HG2  LYS  79           HG2      LYS  79   2.570   3.990  -7.421
  658    HG3  LYS  79           HG1      LYS  79   1.324   4.864  -8.311
  659    HD2  LYS  79           HD2      LYS  79   0.343   5.661  -6.282
  660    HD3  LYS  79           HD1      LYS  79   1.378   4.619  -5.309
  661    HE2  LYS  79           HE2      LYS  79   2.752   6.496  -7.124
  662    HE3  LYS  79           HE1      LYS  79   1.886   7.220  -5.770
  663    HZ1  LYS  79           HZ1      LYS  79   4.110   5.268  -5.686
  664    HZ2  LYS  79           HZ2      LYS  79   3.114   5.549  -4.347
  665    HZ3  LYS  79           HZ3      LYS  79   4.036   6.811  -4.986
  666    H    GLN  80           HN       GLN  80   1.973   0.480  -7.293
  667    HA   GLN  80           HA       GLN  80  -0.099  -1.344  -7.788
  668    HB2  GLN  80           HB2      GLN  80   2.904  -1.622  -7.825
  669    HB3  GLN  80           HB1      GLN  80   1.815  -2.917  -8.307
  670    HG2  GLN  80           HG2      GLN  80   1.430  -0.273  -9.577
  671    HG3  GLN  80           HG1      GLN  80   2.856  -1.200 -10.037
  672   HE21  GLN  80          HE21      GLN  80   0.353  -0.474 -11.486
  673   HE22  GLN  80          HE22      GLN  80  -0.266  -1.976 -12.076
  674    H    ALA  81           HN       ALA  81   2.548  -1.418  -5.421
  675    HA   ALA  81           HA       ALA  81   2.116  -3.854  -4.274
  676    HB1  ALA  81           HB1      ALA  81   3.088  -1.295  -3.058
  677    HB2  ALA  81           HB2      ALA  81   4.021  -2.696  -3.585
  678    HB3  ALA  81           HB3      ALA  81   3.010  -2.801  -2.144
  679    H    ILE  82           HN       ILE  82   0.346  -0.836  -3.519
  680    HA   ILE  82           HA       ILE  82  -1.090  -2.181  -1.450
  681    HB   ILE  82           HB       ILE  82  -0.920   0.180  -1.225
  682   HG12  ILE  82          HG12      ILE  82  -3.275   0.857  -0.967
  683   HG13  ILE  82          HG11      ILE  82  -3.772  -0.530  -1.930
  684   HG21  ILE  82          HG21      ILE  82  -2.349   0.429  -3.858
  685   HG22  ILE  82          HG22      ILE  82  -0.664   0.832  -3.529
  686   HG23  ILE  82          HG23      ILE  82  -1.958   1.766  -2.778
  687   HD11  ILE  82          HD11      ILE  82  -3.065  -2.045  -0.256
  688   HD12  ILE  82          HD12      ILE  82  -4.011  -0.788   0.540
  689   HD13  ILE  82          HD13      ILE  82  -2.251  -0.767   0.646
  690    H    PHE  83           HN       PHE  83  -2.134  -1.265  -4.820
  691    HA   PHE  83           HA       PHE  83  -4.614  -2.701  -4.360
  692    HB2  PHE  83           HB2      PHE  83  -5.329  -1.961  -6.414
  693    HB3  PHE  83           HB1      PHE  83  -4.073  -0.767  -6.123
  694    HD1  PHE  83           HD1      PHE  83  -4.865  -3.895  -7.929
  695    HD2  PHE  83           HD2      PHE  83  -2.203  -0.597  -7.543
  696    HE1  PHE  83           HE1      PHE  83  -3.770  -4.542 -10.032
  697    HE2  PHE  83           HE2      PHE  83  -1.106  -1.241  -9.645
  698    HZ   PHE  83           HZ       PHE  83  -1.884  -3.216 -10.889
  699    H    ASN  84           HN       ASN  84  -1.532  -3.425  -5.804
  700    HA   ASN  84           HA       ASN  84  -2.266  -5.923  -6.894
  701    HB2  ASN  84           HB2      ASN  84  -0.233  -4.662  -7.601
  702    HB3  ASN  84           HB1      ASN  84   0.484  -5.025  -6.036
  703   HD21  ASN  84          HD21      ASN  84   2.173  -6.008  -7.245
  704   HD22  ASN  84          HD22      ASN  84   1.988  -7.613  -7.852
  705    H    TYR  85           HN       TYR  85  -1.310  -4.787  -3.713
  706    HA   TYR  85           HA       TYR  85  -0.723  -7.300  -2.600
  707    HB2  TYR  85           HB2      TYR  85  -0.291  -5.503  -1.136
  708    HB3  TYR  85           HB1      TYR  85  -1.843  -4.746  -1.461
  709    HD1  TYR  85           HD2      TYR  85  -1.003  -8.218  -0.314
  710    HD2  TYR  85           HD1      TYR  85  -2.930  -4.526   0.546
  711    HE1  TYR  85           HE2      TYR  85  -1.925  -9.187   1.750
  712    HE2  TYR  85           HE1      TYR  85  -3.856  -5.484   2.607
  713    HH   TYR  85           HH       TYR  85  -4.189  -7.343   3.761
  714    H    LEU  86           HN       LEU  86  -3.655  -5.484  -3.162
  715    HA   LEU  86           HA       LEU  86  -5.431  -7.389  -2.099
  716    HB2  LEU  86           HB2      LEU  86  -5.930  -5.283  -4.184
  717    HB3  LEU  86           HB1      LEU  86  -7.175  -6.179  -3.332
  718    HG   LEU  86           HG       LEU  86  -5.212  -4.241  -2.109
  719   HD11  LEU  86          HD11      LEU  86  -6.838  -2.971  -3.172
  720   HD12  LEU  86          HD12      LEU  86  -7.430  -3.110  -1.516
  721   HD13  LEU  86          HD13      LEU  86  -8.121  -4.117  -2.787
  722   HD21  LEU  86          HD21      LEU  86  -5.555  -5.926  -0.488
  723   HD22  LEU  86          HD22      LEU  86  -7.276  -6.032  -0.856
  724   HD23  LEU  86          HD23      LEU  86  -6.634  -4.599  -0.053
  725    H    GLU  87           HN       GLU  87  -4.435  -6.738  -5.461
  726    HA   GLU  87           HA       GLU  87  -5.929  -8.802  -6.648
  727    HB2  GLU  87           HB2      GLU  87  -4.890  -6.901  -7.887
  728    HB3  GLU  87           HB1      GLU  87  -3.317  -7.652  -7.658
  729    HG2  GLU  87           HG2      GLU  87  -4.072  -9.609  -8.925
  730    HG3  GLU  87           HG1      GLU  87  -5.640  -8.845  -9.160
  731    H    LYS  88           HN       LYS  88  -2.623  -8.794  -5.369
  732    HA   LYS  88           HA       LYS  88  -1.991 -11.414  -6.252
  733    HB2  LYS  88           HB2      LYS  88  -0.287  -9.718  -5.619
  734    HB3  LYS  88           HB1      LYS  88  -0.780  -9.889  -3.939
  735    HG2  LYS  88           HG2      LYS  88  -0.125 -12.249  -3.994
  736    HG3  LYS  88           HG1      LYS  88   0.394 -12.057  -5.669
  737    HD2  LYS  88           HD2      LYS  88   1.511 -10.424  -3.401
  738    HD3  LYS  88           HD1      LYS  88   2.217 -11.952  -3.928
  739    HE2  LYS  88           HE2      LYS  88   2.315 -10.919  -6.252
  740    HE3  LYS  88           HE1      LYS  88   1.972  -9.379  -5.463
  741    HZ1  LYS  88           HZ1      LYS  88   4.355  -9.767  -5.774
  742    HZ2  LYS  88           HZ2      LYS  88   4.262 -11.150  -4.805
  743    HZ3  LYS  88           HZ3      LYS  88   3.945  -9.624  -4.137
  744    H    LEU  89           HN       LEU  89  -3.304 -10.139  -3.211
  745    HA   LEU  89           HA       LEU  89  -3.265 -12.697  -1.929
  746    HB2  LEU  89           HB2      LEU  89  -4.088 -11.667  -0.048
  747    HB3  LEU  89           HB1      LEU  89  -3.312 -10.317  -0.845
  748    HG   LEU  89           HG       LEU  89  -5.777  -9.984  -1.824
  749   HD11  LEU  89          HD11      LEU  89  -6.427 -12.069  -0.407
  750   HD12  LEU  89          HD12      LEU  89  -7.491 -10.663  -0.427
  751   HD13  LEU  89          HD13      LEU  89  -6.413 -10.932   0.942
  752   HD21  LEU  89          HD21      LEU  89  -4.418  -8.361  -0.565
  753   HD22  LEU  89          HD22      LEU  89  -4.933  -9.124   0.939
  754   HD23  LEU  89          HD23      LEU  89  -6.118  -8.329  -0.098
  755    H    GLU  90           HN       GLU  90  -5.556 -10.894  -3.862
  756    HA   GLU  90           HA       GLU  90  -7.693 -12.771  -3.375
  757    HB2  GLU  90           HB2      GLU  90  -7.408 -10.401  -5.207
  758    HB3  GLU  90           HB1      GLU  90  -8.844 -11.418  -5.189
  759    HG2  GLU  90           HG2      GLU  90  -9.196 -10.864  -2.833
  760    HG3  GLU  90           HG1      GLU  90  -7.754  -9.856  -2.848
  Start of MODEL   24
    1    H1   MET   1           HT1      MET   1   3.609   1.174  13.509
    2    H2   MET   1           HT2      MET   1   4.969   1.552  14.430
    3    H3   MET   1           HT3      MET   1   4.746  -0.028  13.865
    4    HA   MET   1           HA       MET   1   6.272   0.722  12.364
    5    HB2  MET   1           HB2      MET   1   3.808   1.841  11.022
    6    HB3  MET   1           HB1      MET   1   5.198   1.073  10.272
    7    HG2  MET   1           HG2      MET   1   2.940  -0.199  11.772
    8    HG3  MET   1           HG1      MET   1   3.473  -0.489  10.118
    9    HE1  MET   1           HE1      MET   1   4.056  -3.726  12.558
   10    HE2  MET   1           HE2      MET   1   2.938  -3.060  11.367
   11    HE3  MET   1           HE3      MET   1   2.982  -2.399  13.002
   12    H    ALA   2           HN       ALA   2   7.265   2.493  11.116
   13    HA   ALA   2           HA       ALA   2   6.761   5.092  12.408
   14    HB1  ALA   2           HB1      ALA   2   9.308   3.983  11.221
   15    HB2  ALA   2           HB2      ALA   2   8.951   4.183  12.937
   16    HB3  ALA   2           HB3      ALA   2   9.122   5.600  11.900
   17    H    THR   3           HN       THR   3   5.255   4.183  10.270
   18    HA   THR   3           HA       THR   3   6.127   5.011   7.726
   19    HB   THR   3           HB       THR   3   3.634   4.939   7.236
   20    HG1  THR   3           HG1      THR   3   3.232   5.406   9.601
   21   HG21  THR   3          HG21      THR   3   5.008   2.979   6.859
   22   HG22  THR   3          HG22      THR   3   3.480   2.481   7.586
   23   HG23  THR   3          HG23      THR   3   4.941   2.562   8.571
   24    H    THR   4           HN       THR   4   6.176   6.970   6.795
   25    HA   THR   4           HA       THR   4   4.981   9.251   8.221
   26    HB   THR   4           HB       THR   4   6.534  10.642   6.842
   27    HG1  THR   4           HG1      THR   4   7.303   8.078   5.907
   28   HG21  THR   4          HG21      THR   4   8.620   9.914   8.029
   29   HG22  THR   4          HG22      THR   4   7.736   8.491   8.581
   30   HG23  THR   4          HG23      THR   4   7.210  10.100   9.073
   31    H    THR   5           HN       THR   5   4.022  10.989   6.842
   32    HA   THR   5           HA       THR   5   2.182   9.857   4.983
   33    HB   THR   5           HB       THR   5   2.700  12.809   5.292
   34    HG1  THR   5           HG1      THR   5   1.822  12.766   7.231
   35   HG21  THR   5          HG21      THR   5   0.230  11.179   4.672
   36   HG22  THR   5          HG22      THR   5   1.125  12.206   3.552
   37   HG23  THR   5          HG23      THR   5   0.252  12.927   4.904
   38    H    LEU   6           HN       LEU   6   2.818   9.206   3.042
   39    HA   LEU   6           HA       LEU   6   4.468  11.027   1.420
   40    HB2  LEU   6           HB2      LEU   6   4.516   8.004   1.329
   41    HB3  LEU   6           HB1      LEU   6   5.462   9.079   0.320
   42    HG   LEU   6           HG       LEU   6   5.769   8.647   3.294
   43   HD11  LEU   6          HD11      LEU   6   7.706   7.507   2.829
   44   HD12  LEU   6          HD12      LEU   6   7.911   8.277   1.257
   45   HD13  LEU   6          HD13      LEU   6   6.693   7.021   1.469
   46   HD21  LEU   6          HD21      LEU   6   7.710  10.184   3.096
   47   HD22  LEU   6          HD22      LEU   6   6.152  10.979   2.875
   48   HD23  LEU   6          HD23      LEU   6   7.160  10.608   1.475
   49    H    GLY   7           HN       GLY   7   3.920  11.116  -0.802
   50    HA2  GLY   7           HA2      GLY   7   1.142  10.821  -1.334
   51    HA3  GLY   7           HA1      GLY   7   2.372  11.302  -2.493
   52    H    VAL   8           HN       VAL   8   0.129   9.005  -1.785
   53    HA   VAL   8           HA       VAL   8   1.492   6.996  -3.456
   54    HB   VAL   8           HB       VAL   8  -0.294   6.546  -1.062
   55   HG11  VAL   8          HG11      VAL   8   0.646   4.519  -3.086
   56   HG12  VAL   8          HG12      VAL   8  -1.022   4.965  -2.727
   57   HG13  VAL   8          HG13      VAL   8  -0.056   4.119  -1.518
   58   HG21  VAL   8          HG21      VAL   8   1.621   5.253  -0.238
   59   HG22  VAL   8          HG22      VAL   8   2.041   6.938  -0.548
   60   HG23  VAL   8          HG23      VAL   8   2.523   5.683  -1.691
   61    H    LYS   9           HN       LYS   9   0.013   5.688  -4.771
   62    HA   LYS   9           HA       LYS   9  -2.253   7.322  -5.646
   63    HB2  LYS   9           HB2      LYS   9  -0.762   5.103  -7.051
   64    HB3  LYS   9           HB1      LYS   9  -2.087   6.030  -7.741
   65    HG2  LYS   9           HG2      LYS   9   0.444   7.318  -6.766
   66    HG3  LYS   9           HG1      LYS   9   0.249   6.723  -8.415
   67    HD2  LYS   9           HD2      LYS   9  -1.507   8.252  -8.852
   68    HD3  LYS   9           HD1      LYS   9  -1.660   8.672  -7.148
   69    HE2  LYS   9           HE2      LYS   9  -0.306  10.144  -8.976
   70    HE3  LYS   9           HE1      LYS   9   0.007  10.175  -7.243
   71    HZ1  LYS   9           HZ1      LYS   9   2.022   9.907  -8.587
   72    HZ2  LYS   9           HZ2      LYS   9   1.427   8.436  -9.176
   73    HZ3  LYS   9           HZ3      LYS   9   1.773   8.608  -7.530
   74    H    LEU  10           HN       LEU  10  -4.179   6.742  -5.018
   75    HA   LEU  10           HA       LEU  10  -4.878   3.892  -4.737
   76    HB2  LEU  10           HB2      LEU  10  -5.255   6.143  -2.800
   77    HB3  LEU  10           HB1      LEU  10  -6.441   4.856  -2.858
   78    HG   LEU  10           HG       LEU  10  -3.520   4.283  -2.431
   79   HD11  LEU  10          HD11      LEU  10  -5.627   4.891  -0.358
   80   HD12  LEU  10          HD12      LEU  10  -4.199   5.863  -0.711
   81   HD13  LEU  10          HD13      LEU  10  -4.018   4.249  -0.023
   82   HD21  LEU  10          HD21      LEU  10  -6.096   2.814  -2.260
   83   HD22  LEU  10          HD22      LEU  10  -4.830   2.401  -1.108
   84   HD23  LEU  10          HD23      LEU  10  -4.522   2.270  -2.840
   85    H    ASP  11           HN       ASP  11  -6.819   3.386  -5.671
   86    HA   ASP  11           HA       ASP  11  -8.204   5.434  -7.174
   87    HB2  ASP  11           HB2      ASP  11  -7.826   2.955  -7.853
   88    HB3  ASP  11           HB1      ASP  11  -9.166   2.608  -6.770
   89    H    ASP  12           HN       ASP  12 -10.615   5.683  -6.915
   90    HA   ASP  12           HA       ASP  12 -11.303   6.454  -4.309
   91    HB2  ASP  12           HB2      ASP  12 -12.756   6.184  -6.864
   92    HB3  ASP  12           HB1      ASP  12 -13.769   6.016  -5.437
   93    HA   PRO  13           HA       PRO  13 -13.759   2.328  -3.808
   94    HB2  PRO  13           HB2      PRO  13 -13.286   0.328  -5.589
   95    HB3  PRO  13           HB1      PRO  13 -14.582   1.512  -5.792
   96    HG2  PRO  13           HG2      PRO  13 -11.866   1.441  -7.045
   97    HG3  PRO  13           HG1      PRO  13 -13.431   1.828  -7.785
   98    HD2  PRO  13           HD2      PRO  13 -11.675   3.739  -7.039
   99    HD3  PRO  13           HD1      PRO  13 -13.431   3.983  -6.961
  100    H    THR  14           HN       THR  14 -10.476   2.347  -5.029
  101    HA   THR  14           HA       THR  14  -9.606  -0.036  -3.777
  102    HB   THR  14           HB       THR  14  -8.000   2.417  -4.537
  103    HG1  THR  14           HG1      THR  14  -8.266  -0.074  -5.896
  104   HG21  THR  14          HG21      THR  14  -6.948   0.842  -2.839
  105   HG22  THR  14          HG22      THR  14  -6.037   1.124  -4.322
  106   HG23  THR  14          HG23      THR  14  -6.948  -0.371  -4.118
  107    H    ARG  15           HN       ARG  15  -9.607   3.378  -2.746
  108    HA   ARG  15           HA       ARG  15  -8.359   2.883  -0.245
  109    HB2  ARG  15           HB2      ARG  15  -8.536   5.144  -1.247
  110    HB3  ARG  15           HB1      ARG  15 -10.273   5.114  -0.963
  111    HG2  ARG  15           HG2      ARG  15  -9.884   4.953   1.444
  112    HG3  ARG  15           HG1      ARG  15  -8.143   4.979   1.166
  113    HD2  ARG  15           HD2      ARG  15  -8.342   7.205   0.164
  114    HD3  ARG  15           HD1      ARG  15 -10.081   7.176   0.453
  115    HE   ARG  15           HE       ARG  15  -9.706   7.671   2.654
  116   HH11  ARG  15          HH21      ARG  15  -6.655   6.726   1.198
  117   HH12  ARG  15          HH22      ARG  15  -5.707   7.211   2.565
  118   HH21  ARG  15          HH11      ARG  15  -8.455   8.311   4.457
  119   HH22  ARG  15          HH12      ARG  15  -6.735   8.114   4.421
  120    H    GLU  16           HN       GLU  16 -11.720   2.994  -1.317
  121    HA   GLU  16           HA       GLU  16 -12.924   2.568   1.190
  122    HB2  GLU  16           HB2      GLU  16 -13.837   1.900  -1.599
  123    HB3  GLU  16           HB1      GLU  16 -14.841   1.631  -0.182
  124    HG2  GLU  16           HG2      GLU  16 -14.754   4.018   0.325
  125    HG3  GLU  16           HG1      GLU  16 -13.751   4.281  -1.103
  126    H    ARG  17           HN       ARG  17 -11.676   0.382  -1.254
  127    HA   ARG  17           HA       ARG  17 -12.534  -2.041  -0.151
  128    HB2  ARG  17           HB2      ARG  17 -11.299  -1.496  -2.416
  129    HB3  ARG  17           HB1      ARG  17  -9.849  -1.814  -1.477
  130    HG2  ARG  17           HG2      ARG  17 -12.131  -3.744  -1.894
  131    HG3  ARG  17           HG1      ARG  17 -10.582  -3.780  -2.733
  132    HD2  ARG  17           HD2      ARG  17  -9.485  -4.026  -0.491
  133    HD3  ARG  17           HD1      ARG  17 -11.091  -4.219   0.202
  134    HE   ARG  17           HE       ARG  17 -10.489  -6.036  -1.957
  135   HH11  ARG  17          HH21      ARG  17 -10.420  -5.498   1.499
  136   HH12  ARG  17          HH22      ARG  17 -10.305  -7.182   1.895
  137   HH21  ARG  17          HH11      ARG  17 -10.319  -8.269  -1.445
  138   HH22  ARG  17          HH12      ARG  17 -10.253  -8.762   0.217
  139    H    LEU  18           HN       LEU  18  -9.726   0.011   0.491
  140    HA   LEU  18           HA       LEU  18  -8.423  -1.716   2.273
  141    HB2  LEU  18           HB2      LEU  18  -8.359   1.198   1.752
  142    HB3  LEU  18           HB1      LEU  18  -7.813   0.694   3.339
  143    HG   LEU  18           HG       LEU  18  -6.208  -0.878   2.166
  144   HD11  LEU  18          HD11      LEU  18  -5.664  -0.482  -0.130
  145   HD12  LEU  18          HD12      LEU  18  -6.861   0.809  -0.237
  146   HD13  LEU  18          HD13      LEU  18  -7.383  -0.859  -0.010
  147   HD21  LEU  18          HD21      LEU  18  -6.091   2.065   2.287
  148   HD22  LEU  18          HD22      LEU  18  -4.869   1.284   1.286
  149   HD23  LEU  18          HD23      LEU  18  -5.020   0.852   2.989
  150    H    LYS  19           HN       LYS  19 -11.050   0.639   2.769
  151    HA   LYS  19           HA       LYS  19 -11.150   0.437   5.564
  152    HB2  LYS  19           HB2      LYS  19 -12.480   1.978   3.893
  153    HB3  LYS  19           HB1      LYS  19 -13.670   0.691   3.968
  154    HG2  LYS  19           HG2      LYS  19 -12.635   2.228   6.347
  155    HG3  LYS  19           HG1      LYS  19 -14.153   2.549   5.511
  156    HD2  LYS  19           HD2      LYS  19 -14.738   0.108   6.032
  157    HD3  LYS  19           HD1      LYS  19 -13.388   0.158   7.165
  158    HE2  LYS  19           HE2      LYS  19 -15.799   1.975   7.195
  159    HE3  LYS  19           HE1      LYS  19 -15.518   0.616   8.279
  160    HZ1  LYS  19           HZ1      LYS  19 -13.584   1.753   9.159
  161    HZ2  LYS  19           HZ2      LYS  19 -14.956   2.729   9.314
  162    HZ3  LYS  19           HZ3      LYS  19 -13.823   3.051   8.100
  163    H    ALA  20           HN       ALA  20 -12.654  -1.457   3.043
  164    HA   ALA  20           HA       ALA  20 -14.077  -3.237   4.710
  165    HB1  ALA  20           HB1      ALA  20 -14.234  -4.674   2.728
  166    HB2  ALA  20           HB2      ALA  20 -13.032  -3.675   1.911
  167    HB3  ALA  20           HB3      ALA  20 -14.602  -2.995   2.336
  168    H    ALA  21           HN       ALA  21 -10.860  -3.325   3.253
  169    HA   ALA  21           HA       ALA  21 -10.102  -5.894   4.123
  170    HB1  ALA  21           HB1      ALA  21  -7.840  -5.229   3.639
  171    HB2  ALA  21           HB2      ALA  21  -8.284  -3.524   3.700
  172    HB3  ALA  21           HB3      ALA  21  -8.898  -4.548   2.403
  173    H    ALA  22           HN       ALA  22  -9.872  -2.710   5.583
  174    HA   ALA  22           HA       ALA  22  -8.358  -3.323   7.829
  175    HB1  ALA  22           HB1      ALA  22  -9.264  -1.045   6.909
  176    HB2  ALA  22           HB2      ALA  22  -8.936  -1.245   8.630
  177    HB3  ALA  22           HB3      ALA  22 -10.590  -1.361   8.029
  178    H    GLN  23           HN       GLN  23 -11.860  -3.120   7.556
  179    HA   GLN  23           HA       GLN  23 -12.381  -4.104  10.138
  180    HB2  GLN  23           HB2      GLN  23 -14.669  -4.313   9.492
  181    HB3  GLN  23           HB1      GLN  23 -14.017  -2.892   8.734
  182    HG2  GLN  23           HG2      GLN  23 -15.094  -3.658   6.933
  183    HG3  GLN  23           HG1      GLN  23 -13.635  -4.628   6.749
  184   HE21  GLN  23          HE21      GLN  23 -14.953  -6.126   5.577
  185   HE22  GLN  23          HE22      GLN  23 -15.916  -7.274   6.432
  186    H    SER  24           HN       SER  24 -11.922  -5.701   7.057
  187    HA   SER  24           HA       SER  24 -12.853  -8.187   7.927
  188    HB2  SER  24           HB2      SER  24 -10.916  -7.568   5.686
  189    HB3  SER  24           HB1      SER  24 -11.700  -9.128   5.937
  190    HG   SER  24           HG       SER  24 -13.068  -6.679   5.538
  191    H    ILE  25           HN       ILE  25  -9.745  -6.600   8.108
  192    HA   ILE  25           HA       ILE  25  -8.515  -9.019   9.219
  193    HB   ILE  25           HB       ILE  25  -7.402  -7.667   7.343
  194   HG12  ILE  25          HG12      ILE  25  -5.846  -8.220   9.882
  195   HG13  ILE  25          HG11      ILE  25  -6.243  -9.402   8.640
  196   HG21  ILE  25          HG21      ILE  25  -7.852  -5.466   8.526
  197   HG22  ILE  25          HG22      ILE  25  -6.243  -5.687   7.840
  198   HG23  ILE  25          HG23      ILE  25  -6.494  -5.876   9.575
  199   HD11  ILE  25          HD11      ILE  25  -4.924  -7.978   7.035
  200   HD12  ILE  25          HD12      ILE  25  -3.997  -8.786   8.300
  201   HD13  ILE  25          HD13      ILE  25  -4.369  -7.067   8.440
  202    H    ASP  26           HN       ASP  26 -10.334  -6.691  10.321
  203    HA   ASP  26           HA       ASP  26 -10.799  -5.786  12.330
  204    HB2  ASP  26           HB2      ASP  26  -8.813  -7.864  13.255
  205    HB3  ASP  26           HB1      ASP  26  -9.745  -6.856  14.357
  206    H    ARG  27           HN       ARG  27  -9.111  -4.320  10.806
  207    HA   ARG  27           HA       ARG  27  -7.330  -3.081  12.815
  208    HB2  ARG  27           HB2      ARG  27  -6.793  -3.896  10.035
  209    HB3  ARG  27           HB1      ARG  27  -6.273  -2.266  10.427
  210    HG2  ARG  27           HG2      ARG  27  -4.474  -3.876  10.733
  211    HG3  ARG  27           HG1      ARG  27  -4.920  -3.114  12.260
  212    HD2  ARG  27           HD2      ARG  27  -5.499  -5.067  13.176
  213    HD3  ARG  27           HD1      ARG  27  -6.434  -5.537  11.759
  214    HE   ARG  27           HE       ARG  27  -4.689  -6.822  11.075
  215   HH11  ARG  27          HH21      ARG  27  -3.469  -4.563  13.469
  216   HH12  ARG  27          HH22      ARG  27  -1.901  -5.295  13.542
  217   HH21  ARG  27          HH11      ARG  27  -2.615  -7.774  11.168
  218   HH22  ARG  27          HH12      ARG  27  -1.412  -7.116  12.228
  219    H    THR  28           HN       THR  28  -7.113  -0.774  12.659
  220    HA   THR  28           HA       THR  28  -9.558   0.548  11.897
  221    HB   THR  28           HB       THR  28  -6.997   1.841  12.855
  222    HG1  THR  28           HG1      THR  28  -8.845   0.242  14.204
  223   HG21  THR  28          HG21      THR  28  -8.747   3.376  12.068
  224   HG22  THR  28          HG22      THR  28  -8.508   3.518  13.810
  225   HG23  THR  28          HG23      THR  28  -9.898   2.634  13.179
  226    HA   PRO  29           HA       PRO  29  -8.583   1.556   7.649
  227    HB2  PRO  29           HB2      PRO  29  -9.584   4.237   8.536
  228    HB3  PRO  29           HB1      PRO  29  -9.951   3.334   7.059
  229    HG2  PRO  29           HG2      PRO  29 -11.666   3.346   9.087
  230    HG3  PRO  29           HG1      PRO  29 -11.380   1.869   8.149
  231    HD2  PRO  29           HD2      PRO  29 -10.512   2.553  10.903
  232    HD3  PRO  29           HD1      PRO  29 -10.837   0.965  10.182
  233    H    HIS  30           HN       HIS  30  -7.821   4.192   9.962
  234    HA   HIS  30           HA       HIS  30  -5.773   5.360   8.446
  235    HB2  HIS  30           HB2      HIS  30  -6.730   6.574  10.282
  236    HB3  HIS  30           HB1      HIS  30  -6.285   5.313  11.425
  237    HD1  HIS  30           HD1      HIS  30  -4.048   5.507  12.535
  238    HD2  HIS  30           HD2      HIS  30  -4.471   8.132   9.343
  239    HE1  HIS  30           HE1      HIS  30  -2.051   7.019  12.645
  240    HE2  HIS  30           HE2      HIS  30  -2.516   8.791  10.923
  241    H    TRP  31           HN       TRP  31  -5.573   3.012  11.102
  242    HA   TRP  31           HA       TRP  31  -2.791   2.689  11.053
  243    HB2  TRP  31           HB2      TRP  31  -4.024   1.898  12.979
  244    HB3  TRP  31           HB1      TRP  31  -4.957   0.793  11.971
  245    HD1  TRP  31           HD1      TRP  31  -3.841  -1.498  11.298
  246    HE1  TRP  31           HE1      TRP  31  -1.721  -2.729  12.068
  247    HE3  TRP  31           HE3      TRP  31  -1.582   2.317  13.847
  248    HZ2  TRP  31           HZ2      TRP  31   0.596  -2.162  13.580
  249    HZ3  TRP  31           HZ3      TRP  31   0.584   1.885  14.931
  250    HH2  TRP  31           HH2      TRP  31   1.649  -0.308  14.801
  251    H    LEU  32           HN       LEU  32  -5.420   1.064   9.469
  252    HA   LEU  32           HA       LEU  32  -3.947  -0.916   8.204
  253    HB2  LEU  32           HB2      LEU  32  -6.362  -1.065   8.265
  254    HB3  LEU  32           HB1      LEU  32  -6.478   0.344   7.211
  255    HG   LEU  32           HG       LEU  32  -5.054  -0.966   5.555
  256   HD11  LEU  32          HD11      LEU  32  -5.315  -3.448   5.756
  257   HD12  LEU  32          HD12      LEU  32  -5.804  -3.187   7.431
  258   HD13  LEU  32          HD13      LEU  32  -4.195  -2.703   6.896
  259   HD21  LEU  32          HD21      LEU  32  -7.515  -0.542   5.425
  260   HD22  LEU  32          HD22      LEU  32  -7.732  -2.176   6.054
  261   HD23  LEU  32          HD23      LEU  32  -6.898  -1.922   4.522
  262    H    ILE  33           HN       ILE  33  -4.646   2.358   7.147
  263    HA   ILE  33           HA       ILE  33  -3.750   2.015   4.518
  264    HB   ILE  33           HB       ILE  33  -3.576   4.435   6.321
  265   HG12  ILE  33          HG12      ILE  33  -5.335   3.947   3.914
  266   HG13  ILE  33          HG11      ILE  33  -5.816   3.503   5.549
  267   HG21  ILE  33          HG21      ILE  33  -3.180   5.718   4.201
  268   HG22  ILE  33          HG22      ILE  33  -2.856   4.176   3.407
  269   HG23  ILE  33          HG23      ILE  33  -1.825   4.721   4.730
  270   HD11  ILE  33          HD11      ILE  33  -5.649   5.830   6.235
  271   HD12  ILE  33          HD12      ILE  33  -6.765   5.635   4.884
  272   HD13  ILE  33          HD13      ILE  33  -5.147   6.279   4.606
  273    H    LYS  34           HN       LYS  34  -2.021   2.953   7.453
  274    HA   LYS  34           HA       LYS  34   0.580   2.994   6.320
  275    HB2  LYS  34           HB2      LYS  34   0.226   2.163   9.162
  276    HB3  LYS  34           HB1      LYS  34   1.334   3.342   8.473
  277    HG2  LYS  34           HG2      LYS  34  -0.791   4.752   8.061
  278    HG3  LYS  34           HG1      LYS  34  -1.540   3.672   9.233
  279    HD2  LYS  34           HD2      LYS  34   0.957   5.291   9.736
  280    HD3  LYS  34           HD1      LYS  34  -0.665   5.769  10.230
  281    HE2  LYS  34           HE2      LYS  34   0.171   4.812  12.157
  282    HE3  LYS  34           HE1      LYS  34  -0.705   3.468  11.427
  283    HZ1  LYS  34           HZ1      LYS  34   1.172   2.331  11.075
  284    HZ2  LYS  34           HZ2      LYS  34   1.831   3.342  12.265
  285    HZ3  LYS  34           HZ3      LYS  34   2.064   3.699  10.624
  286    H    GLN  35           HN       GLN  35  -1.226   0.520   8.082
  287    HA   GLN  35           HA       GLN  35   0.780  -1.449   7.987
  288    HB2  GLN  35           HB2      GLN  35  -0.762  -1.909   9.631
  289    HB3  GLN  35           HB1      GLN  35  -2.130  -1.465   8.619
  290    HG2  GLN  35           HG2      GLN  35  -2.009  -3.492   7.407
  291    HG3  GLN  35           HG1      GLN  35  -0.457  -3.908   8.127
  292   HE21  GLN  35          HE21      GLN  35  -3.024  -5.333   8.037
  293   HE22  GLN  35          HE22      GLN  35  -3.425  -5.664   9.684
  294    H    ALA  36           HN       ALA  36  -2.177  -1.147   6.040
  295    HA   ALA  36           HA       ALA  36  -2.070  -3.329   4.455
  296    HB1  ALA  36           HB1      ALA  36  -3.919  -2.053   4.042
  297    HB2  ALA  36           HB2      ALA  36  -2.963  -1.716   2.597
  298    HB3  ALA  36           HB3      ALA  36  -2.995  -0.556   3.924
  299    H    ILE  37           HN       ILE  37  -0.320  -0.260   3.715
  300    HA   ILE  37           HA       ILE  37   0.831  -1.422   1.384
  301    HB   ILE  37           HB       ILE  37   0.707   1.021   1.735
  302   HG12  ILE  37          HG12      ILE  37   2.985   1.535   0.858
  303   HG13  ILE  37          HG11      ILE  37   3.461  -0.118   1.232
  304   HG21  ILE  37          HG21      ILE  37   2.975   0.628   3.677
  305   HG22  ILE  37          HG22      ILE  37   1.325   1.089   4.097
  306   HG23  ILE  37          HG23      ILE  37   2.322   2.171   3.126
  307   HD11  ILE  37          HD11      ILE  37   2.034  -1.003  -0.406
  308   HD12  ILE  37          HD12      ILE  37   2.811   0.389  -1.160
  309   HD13  ILE  37          HD13      ILE  37   1.153   0.515  -0.575
  310    H    PHE  38           HN       PHE  38   1.912  -1.146   4.733
  311    HA   PHE  38           HA       PHE  38   4.412  -2.471   4.345
  312    HB2  PHE  38           HB2      PHE  38   4.577  -1.419   6.344
  313    HB3  PHE  38           HB1      PHE  38   2.834  -1.352   6.542
  314    HD1  PHE  38           HD2      PHE  38   1.644  -3.325   7.539
  315    HD2  PHE  38           HD1      PHE  38   5.885  -2.970   7.525
  316    HE1  PHE  38           HE2      PHE  38   1.783  -5.000   9.332
  317    HE2  PHE  38           HE1      PHE  38   6.030  -4.642   9.322
  318    HZ   PHE  38           HZ       PHE  38   3.979  -5.659  10.227
  319    H    ASN  39           HN       ASN  39   1.157  -3.462   4.783
  320    HA   ASN  39           HA       ASN  39   1.564  -6.117   5.661
  321    HB2  ASN  39           HB2      ASN  39  -0.617  -4.567   5.576
  322    HB3  ASN  39           HB1      ASN  39  -0.845  -5.408   4.048
  323   HD21  ASN  39          HD21      ASN  39   0.639  -7.756   5.416
  324   HD22  ASN  39          HD22      ASN  39  -0.613  -8.518   6.338
  325    H    TYR  40           HN       TYR  40   1.357  -4.479   2.573
  326    HA   TYR  40           HA       TYR  40   1.300  -6.790   0.973
  327    HB2  TYR  40           HB2      TYR  40   0.937  -4.641  -0.101
  328    HB3  TYR  40           HB1      TYR  40   2.525  -4.072   0.414
  329    HD1  TYR  40           HD1      TYR  40   1.144  -7.048  -1.361
  330    HD2  TYR  40           HD2      TYR  40   4.122  -4.013  -1.262
  331    HE1  TYR  40           HE1      TYR  40   2.143  -7.974  -3.401
  332    HE2  TYR  40           HE2      TYR  40   5.128  -4.929  -3.312
  333    HH   TYR  40           HH       TYR  40   3.623  -6.981  -5.341
  334    H    LEU  41           HN       LEU  41   3.844  -4.842   2.405
  335    HA   LEU  41           HA       LEU  41   6.029  -6.373   1.493
  336    HB2  LEU  41           HB2      LEU  41   5.793  -4.729   4.013
  337    HB3  LEU  41           HB1      LEU  41   7.293  -5.278   3.290
  338    HG   LEU  41           HG       LEU  41   5.366  -3.238   2.192
  339   HD11  LEU  41          HD11      LEU  41   6.942  -2.482   3.910
  340   HD12  LEU  41          HD12      LEU  41   7.262  -1.748   2.338
  341   HD13  LEU  41          HD13      LEU  41   8.281  -3.064   2.921
  342   HD21  LEU  41          HD21      LEU  41   5.956  -4.308   0.237
  343   HD22  LEU  41          HD22      LEU  41   7.545  -4.768   0.842
  344   HD23  LEU  41          HD23      LEU  41   7.230  -3.096   0.379
  345    H    GLU  42           HN       GLU  42   4.052  -6.532   4.407
  346    HA   GLU  42           HA       GLU  42   5.351  -8.593   5.774
  347    HB2  GLU  42           HB2      GLU  42   3.496  -7.109   6.645
  348    HB3  GLU  42           HB1      GLU  42   2.370  -8.092   5.725
  349    HG2  GLU  42           HG2      GLU  42   2.190  -9.026   7.807
  350    HG3  GLU  42           HG1      GLU  42   3.406 -10.064   7.067
  351    H    LYS  43           HN       LYS  43   2.861  -8.665   3.263
  352    HA   LYS  43           HA       LYS  43   2.465 -11.469   3.287
  353    HB2  LYS  43           HB2      LYS  43   1.669  -9.236   1.541
  354    HB3  LYS  43           HB1      LYS  43   1.887 -10.763   0.700
  355    HG2  LYS  43           HG2      LYS  43  -0.395 -10.622   1.303
  356    HG3  LYS  43           HG1      LYS  43   0.347 -11.809   2.377
  357    HD2  LYS  43           HD2      LYS  43   0.579 -10.000   4.083
  358    HD3  LYS  43           HD1      LYS  43  -0.356  -8.949   3.019
  359    HE2  LYS  43           HE2      LYS  43  -1.282 -11.550   4.237
  360    HE3  LYS  43           HE1      LYS  43  -1.780  -9.933   4.727
  361    HZ1  LYS  43           HZ1      LYS  43  -2.502  -9.763   2.251
  362    HZ2  LYS  43           HZ2      LYS  43  -3.493 -10.554   3.368
  363    HZ3  LYS  43           HZ3      LYS  43  -2.512 -11.455   2.325
  364    H    LEU  44           HN       LEU  44   4.837  -9.388   1.853
  365    HA   LEU  44           HA       LEU  44   5.866 -11.396   0.078
  366    HB2  LEU  44           HB2      LEU  44   7.185  -8.843   1.020
  367    HB3  LEU  44           HB1      LEU  44   7.716  -9.850  -0.314
  368    HG   LEU  44           HG       LEU  44   5.204  -8.186  -0.181
  369   HD11  LEU  44          HD11      LEU  44   7.296  -6.991  -0.668
  370   HD12  LEU  44          HD12      LEU  44   6.179  -6.986  -2.032
  371   HD13  LEU  44          HD13      LEU  44   7.572  -8.067  -2.037
  372   HD21  LEU  44          HD21      LEU  44   4.613 -10.223  -1.290
  373   HD22  LEU  44          HD22      LEU  44   6.083 -10.179  -2.264
  374   HD23  LEU  44          HD23      LEU  44   4.823  -8.969  -2.513
  375    H    GLU  45           HN       GLU  45   6.269 -10.452   3.372
  376    HA   GLU  45           HA       GLU  45   8.717 -11.964   3.741
  377    HB2  GLU  45           HB2      GLU  45   8.419  -9.844   4.968
  378    HB3  GLU  45           HB1      GLU  45   6.989 -10.494   5.754
  379    HG2  GLU  45           HG2      GLU  45   8.380 -12.229   6.808
  380    HG3  GLU  45           HG1      GLU  45   9.800 -11.522   6.047
  381    H1   MET  46           HT1      MET  46  -3.693   0.981 -13.544
  382    H2   MET  46           HT2      MET  46  -5.055   1.291 -14.492
  383    H3   MET  46           HT3      MET  46  -4.811  -0.255 -13.843
  384    HA   MET  46           HA       MET  46  -6.379   0.583 -12.426
  385    HB2  MET  46           HB2      MET  46  -3.922   1.674 -11.055
  386    HB3  MET  46           HB1      MET  46  -5.334   0.926 -10.327
  387    HG2  MET  46           HG2      MET  46  -3.023  -0.360 -11.714
  388    HG3  MET  46           HG1      MET  46  -3.697  -0.692 -10.120
  389    HE1  MET  46           HE1      MET  46  -4.122  -3.884 -12.617
  390    HE2  MET  46           HE2      MET  46  -3.065  -3.197 -11.383
  391    HE3  MET  46           HE3      MET  46  -3.019  -2.571 -13.031
  392    H    ALA  47           HN       ALA  47  -7.339   2.400 -11.238
  393    HA   ALA  47           HA       ALA  47  -6.776   4.958 -12.589
  394    HB1  ALA  47           HB1      ALA  47  -9.340   3.923 -11.372
  395    HB2  ALA  47           HB2      ALA  47  -8.984   4.084 -13.093
  396    HB3  ALA  47           HB3      ALA  47  -9.127   5.523 -12.084
  397    H    THR  48           HN       THR  48  -5.278   4.080 -10.445
  398    HA   THR  48           HA       THR  48  -6.130   4.961  -7.911
  399    HB   THR  48           HB       THR  48  -3.628   4.857  -7.439
  400   HG21  THR  48          HG21      THR  48  -5.046   2.936  -7.007
  401   HG22  THR  48          HG22      THR  48  -3.530   2.390  -7.725
  402   HG23  THR  48          HG23      THR  48  -4.992   2.477  -8.709
  403    H    THR  49           HN       THR  49  -6.153   6.938  -7.020
  404    HA   THR  49           HA       THR  49  -4.921   9.172  -8.484
  405    HB   THR  49           HB       THR  49  -6.461  10.612  -7.145
  406    HG1  THR  49           HG1      THR  49  -7.460   8.085  -6.266
  407   HG21  THR  49          HG21      THR  49  -8.560   9.876  -8.300
  408   HG22  THR  49          HG22      THR  49  -7.698   8.426  -8.816
  409   HG23  THR  49          HG23      THR  49  -7.156  10.014  -9.358
  410    H    THR  50           HN       THR  50  -3.931  10.915  -7.138
  411    HA   THR  50           HA       THR  50  -2.112   9.798  -5.255
  412    HB   THR  50           HB       THR  50  -2.592  12.750  -5.597
  413    HG1  THR  50           HG1      THR  50  -1.515  12.702  -7.498
  414   HG21  THR  50          HG21      THR  50  -0.135  11.084  -5.026
  415   HG22  THR  50          HG22      THR  50  -0.981  12.138  -3.893
  416   HG23  THR  50          HG23      THR  50  -0.132  12.830  -5.276
  417    H    LEU  51           HN       LEU  51  -2.791   9.167  -3.316
  418    HA   LEU  51           HA       LEU  51  -4.405  11.049  -1.725
  419    HB2  LEU  51           HB2      LEU  51  -4.496   8.028  -1.590
  420    HB3  LEU  51           HB1      LEU  51  -5.422   9.129  -0.590
  421    HG   LEU  51           HG       LEU  51  -5.745   8.669  -3.557
  422   HD11  LEU  51          HD11      LEU  51  -7.697   7.569  -3.075
  423   HD12  LEU  51          HD12      LEU  51  -7.895   8.373  -1.519
  424   HD13  LEU  51          HD13      LEU  51  -6.699   7.090  -1.701
  425   HD21  LEU  51          HD21      LEU  51  -7.654  10.247  -3.375
  426   HD22  LEU  51          HD22      LEU  51  -6.079  11.013  -3.170
  427   HD23  LEU  51          HD23      LEU  51  -7.090  10.684  -1.762
  428    H    GLY  52           HN       GLY  52  -3.882  11.141   0.512
  429    HA2  GLY  52           HA2      GLY  52  -1.096  10.848   1.041
  430    HA3  GLY  52           HA1      GLY  52  -2.321  11.359   2.192
  431    H    VAL  53           HN       VAL  53  -0.100   9.029   1.516
  432    HA   VAL  53           HA       VAL  53  -1.477   7.064   3.226
  433    HB   VAL  53           HB       VAL  53   0.300   6.552   0.838
  434   HG11  VAL  53          HG11      VAL  53  -0.667   4.575   2.899
  435   HG12  VAL  53          HG12      VAL  53   1.007   4.992   2.531
  436   HG13  VAL  53          HG13      VAL  53   0.028   4.137   1.339
  437   HG21  VAL  53          HG21      VAL  53  -1.632   5.271   0.035
  438   HG22  VAL  53          HG22      VAL  53  -2.030   6.966   0.316
  439   HG23  VAL  53          HG23      VAL  53  -2.529   5.738   1.480
  440    H    LYS  54           HN       LYS  54  -0.035   5.791   4.586
  441    HA   LYS  54           HA       LYS  54   2.269   7.392   5.410
  442    HB2  LYS  54           HB2      LYS  54   0.760   5.216   6.862
  443    HB3  LYS  54           HB1      LYS  54   2.090   6.151   7.530
  444    HG2  LYS  54           HG2      LYS  54  -0.443   7.421   6.536
  445    HG3  LYS  54           HG1      LYS  54  -0.234   6.870   8.199
  446    HD2  LYS  54           HD2      LYS  54   1.548   8.399   8.567
  447    HD3  LYS  54           HD1      LYS  54   1.645   8.798   6.852
  448    HE2  LYS  54           HE2      LYS  54   0.392  10.347   8.624
  449    HE3  LYS  54           HE1      LYS  54  -0.121  10.219   6.944
  450    HZ1  LYS  54           HZ1      LYS  54  -1.972  10.023   8.484
  451    HZ2  LYS  54           HZ2      LYS  54  -1.251   8.671   9.205
  452    HZ3  LYS  54           HZ3      LYS  54  -1.766   8.598   7.594
  453    H    LEU  55           HN       LEU  55   4.176   6.769   4.778
  454    HA   LEU  55           HA       LEU  55   4.832   3.905   4.556
  455    HB2  LEU  55           HB2      LEU  55   5.233   6.111   2.575
  456    HB3  LEU  55           HB1      LEU  55   6.410   4.818   2.659
  457    HG   LEU  55           HG       LEU  55   3.484   4.259   2.243
  458   HD11  LEU  55          HD11      LEU  55   5.599   4.793   0.158
  459   HD12  LEU  55          HD12      LEU  55   4.185   5.794   0.488
  460   HD13  LEU  55          HD13      LEU  55   3.981   4.167  -0.162
  461   HD21  LEU  55          HD21      LEU  55   6.048   2.763   2.112
  462   HD22  LEU  55          HD22      LEU  55   4.779   2.333   0.968
  463   HD23  LEU  55          HD23      LEU  55   4.468   2.248   2.703
  464    H    ASP  56           HN       ASP  56   6.759   3.388   5.508
  465    HA   ASP  56           HA       ASP  56   8.174   5.445   6.967
  466    HB2  ASP  56           HB2      ASP  56   7.763   2.977   7.685
  467    HB3  ASP  56           HB1      ASP  56   9.118   2.608   6.628
  468    H    ASP  57           HN       ASP  57  10.590   5.652   6.698
  469    HA   ASP  57           HA       ASP  57  11.267   6.339   4.065
  470    HB2  ASP  57           HB2      ASP  57  12.748   6.131   6.617
  471    HB3  ASP  57           HB1      ASP  57  13.737   5.970   5.171
  472    HA   PRO  58           HA       PRO  58  13.690   2.182   3.674
  473    HB2  PRO  58           HB2      PRO  58  13.191   0.232   5.503
  474    HB3  PRO  58           HB1      PRO  58  14.507   1.400   5.674
  475    HG2  PRO  58           HG2      PRO  58  11.793   1.403   6.935
  476    HG3  PRO  58           HG1      PRO  58  13.366   1.784   7.661
  477    HD2  PRO  58           HD2      PRO  58  11.640   3.705   6.876
  478    HD3  PRO  58           HD1      PRO  58  13.400   3.917   6.779
  479    H    THR  59           HN       THR  59  10.408   2.297   4.871
  480    HA   THR  59           HA       THR  59   9.514  -0.118   3.687
  481    HB   THR  59           HB       THR  59   7.934   2.363   4.396
  482    HG1  THR  59           HG1      THR  59   7.847  -0.014   5.877
  483   HG21  THR  59          HG21      THR  59   6.854   0.757   2.741
  484   HG22  THR  59          HG22      THR  59   5.955   1.077   4.223
  485   HG23  THR  59          HG23      THR  59   6.856  -0.427   4.048
  486    H    ARG  60           HN       ARG  60   9.527   3.272   2.587
  487    HA   ARG  60           HA       ARG  60   8.286   2.746   0.096
  488    HB2  ARG  60           HB2      ARG  60   8.488   5.021   1.040
  489    HB3  ARG  60           HB1      ARG  60  10.231   4.959   0.795
  490    HG2  ARG  60           HG2      ARG  60   9.894   4.756  -1.614
  491    HG3  ARG  60           HG1      ARG  60   8.148   4.809  -1.378
  492    HD2  ARG  60           HD2      ARG  60   8.366   7.059  -0.414
  493    HD3  ARG  60           HD1      ARG  60  10.106   6.997  -0.692
  494    HE   ARG  60           HE       ARG  60   9.753   7.409  -2.920
  495   HH11  ARG  60          HH21      ARG  60   6.678   6.615  -1.422
  496   HH12  ARG  60          HH22      ARG  60   5.740   7.091  -2.799
  497   HH21  ARG  60          HH11      ARG  60   8.519   8.032  -4.734
  498   HH22  ARG  60          HH12      ARG  60   6.793   7.905  -4.687
  499    H    GLU  61           HN       GLU  61  11.649   2.830   1.158
  500    HA   GLU  61           HA       GLU  61  12.847   2.352  -1.347
  501    HB2  GLU  61           HB2      GLU  61  13.755   1.739   1.466
  502    HB3  GLU  61           HB1      GLU  61  14.762   1.468   0.051
  503    HG2  GLU  61           HG2      GLU  61  14.662   3.841  -0.488
  504    HG3  GLU  61           HG1      GLU  61  13.635   4.122   0.917
  505    H    ARG  62           HN       ARG  62  11.568   0.238   1.154
  506    HA   ARG  62           HA       ARG  62  12.403  -2.221   0.109
  507    HB2  ARG  62           HB2      ARG  62  11.160  -1.603   2.363
  508    HB3  ARG  62           HB1      ARG  62   9.721  -1.958   1.421
  509    HG2  ARG  62           HG2      ARG  62  12.012  -3.857   1.900
  510    HG3  ARG  62           HG1      ARG  62  10.462  -3.883   2.739
  511    HD2  ARG  62           HD2      ARG  62   9.373  -4.192   0.500
  512    HD3  ARG  62           HD1      ARG  62  10.983  -4.396  -0.181
  513    HE   ARG  62           HE       ARG  62  10.506  -6.158   2.016
  514   HH11  ARG  62          HH21      ARG  62  10.027  -5.704  -1.418
  515   HH12  ARG  62          HH22      ARG  62   9.785  -7.388  -1.743
  516   HH21  ARG  62          HH11      ARG  62  10.202  -8.385   1.609
  517   HH22  ARG  62          HH12      ARG  62   9.877  -8.922  -0.008
  518    H    LEU  63           HN       LEU  63   9.621  -0.155  -0.577
  519    HA   LEU  63           HA       LEU  63   8.291  -1.899  -2.322
  520    HB2  LEU  63           HB2      LEU  63   8.274   1.025  -1.862
  521    HB3  LEU  63           HB1      LEU  63   7.726   0.500  -3.442
  522    HG   LEU  63           HG       LEU  63   6.093  -1.022  -2.248
  523   HD11  LEU  63          HD11      LEU  63   5.547  -0.578   0.040
  524   HD12  LEU  63          HD12      LEU  63   6.762   0.698   0.128
  525   HD13  LEU  63          HD13      LEU  63   7.261  -0.982  -0.066
  526   HD21  LEU  63          HD21      LEU  63   6.021   1.918  -2.426
  527   HD22  LEU  63          HD22      LEU  63   4.786   1.177  -1.410
  528   HD23  LEU  63          HD23      LEU  63   4.931   0.708  -3.104
  529    H    LYS  64           HN       LYS  64  10.951   0.406  -2.870
  530    HA   LYS  64           HA       LYS  64  11.050   0.155  -5.661
  531    HB2  LYS  64           HB2      LYS  64  12.403   1.708  -4.034
  532    HB3  LYS  64           HB1      LYS  64  13.566   0.394  -4.044
  533    HG2  LYS  64           HG2      LYS  64  12.605   1.877  -6.488
  534    HG3  LYS  64           HG1      LYS  64  14.120   2.182  -5.641
  535    HD2  LYS  64           HD2      LYS  64  14.614  -0.310  -6.073
  536    HD3  LYS  64           HD1      LYS  64  13.312  -0.215  -7.257
  537    HE2  LYS  64           HE2      LYS  64  15.838   1.434  -7.220
  538    HE3  LYS  64           HE1      LYS  64  15.457   0.126  -8.336
  539    HZ1  LYS  64           HZ1      LYS  64  13.582   1.470  -9.146
  540    HZ2  LYS  64           HZ2      LYS  64  15.075   2.229  -9.390
  541    HZ3  LYS  64           HZ3      LYS  64  14.062   2.739  -8.134
  542    H    ALA  65           HN       ALA  65  12.534  -1.722  -3.114
  543    HA   ALA  65           HA       ALA  65  13.915  -3.555  -4.759
  544    HB1  ALA  65           HB1      ALA  65  14.058  -4.959  -2.753
  545    HB2  ALA  65           HB2      ALA  65  12.877  -3.927  -1.948
  546    HB3  ALA  65           HB3      ALA  65  14.456  -3.279  -2.390
  547    H    ALA  66           HN       ALA  66  10.698  -3.551  -3.298
  548    HA   ALA  66           HA       ALA  66   9.898  -6.128  -4.109
  549    HB1  ALA  66           HB1      ALA  66   7.647  -5.414  -3.641
  550    HB2  ALA  66           HB2      ALA  66   8.119  -3.719  -3.741
  551    HB3  ALA  66           HB3      ALA  66   8.717  -4.722  -2.420
  552    H    ALA  67           HN       ALA  67   9.722  -2.973  -5.643
  553    HA   ALA  67           HA       ALA  67   8.198  -3.616  -7.875
  554    HB1  ALA  67           HB1      ALA  67   9.132  -1.330  -7.003
  555    HB2  ALA  67           HB2      ALA  67   8.796  -1.562  -8.719
  556    HB3  ALA  67           HB3      ALA  67  10.451  -1.685  -8.119
  557    H    GLN  68           HN       GLN  68  11.702  -3.468  -7.591
  558    HA   GLN  68           HA       GLN  68  12.209  -4.500 -10.161
  559    HB2  GLN  68           HB2      GLN  68  14.493  -4.711  -9.521
  560    HB3  GLN  68           HB1      GLN  68  13.856  -3.278  -8.775
  561    HG2  GLN  68           HG2      GLN  68  14.923  -4.027  -6.965
  562    HG3  GLN  68           HG1      GLN  68  13.471  -5.007  -6.775
  563   HE21  GLN  68          HE21      GLN  68  14.862  -6.453  -5.581
  564   HE22  GLN  68          HE22      GLN  68  15.823  -7.603  -6.435
  565    H    SER  69           HN       SER  69  11.729  -6.027  -7.051
  566    HA   SER  69           HA       SER  69  12.632  -8.541  -7.875
  567    HB2  SER  69           HB2      SER  69  10.711  -7.861  -5.637
  568    HB3  SER  69           HB1      SER  69  11.490  -9.428  -5.857
  569    HG   SER  69           HG       SER  69  12.772  -6.940  -5.384
  570    H    ILE  70           HN       ILE  70   9.570  -6.897  -8.124
  571    HA   ILE  70           HA       ILE  70   8.292  -9.323  -9.167
  572    HB   ILE  70           HB       ILE  70   7.206  -7.921  -7.312
  573   HG12  ILE  70          HG12      ILE  70   5.637  -8.515  -9.833
  574   HG13  ILE  70          HG11      ILE  70   6.015  -9.666  -8.556
  575   HG21  ILE  70          HG21      ILE  70   7.676  -5.748  -8.538
  576   HG22  ILE  70          HG22      ILE  70   6.066  -5.937  -7.844
  577   HG23  ILE  70          HG23      ILE  70   6.312  -6.163  -9.576
  578   HD11  ILE  70          HD11      ILE  70   4.716  -8.182  -6.995
  579   HD12  ILE  70          HD12      ILE  70   3.776  -9.001  -8.242
  580   HD13  ILE  70          HD13      ILE  70   4.181  -7.294  -8.421
  581    H    ASP  71           HN       ASP  71  10.139  -7.034 -10.328
  582    HA   ASP  71           HA       ASP  71  10.592  -6.163 -12.353
  583    HB2  ASP  71           HB2      ASP  71   8.618  -8.272 -13.208
  584    HB3  ASP  71           HB1      ASP  71   9.435  -7.224 -14.362
  585    H    ARG  72           HN       ARG  72   8.932  -4.654 -10.839
  586    HA   ARG  72           HA       ARG  72   7.163  -3.430 -12.868
  587    HB2  ARG  72           HB2      ARG  72   6.613  -4.199 -10.079
  588    HB3  ARG  72           HB1      ARG  72   6.120  -2.564 -10.488
  589    HG2  ARG  72           HG2      ARG  72   4.289  -4.132 -10.781
  590    HG3  ARG  72           HG1      ARG  72   4.762  -3.418 -12.323
  591    HD2  ARG  72           HD2      ARG  72   5.308  -5.404 -13.188
  592    HD3  ARG  72           HD1      ARG  72   6.207  -5.870 -11.747
  593    HE   ARG  72           HE       ARG  72   4.412  -7.086 -11.062
  594   HH11  ARG  72          HH21      ARG  72   3.312  -4.865 -13.548
  595   HH12  ARG  72          HH22      ARG  72   1.709  -5.524 -13.603
  596   HH21  ARG  72          HH11      ARG  72   2.293  -7.951 -11.139
  597   HH22  ARG  72          HH12      ARG  72   1.129  -7.276 -12.230
  598    H    THR  73           HN       THR  73   6.971  -1.114 -12.744
  599    HA   THR  73           HA       THR  73   9.438   0.189 -12.023
  600    HB   THR  73           HB       THR  73   6.889   1.531 -12.932
  601    HG1  THR  73           HG1      THR  73   8.736  -0.037 -14.384
  602   HG21  THR  73          HG21      THR  73   8.707   3.022 -12.252
  603   HG22  THR  73          HG22      THR  73   8.437   3.118 -13.992
  604   HG23  THR  73          HG23      THR  73   9.806   2.202 -13.361
  605    HA   PRO  74           HA       PRO  74   8.506   1.261  -7.773
  606    HB2  PRO  74           HB2      PRO  74   9.554   3.912  -8.696
  607    HB3  PRO  74           HB1      PRO  74   9.913   3.019  -7.212
  608    HG2  PRO  74           HG2      PRO  74  11.619   2.977  -9.247
  609    HG3  PRO  74           HG1      PRO  74  11.308   1.515  -8.293
  610    HD2  PRO  74           HD2      PRO  74  10.435   2.193 -11.049
  611    HD3  PRO  74           HD1      PRO  74  10.743   0.606 -10.319
  612    H    HIS  75           HN       HIS  75   7.795   3.862 -10.134
  613    HA   HIS  75           HA       HIS  75   5.771   5.109  -8.648
  614    HB2  HIS  75           HB2      HIS  75   6.757   6.251 -10.517
  615    HB3  HIS  75           HB1      HIS  75   6.274   4.974 -11.626
  616    HD1  HIS  75           HD1      HIS  75   4.046   5.200 -12.734
  617    HD2  HIS  75           HD2      HIS  75   4.534   7.874  -9.594
  618    HE1  HIS  75           HE1      HIS  75   2.086   6.759 -12.874
  619    HE2  HIS  75           HE2      HIS  75   2.609   8.559 -11.195
  620    H    TRP  76           HN       TRP  76   5.514   2.730 -11.273
  621    HA   TRP  76           HA       TRP  76   2.732   2.446 -11.206
  622    HB2  TRP  76           HB2      TRP  76   3.962   1.590 -13.113
  623    HB3  TRP  76           HB1      TRP  76   4.868   0.491 -12.074
  624    HD1  TRP  76           HD1      TRP  76   3.716  -1.767 -11.368
  625    HE1  TRP  76           HE1      TRP  76   1.576  -2.975 -12.113
  626    HE3  TRP  76           HE3      TRP  76   1.522   2.035 -13.987
  627    HZ2  TRP  76           HZ2      TRP  76  -0.733  -2.399 -13.633
  628    HZ3  TRP  76           HZ3      TRP  76  -0.653   1.619 -15.063
  629    HH2  TRP  76           HH2      TRP  76  -1.755  -0.552 -14.889
  630    H    LEU  77           HN       LEU  77   5.334   0.792  -9.597
  631    HA   LEU  77           HA       LEU  77   3.823  -1.129  -8.288
  632    HB2  LEU  77           HB2      LEU  77   6.237  -1.326  -8.344
  633    HB3  LEU  77           HB1      LEU  77   6.382   0.102  -7.321
  634    HG   LEU  77           HG       LEU  77   4.938  -1.152  -5.633
  635   HD11  LEU  77          HD11      LEU  77   5.161  -3.642  -5.788
  636   HD12  LEU  77          HD12      LEU  77   5.654  -3.420  -7.467
  637   HD13  LEU  77          HD13      LEU  77   4.052  -2.903  -6.941
  638   HD21  LEU  77          HD21      LEU  77   7.408  -0.762  -5.518
  639   HD22  LEU  77          HD22      LEU  77   7.598  -2.412  -6.114
  640   HD23  LEU  77          HD23      LEU  77   6.772  -2.113  -4.585
  641    H    ILE  78           HN       ILE  78   4.585   2.155  -7.292
  642    HA   ILE  78           HA       ILE  78   3.687   1.871  -4.656
  643    HB   ILE  78           HB       ILE  78   3.548   4.260  -6.505
  644   HG12  ILE  78          HG12      ILE  78   5.303   3.787  -4.090
  645   HG13  ILE  78          HG11      ILE  78   5.773   3.311  -5.719
  646   HG21  ILE  78          HG21      ILE  78   3.173   5.590  -4.409
  647   HG22  ILE  78          HG22      ILE  78   2.824   4.069  -3.587
  648   HG23  ILE  78          HG23      ILE  78   1.802   4.604  -4.920
  649   HD11  ILE  78          HD11      ILE  78   5.644   5.626  -6.443
  650   HD12  ILE  78          HD12      ILE  78   6.756   5.439  -5.087
  651   HD13  ILE  78          HD13      ILE  78   5.147   6.111  -4.823
  652    H    LYS  79           HN       LYS  79   1.969   2.790  -7.607
  653    HA   LYS  79           HA       LYS  79  -0.631   2.889  -6.477
  654    HB2  LYS  79           HB2      LYS  79  -0.287   1.997  -9.302
  655    HB3  LYS  79           HB1      LYS  79  -1.378   3.204  -8.637
  656    HG2  LYS  79           HG2      LYS  79   0.763   4.596  -8.252
  657    HG3  LYS  79           HG1      LYS  79   1.502   3.481  -9.397
  658    HD2  LYS  79           HD2      LYS  79  -0.971   5.127  -9.941
  659    HD3  LYS  79           HD1      LYS  79   0.660   5.562 -10.449
  660    HE2  LYS  79           HE2      LYS  79  -0.204   4.571 -12.350
  661    HE3  LYS  79           HE1      LYS  79   0.660   3.235 -11.591
  662    HZ1  LYS  79           HZ1      LYS  79  -1.228   2.128 -11.211
  663    HZ2  LYS  79           HZ2      LYS  79  -1.887   3.128 -12.409
  664    HZ3  LYS  79           HZ3      LYS  79  -2.099   3.515 -10.772
  665    H    GLN  80           HN       GLN  80   1.137   0.354  -8.196
  666    HA   GLN  80           HA       GLN  80  -0.899  -1.581  -8.061
  667    HB2  GLN  80           HB2      GLN  80   0.631  -2.101  -9.697
  668    HB3  GLN  80           HB1      GLN  80   2.009  -1.660  -8.697
  669    HG2  GLN  80           HG2      GLN  80   1.872  -3.660  -7.454
  670    HG3  GLN  80           HG1      GLN  80   0.296  -4.059  -8.132
  671   HE21  GLN  80          HE21      GLN  80   2.837  -5.538  -8.061
  672   HE22  GLN  80          HE22      GLN  80   3.195  -5.914  -9.709
  673    H    ALA  81           HN       ALA  81   2.056  -1.278  -6.112
  674    HA   ALA  81           HA       ALA  81   1.917  -3.442  -4.497
  675    HB1  ALA  81           HB1      ALA  81   3.786  -2.190  -4.100
  676    HB2  ALA  81           HB2      ALA  81   2.832  -1.813  -2.663
  677    HB3  ALA  81           HB3      ALA  81   2.887  -0.676  -4.010
  678    H    ILE  82           HN       ILE  82   0.218  -0.333  -3.809
  679    HA   ILE  82           HA       ILE  82  -0.953  -1.434  -1.458
  680    HB   ILE  82           HB       ILE  82  -0.790   0.999  -1.855
  681   HG12  ILE  82          HG12      ILE  82  -3.058   1.566  -0.989
  682   HG13  ILE  82          HG11      ILE  82  -3.562  -0.085  -1.333
  683   HG21  ILE  82          HG21      ILE  82  -3.063   0.607  -3.790
  684   HG22  ILE  82          HG22      ILE  82  -1.405   1.033  -4.219
  685   HG23  ILE  82          HG23      ILE  82  -2.384   2.149  -3.267
  686   HD11  ILE  82          HD11      ILE  82  -2.148  -0.963   0.322
  687   HD12  ILE  82          HD12      ILE  82  -2.904   0.454   1.050
  688   HD13  ILE  82          HD13      ILE  82  -1.244   0.543   0.463
  689    H    PHE  83           HN       PHE  83  -2.030  -1.200  -4.813
  690    HA   PHE  83           HA       PHE  83  -4.549  -2.477  -4.400
  691    HB2  PHE  83           HB2      PHE  83  -4.702  -1.458  -6.417
  692    HB3  PHE  83           HB1      PHE  83  -2.959  -1.415  -6.617
  693    HD1  PHE  83           HD2      PHE  83  -1.797  -3.428  -7.577
  694    HD2  PHE  83           HD1      PHE  83  -6.031  -2.998  -7.583
  695    HE1  PHE  83           HE2      PHE  83  -1.960  -5.125  -9.347
  696    HE2  PHE  83           HE1      PHE  83  -6.201  -4.693  -9.357
  697    HZ   PHE  83           HZ       PHE  83  -4.164  -5.758 -10.241
  698    H    ASN  84           HN       ASN  84  -1.312  -3.529  -4.816
  699    HA   ASN  84           HA       ASN  84  -1.765  -6.192  -5.650
  700    HB2  ASN  84           HB2      ASN  84   0.439  -4.690  -5.622
  701    HB3  ASN  84           HB1      ASN  84   0.660  -5.477  -4.065
  702   HD21  ASN  84          HD21      ASN  84  -0.849  -7.862  -5.298
  703   HD22  ASN  84          HD22      ASN  84   0.379  -8.676  -6.204
  704    H    TYR  85           HN       TYR  85  -1.513  -4.506  -2.593
  705    HA   TYR  85           HA       TYR  85  -1.504  -6.783  -0.950
  706    HB2  TYR  85           HB2      TYR  85  -1.105  -4.621   0.082
  707    HB3  TYR  85           HB1      TYR  85  -2.685  -4.037  -0.446
  708    HD1  TYR  85           HD1      TYR  85  -1.352  -7.000   1.391
  709    HD2  TYR  85           HD2      TYR  85  -4.283  -3.921   1.226
  710    HE1  TYR  85           HE1      TYR  85  -2.371  -7.871   3.446
  711    HE2  TYR  85           HE2      TYR  85  -5.306  -4.782   3.291
  712    HH   TYR  85           HH       TYR  85  -3.837  -6.832   5.359
  713    H    LEU  86           HN       LEU  86  -4.007  -4.828  -2.429
  714    HA   LEU  86           HA       LEU  86  -6.227  -6.307  -1.495
  715    HB2  LEU  86           HB2      LEU  86  -5.961  -4.703  -4.038
  716    HB3  LEU  86           HB1      LEU  86  -7.469  -5.216  -3.301
  717    HG   LEU  86           HG       LEU  86  -5.507  -3.189  -2.242
  718   HD11  LEU  86          HD11      LEU  86  -7.078  -2.441  -3.968
  719   HD12  LEU  86          HD12      LEU  86  -7.383  -1.676  -2.408
  720   HD13  LEU  86          HD13      LEU  86  -8.422  -2.987  -2.966
  721   HD21  LEU  86          HD21      LEU  86  -6.097  -4.209  -0.265
  722   HD22  LEU  86          HD22      LEU  86  -7.688  -4.681  -0.857
  723   HD23  LEU  86          HD23      LEU  86  -7.372  -3.000  -0.426
  724    H    GLU  87           HN       GLU  87  -4.223  -6.568  -4.387
  725    HA   GLU  87           HA       GLU  87  -5.609  -8.622  -5.704
  726    HB2  GLU  87           HB2      GLU  87  -3.782  -7.193  -6.689
  727    HB3  GLU  87           HB1      GLU  87  -2.620  -8.132  -5.766
  728    HG2  GLU  87           HG2      GLU  87  -2.469  -9.238  -7.732
  729    HG3  GLU  87           HG1      GLU  87  -3.805 -10.140  -7.027
  730    H    LYS  88           HN       LYS  88  -3.170  -8.650  -3.170
  731    HA   LYS  88           HA       LYS  88  -2.760 -11.474  -3.148
  732    HB2  LYS  88           HB2      LYS  88  -1.897  -9.192  -1.506
  733    HB3  LYS  88           HB1      LYS  88  -2.136 -10.674  -0.593
  734    HG2  LYS  88           HG2      LYS  88   0.141 -10.601  -1.227
  735    HG3  LYS  88           HG1      LYS  88  -0.631 -11.830  -2.230
  736    HD2  LYS  88           HD2      LYS  88  -0.854 -10.103  -4.022
  737    HD3  LYS  88           HD1      LYS  88   0.110  -9.017  -3.023
  738    HE2  LYS  88           HE2      LYS  88   0.984 -11.693  -4.114
  739    HE3  LYS  88           HE1      LYS  88   1.491 -10.111  -4.702
  740    HZ1  LYS  88           HZ1      LYS  88   2.191  -9.881  -2.173
  741    HZ2  LYS  88           HZ2      LYS  88   3.215 -10.553  -3.339
  742    HZ3  LYS  88           HZ3      LYS  88   2.323 -11.564  -2.318
  743    H    LEU  89           HN       LEU  89  -5.088  -9.325  -1.767
  744    HA   LEU  89           HA       LEU  89  -6.102 -11.221   0.134
  745    HB2  LEU  89           HB2      LEU  89  -7.387  -8.707  -0.968
  746    HB3  LEU  89           HB1      LEU  89  -7.987  -9.646   0.387
  747    HG   LEU  89           HG       LEU  89  -5.453  -8.012   0.273
  748   HD11  LEU  89          HD11      LEU  89  -7.553  -6.803   0.722
  749   HD12  LEU  89          HD12      LEU  89  -6.446  -6.781   2.094
  750   HD13  LEU  89          HD13      LEU  89  -7.842  -7.858   2.106
  751   HD21  LEU  89          HD21      LEU  89  -4.883 -10.038   1.421
  752   HD22  LEU  89          HD22      LEU  89  -6.364  -9.971   2.377
  753   HD23  LEU  89          HD23      LEU  89  -5.103  -8.763   2.619
  754    H    GLU  90           HN       GLU  90  -6.574 -10.423  -3.193
  755    HA   GLU  90           HA       GLU  90  -9.021 -11.879  -3.508
  756    HB2  GLU  90           HB2      GLU  90  -8.513  -9.926  -4.902
  757    HB3  GLU  90           HB1      GLU  90  -7.125 -10.758  -5.590
  758    HG2  GLU  90           HG2      GLU  90  -8.585 -12.413  -6.586
  759    HG3  GLU  90           HG1      GLU  90  -9.990 -11.655  -5.846
  Start of MODEL   25
    1    H1   MET   1           HT1      MET   1   2.441   0.363  13.837
    2    H2   MET   1           HT2      MET   1   2.097   1.541  12.677
    3    H3   MET   1           HT3      MET   1   2.677   2.002  14.197
    4    HA   MET   1           HA       MET   1   4.734   0.722  13.697
    5    HB2  MET   1           HB2      MET   1   3.824   0.998  10.834
    6    HB3  MET   1           HB1      MET   1   5.210   0.113  11.453
    7    HG2  MET   1           HG2      MET   1   3.715  -1.560  10.907
    8    HG3  MET   1           HG1      MET   1   3.467  -1.359  12.642
    9    HE1  MET   1           HE1      MET   1   1.443  -2.947  11.544
   10    HE2  MET   1           HE2      MET   1  -0.145  -2.185  11.601
   11    HE3  MET   1           HE3      MET   1   0.897  -2.158  13.023
   12    H    ALA   2           HN       ALA   2   6.393   1.905  12.046
   13    HA   ALA   2           HA       ALA   2   6.132   4.702  12.760
   14    HB1  ALA   2           HB1      ALA   2   8.253   3.581  13.154
   15    HB2  ALA   2           HB2      ALA   2   8.457   4.872  11.970
   16    HB3  ALA   2           HB3      ALA   2   8.388   3.192  11.439
   17    H    THR   3           HN       THR   3   4.185   4.477  11.129
   18    HA   THR   3           HA       THR   3   4.971   4.810   8.357
   19    HB   THR   3           HB       THR   3   2.639   4.788   7.821
   20    HG1  THR   3           HG1      THR   3   2.287   6.055  10.015
   21   HG21  THR   3          HG21      THR   3   1.938   2.677   8.659
   22   HG22  THR   3          HG22      THR   3   2.904   2.862  10.122
   23   HG23  THR   3          HG23      THR   3   3.698   2.617   8.566
   24    H    THR   4           HN       THR   4   5.264   6.699   7.393
   25    HA   THR   4           HA       THR   4   4.385   9.147   8.781
   26    HB   THR   4           HB       THR   4   6.631   8.921   6.770
   27    HG1  THR   4           HG1      THR   4   7.238   7.703   8.556
   28   HG21  THR   4          HG21      THR   4   5.871  11.044   8.781
   29   HG22  THR   4          HG22      THR   4   5.778  11.172   7.025
   30   HG23  THR   4          HG23      THR   4   7.348  11.055   7.819
   31    H    THR   5           HN       THR   5   3.458  10.827   7.509
   32    HA   THR   5           HA       THR   5   1.827   9.923   5.373
   33    HB   THR   5           HB       THR   5   2.388  12.809   6.048
   34    HG1  THR   5           HG1      THR   5   1.404  10.881   7.646
   35   HG21  THR   5          HG21      THR   5  -0.131  11.448   5.081
   36   HG22  THR   5          HG22      THR   5   1.010  12.289   4.032
   37   HG23  THR   5          HG23      THR   5   0.133  13.181   5.275
   38    H    LEU   6           HN       LEU   6   2.524   9.487   3.419
   39    HA   LEU   6           HA       LEU   6   4.451  11.284   2.112
   40    HB2  LEU   6           HB2      LEU   6   4.366   8.274   1.804
   41    HB3  LEU   6           HB1      LEU   6   5.472   9.366   0.999
   42    HG   LEU   6           HG       LEU   6   5.419   8.729   3.952
   43   HD11  LEU   6          HD11      LEU   6   6.355   7.061   2.227
   44   HD12  LEU   6          HD12      LEU   6   7.353   7.489   3.614
   45   HD13  LEU   6          HD13      LEU   6   7.668   8.222   2.042
   46   HD21  LEU   6          HD21      LEU   6   6.057  11.027   3.702
   47   HD22  LEU   6          HD22      LEU   6   7.159  10.626   2.384
   48   HD23  LEU   6          HD23      LEU   6   7.508  10.078   4.023
   49    H    GLY   7           HN       GLY   7   4.149  11.486  -0.172
   50    HA2  GLY   7           HA2      GLY   7   1.428  11.325  -1.016
   51    HA3  GLY   7           HA1      GLY   7   2.798  11.789  -2.018
   52    H    VAL   8           HN       VAL   8   0.400   9.579  -1.746
   53    HA   VAL   8           HA       VAL   8   1.950   7.559  -3.217
   54    HB   VAL   8           HB       VAL   8  -0.091   7.025  -1.049
   55   HG11  VAL   8          HG11      VAL   8   0.554   4.614  -1.403
   56   HG12  VAL   8          HG12      VAL   8   1.274   5.122  -2.931
   57   HG13  VAL   8          HG13      VAL   8  -0.455   5.331  -2.659
   58   HG21  VAL   8          HG21      VAL   8   2.059   7.626  -0.151
   59   HG22  VAL   8          HG22      VAL   8   2.865   6.473  -1.214
   60   HG23  VAL   8          HG23      VAL   8   1.803   5.895   0.070
   61    H    LYS   9           HN       LYS   9   0.407   6.050  -4.431
   62    HA   LYS   9           HA       LYS   9  -1.806   7.635  -5.526
   63    HB2  LYS   9           HB2      LYS   9   0.105   5.763  -6.933
   64    HB3  LYS   9           HB1      LYS   9  -1.361   6.392  -7.673
   65    HG2  LYS   9           HG2      LYS   9  -0.244   8.186  -8.322
   66    HG3  LYS   9           HG1      LYS   9   0.038   8.606  -6.634
   67    HD2  LYS   9           HD2      LYS   9   1.786   6.641  -8.087
   68    HD3  LYS   9           HD1      LYS   9   2.079   8.377  -8.169
   69    HE2  LYS   9           HE2      LYS   9   3.394   7.925  -6.380
   70    HE3  LYS   9           HE1      LYS   9   1.869   8.110  -5.516
   71    HZ1  LYS   9           HZ1      LYS   9   1.607   5.642  -5.760
   72    HZ2  LYS   9           HZ2      LYS   9   2.865   6.132  -4.741
   73    HZ3  LYS   9           HZ3      LYS   9   3.208   5.583  -6.305
   74    H    LEU  10           HN       LEU  10  -3.734   6.742  -5.298
   75    HA   LEU  10           HA       LEU  10  -3.943   3.830  -4.878
   76    HB2  LEU  10           HB2      LEU  10  -4.794   6.066  -3.176
   77    HB3  LEU  10           HB1      LEU  10  -6.039   4.868  -3.459
   78    HG   LEU  10           HG       LEU  10  -3.327   4.025  -2.502
   79   HD11  LEU  10          HD11      LEU  10  -4.223   4.165  -0.198
   80   HD12  LEU  10          HD12      LEU  10  -5.610   5.057  -0.824
   81   HD13  LEU  10          HD13      LEU  10  -3.990   5.744  -0.948
   82   HD21  LEU  10          HD21      LEU  10  -4.742   2.248  -1.455
   83   HD22  LEU  10          HD22      LEU  10  -4.759   2.257  -3.218
   84   HD23  LEU  10          HD23      LEU  10  -6.122   2.922  -2.319
   85    H    ASP  11           HN       ASP  11  -5.720   2.837  -5.757
   86    HA   ASP  11           HA       ASP  11  -7.160   4.262  -7.822
   87    HB2  ASP  11           HB2      ASP  11  -7.550   1.401  -6.903
   88    HB3  ASP  11           HB1      ASP  11  -8.095   2.102  -8.418
   89    H    ASP  12           HN       ASP  12  -9.539   4.195  -7.950
   90    HA   ASP  12           HA       ASP  12 -10.756   4.948  -5.493
   91    HB2  ASP  12           HB2      ASP  12 -11.672   4.707  -8.311
   92    HB3  ASP  12           HB1      ASP  12 -12.908   4.698  -7.058
   93    HA   PRO  13           HA       PRO  13 -13.320   0.804  -5.893
   94    HB2  PRO  13           HB2      PRO  13 -12.072  -1.160  -7.374
   95    HB3  PRO  13           HB1      PRO  13 -13.376  -0.132  -7.977
   96    HG2  PRO  13           HG2      PRO  13 -10.422   0.135  -8.356
   97    HG3  PRO  13           HG1      PRO  13 -11.730   0.382  -9.529
   98    HD2  PRO  13           HD2      PRO  13 -10.507   2.453  -8.351
   99    HD3  PRO  13           HD1      PRO  13 -12.250   2.484  -8.692
  100    H    THR  14           HN       THR  14  -9.816   0.868  -5.976
  101    HA   THR  14           HA       THR  14  -9.508  -1.362  -4.224
  102    HB   THR  14           HB       THR  14  -7.749  -0.279  -5.878
  103    HG1  THR  14           HG1      THR  14  -6.200  -1.015  -3.898
  104   HG21  THR  14          HG21      THR  14  -7.050   1.080  -3.280
  105   HG22  THR  14          HG22      THR  14  -7.651   1.895  -4.723
  106   HG23  THR  14          HG23      THR  14  -6.087   1.081  -4.757
  107    H    ARG  15           HN       ARG  15  -9.850   2.114  -3.848
  108    HA   ARG  15           HA       ARG  15  -9.016   2.375  -1.184
  109    HB2  ARG  15           HB2      ARG  15  -9.685   4.160  -2.981
  110    HB3  ARG  15           HB1      ARG  15 -11.297   3.974  -2.312
  111    HG2  ARG  15           HG2      ARG  15  -8.929   4.648  -0.595
  112    HG3  ARG  15           HG1      ARG  15  -9.866   5.882  -1.435
  113    HD2  ARG  15           HD2      ARG  15 -11.009   5.895   0.523
  114    HD3  ARG  15           HD1      ARG  15 -11.869   4.563  -0.248
  115    HE   ARG  15           HE       ARG  15 -10.744   3.045   1.128
  116   HH11  ARG  15          HH21      ARG  15  -9.808   6.353   1.793
  117   HH12  ARG  15          HH22      ARG  15  -8.995   5.964   3.270
  118   HH21  ARG  15          HH11      ARG  15  -9.655   2.519   3.059
  119   HH22  ARG  15          HH12      ARG  15  -8.895   3.767   3.988
  120    H    GLU  16           HN       GLU  16 -12.279   1.836  -2.536
  121    HA   GLU  16           HA       GLU  16 -13.551   1.621  -0.021
  122    HB2  GLU  16           HB2      GLU  16 -15.377   0.458  -1.301
  123    HB3  GLU  16           HB1      GLU  16 -14.916   2.032  -1.931
  124    HG2  GLU  16           HG2      GLU  16 -13.581   0.953  -3.660
  125    HG3  GLU  16           HG1      GLU  16 -14.039  -0.627  -3.028
  126    H    ARG  17           HN       ARG  17 -12.016  -0.768  -2.118
  127    HA   ARG  17           HA       ARG  17 -12.726  -3.060  -0.646
  128    HB2  ARG  17           HB2      ARG  17 -11.602  -2.834  -2.991
  129    HB3  ARG  17           HB1      ARG  17 -10.097  -2.823  -2.085
  130    HG2  ARG  17           HG2      ARG  17 -12.149  -5.017  -1.874
  131    HG3  ARG  17           HG1      ARG  17 -10.785  -5.052  -2.991
  132    HD2  ARG  17           HD2      ARG  17  -9.267  -4.794  -1.031
  133    HD3  ARG  17           HD1      ARG  17 -10.673  -4.950   0.018
  134    HE   ARG  17           HE       ARG  17 -10.226  -7.113  -1.886
  135   HH11  ARG  17          HH21      ARG  17  -9.780  -5.928   1.387
  136   HH12  ARG  17          HH22      ARG  17  -9.576  -7.509   2.062
  137   HH21  ARG  17          HH11      ARG  17  -9.941  -9.157  -1.031
  138   HH22  ARG  17          HH12      ARG  17  -9.673  -9.372   0.675
  139    H    LEU  18           HN       LEU  18 -10.093  -0.736  -0.326
  140    HA   LEU  18           HA       LEU  18  -8.605  -2.074   1.634
  141    HB2  LEU  18           HB2      LEU  18  -8.802   0.685   0.643
  142    HB3  LEU  18           HB1      LEU  18  -8.286   0.560   2.312
  143    HG   LEU  18           HG       LEU  18  -6.490  -1.054   1.499
  144   HD11  LEU  18          HD11      LEU  18  -7.226   0.114  -1.175
  145   HD12  LEU  18          HD12      LEU  18  -7.465  -1.562  -0.681
  146   HD13  LEU  18          HD13      LEU  18  -5.833  -0.910  -0.825
  147   HD21  LEU  18          HD21      LEU  18  -5.822   1.089   2.177
  148   HD22  LEU  18          HD22      LEU  18  -6.546   1.854   0.763
  149   HD23  LEU  18          HD23      LEU  18  -5.100   0.861   0.584
  150    H    LYS  19           HN       LYS  19 -11.492  -0.061   1.848
  151    HA   LYS  19           HA       LYS  19 -11.595   0.194   4.647
  152    HB2  LYS  19           HB2      LYS  19 -13.069   1.473   3.151
  153    HB3  LYS  19           HB1      LYS  19 -13.881  -0.012   2.680
  154    HG2  LYS  19           HG2      LYS  19 -15.283   1.086   4.233
  155    HG3  LYS  19           HG1      LYS  19 -14.567  -0.287   5.074
  156    HD2  LYS  19           HD2      LYS  19 -13.029   1.131   6.226
  157    HD3  LYS  19           HD1      LYS  19 -13.485   2.521   5.237
  158    HE2  LYS  19           HE2      LYS  19 -15.324   1.056   7.127
  159    HE3  LYS  19           HE1      LYS  19 -14.502   2.572   7.491
  160    HZ1  LYS  19           HZ1      LYS  19 -15.856   2.871   5.057
  161    HZ2  LYS  19           HZ2      LYS  19 -16.163   3.652   6.525
  162    HZ3  LYS  19           HZ3      LYS  19 -16.942   2.194   6.164
  163    H    ALA  20           HN       ALA  20 -12.816  -2.242   2.464
  164    HA   ALA  20           HA       ALA  20 -13.988  -3.954   4.356
  165    HB1  ALA  20           HB1      ALA  20 -14.379  -4.109   1.916
  166    HB2  ALA  20           HB2      ALA  20 -13.945  -5.656   2.641
  167    HB3  ALA  20           HB3      ALA  20 -12.747  -4.746   1.721
  168    H    ALA  21           HN       ALA  21 -10.688  -3.714   3.105
  169    HA   ALA  21           HA       ALA  21  -9.642  -6.010   4.385
  170    HB1  ALA  21           HB1      ALA  21  -7.453  -5.026   4.003
  171    HB2  ALA  21           HB2      ALA  21  -8.190  -3.458   3.676
  172    HB3  ALA  21           HB3      ALA  21  -8.467  -4.809   2.577
  173    H    ALA  22           HN       ALA  22  -9.985  -2.645   5.356
  174    HA   ALA  22           HA       ALA  22  -8.716  -2.749   7.851
  175    HB1  ALA  22           HB1      ALA  22 -11.144  -1.102   7.146
  176    HB2  ALA  22           HB2      ALA  22  -9.500  -0.675   6.675
  177    HB3  ALA  22           HB3      ALA  22  -9.938  -0.744   8.382
  178    H    GLN  23           HN       GLN  23 -11.927  -3.470   6.805
  179    HA   GLN  23           HA       GLN  23 -13.054  -4.011   9.333
  180    HB2  GLN  23           HB2      GLN  23 -13.847  -4.844   6.545
  181    HB3  GLN  23           HB1      GLN  23 -14.819  -5.185   7.972
  182    HG2  GLN  23           HG2      GLN  23 -13.991  -2.424   7.117
  183    HG3  GLN  23           HG1      GLN  23 -15.531  -3.170   6.694
  184   HE21  GLN  23          HE21      GLN  23 -13.688  -1.602   9.132
  185   HE22  GLN  23          HE22      GLN  23 -14.917  -1.550  10.344
  186    H    SER  24           HN       SER  24 -11.473  -6.069   6.910
  187    HA   SER  24           HA       SER  24 -12.018  -8.512   8.213
  188    HB2  SER  24           HB2      SER  24 -10.381  -9.513   6.755
  189    HB3  SER  24           HB1      SER  24 -11.277  -8.310   5.831
  190    HG   SER  24           HG       SER  24  -9.287  -6.972   6.766
  191    H    ILE  25           HN       ILE  25  -9.707  -6.018   8.865
  192    HA   ILE  25           HA       ILE  25  -8.331  -7.813  10.747
  193    HB   ILE  25           HB       ILE  25  -6.909  -6.698   9.018
  194   HG12  ILE  25          HG12      ILE  25  -6.198  -5.728  11.784
  195   HG13  ILE  25          HG11      ILE  25  -6.121  -7.428  11.335
  196   HG21  ILE  25          HG21      ILE  25  -8.056  -4.594   8.822
  197   HG22  ILE  25          HG22      ILE  25  -6.386  -4.306   9.311
  198   HG23  ILE  25          HG23      ILE  25  -7.685  -4.195  10.499
  199   HD11  ILE  25          HD11      ILE  25  -4.466  -6.949   9.654
  200   HD12  ILE  25          HD12      ILE  25  -3.947  -6.293  11.207
  201   HD13  ILE  25          HD13      ILE  25  -4.603  -5.219   9.971
  202    H    ASP  26           HN       ASP  26 -10.781  -5.758  10.655
  203    HA   ASP  26           HA       ASP  26 -12.002  -4.605  12.145
  204    HB2  ASP  26           HB2      ASP  26 -10.290  -6.193  14.040
  205    HB3  ASP  26           HB1      ASP  26 -11.516  -5.074  14.622
  206    H    ARG  27           HN       ARG  27 -10.015  -3.123  10.976
  207    HA   ARG  27           HA       ARG  27  -9.341  -1.278  13.175
  208    HB2  ARG  27           HB2      ARG  27  -7.547  -2.029  10.860
  209    HB3  ARG  27           HB1      ARG  27  -7.211  -0.743  12.015
  210    HG2  ARG  27           HG2      ARG  27  -7.180  -2.379  13.830
  211    HG3  ARG  27           HG1      ARG  27  -7.516  -3.666  12.673
  212    HD2  ARG  27           HD2      ARG  27  -5.406  -3.007  11.485
  213    HD3  ARG  27           HD1      ARG  27  -5.055  -1.942  12.847
  214    HE   ARG  27           HE       ARG  27  -5.035  -4.861  12.845
  215   HH11  ARG  27          HH21      ARG  27  -4.747  -1.898  14.693
  216   HH12  ARG  27          HH22      ARG  27  -3.925  -2.653  16.018
  217   HH21  ARG  27          HH11      ARG  27  -3.961  -5.861  14.603
  218   HH22  ARG  27          HH12      ARG  27  -3.475  -4.908  15.967
  219    H    THR  28           HN       THR  28  -8.799   0.953  12.314
  220    HA   THR  28           HA       THR  28 -10.962   1.834  10.673
  221    HB   THR  28           HB       THR  28 -10.537   3.500  12.186
  222    HG1  THR  28           HG1      THR  28  -9.053   5.123  11.188
  223   HG21  THR  28          HG21      THR  28  -8.668   2.449  13.284
  224   HG22  THR  28          HG22      THR  28  -8.285   4.144  12.982
  225   HG23  THR  28          HG23      THR  28  -7.597   2.888  11.953
  226    HA   PRO  29           HA       PRO  29  -9.324   1.660   6.592
  227    HB2  PRO  29           HB2      PRO  29 -10.088   4.225   5.760
  228    HB3  PRO  29           HB1      PRO  29 -11.056   2.756   5.632
  229    HG2  PRO  29           HG2      PRO  29 -11.137   4.910   7.691
  230    HG3  PRO  29           HG1      PRO  29 -12.467   3.961   7.001
  231    HD2  PRO  29           HD2      PRO  29 -11.541   3.451   9.453
  232    HD3  PRO  29           HD1      PRO  29 -12.032   2.130   8.369
  233    H    HIS  30           HN       HIS  30  -8.697   4.635   8.424
  234    HA   HIS  30           HA       HIS  30  -6.581   5.611   6.832
  235    HB2  HIS  30           HB2      HIS  30  -7.904   6.770   8.726
  236    HB3  HIS  30           HB1      HIS  30  -6.771   5.990   9.820
  237    HD1  HIS  30           HD1      HIS  30  -5.283   7.816  10.602
  238    HD2  HIS  30           HD2      HIS  30  -5.956   8.002   6.506
  239    HE1  HIS  30           HE1      HIS  30  -3.846   9.701   9.770
  240    HE2  HIS  30           HE2      HIS  30  -4.536   9.990   7.365
  241    H    TRP  31           HN       TRP  31  -6.581   3.678   9.792
  242    HA   TRP  31           HA       TRP  31  -3.797   3.300   9.965
  243    HB2  TRP  31           HB2      TRP  31  -5.295   2.959  11.895
  244    HB3  TRP  31           HB1      TRP  31  -6.030   1.585  11.075
  245    HD1  TRP  31           HD1      TRP  31  -4.410  -0.618  10.739
  246    HE1  TRP  31           HE1      TRP  31  -2.476  -1.482  12.193
  247    HE3  TRP  31           HE3      TRP  31  -3.453   3.627  13.423
  248    HZ2  TRP  31           HZ2      TRP  31  -0.771  -0.501  14.218
  249    HZ3  TRP  31           HZ3      TRP  31  -1.656   3.578  15.103
  250    HH2  TRP  31           HH2      TRP  31  -0.344   1.555  15.492
  251    H    LEU  32           HN       LEU  32  -6.405   1.531   8.521
  252    HA   LEU  32           HA       LEU  32  -5.055  -0.780   7.813
  253    HB2  LEU  32           HB2      LEU  32  -7.480  -0.594   7.699
  254    HB3  LEU  32           HB1      LEU  32  -7.340   0.559   6.389
  255    HG   LEU  32           HG       LEU  32  -7.989  -1.852   5.804
  256   HD11  LEU  32          HD11      LEU  32  -6.920  -1.764   3.692
  257   HD12  LEU  32          HD12      LEU  32  -5.605  -0.776   4.325
  258   HD13  LEU  32          HD13      LEU  32  -7.227  -0.100   4.188
  259   HD21  LEU  32          HD21      LEU  32  -6.191  -3.442   5.518
  260   HD22  LEU  32          HD22      LEU  32  -6.295  -2.946   7.207
  261   HD23  LEU  32          HD23      LEU  32  -5.029  -2.286   6.171
  262    H    ILE  33           HN       ILE  33  -5.384   2.252   6.059
  263    HA   ILE  33           HA       ILE  33  -4.172   1.386   3.683
  264    HB   ILE  33           HB       ILE  33  -4.060   4.158   4.894
  265   HG12  ILE  33          HG12      ILE  33  -5.903   3.103   2.743
  266   HG13  ILE  33          HG11      ILE  33  -6.355   3.209   4.441
  267   HG21  ILE  33          HG21      ILE  33  -2.350   3.635   3.133
  268   HG22  ILE  33          HG22      ILE  33  -3.441   4.967   2.749
  269   HG23  ILE  33          HG23      ILE  33  -3.686   3.385   2.010
  270   HD11  ILE  33          HD11      ILE  33  -6.052   5.624   4.375
  271   HD12  ILE  33          HD12      ILE  33  -7.215   5.089   3.162
  272   HD13  ILE  33          HD13      ILE  33  -5.574   5.522   2.680
  273    H    LYS  34           HN       LYS  34  -2.770   2.903   6.578
  274    HA   LYS  34           HA       LYS  34  -0.090   2.973   5.645
  275    HB2  LYS  34           HB2      LYS  34  -0.421   2.449   8.524
  276    HB3  LYS  34           HB1      LYS  34   0.423   3.758   7.710
  277    HG2  LYS  34           HG2      LYS  34  -1.723   4.873   7.311
  278    HG3  LYS  34           HG1      LYS  34  -2.544   3.573   8.170
  279    HD2  LYS  34           HD2      LYS  34  -0.471   5.428   9.338
  280    HD3  LYS  34           HD1      LYS  34  -2.212   5.523   9.606
  281    HE2  LYS  34           HE2      LYS  34  -1.958   4.166  11.345
  282    HE3  LYS  34           HE1      LYS  34  -1.490   2.889  10.224
  283    HZ1  LYS  34           HZ1      LYS  34   0.428   2.913  11.327
  284    HZ2  LYS  34           HZ2      LYS  34   0.129   4.415  12.043
  285    HZ3  LYS  34           HZ3      LYS  34   0.784   4.337  10.481
  286    H    GLN  35           HN       GLN  35  -1.756   0.639   7.728
  287    HA   GLN  35           HA       GLN  35   0.465  -1.108   7.833
  288    HB2  GLN  35           HB2      GLN  35  -0.827  -2.539   9.118
  289    HB3  GLN  35           HB1      GLN  35  -1.523  -0.965   9.475
  290    HG2  GLN  35           HG2      GLN  35  -3.322  -1.393   7.902
  291    HG3  GLN  35           HG1      GLN  35  -2.622  -2.960   7.513
  292   HE21  GLN  35          HE21      GLN  35  -1.829  -3.464  10.277
  293   HE22  GLN  35          HE22      GLN  35  -3.283  -3.871  11.113
  294    H    ALA  36           HN       ALA  36  -2.223  -0.767   5.599
  295    HA   ALA  36           HA       ALA  36  -2.214  -3.342   4.529
  296    HB1  ALA  36           HB1      ALA  36  -2.966  -0.687   3.390
  297    HB2  ALA  36           HB2      ALA  36  -3.984  -2.077   3.770
  298    HB3  ALA  36           HB3      ALA  36  -2.929  -2.116   2.358
  299    H    ILE  37           HN       ILE  37  -0.245  -0.509   3.615
  300    HA   ILE  37           HA       ILE  37   1.068  -1.982   1.558
  301    HB   ILE  37           HB       ILE  37   0.990   0.458   1.490
  302   HG12  ILE  37          HG12      ILE  37   3.341   0.871   0.870
  303   HG13  ILE  37          HG11      ILE  37   3.801  -0.637   1.651
  304   HG21  ILE  37          HG21      ILE  37   2.454   1.816   2.909
  305   HG22  ILE  37          HG22      ILE  37   2.861   0.378   3.845
  306   HG23  ILE  37          HG23      ILE  37   1.205   0.984   3.836
  307   HD11  ILE  37          HD11      ILE  37   1.820  -0.509  -0.596
  308   HD12  ILE  37          HD12      ILE  37   2.659  -1.922   0.045
  309   HD13  ILE  37          HD13      ILE  37   3.554  -0.695  -0.850
  310    H    PHE  38           HN       PHE  38   1.962  -1.278   4.951
  311    HA   PHE  38           HA       PHE  38   4.465  -2.692   4.710
  312    HB2  PHE  38           HB2      PHE  38   4.741  -1.367   6.527
  313    HB3  PHE  38           HB1      PHE  38   3.010  -1.181   6.754
  314    HD1  PHE  38           HD1      PHE  38   1.763  -2.874   8.093
  315    HD2  PHE  38           HD2      PHE  38   6.014  -2.817   7.882
  316    HE1  PHE  38           HE1      PHE  38   1.876  -4.263  10.115
  317    HE2  PHE  38           HE2      PHE  38   6.132  -4.209   9.907
  318    HZ   PHE  38           HZ       PHE  38   4.062  -4.935  11.025
  319    H    ASN  39           HN       ASN  39   1.249  -3.516   5.778
  320    HA   ASN  39           HA       ASN  39   1.858  -6.113   6.723
  321    HB2  ASN  39           HB2      ASN  39  -0.279  -4.679   7.150
  322    HB3  ASN  39           HB1      ASN  39  -0.828  -5.350   5.621
  323   HD21  ASN  39          HD21      ASN  39  -2.057  -5.689   8.139
  324   HD22  ASN  39          HD22      ASN  39  -2.005  -7.367   8.540
  325    H    TYR  40           HN       TYR  40   1.176  -4.666   3.631
  326    HA   TYR  40           HA       TYR  40   0.579  -6.982   2.176
  327    HB2  TYR  40           HB2      TYR  40   0.363  -4.856   1.062
  328    HB3  TYR  40           HB1      TYR  40   2.042  -4.448   1.392
  329    HD1  TYR  40           HD2      TYR  40   0.845  -7.712   0.082
  330    HD2  TYR  40           HD1      TYR  40   2.775  -4.029  -0.811
  331    HE1  TYR  40           HE2      TYR  40   1.488  -8.591  -2.117
  332    HE2  TYR  40           HE1      TYR  40   3.426  -4.900  -3.014
  333    HH   TYR  40           HH       TYR  40   3.339  -6.595  -4.417
  334    H    LEU  41           HN       LEU  41   3.566  -5.389   3.086
  335    HA   LEU  41           HA       LEU  41   5.316  -7.214   1.925
  336    HB2  LEU  41           HB2      LEU  41   5.678  -5.494   4.355
  337    HB3  LEU  41           HB1      LEU  41   6.971  -6.415   3.608
  338    HG   LEU  41           HG       LEU  41   5.496  -4.040   2.497
  339   HD11  LEU  41          HD11      LEU  41   7.761  -3.176   2.227
  340   HD12  LEU  41          HD12      LEU  41   8.410  -4.666   2.911
  341   HD13  LEU  41          HD13      LEU  41   7.418  -3.599   3.904
  342   HD21  LEU  41          HD21      LEU  41   7.201  -6.026   1.002
  343   HD22  LEU  41          HD22      LEU  41   6.810  -4.413   0.407
  344   HD23  LEU  41          HD23      LEU  41   5.524  -5.589   0.675
  345    H    GLU  42           HN       GLU  42   3.915  -7.099   5.165
  346    HA   GLU  42           HA       GLU  42   5.126  -9.402   6.223
  347    HB2  GLU  42           HB2      GLU  42   4.009  -7.660   7.573
  348    HB3  GLU  42           HB1      GLU  42   2.454  -8.174   6.938
  349    HG2  GLU  42           HG2      GLU  42   2.743 -10.359   7.995
  350    HG3  GLU  42           HG1      GLU  42   4.304  -9.845   8.629
  351    H    LYS  43           HN       LYS  43   2.082  -9.007   4.450
  352    HA   LYS  43           HA       LYS  43   1.157 -11.659   4.847
  353    HB2  LYS  43           HB2      LYS  43   0.462  -9.622   2.726
  354    HB3  LYS  43           HB1      LYS  43  -0.372 -11.155   2.927
  355    HG2  LYS  43           HG2      LYS  43  -0.190  -9.064   5.079
  356    HG3  LYS  43           HG1      LYS  43  -1.520  -9.180   3.929
  357    HD2  LYS  43           HD2      LYS  43  -1.974 -11.466   4.720
  358    HD3  LYS  43           HD1      LYS  43  -0.678 -11.296   5.906
  359    HE2  LYS  43           HE2      LYS  43  -2.833 -10.878   6.943
  360    HE3  LYS  43           HE1      LYS  43  -1.867  -9.403   6.917
  361    HZ1  LYS  43           HZ1      LYS  43  -4.157  -8.978   6.281
  362    HZ2  LYS  43           HZ2      LYS  43  -4.037 -10.080   5.006
  363    HZ3  LYS  43           HZ3      LYS  43  -3.114  -8.658   4.984
  364    H    LEU  44           HN       LEU  44   3.026 -10.134   2.244
  365    HA   LEU  44           HA       LEU  44   3.043 -12.551   0.700
  366    HB2  LEU  44           HB2      LEU  44   4.330 -11.415  -0.907
  367    HB3  LEU  44           HB1      LEU  44   3.195 -10.238  -0.284
  368    HG   LEU  44           HG       LEU  44   5.333  -9.713   1.291
  369   HD11  LEU  44          HD11      LEU  44   6.442 -10.575  -1.377
  370   HD12  LEU  44          HD12      LEU  44   6.752 -11.347   0.178
  371   HD13  LEU  44          HD13      LEU  44   7.330  -9.709  -0.124
  372   HD21  LEU  44          HD21      LEU  44   4.773  -8.618  -1.462
  373   HD22  LEU  44          HD22      LEU  44   5.779  -7.838  -0.241
  374   HD23  LEU  44          HD23      LEU  44   4.055  -8.069   0.053
  375    H    GLU  45           HN       GLU  45   5.118 -11.071   3.086
  376    HA   GLU  45           HA       GLU  45   7.255 -12.971   2.634
  377    HB2  GLU  45           HB2      GLU  45   6.902 -10.747   4.639
  378    HB3  GLU  45           HB1      GLU  45   8.296 -11.816   4.624
  379    HG2  GLU  45           HG2      GLU  45   8.842 -11.069   2.359
  380    HG3  GLU  45           HG1      GLU  45   7.444  -9.999   2.380
  381    H1   MET  46           HT1      MET  46  -2.490   0.125 -13.876
  382    H2   MET  46           HT2      MET  46  -2.126   1.403 -12.836
  383    H3   MET  46           HT3      MET  46  -2.705   1.723 -14.391
  384    HA   MET  46           HA       MET  46  -4.790   0.583 -13.797
  385    HB2  MET  46           HB2      MET  46  -3.868   0.916 -10.947
  386    HB3  MET  46           HB1      MET  46  -5.269   0.041 -11.545
  387    HG2  MET  46           HG2      MET  46  -3.807  -1.644 -10.948
  388    HG3  MET  46           HG1      MET  46  -3.557  -1.498 -12.688
  389    HE1  MET  46           HE1      MET  46  -1.554  -3.090 -11.619
  390    HE2  MET  46           HE2      MET  46   0.045  -2.353 -11.698
  391    HE3  MET  46           HE3      MET  46  -1.017  -2.308 -13.105
  392    H    ALA  47           HN       ALA  47  -6.390   1.846 -12.142
  393    HA   ALA  47           HA       ALA  47  -6.070   4.627 -12.915
  394    HB1  ALA  47           HB1      ALA  47  -8.216   3.546 -13.296
  395    HB2  ALA  47           HB2      ALA  47  -8.393   4.862 -12.135
  396    HB3  ALA  47           HB3      ALA  47  -8.363   3.190 -11.575
  397    H    THR  48           HN       THR  48  -4.133   4.421 -11.293
  398    HA   THR  48           HA       THR  48  -4.909   4.800  -8.521
  399    HB   THR  48           HB       THR  48  -2.579   4.733  -7.979
  400    HG1  THR  48           HG1      THR  48  -2.169   5.974 -10.163
  401   HG21  THR  48          HG21      THR  48  -1.921   2.595  -8.784
  402   HG22  THR  48          HG22      THR  48  -2.886   2.777 -10.248
  403   HG23  THR  48          HG23      THR  48  -3.682   2.577  -8.687
  404    H    THR  49           HN       THR  49  -5.129   6.708  -7.571
  405    HA   THR  49           HA       THR  49  -4.209   9.113  -9.007
  406    HB   THR  49           HB       THR  49  -6.476   8.959  -7.009
  407    HG1  THR  49           HG1      THR  49  -7.077   7.741  -8.802
  408   HG21  THR  49          HG21      THR  49  -5.671  11.052  -9.036
  409   HG22  THR  49          HG22      THR  49  -5.553  11.190  -7.282
  410   HG23  THR  49          HG23      THR  49  -7.136  11.103  -8.056
  411    H    THR  50           HN       THR  50  -3.245  10.792  -7.766
  412    HA   THR  50           HA       THR  50  -1.640   9.897  -5.608
  413    HB   THR  50           HB       THR  50  -2.146  12.784  -6.320
  414    HG1  THR  50           HG1      THR  50  -1.283  10.876  -7.945
  415   HG21  THR  50          HG21      THR  50   0.347  11.390  -5.335
  416   HG22  THR  50          HG22      THR  50  -0.779  12.264  -4.297
  417   HG23  THR  50          HG23      THR  50   0.115  13.125  -5.549
  418    H    LEU  51           HN       LEU  51  -2.350   9.501  -3.655
  419    HA   LEU  51           HA       LEU  51  -4.238  11.354  -2.369
  420    HB2  LEU  51           HB2      LEU  51  -4.214   8.347  -2.029
  421    HB3  LEU  51           HB1      LEU  51  -5.293   9.468  -1.227
  422    HG   LEU  51           HG       LEU  51  -5.271   8.799  -4.173
  423   HD11  LEU  51          HD11      LEU  51  -6.236   7.175  -2.421
  424   HD12  LEU  51          HD12      LEU  51  -7.232   7.609  -3.809
  425   HD13  LEU  51          HD13      LEU  51  -7.521   8.369  -2.245
  426   HD21  LEU  51          HD21      LEU  51  -5.852  11.116  -3.945
  427   HD22  LEU  51          HD22      LEU  51  -6.959  10.754  -2.620
  428   HD23  LEU  51          HD23      LEU  51  -7.326  10.197  -4.252
  429    H    GLY  52           HN       GLY  52  -3.916  11.590  -0.093
  430    HA2  GLY  52           HA2      GLY  52  -1.195  11.366   0.742
  431    HA3  GLY  52           HA1      GLY  52  -2.545  11.898   1.738
  432    H    VAL  53           HN       VAL  53  -0.224   9.601   1.501
  433    HA   VAL  53           HA       VAL  53  -1.833   7.659   3.015
  434    HB   VAL  53           HB       VAL  53   0.186   7.028   0.852
  435   HG11  VAL  53          HG11      VAL  53  -0.526   4.642   1.248
  436   HG12  VAL  53          HG12      VAL  53  -1.224   5.196   2.770
  437   HG13  VAL  53          HG13      VAL  53   0.508   5.352   2.487
  438   HG21  VAL  53          HG21      VAL  53  -1.950   7.675  -0.050
  439   HG22  VAL  53          HG22      VAL  53  -2.782   6.558   1.031
  440   HG23  VAL  53          HG23      VAL  53  -1.738   5.935  -0.246
  441    H    LYS  54           HN       LYS  54  -0.324   6.123   4.247
  442    HA   LYS  54           HA       LYS  54   1.931   7.668   5.311
  443    HB2  LYS  54           HB2      LYS  54  -0.015   5.857   6.751
  444    HB3  LYS  54           HB1      LYS  54   1.467   6.463   7.476
  445    HG2  LYS  54           HG2      LYS  54   0.388   8.286   8.109
  446    HG3  LYS  54           HG1      LYS  54   0.118   8.696   6.416
  447    HD2  LYS  54           HD2      LYS  54  -1.677   6.796   7.902
  448    HD3  LYS  54           HD1      LYS  54  -1.933   8.539   7.935
  449    HE2  LYS  54           HE2      LYS  54  -3.247   8.071   6.151
  450    HE3  LYS  54           HE1      LYS  54  -1.714   8.188   5.290
  451    HZ1  LYS  54           HZ1      LYS  54  -1.515   5.729   5.591
  452    HZ2  LYS  54           HZ2      LYS  54  -2.780   6.215   4.579
  453    HZ3  LYS  54           HZ3      LYS  54  -3.108   5.717   6.162
  454    H    LEU  55           HN       LEU  55   3.838   6.727   5.110
  455    HA   LEU  55           HA       LEU  55   3.983   3.807   4.723
  456    HB2  LEU  55           HB2      LEU  55   4.883   5.999   2.988
  457    HB3  LEU  55           HB1      LEU  55   6.100   4.776   3.289
  458    HG   LEU  55           HG       LEU  55   3.369   3.983   2.345
  459   HD11  LEU  55          HD11      LEU  55   4.265   4.066   0.038
  460   HD12  LEU  55          HD12      LEU  55   5.673   4.935   0.649
  461   HD13  LEU  55          HD13      LEU  55   4.070   5.661   0.763
  462   HD21  LEU  55          HD21      LEU  55   4.736   2.156   1.326
  463   HD22  LEU  55          HD22      LEU  55   4.760   2.194   3.088
  464   HD23  LEU  55          HD23      LEU  55   6.136   2.811   2.174
  465    H    ASP  56           HN       ASP  56   5.742   2.791   5.613
  466    HA   ASP  56           HA       ASP  56   7.205   4.216   7.661
  467    HB2  ASP  56           HB2      ASP  56   7.549   1.331   6.803
  468    HB3  ASP  56           HB1      ASP  56   8.045   2.050   8.327
  469    H    ASP  57           HN       ASP  57   9.592   4.080   7.806
  470    HA   ASP  57           HA       ASP  57  10.845   4.782   5.350
  471    HB2  ASP  57           HB2      ASP  57  11.742   4.527   8.171
  472    HB3  ASP  57           HB1      ASP  57  12.986   4.423   6.932
  473    HA   PRO  58           HA       PRO  58  13.281   0.564   5.767
  474    HB2  PRO  58           HB2      PRO  58  11.988  -1.357   7.260
  475    HB3  PRO  58           HB1      PRO  58  13.317  -0.357   7.856
  476    HG2  PRO  58           HG2      PRO  58  10.369  -0.016   8.233
  477    HG3  PRO  58           HG1      PRO  58  11.682   0.205   9.405
  478    HD2  PRO  58           HD2      PRO  58  10.511   2.299   8.214
  479    HD3  PRO  58           HD1      PRO  58  12.253   2.289   8.558
  480    H    THR  59           HN       THR  59   9.775   0.693   5.870
  481    HA   THR  59           HA       THR  59   9.412  -1.535   4.130
  482    HB   THR  59           HB       THR  59   7.682  -0.401   5.777
  483    HG1  THR  59           HG1      THR  59   6.072  -1.097   3.873
  484   HG21  THR  59          HG21      THR  59   7.019   0.978   3.180
  485   HG22  THR  59          HG22      THR  59   7.655   1.774   4.619
  486   HG23  THR  59          HG23      THR  59   6.064   1.013   4.662
  487    H    ARG  60           HN       ARG  60   9.829   1.932   3.721
  488    HA   ARG  60           HA       ARG  60   9.003   2.180   1.053
  489    HB2  ARG  60           HB2      ARG  60   9.708   3.973   2.827
  490    HB3  ARG  60           HB1      ARG  60  11.315   3.747   2.160
  491    HG2  ARG  60           HG2      ARG  60   8.958   4.449   0.438
  492    HG3  ARG  60           HG1      ARG  60   9.925   5.672   1.258
  493    HD2  ARG  60           HD2      ARG  60  11.051   5.632  -0.712
  494    HD3  ARG  60           HD1      ARG  60  11.897   4.306   0.084
  495    HE   ARG  60           HE       ARG  60  10.725   2.769  -1.243
  496   HH11  ARG  60          HH21      ARG  60   9.906   6.083  -2.020
  497   HH12  ARG  60          HH22      ARG  60   9.114   5.676  -3.504
  498   HH21  ARG  60          HH11      ARG  60   9.655   2.221  -3.177
  499   HH22  ARG  60          HH12      ARG  60   8.955   3.463  -4.158
  500    H    GLU  61           HN       GLU  61  12.259   1.583   2.409
  501    HA   GLU  61           HA       GLU  61  13.504   1.317  -0.118
  502    HB2  GLU  61           HB2      GLU  61  15.348   0.210   1.115
  503    HB3  GLU  61           HB1      GLU  61  14.850   1.734   1.834
  504    HG2  GLU  61           HG2      GLU  61  13.580   0.523   3.525
  505    HG3  GLU  61           HG1      GLU  61  14.080  -1.006   2.803
  506    H    ARG  62           HN       ARG  62  11.932  -1.009   2.016
  507    HA   ARG  62           HA       ARG  62  12.599  -3.336   0.583
  508    HB2  ARG  62           HB2      ARG  62  11.473  -3.050   2.920
  509    HB3  ARG  62           HB1      ARG  62   9.971  -3.025   2.009
  510    HG2  ARG  62           HG2      ARG  62  11.983  -5.258   1.842
  511    HG3  ARG  62           HG1      ARG  62  10.610  -5.252   2.949
  512    HD2  ARG  62           HD2      ARG  62   9.120  -4.978   0.959
  513    HD3  ARG  62           HD1      ARG  62  10.535  -5.212  -0.063
  514    HE   ARG  62           HE       ARG  62  10.044  -7.310   1.883
  515   HH11  ARG  62          HH21      ARG  62   9.494  -6.183  -1.397
  516   HH12  ARG  62          HH22      ARG  62   9.170  -7.767  -2.015
  517   HH21  ARG  62          HH11      ARG  62   9.612  -9.355   1.098
  518   HH22  ARG  62          HH12      ARG  62   9.237  -9.593  -0.584
  519    H    LEU  63           HN       LEU  63  10.009  -0.971   0.230
  520    HA   LEU  63           HA       LEU  63   8.502  -2.296  -1.721
  521    HB2  LEU  63           HB2      LEU  63   8.760   0.470  -0.759
  522    HB3  LEU  63           HB1      LEU  63   8.241   0.337  -2.427
  523    HG   LEU  63           HG       LEU  63   6.410  -1.226  -1.598
  524   HD11  LEU  63          HD11      LEU  63   7.178  -0.051   1.064
  525   HD12  LEU  63          HD12      LEU  63   7.374  -1.737   0.586
  526   HD13  LEU  63          HD13      LEU  63   5.759  -1.044   0.726
  527   HD21  LEU  63          HD21      LEU  63   5.789   0.923  -2.295
  528   HD22  LEU  63          HD22      LEU  63   6.534   1.686  -0.891
  529   HD23  LEU  63          HD23      LEU  63   5.066   0.729  -0.698
  530    H    LYS  64           HN       LYS  64  11.433  -0.344  -1.951
  531    HA   LYS  64           HA       LYS  64  11.536  -0.127  -4.754
  532    HB2  LYS  64           HB2      LYS  64  13.035   1.152  -3.281
  533    HB3  LYS  64           HB1      LYS  64  13.826  -0.337  -2.789
  534    HG2  LYS  64           HG2      LYS  64  15.236   0.740  -4.366
  535    HG3  LYS  64           HG1      LYS  64  14.526  -0.662  -5.166
  536    HD2  LYS  64           HD2      LYS  64  12.935   0.741  -6.315
  537    HD3  LYS  64           HD1      LYS  64  13.484   2.159  -5.420
  538    HE2  LYS  64           HE2      LYS  64  15.263   0.540  -7.236
  539    HE3  LYS  64           HE1      LYS  64  14.362   1.955  -7.772
  540    HZ1  LYS  64           HZ1      LYS  64  15.764   2.648  -5.452
  541    HZ2  LYS  64           HZ2      LYS  64  16.002   3.223  -7.024
  542    HZ3  LYS  64           HZ3      LYS  64  16.850   1.863  -6.486
  543    H    ALA  65           HN       ALA  65  12.684  -2.569  -2.541
  544    HA   ALA  65           HA       ALA  65  13.831  -4.324  -4.419
  545    HB1  ALA  65           HB1      ALA  65  14.228  -4.457  -1.979
  546    HB2  ALA  65           HB2      ALA  65  13.757  -6.004  -2.682
  547    HB3  ALA  65           HB3      ALA  65  12.583  -5.056  -1.770
  548    H    ALA  66           HN       ALA  66  10.542  -4.006  -3.151
  549    HA   ALA  66           HA       ALA  66   9.436  -6.290  -4.395
  550    HB1  ALA  66           HB1      ALA  66   7.271  -5.243  -4.029
  551    HB2  ALA  66           HB2      ALA  66   8.051  -3.689  -3.729
  552    HB3  ALA  66           HB3      ALA  66   8.293  -5.028  -2.607
  553    H    ALA  67           HN       ALA  67   9.865  -2.955  -5.427
  554    HA   ALA  67           HA       ALA  67   8.591  -3.073  -7.918
  555    HB1  ALA  67           HB1      ALA  67  11.050  -1.466  -7.240
  556    HB2  ALA  67           HB2      ALA  67   9.415  -1.001  -6.775
  557    HB3  ALA  67           HB3      ALA  67   9.850  -1.104  -8.481
  558    H    GLN  68           HN       GLN  68  11.786  -3.854  -6.867
  559    HA   GLN  68           HA       GLN  68  12.888  -4.445  -9.397
  560    HB2  GLN  68           HB2      GLN  68  13.688  -5.265  -6.605
  561    HB3  GLN  68           HB1      GLN  68  14.644  -5.627  -8.037
  562    HG2  GLN  68           HG2      GLN  68  13.854  -2.844  -7.224
  563    HG3  GLN  68           HG1      GLN  68  15.369  -3.606  -6.749
  564   HE21  GLN  68          HE21      GLN  68  13.607  -2.070  -9.274
  565   HE22  GLN  68          HE22      GLN  68  14.874  -2.050 -10.448
  566    H    SER  69           HN       SER  69  11.274  -6.434  -6.940
  567    HA   SER  69           HA       SER  69  11.754  -8.903  -8.222
  568    HB2  SER  69           HB2      SER  69  10.098  -9.852  -6.746
  569    HB3  SER  69           HB1      SER  69  11.045  -8.677  -5.838
  570    HG   SER  69           HG       SER  69   9.104  -7.261  -6.718
  571    H    ILE  70           HN       ILE  70   9.493  -6.364  -8.879
  572    HA   ILE  70           HA       ILE  70   8.065  -8.153 -10.724
  573    HB   ILE  70           HB       ILE  70   6.680  -6.978  -9.008
  574   HG12  ILE  70          HG12      ILE  70   5.977  -6.040 -11.788
  575   HG13  ILE  70          HG11      ILE  70   5.860  -7.729 -11.306
  576   HG21  ILE  70          HG21      ILE  70   7.873  -4.899  -8.849
  577   HG22  ILE  70          HG22      ILE  70   6.209  -4.580  -9.340
  578   HG23  ILE  70          HG23      ILE  70   7.508  -4.519 -10.532
  579   HD11  ILE  70          HD11      ILE  70   4.227  -7.178  -9.628
  580   HD12  ILE  70          HD12      ILE  70   3.717  -6.535 -11.189
  581   HD13  ILE  70          HD13      ILE  70   4.406  -5.459  -9.974
  582    H    ASP  71           HN       ASP  71  10.568  -6.160 -10.689
  583    HA   ASP  71           HA       ASP  71  11.803  -5.072 -12.220
  584    HB2  ASP  71           HB2      ASP  71  10.004  -6.636 -14.053
  585    HB3  ASP  71           HB1      ASP  71  11.238  -5.553 -14.686
  586    H    ARG  72           HN       ARG  72   9.886  -3.500 -11.033
  587    HA   ARG  72           HA       ARG  72   9.240  -1.676 -13.255
  588    HB2  ARG  72           HB2      ARG  72   7.419  -2.327 -10.931
  589    HB3  ARG  72           HB1      ARG  72   7.121  -1.072 -12.128
  590    HG2  ARG  72           HG2      ARG  72   7.058  -2.761 -13.891
  591    HG3  ARG  72           HG1      ARG  72   7.358  -4.020 -12.694
  592    HD2  ARG  72           HD2      ARG  72   5.257  -3.274 -11.539
  593    HD3  ARG  72           HD1      ARG  72   4.940  -2.245 -12.935
  594    HE   ARG  72           HE       ARG  72   4.813  -5.154 -12.831
  595   HH11  ARG  72          HH21      ARG  72   4.707  -2.264 -14.800
  596   HH12  ARG  72          HH22      ARG  72   3.913  -3.042 -16.128
  597   HH21  ARG  72          HH11      ARG  72   3.768  -6.190 -14.587
  598   HH22  ARG  72          HH12      ARG  72   3.373  -5.278 -16.006
  599    H    THR  73           HN       THR  73   8.729   0.563 -12.436
  600    HA   THR  73           HA       THR  73  10.916   1.444 -10.831
  601    HB   THR  73           HB       THR  73  10.513   3.027 -12.432
  602    HG1  THR  73           HG1      THR  73   9.831   4.813 -11.423
  603   HG21  THR  73          HG21      THR  73   8.597   2.001 -13.451
  604   HG22  THR  73          HG22      THR  73   8.246   3.712 -13.208
  605   HG23  THR  73          HG23      THR  73   7.558   2.506 -12.119
  606    HA   PRO  74           HA       PRO  74   9.281   1.351  -6.736
  607    HB2  PRO  74           HB2      PRO  74  10.124   3.888  -5.905
  608    HB3  PRO  74           HB1      PRO  74  11.055   2.393  -5.791
  609    HG2  PRO  74           HG2      PRO  74  11.172   4.550  -7.845
  610    HG3  PRO  74           HG1      PRO  74  12.485   3.572  -7.163
  611    HD2  PRO  74           HD2      PRO  74  11.533   3.083  -9.611
  612    HD3  PRO  74           HD1      PRO  74  12.004   1.752  -8.532
  613    H    HIS  75           HN       HIS  75   8.731   4.302  -8.606
  614    HA   HIS  75           HA       HIS  75   6.650   5.372  -7.035
  615    HB2  HIS  75           HB2      HIS  75   8.000   6.433  -8.972
  616    HB3  HIS  75           HB1      HIS  75   6.831   5.660 -10.033
  617    HD1  HIS  75           HD1      HIS  75   5.408   7.528 -10.854
  618    HD2  HIS  75           HD2      HIS  75   6.102   7.764  -6.762
  619    HE1  HIS  75           HE1      HIS  75   4.044   9.480 -10.050
  620    HE2  HIS  75           HE2      HIS  75   4.758   9.790  -7.650
  621    H    TRP  76           HN       TRP  76   6.581   3.404  -9.972
  622    HA   TRP  76           HA       TRP  76   3.797   3.061 -10.115
  623    HB2  TRP  76           HB2      TRP  76   5.290   2.653 -12.041
  624    HB3  TRP  76           HB1      TRP  76   5.988   1.275 -11.196
  625    HD1  TRP  76           HD1      TRP  76   4.316  -0.884 -10.831
  626    HE1  TRP  76           HE1      TRP  76   2.360  -1.721 -12.274
  627    HE3  TRP  76           HE3      TRP  76   3.461   3.346 -13.573
  628    HZ2  TRP  76           HZ2      TRP  76   0.679  -0.725 -14.313
  629    HZ3  TRP  76           HZ3      TRP  76   1.664   3.318 -15.253
  630    HH2  TRP  76           HH2      TRP  76   0.303   1.324 -15.615
  631    H    LEU  77           HN       LEU  77   6.372   1.261  -8.647
  632    HA   LEU  77           HA       LEU  77   4.972  -1.009  -7.899
  633    HB2  LEU  77           HB2      LEU  77   7.403  -0.872  -7.791
  634    HB3  LEU  77           HB1      LEU  77   7.287   0.300  -6.495
  635    HG   LEU  77           HG       LEU  77   7.884  -2.118  -5.881
  636   HD11  LEU  77          HD11      LEU  77   6.820  -1.979  -3.769
  637   HD12  LEU  77          HD12      LEU  77   5.528  -0.969  -4.414
  638   HD13  LEU  77          HD13      LEU  77   7.165  -0.329  -4.287
  639   HD21  LEU  77          HD21      LEU  77   6.050  -3.662  -5.573
  640   HD22  LEU  77          HD22      LEU  77   6.164  -3.190  -7.269
  641   HD23  LEU  77          HD23      LEU  77   4.915  -2.488  -6.240
  642    H    ILE  78           HN       ILE  78   5.371   2.042  -6.191
  643    HA   ILE  78           HA       ILE  78   4.143   1.237  -3.802
  644    HB   ILE  78           HB       ILE  78   4.097   3.993  -5.051
  645   HG12  ILE  78          HG12      ILE  78   5.906   2.925  -2.881
  646   HG13  ILE  78          HG11      ILE  78   6.365   2.996  -4.579
  647   HG21  ILE  78          HG21      ILE  78   2.370   3.540  -3.288
  648   HG22  ILE  78          HG22      ILE  78   3.492   4.849  -2.920
  649   HG23  ILE  78          HG23      ILE  78   3.696   3.271  -2.158
  650   HD11  ILE  78          HD11      ILE  78   6.120   5.419  -4.546
  651   HD12  ILE  78          HD12      ILE  78   7.268   4.871  -3.324
  652   HD13  ILE  78          HD13      ILE  78   5.638   5.351  -2.850
  653    H    LYS  79           HN       LYS  79   2.777   2.741  -6.717
  654    HA   LYS  79           HA       LYS  79   0.098   2.894  -5.788
  655    HB2  LYS  79           HB2      LYS  79   0.428   2.319  -8.658
  656    HB3  LYS  79           HB1      LYS  79  -0.394   3.656  -7.868
  657    HG2  LYS  79           HG2      LYS  79   1.763   4.739  -7.477
  658    HG3  LYS  79           HG1      LYS  79   2.572   3.407  -8.297
  659    HD2  LYS  79           HD2      LYS  79   0.549   5.274  -9.531
  660    HD3  LYS  79           HD1      LYS  79   2.295   5.326  -9.782
  661    HE2  LYS  79           HE2      LYS  79   1.973   3.980 -11.525
  662    HE3  LYS  79           HE1      LYS  79   1.601   2.706 -10.364
  663    HZ1  LYS  79           HZ1      LYS  79  -0.382   2.634 -11.326
  664    HZ2  LYS  79           HZ2      LYS  79  -0.135   4.078 -12.169
  665    HZ3  LYS  79           HZ3      LYS  79  -0.728   4.117 -10.582
  666    H    GLN  80           HN       GLN  80   1.709   0.491  -7.832
  667    HA   GLN  80           HA       GLN  80  -0.556  -1.203  -7.916
  668    HB2  GLN  80           HB2      GLN  80   0.702  -2.683  -9.180
  669    HB3  GLN  80           HB1      GLN  80   1.432  -1.130  -9.563
  670    HG2  GLN  80           HG2      GLN  80   3.222  -1.574  -7.982
  671    HG3  GLN  80           HG1      GLN  80   2.488  -3.120  -7.571
  672   HE21  GLN  80          HE21      GLN  80   1.685  -3.649 -10.325
  673   HE22  GLN  80          HE22      GLN  80   3.130  -4.098 -11.156
  674    H    ALA  81           HN       ALA  81   2.138  -0.890  -5.687
  675    HA   ALA  81           HA       ALA  81   2.075  -3.451  -4.585
  676    HB1  ALA  81           HB1      ALA  81   2.887  -0.799  -3.481
  677    HB2  ALA  81           HB2      ALA  81   3.873  -2.217  -3.840
  678    HB3  ALA  81           HB3      ALA  81   2.817  -2.212  -2.429
  679    H    ILE  82           HN       ILE  82   0.171  -0.564  -3.708
  680    HA   ILE  82           HA       ILE  82  -1.174  -1.978  -1.632
  681    HB   ILE  82           HB       ILE  82  -1.042   0.460  -1.599
  682   HG12  ILE  82          HG12      ILE  82  -3.385   0.933  -0.984
  683   HG13  ILE  82          HG11      ILE  82  -3.876  -0.577  -1.743
  684   HG21  ILE  82          HG21      ILE  82  -2.479   1.830  -3.036
  685   HG22  ILE  82          HG22      ILE  82  -2.919   0.387  -3.950
  686   HG23  ILE  82          HG23      ILE  82  -1.250   0.957  -3.953
  687   HD11  ILE  82          HD11      ILE  82  -1.892  -0.459   0.503
  688   HD12  ILE  82          HD12      ILE  82  -2.763  -1.862  -0.116
  689   HD13  ILE  82          HD13      ILE  82  -3.630  -0.602   0.760
  690    H    PHE  83           HN       PHE  83  -2.054  -1.300  -5.035
  691    HA   PHE  83           HA       PHE  83  -4.586  -2.660  -4.779
  692    HB2  PHE  83           HB2      PHE  83  -4.829  -1.350  -6.612
  693    HB3  PHE  83           HB1      PHE  83  -3.093  -1.210  -6.842
  694    HD1  PHE  83           HD1      PHE  83  -1.890  -2.956  -8.154
  695    HD2  PHE  83           HD2      PHE  83  -6.138  -2.780  -7.950
  696    HE1  PHE  83           HE1      PHE  83  -2.039  -4.368 -10.159
  697    HE2  PHE  83           HE2      PHE  83  -6.293  -4.195  -9.957
  698    HZ   PHE  83           HZ       PHE  83  -4.241  -4.992 -11.062
  699    H    ASN  84           HN       ASN  84  -1.384  -3.570  -5.832
  700    HA   ASN  84           HA       ASN  84  -2.055  -6.168  -6.733
  701    HB2  ASN  84           HB2      ASN  84   0.113  -4.796  -7.197
  702    HB3  ASN  84           HB1      ASN  84   0.652  -5.444  -5.656
  703   HD21  ASN  84          HD21      ASN  84   1.894  -5.873  -8.143
  704   HD22  ASN  84          HD22      ASN  84   1.796  -7.556  -8.516
  705    H    TYR  85           HN       TYR  85  -1.364  -4.682  -3.669
  706    HA   TYR  85           HA       TYR  85  -0.805  -6.988  -2.179
  707    HB2  TYR  85           HB2      TYR  85  -0.547  -4.849  -1.096
  708    HB3  TYR  85           HB1      TYR  85  -2.218  -4.414  -1.430
  709    HD1  TYR  85           HD2      TYR  85  -1.089  -7.685  -0.079
  710    HD2  TYR  85           HD1      TYR  85  -2.932  -3.947   0.770
  711    HE1  TYR  85           HE2      TYR  85  -1.748  -8.522   2.133
  712    HE2  TYR  85           HE1      TYR  85  -3.598  -4.775   2.985
  713    HH   TYR  85           HH       TYR  85  -3.480  -6.430   4.438
  714    H    LEU  86           HN       LEU  86  -3.754  -5.352  -3.133
  715    HA   LEU  86           HA       LEU  86  -5.539  -7.142  -1.955
  716    HB2  LEU  86           HB2      LEU  86  -5.884  -5.437  -4.398
  717    HB3  LEU  86           HB1      LEU  86  -7.186  -6.314  -3.616
  718    HG   LEU  86           HG       LEU  86  -5.636  -3.964  -2.555
  719   HD11  LEU  86          HD11      LEU  86  -7.888  -3.040  -2.296
  720   HD12  LEU  86          HD12      LEU  86  -8.562  -4.515  -2.988
  721   HD13  LEU  86          HD13      LEU  86  -7.531  -3.473  -3.967
  722   HD21  LEU  86          HD21      LEU  86  -7.399  -5.878  -1.032
  723   HD22  LEU  86          HD22      LEU  86  -6.959  -4.269  -0.458
  724   HD23  LEU  86          HD23      LEU  86  -5.709  -5.487  -0.712
  725    H    GLU  87           HN       GLU  87  -4.119  -7.069  -5.187
  726    HA   GLU  87           HA       GLU  87  -5.353  -9.349  -6.259
  727    HB2  GLU  87           HB2      GLU  87  -4.168  -7.669  -7.617
  728    HB3  GLU  87           HB1      GLU  87  -2.639  -8.179  -6.919
  729    HG2  GLU  87           HG2      GLU  87  -2.976 -10.419  -7.913
  730    HG3  GLU  87           HG1      GLU  87  -4.445  -9.824  -8.682
  731    H    LYS  88           HN       LYS  88  -2.357  -9.010  -4.400
  732    HA   LYS  88           HA       LYS  88  -1.508 -11.706  -4.744
  733    HB2  LYS  88           HB2      LYS  88  -0.724  -9.663  -2.668
  734    HB3  LYS  88           HB1      LYS  88   0.054 -11.224  -2.866
  735    HG2  LYS  88           HG2      LYS  88  -0.075  -9.140  -5.030
  736    HG3  LYS  88           HG1      LYS  88   1.260  -9.296  -3.892
  737    HD2  LYS  88           HD2      LYS  88   1.628 -11.603  -4.679
  738    HD3  LYS  88           HD1      LYS  88   0.335 -11.385  -5.861
  739    HE2  LYS  88           HE2      LYS  88   2.518 -11.043  -6.890
  740    HE3  LYS  88           HE1      LYS  88   1.583  -9.549  -6.887
  741    HZ1  LYS  88           HZ1      LYS  88   3.877  -9.161  -6.241
  742    HZ2  LYS  88           HZ2      LYS  88   3.728 -10.247  -4.956
  743    HZ3  LYS  88           HZ3      LYS  88   2.835  -8.807  -4.953
  744    H    LEU  89           HN       LEU  89  -3.307 -10.057  -2.160
  745    HA   LEU  89           HA       LEU  89  -3.337 -12.415  -0.533
  746    HB2  LEU  89           HB2      LEU  89  -4.640 -11.229   1.030
  747    HB3  LEU  89           HB1      LEU  89  -3.492 -10.080   0.382
  748    HG   LEU  89           HG       LEU  89  -5.617  -9.589  -1.225
  749   HD11  LEU  89          HD11      LEU  89  -6.746 -10.370   1.462
  750   HD12  LEU  89          HD12      LEU  89  -7.073 -11.161  -0.079
  751   HD13  LEU  89          HD13      LEU  89  -7.621  -9.508   0.196
  752   HD21  LEU  89          HD21      LEU  89  -5.053  -8.412   1.493
  753   HD22  LEU  89          HD22      LEU  89  -6.048  -7.661   0.245
  754   HD23  LEU  89          HD23      LEU  89  -4.326  -7.921  -0.037
  755    H    GLU  90           HN       GLU  90  -5.491 -10.996  -2.918
  756    HA   GLU  90           HA       GLU  90  -7.632 -12.828  -2.322
  757    HB2  GLU  90           HB2      GLU  90  -7.243 -10.795  -4.531
  758    HB3  GLU  90           HB1      GLU  90  -8.668 -11.821  -4.401
  759    HG2  GLU  90           HG2      GLU  90  -9.149 -10.886  -2.192
  760    HG3  GLU  90           HG1      GLU  90  -7.720  -9.867  -2.311
  Start of MODEL   26
    1    H1   MET   1           HT1      MET   1   6.644   0.873  13.095
    2    H2   MET   1           HT2      MET   1   5.326   0.016  13.714
    3    H3   MET   1           HT3      MET   1   5.872   1.410  14.501
    4    HA   MET   1           HA       MET   1   4.785   1.393  11.750
    5    HB2  MET   1           HB2      MET   1   3.438   1.974  14.391
    6    HB3  MET   1           HB1      MET   1   2.814   2.573  12.864
    7    HG2  MET   1           HG2      MET   1   2.554   0.276  12.073
    8    HG3  MET   1           HG1      MET   1   3.167  -0.316  13.618
    9    HE1  MET   1           HE1      MET   1   0.390   0.615  16.136
   10    HE2  MET   1           HE2      MET   1   2.071   1.075  15.864
   11    HE3  MET   1           HE3      MET   1   1.598  -0.622  15.791
   12    H    ALA   2           HN       ALA   2   6.516   2.828  11.161
   13    HA   ALA   2           HA       ALA   2   6.376   5.466  12.472
   14    HB1  ALA   2           HB1      ALA   2   8.593   4.168  10.888
   15    HB2  ALA   2           HB2      ALA   2   8.597   4.578  12.604
   16    HB3  ALA   2           HB3      ALA   2   8.603   5.858  11.391
   17    H    THR   3           HN       THR   3   4.662   4.199  10.417
   18    HA   THR   3           HA       THR   3   5.109   5.337   7.878
   19    HB   THR   3           HB       THR   3   2.717   4.773   7.482
   20    HG1  THR   3           HG1      THR   3   2.460   5.113   9.998
   21   HG21  THR   3          HG21      THR   3   4.544   3.076   7.270
   22   HG22  THR   3          HG22      THR   3   2.964   2.391   7.652
   23   HG23  THR   3          HG23      THR   3   4.181   2.559   8.917
   24    H    THR   4           HN       THR   4   4.652   7.268   7.097
   25    HA   THR   4           HA       THR   4   3.028   9.111   8.725
   26    HB   THR   4           HB       THR   4   5.246   9.855   6.796
   27    HG1  THR   4           HG1      THR   4   6.048   8.724   8.640
   28   HG21  THR   4          HG21      THR   4   3.679  11.444   8.831
   29   HG22  THR   4          HG22      THR   4   3.741  11.698   7.087
   30   HG23  THR   4          HG23      THR   4   5.165  12.019   8.076
   31    H    THR   5           HN       THR   5   2.016  10.902   7.257
   32    HA   THR   5           HA       THR   5   0.518   9.565   5.195
   33    HB   THR   5           HB       THR   5  -0.307  12.118   5.005
   34    HG1  THR   5           HG1      THR   5   0.320  13.295   6.649
   35   HG21  THR   5          HG21      THR   5  -1.730  10.234   5.592
   36   HG22  THR   5          HG22      THR   5  -2.019  11.586   6.687
   37   HG23  THR   5          HG23      THR   5  -1.053  10.209   7.219
   38    H    LEU   6           HN       LEU   6   1.755   9.196   3.367
   39    HA   LEU   6           HA       LEU   6   2.825  11.612   2.058
   40    HB2  LEU   6           HB2      LEU   6   4.217   9.481   0.943
   41    HB3  LEU   6           HB1      LEU   6   4.847  10.697   2.032
   42    HG   LEU   6           HG       LEU   6   3.542   8.335   3.275
   43   HD11  LEU   6          HD11      LEU   6   5.610   7.020   3.046
   44   HD12  LEU   6          HD12      LEU   6   6.243   8.233   1.933
   45   HD13  LEU   6          HD13      LEU   6   4.818   7.293   1.494
   46   HD21  LEU   6          HD21      LEU   6   6.077   9.864   3.865
   47   HD22  LEU   6          HD22      LEU   6   5.331   8.637   4.889
   48   HD23  LEU   6          HD23      LEU   6   4.505  10.168   4.604
   49    H    GLY   7           HN       GLY   7   2.857  11.537  -0.284
   50    HA2  GLY   7           HA2      GLY   7   0.392  10.669  -1.358
   51    HA3  GLY   7           HA1      GLY   7   1.738  11.325  -2.275
   52    H    VAL   8           HN       VAL   8  -0.135   8.647  -1.700
   53    HA   VAL   8           HA       VAL   8   1.815   6.864  -3.013
   54    HB   VAL   8           HB       VAL   8  -0.252   6.188  -0.922
   55   HG11  VAL   8          HG11      VAL   8  -0.235   4.371  -2.486
   56   HG12  VAL   8          HG12      VAL   8   0.649   3.877  -1.042
   57   HG13  VAL   8          HG13      VAL   8   1.528   4.343  -2.497
   58   HG21  VAL   8          HG21      VAL   8   1.715   5.459   0.381
   59   HG22  VAL   8          HG22      VAL   8   1.737   7.183   0.005
   60   HG23  VAL   8          HG23      VAL   8   2.756   6.068  -0.905
   61    H    LYS   9           HN       LYS   9   0.851   5.232  -4.410
   62    HA   LYS   9           HA       LYS   9  -1.357   6.366  -5.913
   63    HB2  LYS   9           HB2      LYS   9   0.183   3.854  -6.562
   64    HB3  LYS   9           HB1      LYS   9  -0.722   4.883  -7.664
   65    HG2  LYS   9           HG2      LYS   9   1.811   5.663  -6.234
   66    HG3  LYS   9           HG1      LYS   9   1.699   5.143  -7.916
   67    HD2  LYS   9           HD2      LYS   9   0.432   7.063  -8.513
   68    HD3  LYS   9           HD1      LYS   9   0.198   7.512  -6.821
   69    HE2  LYS   9           HE2      LYS   9   2.919   7.354  -8.095
   70    HE3  LYS   9           HE1      LYS   9   1.944   8.822  -8.122
   71    HZ1  LYS   9           HZ1      LYS   9   3.374   8.996  -6.269
   72    HZ2  LYS   9           HZ2      LYS   9   3.031   7.424  -5.745
   73    HZ3  LYS   9           HZ3      LYS   9   1.849   8.624  -5.638
   74    H    LEU  10           HN       LEU  10  -3.199   5.949  -4.788
   75    HA   LEU  10           HA       LEU  10  -3.933   3.112  -4.518
   76    HB2  LEU  10           HB2      LEU  10  -3.807   5.136  -2.457
   77    HB3  LEU  10           HB1      LEU  10  -5.451   4.558  -2.644
   78    HG   LEU  10           HG       LEU  10  -3.124   2.681  -2.247
   79   HD11  LEU  10          HD11      LEU  10  -4.667   2.835   0.095
   80   HD12  LEU  10          HD12      LEU  10  -4.266   4.493  -0.351
   81   HD13  LEU  10          HD13      LEU  10  -2.982   3.306  -0.125
   82   HD21  LEU  10          HD21      LEU  10  -5.037   1.266  -1.357
   83   HD22  LEU  10          HD22      LEU  10  -4.987   1.533  -3.099
   84   HD23  LEU  10          HD23      LEU  10  -6.113   2.449  -2.098
   85    H    ASP  11           HN       ASP  11  -6.013   2.607  -5.131
   86    HA   ASP  11           HA       ASP  11  -7.334   4.568  -6.814
   87    HB2  ASP  11           HB2      ASP  11  -7.066   1.786  -6.885
   88    HB3  ASP  11           HB1      ASP  11  -8.746   2.054  -6.439
   89    H    ASP  12           HN       ASP  12  -9.458   5.319  -6.485
   90    HA   ASP  12           HA       ASP  12 -10.231   5.778  -3.825
   91    HB2  ASP  12           HB2      ASP  12 -11.437   6.305  -6.478
   92    HB3  ASP  12           HB1      ASP  12 -12.562   6.243  -5.125
   93    HA   PRO  13           HA       PRO  13 -13.706   2.425  -4.419
   94    HB2  PRO  13           HB2      PRO  13 -13.175   0.541  -6.353
   95    HB3  PRO  13           HB1      PRO  13 -14.248   1.924  -6.580
   96    HG2  PRO  13           HG2      PRO  13 -11.398   1.580  -7.411
   97    HG3  PRO  13           HG1      PRO  13 -12.738   2.341  -8.287
   98    HD2  PRO  13           HD2      PRO  13 -10.864   3.790  -7.017
   99    HD3  PRO  13           HD1      PRO  13 -12.557   4.316  -7.103
  100    H    THR  14           HN       THR  14 -10.380   1.583  -5.274
  101    HA   THR  14           HA       THR  14 -10.379  -0.864  -3.837
  102    HB   THR  14           HB       THR  14  -8.613   0.430  -5.598
  103    HG1  THR  14           HG1      THR  14  -8.330  -2.048  -4.229
  104   HG21  THR  14          HG21      THR  14  -7.252  -0.226  -2.990
  105   HG22  THR  14          HG22      THR  14  -7.380   1.370  -3.729
  106   HG23  THR  14          HG23      THR  14  -6.434   0.107  -4.516
  107    H    ARG  15           HN       ARG  15  -9.836   2.476  -2.954
  108    HA   ARG  15           HA       ARG  15  -8.533   2.017  -0.487
  109    HB2  ARG  15           HB2      ARG  15  -8.683   4.254  -1.557
  110    HB3  ARG  15           HB1      ARG  15 -10.409   4.276  -1.221
  111    HG2  ARG  15           HG2      ARG  15  -9.956   4.205   1.169
  112    HG3  ARG  15           HG1      ARG  15  -8.221   4.175   0.844
  113    HD2  ARG  15           HD2      ARG  15  -8.492   6.352  -0.352
  114    HD3  ARG  15           HD1      ARG  15 -10.168   6.381   0.194
  115    HE   ARG  15           HE       ARG  15  -9.455   7.007   2.268
  116   HH11  ARG  15          HH21      ARG  15  -6.727   5.749   0.474
  117   HH12  ARG  15          HH22      ARG  15  -5.548   6.296   1.617
  118   HH21  ARG  15          HH11      ARG  15  -7.913   7.732   3.791
  119   HH22  ARG  15          HH12      ARG  15  -6.229   7.441   3.508
  120    H    GLU  16           HN       GLU  16 -11.903   2.207  -1.482
  121    HA   GLU  16           HA       GLU  16 -13.066   1.833   1.052
  122    HB2  GLU  16           HB2      GLU  16 -14.069   1.066  -1.701
  123    HB3  GLU  16           HB1      GLU  16 -15.051   1.007  -0.241
  124    HG2  GLU  16           HG2      GLU  16 -13.792   3.463  -1.443
  125    HG3  GLU  16           HG1      GLU  16 -15.497   3.020  -1.506
  126    H    ARG  17           HN       ARG  17 -11.793  -0.353  -1.371
  127    HA   ARG  17           HA       ARG  17 -12.588  -2.781  -0.227
  128    HB2  ARG  17           HB2      ARG  17 -11.670  -2.737  -2.469
  129    HB3  ARG  17           HB1      ARG  17 -10.128  -2.139  -1.870
  130    HG2  ARG  17           HG2      ARG  17 -10.042  -4.516  -2.415
  131    HG3  ARG  17           HG1      ARG  17  -9.742  -4.228  -0.700
  132    HD2  ARG  17           HD2      ARG  17 -12.102  -4.789  -0.230
  133    HD3  ARG  17           HD1      ARG  17 -12.334  -5.152  -1.941
  134    HE   ARG  17           HE       ARG  17 -10.945  -7.044  -1.718
  135   HH11  ARG  17          HH21      ARG  17 -11.436  -5.354   1.324
  136   HH12  ARG  17          HH22      ARG  17 -11.016  -6.721   2.304
  137   HH21  ARG  17          HH11      ARG  17 -10.374  -8.843  -0.425
  138   HH22  ARG  17          HH12      ARG  17 -10.401  -8.713   1.305
  139    H    LEU  18           HN       LEU  18  -9.817  -0.679   0.363
  140    HA   LEU  18           HA       LEU  18  -8.493  -2.312   2.221
  141    HB2  LEU  18           HB2      LEU  18  -8.474   0.585   1.569
  142    HB3  LEU  18           HB1      LEU  18  -7.860   0.135   3.147
  143    HG   LEU  18           HG       LEU  18  -6.286  -1.462   1.965
  144   HD11  LEU  18          HD11      LEU  18  -5.821  -1.012  -0.393
  145   HD12  LEU  18          HD12      LEU  18  -7.201   0.085  -0.452
  146   HD13  LEU  18          HD13      LEU  18  -7.453  -1.634  -0.152
  147   HD21  LEU  18          HD21      LEU  18  -6.113   1.510   1.530
  148   HD22  LEU  18          HD22      LEU  18  -4.782   0.402   1.199
  149   HD23  LEU  18          HD23      LEU  18  -5.411   0.559   2.839
  150    H    LYS  19           HN       LYS  19 -11.134   0.027   2.572
  151    HA   LYS  19           HA       LYS  19 -11.351  -0.051   5.364
  152    HB2  LYS  19           HB2      LYS  19 -12.590   1.623   4.216
  153    HB3  LYS  19           HB1      LYS  19 -13.391   0.433   3.202
  154    HG2  LYS  19           HG2      LYS  19 -14.951   1.275   4.814
  155    HG3  LYS  19           HG1      LYS  19 -14.592  -0.408   5.189
  156    HD2  LYS  19           HD2      LYS  19 -14.295   0.344   7.283
  157    HD3  LYS  19           HD1      LYS  19 -12.728   0.900   6.691
  158    HE2  LYS  19           HE2      LYS  19 -13.506   3.096   6.380
  159    HE3  LYS  19           HE1      LYS  19 -15.194   2.604   6.506
  160    HZ1  LYS  19           HZ1      LYS  19 -14.983   2.281   8.813
  161    HZ2  LYS  19           HZ2      LYS  19 -14.218   3.757   8.504
  162    HZ3  LYS  19           HZ3      LYS  19 -13.296   2.365   8.766
  163    H    ALA  20           HN       ALA  20 -12.871  -1.982   2.885
  164    HA   ALA  20           HA       ALA  20 -14.294  -3.737   4.540
  165    HB1  ALA  20           HB1      ALA  20 -14.765  -3.607   2.169
  166    HB2  ALA  20           HB2      ALA  20 -14.305  -5.258   2.584
  167    HB3  ALA  20           HB3      ALA  20 -13.148  -4.195   1.783
  168    H    ALA  21           HN       ALA  21 -11.000  -3.806   3.273
  169    HA   ALA  21           HA       ALA  21 -10.262  -6.346   4.260
  170    HB1  ALA  21           HB1      ALA  21  -8.995  -4.990   2.556
  171    HB2  ALA  21           HB2      ALA  21  -8.004  -5.706   3.827
  172    HB3  ALA  21           HB3      ALA  21  -8.413  -3.992   3.889
  173    H    ALA  22           HN       ALA  22 -10.158  -3.099   5.591
  174    HA   ALA  22           HA       ALA  22  -8.856  -3.624   7.998
  175    HB1  ALA  22           HB1      ALA  22 -11.069  -1.621   7.600
  176    HB2  ALA  22           HB2      ALA  22  -9.418  -1.368   7.036
  177    HB3  ALA  22           HB3      ALA  22  -9.743  -1.541   8.761
  178    H    GLN  23           HN       GLN  23 -12.196  -3.759   7.079
  179    HA   GLN  23           HA       GLN  23 -13.262  -4.449   9.601
  180    HB2  GLN  23           HB2      GLN  23 -14.305  -4.906   6.796
  181    HB3  GLN  23           HB1      GLN  23 -15.248  -5.178   8.256
  182    HG2  GLN  23           HG2      GLN  23 -14.008  -2.532   7.570
  183    HG3  GLN  23           HG1      GLN  23 -15.637  -2.987   7.075
  184   HE21  GLN  23          HE21      GLN  23 -14.444  -0.954   9.002
  185   HE22  GLN  23          HE22      GLN  23 -15.353  -1.171  10.453
  186    H    SER  24           HN       SER  24 -12.121  -6.378   6.855
  187    HA   SER  24           HA       SER  24 -12.875  -8.868   7.991
  188    HB2  SER  24           HB2      SER  24 -11.376  -9.860   6.244
  189    HB3  SER  24           HB1      SER  24 -12.593  -8.754   5.610
  190    HG   SER  24           HG       SER  24 -10.195  -7.569   6.277
  191    H    ILE  25           HN       ILE  25 -10.223  -6.768   8.603
  192    HA   ILE  25           HA       ILE  25  -8.812  -8.950   9.980
  193    HB   ILE  25           HB       ILE  25  -7.525  -7.763   8.187
  194   HG12  ILE  25          HG12      ILE  25  -5.464  -7.528   9.478
  195   HG13  ILE  25          HG11      ILE  25  -6.388  -7.431  10.972
  196   HG21  ILE  25          HG21      ILE  25  -7.940  -5.559   8.122
  197   HG22  ILE  25          HG22      ILE  25  -6.573  -5.489   9.235
  198   HG23  ILE  25          HG23      ILE  25  -8.222  -5.444   9.859
  199   HD11  ILE  25          HD11      ILE  25  -7.035  -9.698  10.820
  200   HD12  ILE  25          HD12      ILE  25  -5.302  -9.634  10.499
  201   HD13  ILE  25          HD13      ILE  25  -6.440  -9.828   9.165
  202    H    ASP  26           HN       ASP  26 -10.984  -6.679  10.567
  203    HA   ASP  26           HA       ASP  26 -11.767  -5.598  12.376
  204    HB2  ASP  26           HB2      ASP  26  -9.983  -7.600  13.762
  205    HB3  ASP  26           HB1      ASP  26 -11.032  -6.494  14.640
  206    H    ARG  27           HN       ARG  27  -9.807  -4.226  11.065
  207    HA   ARG  27           HA       ARG  27  -8.512  -2.799  13.299
  208    HB2  ARG  27           HB2      ARG  27  -7.295  -3.318  10.573
  209    HB3  ARG  27           HB1      ARG  27  -6.581  -2.316  11.830
  210    HG2  ARG  27           HG2      ARG  27  -6.428  -4.292  13.291
  211    HG3  ARG  27           HG1      ARG  27  -7.093  -5.283  11.991
  212    HD2  ARG  27           HD2      ARG  27  -5.150  -4.441  10.575
  213    HD3  ARG  27           HD1      ARG  27  -4.455  -3.840  12.078
  214    HE   ARG  27           HE       ARG  27  -4.527  -6.553  11.167
  215   HH11  ARG  27          HH21      ARG  27  -4.480  -4.573  14.044
  216   HH12  ARG  27          HH22      ARG  27  -3.723  -5.784  15.027
  217   HH21  ARG  27          HH11      ARG  27  -3.517  -8.154  12.452
  218   HH22  ARG  27          HH12      ARG  27  -3.163  -7.825  14.114
  219    H    THR  28           HN       THR  28  -8.136  -0.504  12.868
  220    HA   THR  28           HA       THR  28 -10.334   0.671  11.436
  221    HB   THR  28           HB       THR  28  -9.097   1.469  13.661
  222    HG1  THR  28           HG1      THR  28 -10.238   3.327  13.413
  223   HG21  THR  28          HG21      THR  28  -6.939   1.903  12.546
  224   HG22  THR  28          HG22      THR  28  -7.614   3.358  13.279
  225   HG23  THR  28          HG23      THR  28  -7.720   3.116  11.534
  226    HA   PRO  29           HA       PRO  29  -8.744   1.383   7.378
  227    HB2  PRO  29           HB2      PRO  29  -9.073   4.294   7.988
  228    HB3  PRO  29           HB1      PRO  29  -9.558   3.383   6.553
  229    HG2  PRO  29           HG2      PRO  29 -11.344   4.040   8.430
  230    HG3  PRO  29           HG1      PRO  29 -11.424   2.485   7.584
  231    HD2  PRO  29           HD2      PRO  29 -10.628   3.079  10.368
  232    HD3  PRO  29           HD1      PRO  29 -11.297   1.590   9.674
  233    H    HIS  30           HN       HIS  30  -7.544   3.912   9.616
  234    HA   HIS  30           HA       HIS  30  -5.170   4.392   8.185
  235    HB2  HIS  30           HB2      HIS  30  -5.908   4.923  11.060
  236    HB3  HIS  30           HB1      HIS  30  -4.365   5.419  10.361
  237    HD1  HIS  30           HD1      HIS  30  -6.654   7.409  11.385
  238    HD2  HIS  30           HD2      HIS  30  -5.866   6.334   7.442
  239    HE1  HIS  30           HE1      HIS  30  -7.611   9.260   9.981
  240    HE2  HIS  30           HE2      HIS  30  -7.340   8.475   7.604
  241    H    TRP  31           HN       TRP  31  -5.885   2.192  10.824
  242    HA   TRP  31           HA       TRP  31  -3.238   1.252  11.213
  243    HB2  TRP  31           HB2      TRP  31  -5.127   1.098  12.852
  244    HB3  TRP  31           HB1      TRP  31  -5.879  -0.094  11.814
  245    HD1  TRP  31           HD1      TRP  31  -5.808  -1.431  14.230
  246    HE1  TRP  31           HE1      TRP  31  -4.058  -3.087  15.112
  247    HE3  TRP  31           HE3      TRP  31  -1.841  -0.139  11.246
  248    HZ2  TRP  31           HZ2      TRP  31  -1.386  -3.772  14.620
  249    HZ3  TRP  31           HZ3      TRP  31   0.269  -1.360  11.527
  250    HH2  TRP  31           HH2      TRP  31   0.492  -3.139  13.178
  251    H    LEU  32           HN       LEU  32  -6.038   0.103   9.455
  252    HA   LEU  32           HA       LEU  32  -4.895  -2.198   8.361
  253    HB2  LEU  32           HB2      LEU  32  -7.304  -1.818   8.389
  254    HB3  LEU  32           HB1      LEU  32  -7.117  -0.501   7.252
  255    HG   LEU  32           HG       LEU  32  -7.969  -2.754   6.361
  256   HD11  LEU  32          HD11      LEU  32  -7.069  -2.374   4.237
  257   HD12  LEU  32          HD12      LEU  32  -5.565  -1.731   4.892
  258   HD13  LEU  32          HD13      LEU  32  -7.052  -0.793   5.019
  259   HD21  LEU  32          HD21      LEU  32  -6.283  -4.135   7.520
  260   HD22  LEU  32          HD22      LEU  32  -5.038  -3.435   6.486
  261   HD23  LEU  32          HD23      LEU  32  -6.325  -4.411   5.779
  262    H    ILE  33           HN       ILE  33  -4.983   1.098   7.165
  263    HA   ILE  33           HA       ILE  33  -3.958   0.571   4.612
  264    HB   ILE  33           HB       ILE  33  -3.717   3.042   6.334
  265   HG12  ILE  33          HG12      ILE  33  -5.297   2.580   3.800
  266   HG13  ILE  33          HG11      ILE  33  -5.959   2.306   5.408
  267   HG21  ILE  33          HG21      ILE  33  -2.828   2.652   3.481
  268   HG22  ILE  33          HG22      ILE  33  -1.809   3.049   4.865
  269   HG23  ILE  33          HG23      ILE  33  -2.993   4.217   4.277
  270   HD11  ILE  33          HD11      ILE  33  -4.829   4.945   4.539
  271   HD12  ILE  33          HD12      ILE  33  -5.831   4.593   5.948
  272   HD13  ILE  33          HD13      ILE  33  -6.522   4.498   4.328
  273    H    LYS  34           HN       LYS  34  -2.325   1.311   7.677
  274    HA   LYS  34           HA       LYS  34   0.317   1.147   6.726
  275    HB2  LYS  34           HB2      LYS  34  -0.729   0.264   9.430
  276    HB3  LYS  34           HB1      LYS  34   0.954   0.578   9.038
  277    HG2  LYS  34           HG2      LYS  34   0.426   2.930   8.653
  278    HG3  LYS  34           HG1      LYS  34  -1.266   2.607   9.048
  279    HD2  LYS  34           HD2      LYS  34  -0.537   1.800  11.278
  280    HD3  LYS  34           HD1      LYS  34   1.111   2.283  10.875
  281    HE2  LYS  34           HE2      LYS  34   0.220   4.052  12.145
  282    HE3  LYS  34           HE1      LYS  34   0.181   4.604  10.470
  283    HZ1  LYS  34           HZ1      LYS  34  -2.157   3.998  10.370
  284    HZ2  LYS  34           HZ2      LYS  34  -1.878   5.112  11.617
  285    HZ3  LYS  34           HZ3      LYS  34  -2.112   3.477  11.980
  286    H    GLN  35           HN       GLN  35  -1.881  -1.279   8.038
  287    HA   GLN  35           HA       GLN  35  -0.159  -3.491   7.812
  288    HB2  GLN  35           HB2      GLN  35  -3.152  -3.269   8.002
  289    HB3  GLN  35           HB1      GLN  35  -2.322  -4.819   7.927
  290    HG2  GLN  35           HG2      GLN  35  -1.718  -2.726   9.997
  291    HG3  GLN  35           HG1      GLN  35  -2.921  -3.996  10.223
  292   HE21  GLN  35          HE21      GLN  35   0.472  -3.279   9.928
  293   HE22  GLN  35          HE22      GLN  35   1.049  -4.810  10.481
  294    H    ALA  36           HN       ALA  36  -2.521  -2.142   5.542
  295    HA   ALA  36           HA       ALA  36  -2.605  -4.220   3.716
  296    HB1  ALA  36           HB1      ALA  36  -2.902  -2.270   2.019
  297    HB2  ALA  36           HB2      ALA  36  -2.895  -1.256   3.462
  298    HB3  ALA  36           HB3      ALA  36  -4.111  -2.521   3.278
  299    H    ILE  37           HN       ILE  37  -0.326  -1.508   3.916
  300    HA   ILE  37           HA       ILE  37   1.258  -2.642   1.790
  301    HB   ILE  37           HB       ILE  37   1.007  -0.214   1.967
  302   HG12  ILE  37          HG12      ILE  37   3.498   0.344   1.866
  303   HG13  ILE  37          HG11      ILE  37   3.777  -1.357   2.225
  304   HG21  ILE  37          HG21      ILE  37   1.052  -0.232   4.512
  305   HG22  ILE  37          HG22      ILE  37   1.845   1.106   3.682
  306   HG23  ILE  37          HG23      ILE  37   2.807  -0.209   4.353
  307   HD11  ILE  37          HD11      ILE  37   2.293  -1.833   0.205
  308   HD12  ILE  37          HD12      ILE  37   3.917  -1.218  -0.086
  309   HD13  ILE  37          HD13      ILE  37   2.531  -0.134  -0.204
  310    H    PHE  38           HN       PHE  38   1.508  -2.387   5.317
  311    HA   PHE  38           HA       PHE  38   4.166  -3.436   5.454
  312    HB2  PHE  38           HB2      PHE  38   1.997  -2.841   7.423
  313    HB3  PHE  38           HB1      PHE  38   3.245  -3.978   7.912
  314    HD1  PHE  38           HD2      PHE  38   3.809  -1.075   5.712
  315    HD2  PHE  38           HD1      PHE  38   4.214  -2.685   9.624
  316    HE1  PHE  38           HE2      PHE  38   5.275   0.800   6.327
  317    HE2  PHE  38           HE1      PHE  38   5.682  -0.815  10.246
  318    HZ   PHE  38           HZ       PHE  38   6.215   0.929   8.597
  319    H    ASN  39           HN       ASN  39   0.938  -4.843   5.842
  320    HA   ASN  39           HA       ASN  39   1.876  -7.438   6.416
  321    HB2  ASN  39           HB2      ASN  39  -0.463  -6.781   6.884
  322    HB3  ASN  39           HB1      ASN  39  -0.747  -6.637   5.153
  323   HD21  ASN  39          HD21      ASN  39  -2.431  -8.144   5.312
  324   HD22  ASN  39          HD22      ASN  39  -2.124  -9.838   5.513
  325    H    TYR  40           HN       TYR  40   1.308  -5.594   3.505
  326    HA   TYR  40           HA       TYR  40   1.466  -7.713   1.674
  327    HB2  TYR  40           HB2      TYR  40   0.829  -5.493   0.898
  328    HB3  TYR  40           HB1      TYR  40   2.379  -4.834   1.415
  329    HD1  TYR  40           HD1      TYR  40   0.979  -7.433  -0.855
  330    HD2  TYR  40           HD2      TYR  40   4.075  -4.610  -0.157
  331    HE1  TYR  40           HE1      TYR  40   1.909  -7.914  -3.076
  332    HE2  TYR  40           HE2      TYR  40   5.018  -5.081  -2.380
  333    HH   TYR  40           HH       TYR  40   4.994  -6.720  -4.090
  334    H    LEU  41           HN       LEU  41   3.871  -5.608   3.136
  335    HA   LEU  41           HA       LEU  41   6.108  -6.861   1.937
  336    HB2  LEU  41           HB2      LEU  41   5.889  -5.024   4.295
  337    HB3  LEU  41           HB1      LEU  41   7.413  -5.549   3.601
  338    HG   LEU  41           HG       LEU  41   5.293  -3.950   2.145
  339   HD11  LEU  41          HD11      LEU  41   6.453  -2.694   3.921
  340   HD12  LEU  41          HD12      LEU  41   6.820  -2.094   2.304
  341   HD13  LEU  41          HD13      LEU  41   7.995  -3.090   3.162
  342   HD21  LEU  41          HD21      LEU  41   7.165  -3.664   0.478
  343   HD22  LEU  41          HD22      LEU  41   6.445  -5.271   0.549
  344   HD23  LEU  41          HD23      LEU  41   8.003  -4.969   1.318
  345    H    GLU  42           HN       GLU  42   4.844  -6.985   5.247
  346    HA   GLU  42           HA       GLU  42   6.728  -8.741   6.326
  347    HB2  GLU  42           HB2      GLU  42   5.175  -7.332   7.644
  348    HB3  GLU  42           HB1      GLU  42   3.838  -8.351   7.138
  349    HG2  GLU  42           HG2      GLU  42   4.826 -10.244   8.302
  350    HG3  GLU  42           HG1      GLU  42   6.191  -9.240   8.789
  351    H    LYS  43           HN       LYS  43   3.665  -9.386   4.692
  352    HA   LYS  43           HA       LYS  43   3.611 -12.158   5.228
  353    HB2  LYS  43           HB2      LYS  43   1.637 -10.916   4.533
  354    HB3  LYS  43           HB1      LYS  43   2.378 -10.580   2.978
  355    HG2  LYS  43           HG2      LYS  43   2.170 -12.800   2.277
  356    HG3  LYS  43           HG1      LYS  43   1.824 -13.373   3.911
  357    HD2  LYS  43           HD2      LYS  43  -0.200 -13.280   2.507
  358    HD3  LYS  43           HD1      LYS  43  -0.307 -12.203   3.899
  359    HE2  LYS  43           HE2      LYS  43   0.665 -11.176   1.257
  360    HE3  LYS  43           HE1      LYS  43  -1.062 -11.356   1.560
  361    HZ1  LYS  43           HZ1      LYS  43  -0.510  -9.155   2.147
  362    HZ2  LYS  43           HZ2      LYS  43   0.866  -9.626   3.013
  363    HZ3  LYS  43           HZ3      LYS  43  -0.674  -9.977   3.616
  364    H    LEU  44           HN       LEU  44   5.029 -10.272   2.564
  365    HA   LEU  44           HA       LEU  44   5.842 -12.733   1.273
  366    HB2  LEU  44           HB2      LEU  44   6.777 -11.376  -0.498
  367    HB3  LEU  44           HB1      LEU  44   5.121 -10.922  -0.168
  368    HG   LEU  44           HG       LEU  44   6.352  -9.054   1.313
  369   HD11  LEU  44          HD11      LEU  44   8.350  -8.262   0.251
  370   HD12  LEU  44          HD12      LEU  44   8.251  -9.520  -0.980
  371   HD13  LEU  44          HD13      LEU  44   8.592  -9.952   0.695
  372   HD21  LEU  44          HD21      LEU  44   6.043  -8.864  -1.683
  373   HD22  LEU  44          HD22      LEU  44   6.000  -7.535  -0.525
  374   HD23  LEU  44          HD23      LEU  44   4.714  -8.741  -0.532
  375    H    GLU  45           HN       GLU  45   7.082 -10.628   3.637
  376    HA   GLU  45           HA       GLU  45   9.430 -12.228   3.901
  377    HB2  GLU  45           HB2      GLU  45  11.078 -10.395   3.681
  378    HB3  GLU  45           HB1      GLU  45  10.285 -10.771   2.161
  379    HG2  GLU  45           HG2      GLU  45   9.685  -8.653   1.927
  380    HG3  GLU  45           HG1      GLU  45   8.814  -8.707   3.457
  381    H1   MET  46           HT1      MET  46  -6.667   0.392 -13.019
  382    H2   MET  46           HT2      MET  46  -5.318  -0.521 -13.475
  383    H3   MET  46           HT3      MET  46  -5.833   0.771 -14.440
  384    HA   MET  46           HA       MET  46  -4.768   1.002 -11.685
  385    HB2  MET  46           HB2      MET  46  -3.547   1.558 -14.387
  386    HB3  MET  46           HB1      MET  46  -2.935   2.298 -12.919
  387    HG2  MET  46           HG2      MET  46  -2.470   0.070 -12.009
  388    HG3  MET  46           HG1      MET  46  -3.046  -0.648 -13.515
  389    HE1  MET  46           HE1      MET  46  -0.395   0.414 -16.115
  390    HE2  MET  46           HE2      MET  46  -2.099   0.775 -15.836
  391    HE3  MET  46           HE3      MET  46  -1.515  -0.884 -15.704
  392    H    ALA  47           HN       ALA  47  -6.602   2.339 -11.103
  393    HA   ALA  47           HA       ALA  47  -6.621   4.953 -12.475
  394    HB1  ALA  47           HB1      ALA  47  -8.766   3.558 -10.874
  395    HB2  ALA  47           HB2      ALA  47  -8.789   3.944 -12.596
  396    HB3  ALA  47           HB3      ALA  47  -8.870   5.238 -11.400
  397    H    THR  48           HN       THR  48  -4.845   3.823 -10.382
  398    HA   THR  48           HA       THR  48  -5.373   4.980  -7.869
  399    HB   THR  48           HB       THR  48  -2.966   4.547  -7.436
  400    HG1  THR  48           HG1      THR  48  -2.638   4.927  -9.909
  401   HG21  THR  48          HG21      THR  48  -4.686   2.747  -7.238
  402   HG22  THR  48          HG22      THR  48  -3.068   2.151  -7.609
  403   HG23  THR  48          HG23      THR  48  -4.284   2.250  -8.882
  404    H    THR  49           HN       THR  49  -5.062   6.952  -7.129
  405    HA   THR  49           HA       THR  49  -3.522   8.866  -8.757
  406    HB   THR  49           HB       THR  49  -5.747   9.517  -6.805
  407    HG1  THR  49           HG1      THR  49  -6.450   8.276  -8.669
  408   HG21  THR  49          HG21      THR  49  -4.299  11.141  -8.899
  409   HG22  THR  49          HG22      THR  49  -4.357  11.431  -7.160
  410   HG23  THR  49          HG23      THR  49  -5.806  11.653  -8.140
  411    H    THR  50           HN       THR  50  -2.604  10.715  -7.295
  412    HA   THR  50           HA       THR  50  -1.028   9.468  -5.232
  413    HB   THR  50           HB       THR  50  -0.318  12.049  -5.059
  414    HG1  THR  50           HG1      THR  50  -0.720  13.145  -6.917
  415   HG21  THR  50          HG21      THR  50   1.180  10.240  -5.690
  416   HG22  THR  50          HG22      THR  50   1.378  11.609  -6.785
  417   HG23  THR  50          HG23      THR  50   0.466  10.190  -7.301
  418    H    LEU  51           HN       LEU  51  -2.282   9.038  -3.413
  419    HA   LEU  51           HA       LEU  51  -3.464  11.409  -2.112
  420    HB2  LEU  51           HB2      LEU  51  -4.725   9.206  -0.974
  421    HB3  LEU  51           HB1      LEU  51  -5.429  10.379  -2.066
  422    HG   LEU  51           HG       LEU  51  -3.994   8.086  -3.298
  423   HD11  LEU  51          HD11      LEU  51  -5.990   6.665  -3.067
  424   HD12  LEU  51          HD12      LEU  51  -6.690   7.850  -1.964
  425   HD13  LEU  51          HD13      LEU  51  -5.219   6.988  -1.514
  426   HD21  LEU  51          HD21      LEU  51  -6.603   9.478  -3.901
  427   HD22  LEU  51          HD22      LEU  51  -5.792   8.287  -4.918
  428   HD23  LEU  51          HD23      LEU  51  -5.047   9.860  -4.638
  429    H    GLY  52           HN       GLY  52  -3.527  11.317   0.248
  430    HA2  GLY  52           HA2      GLY  52  -0.991  10.636   1.316
  431    HA3  GLY  52           HA1      GLY  52  -2.373  11.216   2.230
  432    H    VAL  53           HN       VAL  53  -0.347   8.642   1.646
  433    HA   VAL  53           HA       VAL  53  -2.178   6.759   2.991
  434    HB   VAL  53           HB       VAL  53  -0.063   6.189   0.917
  435   HG11  VAL  53          HG11      VAL  53   0.009   4.385   2.491
  436   HG12  VAL  53          HG12      VAL  53  -0.841   3.833   1.048
  437   HG13  VAL  53          HG13      VAL  53  -1.749   4.263   2.496
  438   HG21  VAL  53          HG21      VAL  53  -1.979   5.343  -0.395
  439   HG22  VAL  53          HG22      VAL  53  -2.095   7.066  -0.035
  440   HG23  VAL  53          HG23      VAL  53  -3.060   5.907   0.879
  441    H    LYS  54           HN       LYS  54  -1.114   5.195   4.398
  442    HA   LYS  54           HA       LYS  54   1.011   6.484   5.901
  443    HB2  LYS  54           HB2      LYS  54  -0.377   3.892   6.578
  444    HB3  LYS  54           HB1      LYS  54   0.462   4.988   7.669
  445    HG2  LYS  54           HG2      LYS  54  -2.105   5.608   6.220
  446    HG3  LYS  54           HG1      LYS  54  -1.980   5.095   7.903
  447    HD2  LYS  54           HD2      LYS  54  -0.866   7.087   8.524
  448    HD3  LYS  54           HD1      LYS  54  -0.582   7.537   6.840
  449    HE2  LYS  54           HE2      LYS  54  -3.334   7.265   8.028
  450    HE3  LYS  54           HE1      LYS  54  -2.436   8.782   8.022
  451    HZ1  LYS  54           HZ1      LYS  54  -3.843   8.788   6.130
  452    HZ2  LYS  54           HZ2      LYS  54  -3.362   7.234   5.665
  453    HZ3  LYS  54           HZ3      LYS  54  -2.274   8.521   5.556
  454    H    LEU  55           HN       LEU  55   2.876   6.162   4.780
  455    HA   LEU  55           HA       LEU  55   3.771   3.369   4.546
  456    HB2  LEU  55           HB2      LEU  55   3.541   5.364   2.466
  457    HB3  LEU  55           HB1      LEU  55   5.213   4.873   2.661
  458    HG   LEU  55           HG       LEU  55   2.987   2.874   2.282
  459   HD11  LEU  55          HD11      LEU  55   4.522   3.090  -0.063
  460   HD12  LEU  55          HD12      LEU  55   4.027   4.726   0.368
  461   HD13  LEU  55          HD13      LEU  55   2.812   3.465   0.153
  462   HD21  LEU  55          HD21      LEU  55   4.974   1.553   1.404
  463   HD22  LEU  55          HD22      LEU  55   4.907   1.833   3.143
  464   HD23  LEU  55          HD23      LEU  55   5.984   2.799   2.135
  465    H    ASP  56           HN       ASP  56   5.869   2.983   5.166
  466    HA   ASP  56           HA       ASP  56   7.080   5.018   6.841
  467    HB2  ASP  56           HB2      ASP  56   6.969   2.229   6.924
  468    HB3  ASP  56           HB1      ASP  56   8.626   2.581   6.454
  469    H    ASP  57           HN       ASP  57   9.166   5.878   6.509
  470    HA   ASP  57           HA       ASP  57   9.895   6.373   3.840
  471    HB2  ASP  57           HB2      ASP  57  10.994   7.052   6.482
  472    HB3  ASP  57           HB1      ASP  57  12.204   6.941   5.209
  473    HA   PRO  58           HA       PRO  58  13.567   3.233   4.447
  474    HB2  PRO  58           HB2      PRO  58  13.158   1.344   6.406
  475    HB3  PRO  58           HB1      PRO  58  14.149   2.792   6.612
  476    HG2  PRO  58           HG2      PRO  58  11.326   2.290   7.456
  477    HG3  PRO  58           HG1      PRO  58  12.623   3.134   8.322
  478    HD2  PRO  58           HD2      PRO  58  10.669   4.467   7.048
  479    HD3  PRO  58           HD1      PRO  58  12.333   5.084   7.114
  480    H    THR  59           HN       THR  59  10.291   2.222   5.312
  481    HA   THR  59           HA       THR  59  10.442  -0.248   3.916
  482    HB   THR  59           HB       THR  59   8.616   0.917   5.683
  483    HG1  THR  59           HG1      THR  59   8.175  -1.512   4.305
  484   HG21  THR  59          HG21      THR  59   7.267   0.255   3.068
  485   HG22  THR  59          HG22      THR  59   7.333   1.843   3.833
  486   HG23  THR  59          HG23      THR  59   6.446   0.528   4.604
  487    H    ARG  60           HN       ARG  60   9.713   3.037   2.992
  488    HA   ARG  60           HA       ARG  60   8.429   2.473   0.535
  489    HB2  ARG  60           HB2      ARG  60   8.460   4.732   1.577
  490    HB3  ARG  60           HB1      ARG  60  10.180   4.846   1.223
  491    HG2  ARG  60           HG2      ARG  60   9.705   4.706  -1.162
  492    HG3  ARG  60           HG1      ARG  60   7.978   4.585  -0.813
  493    HD2  ARG  60           HD2      ARG  60   8.132   6.793   0.334
  494    HD3  ARG  60           HD1      ARG  60   9.801   6.911  -0.221
  495    HE   ARG  60           HE       ARG  60   9.046   7.427  -2.315
  496   HH11  ARG  60          HH21      ARG  60   6.391   6.139  -0.443
  497   HH12  ARG  60          HH22      ARG  60   5.178   6.608  -1.585
  498   HH21  ARG  60          HH11      ARG  60   7.459   8.051  -3.839
  499   HH22  ARG  60          HH12      ARG  60   5.790   7.713  -3.522
  500    H    GLU  61           HN       GLU  61  11.784   2.864   1.531
  501    HA   GLU  61           HA       GLU  61  12.980   2.519  -0.991
  502    HB2  GLU  61           HB2      GLU  61  14.016   1.774   1.756
  503    HB3  GLU  61           HB1      GLU  61  14.997   1.826   0.297
  504    HG2  GLU  61           HG2      GLU  61  13.584   4.152   1.578
  505    HG3  GLU  61           HG1      GLU  61  15.315   3.821   1.621
  506    H    ARG  62           HN       ARG  62  11.808   0.289   1.443
  507    HA   ARG  62           HA       ARG  62  12.726  -2.104   0.319
  508    HB2  ARG  62           HB2      ARG  62  11.806  -2.092   2.561
  509    HB3  ARG  62           HB1      ARG  62  10.239  -1.570   1.959
  510    HG2  ARG  62           HG2      ARG  62  10.252  -3.941   2.518
  511    HG3  ARG  62           HG1      ARG  62   9.957  -3.683   0.797
  512    HD2  ARG  62           HD2      ARG  62  12.346  -4.139   0.358
  513    HD3  ARG  62           HD1      ARG  62  12.573  -4.481   2.073
  514    HE   ARG  62           HE       ARG  62  11.296  -6.441   1.847
  515   HH11  ARG  62          HH21      ARG  62  11.665  -4.725  -1.195
  516   HH12  ARG  62          HH22      ARG  62  11.270  -6.101  -2.172
  517   HH21  ARG  62          HH11      ARG  62  10.762  -8.251   0.563
  518   HH22  ARG  62          HH12      ARG  62  10.738  -8.115  -1.166
  519    H    LEU  63           HN       LEU  63   9.858  -0.142  -0.295
  520    HA   LEU  63           HA       LEU  63   8.617  -1.864  -2.136
  521    HB2  LEU  63           HB2      LEU  63   8.447   1.032  -1.508
  522    HB3  LEU  63           HB1      LEU  63   7.859   0.540  -3.084
  523    HG   LEU  63           HG       LEU  63   6.371  -1.129  -1.892
  524   HD11  LEU  63          HD11      LEU  63   5.879  -0.689   0.460
  525   HD12  LEU  63          HD12      LEU  63   7.197   0.481   0.515
  526   HD13  LEU  63          HD13      LEU  63   7.542  -1.223   0.226
  527   HD21  LEU  63          HD21      LEU  63   6.038   1.833  -1.481
  528   HD22  LEU  63          HD22      LEU  63   4.769   0.658  -1.141
  529   HD23  LEU  63          HD23      LEU  63   5.389   0.834  -2.782
  530    H    LYS  64           HN       LYS  64  11.130   0.615  -2.507
  531    HA   LYS  64           HA       LYS  64  11.354   0.520  -5.298
  532    HB2  LYS  64           HB2      LYS  64  12.501   2.270  -4.179
  533    HB3  LYS  64           HB1      LYS  64  13.356   1.144  -3.137
  534    HG2  LYS  64           HG2      LYS  64  14.891   2.021  -4.743
  535    HG3  LYS  64           HG1      LYS  64  14.601   0.324  -5.116
  536    HD2  LYS  64           HD2      LYS  64  14.308   1.075  -7.216
  537    HD3  LYS  64           HD1      LYS  64  12.703   1.534  -6.644
  538    HE2  LYS  64           HE2      LYS  64  13.337   3.770  -6.326
  539    HE3  LYS  64           HE1      LYS  64  15.055   3.384  -6.406
  540    HZ1  LYS  64           HZ1      LYS  64  14.938   3.069  -8.714
  541    HZ2  LYS  64           HZ2      LYS  64  14.047   4.477  -8.426
  542    HZ3  LYS  64           HZ3      LYS  64  13.246   3.017  -8.722
  543    H    ALA  65           HN       ALA  65  12.956  -1.313  -2.798
  544    HA   ALA  65           HA       ALA  65  14.477  -3.002  -4.437
  545    HB1  ALA  65           HB1      ALA  65  14.937  -2.828  -2.067
  546    HB2  ALA  65           HB2      ALA  65  14.567  -4.505  -2.469
  547    HB3  ALA  65           HB3      ALA  65  13.353  -3.499  -1.678
  548    H    ALA  66           HN       ALA  66  11.191  -3.233  -3.177
  549    HA   ALA  66           HA       ALA  66  10.592  -5.816  -4.144
  550    HB1  ALA  66           HB1      ALA  66   9.247  -4.514  -2.457
  551    HB2  ALA  66           HB2      ALA  66   8.302  -5.293  -3.725
  552    HB3  ALA  66           HB3      ALA  66   8.619  -3.560  -3.801
  553    H    ALA  67           HN       ALA  67  10.323  -2.589  -5.494
  554    HA   ALA  67           HA       ALA  67   9.064  -3.192  -7.902
  555    HB1  ALA  67           HB1      ALA  67  11.170  -1.074  -7.509
  556    HB2  ALA  67           HB2      ALA  67   9.506  -0.909  -6.951
  557    HB3  ALA  67           HB3      ALA  67   9.843  -1.072  -8.673
  558    H    GLN  68           HN       GLN  68  12.400  -3.168  -6.975
  559    HA   GLN  68           HA       GLN  68  13.498  -3.813  -9.498
  560    HB2  GLN  68           HB2      GLN  68  14.585  -4.206  -6.697
  561    HB3  GLN  68           HB1      GLN  68  15.527  -4.405  -8.171
  562    HG2  GLN  68           HG2      GLN  68  14.124  -1.850  -7.458
  563    HG3  GLN  68           HG1      GLN  68  15.783  -2.199  -6.978
  564   HE21  GLN  68          HE21      GLN  68  14.437  -0.243  -8.882
  565   HE22  GLN  68          HE22      GLN  68  15.345  -0.389 -10.343
  566    H    SER  69           HN       SER  69  12.475  -5.773  -6.730
  567    HA   SER  69           HA       SER  69  13.359  -8.228  -7.843
  568    HB2  SER  69           HB2      SER  69  11.913  -9.280  -6.083
  569    HB3  SER  69           HB1      SER  69  13.074  -8.107  -5.464
  570    HG   SER  69           HG       SER  69  10.630  -7.035  -6.133
  571    H    ILE  70           HN       ILE  70  10.598  -6.279  -8.476
  572    HA   ILE  70           HA       ILE  70   9.306  -8.547  -9.832
  573    HB   ILE  70           HB       ILE  70   7.953  -7.408  -8.059
  574   HG12  ILE  70          HG12      ILE  70   5.888  -7.292  -9.361
  575   HG13  ILE  70          HG11      ILE  70   6.813  -7.166 -10.852
  576   HG21  ILE  70          HG21      ILE  70   8.260  -5.185  -8.019
  577   HG22  ILE  70          HG22      ILE  70   6.891  -5.197  -9.131
  578   HG23  ILE  70          HG23      ILE  70   8.535  -5.076  -9.756
  579   HD11  ILE  70          HD11      ILE  70   7.571  -9.396 -10.670
  580   HD12  ILE  70          HD12      ILE  70   5.836  -9.415 -10.353
  581   HD13  ILE  70          HD13      ILE  70   6.978  -9.534  -9.015
  582    H    ASP  71           HN       ASP  71  11.342  -6.149 -10.434
  583    HA   ASP  71           HA       ASP  71  12.089  -5.065 -12.254
  584    HB2  ASP  71           HB2      ASP  71  10.402  -7.150 -13.633
  585    HB3  ASP  71           HB1      ASP  71  11.395  -5.997 -14.517
  586    H    ARG  72           HN       ARG  72  10.047  -3.783 -10.955
  587    HA   ARG  72           HA       ARG  72   8.691  -2.435 -13.205
  588    HB2  ARG  72           HB2      ARG  72   7.492  -2.997 -10.480
  589    HB3  ARG  72           HB1      ARG  72   6.730  -2.046 -11.748
  590    HG2  ARG  72           HG2      ARG  72   6.695  -4.040 -13.193
  591    HG3  ARG  72           HG1      ARG  72   7.400  -4.983 -11.878
  592    HD2  ARG  72           HD2      ARG  72   5.413  -4.269 -10.481
  593    HD3  ARG  72           HD1      ARG  72   4.699  -3.655 -11.970
  594    HE   ARG  72           HE       ARG  72   4.769  -6.353 -11.110
  595   HH11  ARG  72          HH21      ARG  72   5.001  -4.413 -14.012
  596   HH12  ARG  72          HH22      ARG  72   4.432  -5.670 -15.059
  597   HH21  ARG  72          HH11      ARG  72   4.001  -8.012 -12.482
  598   HH22  ARG  72          HH12      ARG  72   3.862  -7.722 -14.184
  599    H    THR  73           HN       THR  73   8.207  -0.165 -12.811
  600    HA   THR  73           HA       THR  73  10.325   1.134 -11.374
  601    HB   THR  73           HB       THR  73   9.077   1.858 -13.607
  602    HG1  THR  73           HG1      THR  73  10.274   3.608 -13.379
  603   HG21  THR  73          HG21      THR  73   6.870   2.142 -12.534
  604   HG22  THR  73          HG22      THR  73   7.457   3.640 -13.254
  605   HG23  THR  73          HG23      THR  73   7.547   3.404 -11.508
  606    HA   PRO  74           HA       PRO  74   8.688   1.798  -7.327
  607    HB2  PRO  74           HB2      PRO  74   8.844   4.720  -7.956
  608    HB3  PRO  74           HB1      PRO  74   9.382   3.848  -6.515
  609    HG2  PRO  74           HG2      PRO  74  11.129   4.598  -8.391
  610    HG3  PRO  74           HG1      PRO  74  11.296   3.051  -7.544
  611    HD2  PRO  74           HD2      PRO  74  10.455   3.597 -10.328
  612    HD3  PRO  74           HD1      PRO  74  11.226   2.155  -9.639
  613    H    HIS  75           HN       HIS  75   7.344   4.240  -9.581
  614    HA   HIS  75           HA       HIS  75   4.942   4.582  -8.157
  615    HB2  HIS  75           HB2      HIS  75   5.641   5.126 -11.039
  616    HB3  HIS  75           HB1      HIS  75   4.075   5.535 -10.339
  617    HD1  HIS  75           HD1      HIS  75   6.211   7.637 -11.408
  618    HD2  HIS  75           HD2      HIS  75   5.534   6.582  -7.441
  619    HE1  HIS  75           HE1      HIS  75   7.065   9.572 -10.046
  620    HE2  HIS  75           HE2      HIS  75   6.852   8.818  -7.650
  621    H    TRP  76           HN       TRP  76   5.786   2.418 -10.785
  622    HA   TRP  76           HA       TRP  76   3.201   1.323 -11.168
  623    HB2  TRP  76           HB2      TRP  76   5.096   1.256 -12.806
  624    HB3  TRP  76           HB1      TRP  76   5.915   0.122 -11.755
  625    HD1  TRP  76           HD1      TRP  76   5.928  -1.257 -14.143
  626    HE1  TRP  76           HE1      TRP  76   4.275  -3.019 -15.009
  627    HE3  TRP  76           HE3      TRP  76   1.878  -0.133 -11.202
  628    HZ2  TRP  76           HZ2      TRP  76   1.638  -3.836 -14.520
  629    HZ3  TRP  76           HZ3      TRP  76  -0.163  -1.469 -11.475
  630    HH2  TRP  76           HH2      TRP  76  -0.280  -3.282 -13.098
  631    H    LEU  77           HN       LEU  77   6.053   0.347  -9.391
  632    HA   LEU  77           HA       LEU  77   5.036  -2.005  -8.279
  633    HB2  LEU  77           HB2      LEU  77   7.421  -1.494  -8.307
  634    HB3  LEU  77           HB1      LEU  77   7.160  -0.179  -7.182
  635    HG   LEU  77           HG       LEU  77   8.127  -2.376  -6.269
  636   HD11  LEU  77          HD11      LEU  77   7.205  -2.028  -4.154
  637   HD12  LEU  77          HD12      LEU  77   5.669  -1.473  -4.814
  638   HD13  LEU  77          HD13      LEU  77   7.103  -0.456  -4.947
  639   HD21  LEU  77          HD21      LEU  77   6.520  -3.856  -7.421
  640   HD22  LEU  77          HD22      LEU  77   5.236  -3.216  -6.395
  641   HD23  LEU  77          HD23      LEU  77   6.573  -4.115  -5.678
  642    H    ILE  78           HN       ILE  78   4.940   1.303  -7.116
  643    HA   ILE  78           HA       ILE  78   3.939   0.741  -4.560
  644    HB   ILE  78           HB       ILE  78   3.567   3.182  -6.305
  645   HG12  ILE  78          HG12      ILE  78   5.170   2.831  -3.765
  646   HG13  ILE  78          HG11      ILE  78   5.845   2.578  -5.371
  647   HG21  ILE  78          HG21      ILE  78   2.695   2.772  -3.449
  648   HG22  ILE  78          HG22      ILE  78   1.662   3.099  -4.841
  649   HG23  ILE  78          HG23      ILE  78   2.778   4.335  -4.263
  650   HD11  ILE  78          HD11      ILE  78   4.572   5.159  -4.530
  651   HD12  ILE  78          HD12      ILE  78   5.594   4.849  -5.935
  652   HD13  ILE  78          HD13      ILE  78   6.285   4.808  -4.313
  653    H    LYS  79           HN       LYS  79   2.276   1.364  -7.632
  654    HA   LYS  79           HA       LYS  79  -0.357   1.068  -6.681
  655    HB2  LYS  79           HB2      LYS  79   0.747   0.222  -9.375
  656    HB3  LYS  79           HB1      LYS  79  -0.952   0.446  -8.993
  657    HG2  LYS  79           HG2      LYS  79  -0.553   2.827  -8.623
  658    HG3  LYS  79           HG1      LYS  79   1.155   2.592  -9.012
  659    HD2  LYS  79           HD2      LYS  79   0.481   1.738 -11.238
  660    HD3  LYS  79           HD1      LYS  79  -1.195   2.127 -10.848
  661    HE2  LYS  79           HE2      LYS  79  -0.366   3.929 -12.135
  662    HE3  LYS  79           HE1      LYS  79  -0.428   4.497 -10.467
  663    HZ1  LYS  79           HZ1      LYS  79   1.927   4.111 -10.264
  664    HZ2  LYS  79           HZ2      LYS  79   1.634   5.115 -11.597
  665    HZ3  LYS  79           HZ3      LYS  79   2.002   3.482 -11.832
  666    H    GLN  80           HN       GLN  80   1.973  -1.245  -7.967
  667    HA   GLN  80           HA       GLN  80   0.376  -3.548  -7.723
  668    HB2  GLN  80           HB2      GLN  80   3.352  -3.161  -7.909
  669    HB3  GLN  80           HB1      GLN  80   2.611  -4.754  -7.822
  670    HG2  GLN  80           HG2      GLN  80   1.887  -2.720  -9.913
  671    HG3  GLN  80           HG1      GLN  80   3.171  -3.911 -10.126
  672   HE21  GLN  80          HE21      GLN  80  -0.261  -3.411  -9.854
  673   HE22  GLN  80          HE22      GLN  80  -0.736  -4.984 -10.392
  674    H    ALA  81           HN       ALA  81   2.642  -2.037  -5.461
  675    HA   ALA  81           HA       ALA  81   2.848  -4.098  -3.620
  676    HB1  ALA  81           HB1      ALA  81   3.037  -2.119  -1.940
  677    HB2  ALA  81           HB2      ALA  81   2.978  -1.121  -3.393
  678    HB3  ALA  81           HB3      ALA  81   4.258  -2.318  -3.197
  679    H    ILE  82           HN       ILE  82   0.424  -1.520  -3.847
  680    HA   ILE  82           HA       ILE  82  -1.098  -2.718  -1.710
  681    HB   ILE  82           HB       ILE  82  -0.979  -0.282  -1.910
  682   HG12  ILE  82          HG12      ILE  82  -3.496   0.139  -1.816
  683   HG13  ILE  82          HG11      ILE  82  -3.682  -1.577  -2.160
  684   HG21  ILE  82          HG21      ILE  82  -1.020  -0.330  -4.457
  685   HG22  ILE  82          HG22      ILE  82  -1.883   0.973  -3.640
  686   HG23  ILE  82          HG23      ILE  82  -2.775  -0.397  -4.296
  687   HD11  ILE  82          HD11      ILE  82  -2.176  -1.954  -0.135
  688   HD12  ILE  82          HD12      ILE  82  -3.833  -1.427   0.148
  689   HD13  ILE  82          HD13      ILE  82  -2.509  -0.268   0.259
  690    H    PHE  83           HN       PHE  83  -1.353  -2.509  -5.240
  691    HA   PHE  83           HA       PHE  83  -3.949  -3.704  -5.372
  692    HB2  PHE  83           HB2      PHE  83  -1.812  -3.008  -7.343
  693    HB3  PHE  83           HB1      PHE  83  -2.993  -4.218  -7.822
  694    HD1  PHE  83           HD2      PHE  83  -3.719  -1.326  -5.653
  695    HD2  PHE  83           HD1      PHE  83  -4.039  -3.004  -9.545
  696    HE1  PHE  83           HE2      PHE  83  -5.290   0.454  -6.286
  697    HE2  PHE  83           HE1      PHE  83  -5.612  -1.228 -10.185
  698    HZ   PHE  83           HZ       PHE  83  -6.239   0.503  -8.555
  699    H    ASN  84           HN       ASN  84  -0.645  -4.936  -5.738
  700    HA   ASN  84           HA       ASN  84  -1.442  -7.583  -6.288
  701    HB2  ASN  84           HB2      ASN  84   0.855  -6.807  -6.768
  702    HB3  ASN  84           HB1      ASN  84   1.134  -6.619  -5.042
  703   HD21  ASN  84          HD21      ASN  84   2.902  -8.016  -5.181
  704   HD22  ASN  84          HD22      ASN  84   2.704  -9.729  -5.357
  705    H    TYR  85           HN       TYR  85  -0.975  -5.682  -3.394
  706    HA   TYR  85           HA       TYR  85  -1.025  -7.789  -1.542
  707    HB2  TYR  85           HB2      TYR  85  -0.508  -5.535  -0.784
  708    HB3  TYR  85           HB1      TYR  85  -2.089  -4.960  -1.309
  709    HD1  TYR  85           HD1      TYR  85  -0.559  -7.467   0.984
  710    HD2  TYR  85           HD2      TYR  85  -3.799  -4.816   0.259
  711    HE1  TYR  85           HE1      TYR  85  -1.467  -7.979   3.206
  712    HE2  TYR  85           HE2      TYR  85  -4.719  -5.319   2.485
  713    HH   TYR  85           HH       TYR  85  -4.596  -6.803   4.243
  714    H    LEU  86           HN       LEU  86  -3.532  -5.836  -3.037
  715    HA   LEU  86           HA       LEU  86  -5.701  -7.192  -1.829
  716    HB2  LEU  86           HB2      LEU  86  -5.572  -5.372  -4.206
  717    HB3  LEU  86           HB1      LEU  86  -7.069  -5.976  -3.518
  718    HG   LEU  86           HG       LEU  86  -5.057  -4.240  -2.064
  719   HD11  LEU  86          HD11      LEU  86  -6.285  -3.074  -3.859
  720   HD12  LEU  86          HD12      LEU  86  -6.690  -2.480  -2.249
  721   HD13  LEU  86          HD13      LEU  86  -7.802  -3.553  -3.098
  722   HD21  LEU  86          HD21      LEU  86  -6.948  -4.052  -0.406
  723   HD22  LEU  86          HD22      LEU  86  -6.138  -5.617  -0.462
  724   HD23  LEU  86          HD23      LEU  86  -7.707  -5.409  -1.239
  725    H    GLU  87           HN       GLU  87  -4.436  -7.281  -5.139
  726    HA   GLU  87           HA       GLU  87  -6.206  -9.152  -6.209
  727    HB2  GLU  87           HB2      GLU  87  -4.742  -7.696  -7.548
  728    HB3  GLU  87           HB1      GLU  87  -3.336  -8.579  -6.980
  729    HG2  GLU  87           HG2      GLU  87  -4.141 -10.590  -8.104
  730    HG3  GLU  87           HG1      GLU  87  -5.556  -9.705  -8.673
  731    H    LYS  88           HN       LYS  88  -3.117  -9.622  -4.571
  732    HA   LYS  88           HA       LYS  88  -2.916 -12.392  -5.066
  733    HB2  LYS  88           HB2      LYS  88  -1.012 -11.040  -4.378
  734    HB3  LYS  88           HB1      LYS  88  -1.775 -10.725  -2.830
  735    HG2  LYS  88           HG2      LYS  88  -1.454 -12.924  -2.101
  736    HG3  LYS  88           HG1      LYS  88  -1.074 -13.497  -3.727
  737    HD2  LYS  88           HD2      LYS  88   0.937 -13.277  -2.307
  738    HD3  LYS  88           HD1      LYS  88   0.996 -12.234  -3.728
  739    HE2  LYS  88           HE2      LYS  88  -0.040 -11.184  -1.120
  740    HE3  LYS  88           HE1      LYS  88   1.695 -11.291  -1.407
  741    HZ1  LYS  88           HZ1      LYS  88   1.054  -9.137  -2.061
  742    HZ2  LYS  88           HZ2      LYS  88  -0.302  -9.689  -2.911
  743    HZ3  LYS  88           HZ3      LYS  88   1.252  -9.991  -3.508
  744    H    LEU  89           HN       LEU  89  -4.450 -10.552  -2.433
  745    HA   LEU  89           HA       LEU  89  -5.143 -13.038  -1.115
  746    HB2  LEU  89           HB2      LEU  89  -6.133 -11.716   0.648
  747    HB3  LEU  89           HB1      LEU  89  -4.507 -11.171   0.305
  748    HG   LEU  89           HG       LEU  89  -5.845  -9.385  -1.181
  749   HD11  LEU  89          HD11      LEU  89  -7.884  -8.699  -0.123
  750   HD12  LEU  89          HD12      LEU  89  -7.715  -9.942   1.116
  751   HD13  LEU  89          HD13      LEU  89  -8.033 -10.402  -0.556
  752   HD21  LEU  89          HD21      LEU  89  -5.551  -9.160   1.814
  753   HD22  LEU  89          HD22      LEU  89  -5.577  -7.838   0.646
  754   HD23  LEU  89          HD23      LEU  89  -4.228  -8.973   0.664
  755    H    GLU  90           HN       GLU  90  -6.481 -10.963  -3.464
  756    HA   GLU  90           HA       GLU  90  -8.728 -12.681  -3.803
  757    HB2  GLU  90           HB2      GLU  90 -10.495 -10.995  -3.509
  758    HB3  GLU  90           HB1      GLU  90  -9.659 -11.319  -2.002
  759    HG2  GLU  90           HG2      GLU  90  -9.262  -9.159  -1.750
  760    HG3  GLU  90           HG1      GLU  90  -8.358  -9.136  -3.261
  Start of MODEL   27
    1    H1   MET   1           HT1      MET   1   3.595   1.061  11.319
    2    H2   MET   1           HT2      MET   1   2.337   2.038  11.885
    3    H3   MET   1           HT3      MET   1   2.278   0.365  12.119
    4    HA   MET   1           HA       MET   1   2.870   1.427  14.169
    5    HB2  MET   1           HB2      MET   1   5.450   0.290  13.119
    6    HB3  MET   1           HB1      MET   1   4.740   0.115  14.716
    7    HG2  MET   1           HG2      MET   1   4.540  -1.979  13.662
    8    HG3  MET   1           HG1      MET   1   2.931  -1.260  13.648
    9    HE1  MET   1           HE1      MET   1   5.993  -2.447  11.469
   10    HE2  MET   1           HE2      MET   1   6.133  -0.689  11.453
   11    HE3  MET   1           HE3      MET   1   5.713  -1.553   9.975
   12    H    ALA   2           HN       ALA   2   5.587   1.877  11.895
   13    HA   ALA   2           HA       ALA   2   5.993   4.561  13.049
   14    HB1  ALA   2           HB1      ALA   2   8.005   2.675  11.804
   15    HB2  ALA   2           HB2      ALA   2   7.875   3.084  13.514
   16    HB3  ALA   2           HB3      ALA   2   8.354   4.316  12.347
   17    H    THR   3           HN       THR   3   4.195   3.659  10.975
   18    HA   THR   3           HA       THR   3   5.176   4.225   8.398
   19    HB   THR   3           HB       THR   3   2.864   4.135   7.679
   20    HG1  THR   3           HG1      THR   3   1.181   4.244   9.087
   21   HG21  THR   3          HG21      THR   3   4.026   2.110   9.403
   22   HG22  THR   3          HG22      THR   3   3.181   1.936   7.864
   23   HG23  THR   3          HG23      THR   3   2.265   2.033   9.368
   24    H    THR   4           HN       THR   4   5.523   6.079   7.427
   25    HA   THR   4           HA       THR   4   4.480   8.560   8.616
   26    HB   THR   4           HB       THR   4   6.681   8.271   6.560
   27    HG1  THR   4           HG1      THR   4   6.920   7.281   8.837
   28   HG21  THR   4          HG21      THR   4   7.338  10.509   7.383
   29   HG22  THR   4          HG22      THR   4   5.921  10.520   8.433
   30   HG23  THR   4          HG23      THR   4   5.720  10.501   6.681
   31    H    THR   5           HN       THR   5   3.316  10.023   7.290
   32    HA   THR   5           HA       THR   5   1.784   8.838   5.221
   33    HB   THR   5           HB       THR   5   2.083  11.788   5.767
   34    HG1  THR   5           HG1      THR   5   0.439  11.482   7.319
   35   HG21  THR   5          HG21      THR   5   0.864  11.207   3.717
   36   HG22  THR   5          HG22      THR   5  -0.226  11.893   4.921
   37   HG23  THR   5          HG23      THR   5  -0.206  10.151   4.641
   38    H    LEU   6           HN       LEU   6   2.443   8.419   3.262
   39    HA   LEU   6           HA       LEU   6   4.236  10.309   1.915
   40    HB2  LEU   6           HB2      LEU   6   4.398   7.297   1.693
   41    HB3  LEU   6           HB1      LEU   6   5.403   8.453   0.845
   42    HG   LEU   6           HG       LEU   6   5.438   7.843   3.804
   43   HD11  LEU   6          HD11      LEU   6   6.611   6.451   1.868
   44   HD12  LEU   6          HD12      LEU   6   7.369   6.712   3.439
   45   HD13  LEU   6          HD13      LEU   6   7.826   7.714   2.060
   46   HD21  LEU   6          HD21      LEU   6   6.924   9.972   2.265
   47   HD22  LEU   6          HD22      LEU   6   7.340   9.446   3.897
   48   HD23  LEU   6          HD23      LEU   6   5.782  10.214   3.588
   49    H    GLY   7           HN       GLY   7   4.023  10.239  -0.420
   50    HA2  GLY   7           HA2      GLY   7   1.287  10.055  -1.211
   51    HA3  GLY   7           HA1      GLY   7   2.645  10.468  -2.248
   52    H    VAL   8           HN       VAL   8   0.273   8.272  -1.718
   53    HA   VAL   8           HA       VAL   8   1.677   6.207  -3.278
   54    HB   VAL   8           HB       VAL   8  -0.246   5.714  -0.987
   55   HG11  VAL   8          HG11      VAL   8   0.301   3.306  -1.364
   56   HG12  VAL   8          HG12      VAL   8   1.075   3.776  -2.877
   57   HG13  VAL   8          HG13      VAL   8  -0.652   4.044  -2.650
   58   HG21  VAL   8          HG21      VAL   8   1.680   4.582   0.067
   59   HG22  VAL   8          HG22      VAL   8   1.956   6.307  -0.185
   60   HG23  VAL   8          HG23      VAL   8   2.698   5.127  -1.266
   61    H    LYS   9           HN       LYS   9   0.074   4.862  -4.549
   62    HA   LYS   9           HA       LYS   9  -2.188   6.589  -5.267
   63    HB2  LYS   9           HB2      LYS   9  -0.681   4.650  -7.010
   64    HB3  LYS   9           HB1      LYS   9  -2.036   5.651  -7.516
   65    HG2  LYS   9           HG2      LYS   9  -0.678   7.655  -6.883
   66    HG3  LYS   9           HG1      LYS   9   0.694   6.566  -6.662
   67    HD2  LYS   9           HD2      LYS   9   1.109   6.672  -8.837
   68    HD3  LYS   9           HD1      LYS   9  -0.474   5.963  -9.165
   69    HE2  LYS   9           HE2      LYS   9   0.088   8.904  -8.783
   70    HE3  LYS   9           HE1      LYS   9  -0.146   8.103 -10.336
   71    HZ1  LYS   9           HZ1      LYS   9  -2.152   8.368  -8.166
   72    HZ2  LYS   9           HZ2      LYS   9  -2.395   7.481  -9.591
   73    HZ3  LYS   9           HZ3      LYS   9  -2.169   9.157  -9.662
   74    H    LEU  10           HN       LEU  10  -4.145   5.869  -5.034
   75    HA   LEU  10           HA       LEU  10  -4.635   2.972  -4.803
   76    HB2  LEU  10           HB2      LEU  10  -5.524   5.253  -3.095
   77    HB3  LEU  10           HB1      LEU  10  -6.616   3.902  -3.314
   78    HG   LEU  10           HG       LEU  10  -3.811   3.409  -2.387
   79   HD11  LEU  10          HD11      LEU  10  -4.636   3.586  -0.066
   80   HD12  LEU  10          HD12      LEU  10  -6.146   4.264  -0.677
   81   HD13  LEU  10          HD13      LEU  10  -4.631   5.138  -0.902
   82   HD21  LEU  10          HD21      LEU  10  -4.996   1.542  -1.223
   83   HD22  LEU  10          HD22      LEU  10  -5.091   1.474  -2.982
   84   HD23  LEU  10          HD23      LEU  10  -6.474   2.039  -2.045
   85    H    ASP  11           HN       ASP  11  -6.325   2.209  -5.970
   86    HA   ASP  11           HA       ASP  11  -7.624   3.989  -7.861
   87    HB2  ASP  11           HB2      ASP  11  -8.239   1.055  -7.407
   88    HB3  ASP  11           HB1      ASP  11  -8.565   2.005  -8.848
   89    H    ASP  12           HN       ASP  12 -10.026   4.095  -7.978
   90    HA   ASP  12           HA       ASP  12 -11.245   4.646  -5.548
   91    HB2  ASP  12           HB2      ASP  12 -12.214   4.274  -8.309
   92    HB3  ASP  12           HB1      ASP  12 -13.421   4.002  -7.054
   93    HA   PRO  13           HA       PRO  13 -13.274   0.191  -5.674
   94    HB2  PRO  13           HB2      PRO  13 -11.695  -1.672  -6.960
   95    HB3  PRO  13           HB1      PRO  13 -13.135  -0.922  -7.656
   96    HG2  PRO  13           HG2      PRO  13 -10.255  -0.223  -8.043
   97    HG3  PRO  13           HG1      PRO  13 -11.568  -0.274  -9.235
   98    HD2  PRO  13           HD2      PRO  13 -10.699   2.047  -8.224
   99    HD3  PRO  13           HD1      PRO  13 -12.422   1.779  -8.565
  100    H    THR  14           HN       THR  14  -9.726   0.554  -5.759
  101    HA   THR  14           HA       THR  14  -9.260  -1.508  -3.878
  102    HB   THR  14           HB       THR  14  -7.018  -0.628  -3.585
  103    HG1  THR  14           HG1      THR  14  -8.106   1.657  -4.846
  104   HG21  THR  14          HG21      THR  14  -6.855  -1.846  -5.480
  105   HG22  THR  14          HG22      THR  14  -6.562  -0.266  -6.210
  106   HG23  THR  14          HG23      THR  14  -8.172  -0.984  -6.276
  107    H    ARG  15           HN       ARG  15  -9.696   2.003  -3.527
  108    HA   ARG  15           HA       ARG  15  -9.129   2.141  -0.782
  109    HB2  ARG  15           HB2      ARG  15  -9.337   4.095  -2.290
  110    HB3  ARG  15           HB1      ARG  15 -11.074   3.822  -2.370
  111    HG2  ARG  15           HG2      ARG  15 -11.217   4.189   0.071
  112    HG3  ARG  15           HG1      ARG  15  -9.493   4.573   0.082
  113    HD2  ARG  15           HD2      ARG  15 -10.752   6.624   0.008
  114    HD3  ARG  15           HD1      ARG  15  -9.939   6.394  -1.541
  115    HE   ARG  15           HE       ARG  15 -12.813   5.994  -1.034
  116   HH11  ARG  15          HH21      ARG  15 -10.168   6.476  -3.297
  117   HH12  ARG  15          HH22      ARG  15 -11.224   6.655  -4.667
  118   HH21  ARG  15          HH11      ARG  15 -14.174   6.222  -2.857
  119   HH22  ARG  15          HH12      ARG  15 -13.462   6.515  -4.424
  120    H    GLU  16           HN       GLU  16 -12.129   1.503  -2.531
  121    HA   GLU  16           HA       GLU  16 -13.772   1.304  -0.228
  122    HB2  GLU  16           HB2      GLU  16 -14.122   0.121  -2.992
  123    HB3  GLU  16           HB1      GLU  16 -15.372   0.171  -1.756
  124    HG2  GLU  16           HG2      GLU  16 -14.067   2.556  -3.055
  125    HG3  GLU  16           HG1      GLU  16 -15.679   1.933  -3.399
  126    H    ARG  17           HN       ARG  17 -11.943  -1.038  -2.157
  127    HA   ARG  17           HA       ARG  17 -12.775  -3.349  -0.761
  128    HB2  ARG  17           HB2      ARG  17 -11.422  -3.078  -3.013
  129    HB3  ARG  17           HB1      ARG  17 -10.028  -3.164  -1.947
  130    HG2  ARG  17           HG2      ARG  17 -12.173  -5.254  -1.847
  131    HG3  ARG  17           HG1      ARG  17 -10.881  -5.329  -3.044
  132    HD2  ARG  17           HD2      ARG  17  -9.550  -6.262  -1.528
  133    HD3  ARG  17           HD1      ARG  17  -9.684  -4.815  -0.529
  134    HE   ARG  17           HE       ARG  17 -11.964  -6.397  -0.132
  135   HH11  ARG  17          HH21      ARG  17  -8.534  -6.505   0.507
  136   HH12  ARG  17          HH22      ARG  17  -8.695  -7.472   1.935
  137   HH21  ARG  17          HH11      ARG  17 -12.193  -7.663   1.765
  138   HH22  ARG  17          HH12      ARG  17 -10.783  -8.129   2.659
  139    H    LEU  18           HN       LEU  18 -10.242  -0.984  -0.247
  140    HA   LEU  18           HA       LEU  18  -8.852  -2.270   1.809
  141    HB2  LEU  18           HB2      LEU  18  -9.076   0.471   0.779
  142    HB3  LEU  18           HB1      LEU  18  -8.688   0.388   2.486
  143    HG   LEU  18           HG       LEU  18  -6.778  -1.192   1.803
  144   HD11  LEU  18          HD11      LEU  18  -7.242   0.047  -0.886
  145   HD12  LEU  18          HD12      LEU  18  -7.627  -1.621  -0.467
  146   HD13  LEU  18          HD13      LEU  18  -5.955  -1.066  -0.421
  147   HD21  LEU  18          HD21      LEU  18  -6.659   1.673   0.878
  148   HD22  LEU  18          HD22      LEU  18  -5.295   0.657   1.347
  149   HD23  LEU  18          HD23      LEU  18  -6.491   1.138   2.550
  150    H    LYS  19           HN       LYS  19 -11.803  -0.305   1.832
  151    HA   LYS  19           HA       LYS  19 -12.107  -0.181   4.627
  152    HB2  LYS  19           HB2      LYS  19 -13.454   1.197   3.122
  153    HB3  LYS  19           HB1      LYS  19 -14.228  -0.241   2.474
  154    HG2  LYS  19           HG2      LYS  19 -15.750   0.784   3.974
  155    HG3  LYS  19           HG1      LYS  19 -15.151  -0.679   4.753
  156    HD2  LYS  19           HD2      LYS  19 -13.679   0.606   6.158
  157    HD3  LYS  19           HD1      LYS  19 -14.063   2.088   5.278
  158    HE2  LYS  19           HE2      LYS  19 -16.395   1.917   6.019
  159    HE3  LYS  19           HE1      LYS  19 -16.007   0.445   6.904
  160    HZ1  LYS  19           HZ1      LYS  19 -14.813   3.111   7.446
  161    HZ2  LYS  19           HZ2      LYS  19 -14.560   1.698   8.341
  162    HZ3  LYS  19           HZ3      LYS  19 -16.085   2.425   8.323
  163    H    ALA  20           HN       ALA  20 -13.088  -2.527   2.246
  164    HA   ALA  20           HA       ALA  20 -14.420  -4.321   3.965
  165    HB1  ALA  20           HB1      ALA  20 -13.010  -4.827   1.342
  166    HB2  ALA  20           HB2      ALA  20 -14.722  -4.471   1.571
  167    HB3  ALA  20           HB3      ALA  20 -14.051  -5.990   2.164
  168    H    ALA  21           HN       ALA  21 -11.047  -3.957   3.000
  169    HA   ALA  21           HA       ALA  21 -10.079  -6.285   4.315
  170    HB1  ALA  21           HB1      ALA  21  -8.560  -3.752   3.699
  171    HB2  ALA  21           HB2      ALA  21  -8.819  -5.066   2.553
  172    HB3  ALA  21           HB3      ALA  21  -7.876  -5.345   4.018
  173    H    ALA  22           HN       ALA  22 -10.608  -2.961   5.236
  174    HA   ALA  22           HA       ALA  22  -9.359  -2.908   7.729
  175    HB1  ALA  22           HB1      ALA  22 -10.273  -0.962   6.416
  176    HB2  ALA  22           HB2      ALA  22 -10.604  -0.937   8.149
  177    HB3  ALA  22           HB3      ALA  22 -11.867  -1.421   7.016
  178    H    GLN  23           HN       GLN  23 -12.699  -3.623   6.907
  179    HA   GLN  23           HA       GLN  23 -13.504  -4.182   9.559
  180    HB2  GLN  23           HB2      GLN  23 -15.505  -5.154   8.614
  181    HB3  GLN  23           HB1      GLN  23 -15.089  -3.709   7.742
  182    HG2  GLN  23           HG2      GLN  23 -15.515  -4.945   5.942
  183    HG3  GLN  23           HG1      GLN  23 -13.865  -5.509   6.196
  184   HE21  GLN  23          HE21      GLN  23 -14.178  -7.525   5.325
  185   HE22  GLN  23          HE22      GLN  23 -15.162  -8.734   6.070
  186    H    SER  24           HN       SER  24 -11.968  -6.025   7.076
  187    HA   SER  24           HA       SER  24 -12.512  -8.552   8.067
  188    HB2  SER  24           HB2      SER  24 -10.097  -7.623   6.489
  189    HB3  SER  24           HB1      SER  24 -10.532  -9.310   6.753
  190    HG   SER  24           HG       SER  24 -12.169  -7.380   5.459
  191    H    ILE  25           HN       ILE  25 -10.046  -6.191   8.827
  192    HA   ILE  25           HA       ILE  25  -8.853  -7.989  10.812
  193    HB   ILE  25           HB       ILE  25  -7.321  -6.977   9.173
  194   HG12  ILE  25          HG12      ILE  25  -6.849  -5.836  11.934
  195   HG13  ILE  25          HG11      ILE  25  -6.539  -7.508  11.480
  196   HG21  ILE  25          HG21      ILE  25  -6.828  -4.542   9.316
  197   HG22  ILE  25          HG22      ILE  25  -8.268  -4.365  10.319
  198   HG23  ILE  25          HG23      ILE  25  -8.416  -4.933   8.656
  199   HD11  ILE  25          HD11      ILE  25  -4.843  -6.812   9.920
  200   HD12  ILE  25          HD12      ILE  25  -4.514  -6.115  11.507
  201   HD13  ILE  25          HD13      ILE  25  -5.210  -5.115  10.231
  202    H    ASP  26           HN       ASP  26 -11.289  -5.916  10.688
  203    HA   ASP  26           HA       ASP  26 -12.506  -4.720  12.160
  204    HB2  ASP  26           HB2      ASP  26 -11.997  -6.778  13.591
  205    HB3  ASP  26           HB1      ASP  26 -10.773  -5.792  14.384
  206    H    ARG  27           HN       ARG  27 -10.624  -3.296  10.881
  207    HA   ARG  27           HA       ARG  27  -9.785  -1.347  12.941
  208    HB2  ARG  27           HB2      ARG  27  -8.234  -2.118  10.455
  209    HB3  ARG  27           HB1      ARG  27  -7.765  -0.887  11.619
  210    HG2  ARG  27           HG2      ARG  27  -8.179  -3.720  12.484
  211    HG3  ARG  27           HG1      ARG  27  -6.663  -3.214  11.738
  212    HD2  ARG  27           HD2      ARG  27  -7.799  -1.681  14.044
  213    HD3  ARG  27           HD1      ARG  27  -6.899  -3.173  14.324
  214    HE   ARG  27           HE       ARG  27  -5.339  -1.647  12.643
  215   HH11  ARG  27          HH21      ARG  27  -6.673  -1.316  15.854
  216   HH12  ARG  27          HH22      ARG  27  -5.365  -0.346  16.444
  217   HH21  ARG  27          HH11      ARG  27  -3.593  -0.379  13.416
  218   HH22  ARG  27          HH12      ARG  27  -3.603   0.183  15.054
  219    H    THR  28           HN       THR  28  -9.713   0.876  12.150
  220    HA   THR  28           HA       THR  28 -11.761   1.395  10.208
  221    HB   THR  28           HB       THR  28 -10.680   2.856  12.356
  222    HG1  THR  28           HG1      THR  28 -12.416   4.230  11.858
  223   HG21  THR  28          HG21      THR  28 -10.089   5.015  11.447
  224   HG22  THR  28          HG22      THR  28 -10.321   4.429   9.800
  225   HG23  THR  28          HG23      THR  28  -8.996   3.801  10.780
  226    HA   PRO  29           HA       PRO  29  -9.674   1.656   6.375
  227    HB2  PRO  29           HB2      PRO  29 -10.100   4.405   5.806
  228    HB3  PRO  29           HB1      PRO  29 -11.049   3.028   5.244
  229    HG2  PRO  29           HG2      PRO  29 -11.542   4.866   7.522
  230    HG3  PRO  29           HG1      PRO  29 -12.704   4.003   6.498
  231    HD2  PRO  29           HD2      PRO  29 -12.225   3.218   9.008
  232    HD3  PRO  29           HD1      PRO  29 -12.491   2.028   7.714
  233    H    HIS  30           HN       HIS  30  -8.991   4.470   8.471
  234    HA   HIS  30           HA       HIS  30  -6.620   5.258   7.221
  235    HB2  HIS  30           HB2      HIS  30  -7.879   6.582   8.917
  236    HB3  HIS  30           HB1      HIS  30  -7.265   5.499  10.161
  237    HD1  HIS  30           HD1      HIS  30  -5.913   7.277  11.382
  238    HD2  HIS  30           HD2      HIS  30  -4.919   6.932   7.362
  239    HE1  HIS  30           HE1      HIS  30  -3.799   8.603  11.095
  240    HE2  HIS  30           HE2      HIS  30  -3.421   8.631   8.607
  241    H    TRP  31           HN       TRP  31  -7.024   3.076  10.045
  242    HA   TRP  31           HA       TRP  31  -4.235   2.558  10.272
  243    HB2  TRP  31           HB2      TRP  31  -6.208   0.511  11.178
  244    HB3  TRP  31           HB1      TRP  31  -4.723   1.042  11.953
  245    HD1  TRP  31           HD1      TRP  31  -8.414   1.801  11.714
  246    HE1  TRP  31           HE1      TRP  31  -9.066   3.487  13.543
  247    HE3  TRP  31           HE3      TRP  31  -3.746   3.014  13.400
  248    HZ2  TRP  31           HZ2      TRP  31  -7.783   5.109  15.441
  249    HZ3  TRP  31           HZ3      TRP  31  -3.550   4.644  15.234
  250    HH2  TRP  31           HH2      TRP  31  -5.528   5.668  16.232
  251    H    LEU  32           HN       LEU  32  -6.915   1.069   8.661
  252    HA   LEU  32           HA       LEU  32  -5.629  -1.241   7.770
  253    HB2  LEU  32           HB2      LEU  32  -8.077  -0.901   7.724
  254    HB3  LEU  32           HB1      LEU  32  -7.863   0.236   6.409
  255    HG   LEU  32           HG       LEU  32  -8.608  -2.150   5.827
  256   HD11  LEU  32          HD11      LEU  32  -6.150  -1.303   4.349
  257   HD12  LEU  32          HD12      LEU  32  -7.635  -0.355   4.284
  258   HD13  LEU  32          HD13      LEU  32  -7.632  -2.026   3.725
  259   HD21  LEU  32          HD21      LEU  32  -6.883  -3.811   5.580
  260   HD22  LEU  32          HD22      LEU  32  -6.947  -3.283   7.262
  261   HD23  LEU  32          HD23      LEU  32  -5.668  -2.694   6.201
  262    H    ILE  33           HN       ILE  33  -5.875   1.958   6.329
  263    HA   ILE  33           HA       ILE  33  -4.693   1.374   3.871
  264    HB   ILE  33           HB       ILE  33  -4.624   3.898   5.529
  265   HG12  ILE  33          HG12      ILE  33  -6.027   3.302   2.917
  266   HG13  ILE  33          HG11      ILE  33  -6.779   3.107   4.497
  267   HG21  ILE  33          HG21      ILE  33  -2.630   4.015   4.247
  268   HG22  ILE  33          HG22      ILE  33  -3.824   5.043   3.453
  269   HG23  ILE  33          HG23      ILE  33  -3.455   3.449   2.794
  270   HD11  ILE  33          HD11      ILE  33  -5.693   5.701   3.425
  271   HD12  ILE  33          HD12      ILE  33  -6.595   5.466   4.922
  272   HD13  ILE  33          HD13      ILE  33  -7.385   5.209   3.366
  273    H    LYS  34           HN       LYS  34  -3.233   2.302   6.956
  274    HA   LYS  34           HA       LYS  34  -0.528   2.189   6.180
  275    HB2  LYS  34           HB2      LYS  34  -1.637   1.305   8.856
  276    HB3  LYS  34           HB1      LYS  34  -0.018   1.902   8.528
  277    HG2  LYS  34           HG2      LYS  34  -0.856   4.115   8.143
  278    HG3  LYS  34           HG1      LYS  34  -2.522   3.545   8.269
  279    HD2  LYS  34           HD2      LYS  34  -1.979   2.789  10.602
  280    HD3  LYS  34           HD1      LYS  34  -0.436   3.631  10.442
  281    HE2  LYS  34           HE2      LYS  34  -1.392   5.688  10.556
  282    HE3  LYS  34           HE1      LYS  34  -2.887   5.157   9.785
  283    HZ1  LYS  34           HZ1      LYS  34  -3.635   4.208  11.795
  284    HZ2  LYS  34           HZ2      LYS  34  -3.060   5.748  12.198
  285    HZ3  LYS  34           HZ3      LYS  34  -2.128   4.381  12.541
  286    H    GLN  35           HN       GLN  35  -2.739  -0.245   7.445
  287    HA   GLN  35           HA       GLN  35  -0.891  -2.382   7.499
  288    HB2  GLN  35           HB2      GLN  35  -3.906  -2.351   7.475
  289    HB3  GLN  35           HB1      GLN  35  -2.943  -3.804   7.711
  290    HG2  GLN  35           HG2      GLN  35  -2.788  -1.370   9.476
  291    HG3  GLN  35           HG1      GLN  35  -3.798  -2.777   9.807
  292   HE21  GLN  35          HE21      GLN  35  -1.336  -1.503  11.086
  293   HE22  GLN  35          HE22      GLN  35  -0.279  -2.843  11.348
  294    H    ALA  36           HN       ALA  36  -3.198  -1.294   5.037
  295    HA   ALA  36           HA       ALA  36  -3.104  -3.504   3.368
  296    HB1  ALA  36           HB1      ALA  36  -3.600  -1.896   1.525
  297    HB2  ALA  36           HB2      ALA  36  -3.345  -0.582   2.674
  298    HB3  ALA  36           HB3      ALA  36  -4.654  -1.736   2.929
  299    H    ILE  37           HN       ILE  37  -0.896  -0.755   3.617
  300    HA   ILE  37           HA       ILE  37   0.830  -1.956   1.622
  301    HB   ILE  37           HB       ILE  37   0.602   0.447   1.555
  302   HG12  ILE  37          HG12      ILE  37   2.972   1.117   1.641
  303   HG13  ILE  37          HG11      ILE  37   3.345  -0.360   2.524
  304   HG21  ILE  37          HG21      ILE  37   1.722   0.475   4.343
  305   HG22  ILE  37          HG22      ILE  37   0.077   0.893   3.865
  306   HG23  ILE  37          HG23      ILE  37   1.429   1.896   3.339
  307   HD11  ILE  37          HD11      ILE  37   3.858  -0.386   0.077
  308   HD12  ILE  37          HD12      ILE  37   2.118  -0.352  -0.213
  309   HD13  ILE  37          HD13      ILE  37   2.843  -1.707   0.655
  310    H    PHE  38           HN       PHE  38   0.990  -1.328   5.126
  311    HA   PHE  38           HA       PHE  38   3.604  -2.433   5.370
  312    HB2  PHE  38           HB2      PHE  38   3.214  -1.063   7.173
  313    HB3  PHE  38           HB1      PHE  38   1.504  -1.477   7.258
  314    HD1  PHE  38           HD2      PHE  38   4.813  -3.178   7.704
  315    HD2  PHE  38           HD1      PHE  38   0.821  -2.657   9.090
  316    HE1  PHE  38           HE2      PHE  38   5.256  -4.734   9.557
  317    HE2  PHE  38           HE1      PHE  38   1.259  -4.214  10.942
  318    HZ   PHE  38           HZ       PHE  38   3.477  -5.254  11.178
  319    H    ASN  39           HN       ASN  39   0.334  -3.733   5.882
  320    HA   ASN  39           HA       ASN  39   1.266  -6.204   6.879
  321    HB2  ASN  39           HB2      ASN  39  -1.124  -5.231   7.064
  322    HB3  ASN  39           HB1      ASN  39  -1.363  -5.903   5.456
  323   HD21  ASN  39          HD21      ASN  39  -3.070  -6.979   6.832
  324   HD22  ASN  39          HD22      ASN  39  -2.647  -8.490   7.558
  325    H    TYR  40           HN       TYR  40   0.711  -4.865   3.671
  326    HA   TYR  40           HA       TYR  40   0.892  -7.279   2.235
  327    HB2  TYR  40           HB2      TYR  40   0.287  -5.270   1.025
  328    HB3  TYR  40           HB1      TYR  40   1.790  -4.479   1.493
  329    HD1  TYR  40           HD1      TYR  40   0.936  -7.772  -0.086
  330    HD2  TYR  40           HD2      TYR  40   3.207  -4.184  -0.315
  331    HE1  TYR  40           HE1      TYR  40   1.973  -8.573  -2.162
  332    HE2  TYR  40           HE2      TYR  40   4.256  -4.978  -2.395
  333    HH   TYR  40           HH       TYR  40   4.687  -7.032  -3.586
  334    H    LEU  41           HN       LEU  41   3.204  -4.996   3.475
  335    HA   LEU  41           HA       LEU  41   5.515  -6.346   2.580
  336    HB2  LEU  41           HB2      LEU  41   4.992  -4.150   4.539
  337    HB3  LEU  41           HB1      LEU  41   6.587  -4.867   4.435
  338    HG   LEU  41           HG       LEU  41   5.659  -2.712   2.936
  339   HD11  LEU  41          HD11      LEU  41   7.769  -2.987   1.706
  340   HD12  LEU  41          HD12      LEU  41   7.949  -4.594   2.407
  341   HD13  LEU  41          HD13      LEU  41   7.969  -3.171   3.447
  342   HD21  LEU  41          HD21      LEU  41   5.880  -5.074   1.088
  343   HD22  LEU  41          HD22      LEU  41   5.553  -3.395   0.661
  344   HD23  LEU  41          HD23      LEU  41   4.354  -4.327   1.559
  345    H    GLU  42           HN       GLU  42   3.784  -6.300   5.684
  346    HA   GLU  42           HA       GLU  42   5.517  -7.897   7.171
  347    HB2  GLU  42           HB2      GLU  42   3.568  -6.606   8.085
  348    HB3  GLU  42           HB1      GLU  42   2.504  -7.836   7.417
  349    HG2  GLU  42           HG2      GLU  42   3.542  -9.526   8.832
  350    HG3  GLU  42           HG1      GLU  42   4.628  -8.313   9.500
  351    H    LYS  43           HN       LYS  43   2.903  -8.829   4.981
  352    HA   LYS  43           HA       LYS  43   2.874 -11.574   5.615
  353    HB2  LYS  43           HB2      LYS  43   1.825  -9.873   3.466
  354    HB3  LYS  43           HB1      LYS  43   2.197 -11.512   2.951
  355    HG2  LYS  43           HG2      LYS  43  -0.105 -11.402   3.615
  356    HG3  LYS  43           HG1      LYS  43   0.784 -12.369   4.794
  357    HD2  LYS  43           HD2      LYS  43   0.841 -10.539   6.342
  358    HD3  LYS  43           HD1      LYS  43   0.155  -9.443   5.144
  359    HE2  LYS  43           HE2      LYS  43  -1.327 -11.894   6.039
  360    HE3  LYS  43           HE1      LYS  43  -1.387 -10.400   6.972
  361    HZ1  LYS  43           HZ1      LYS  43  -2.150  -9.276   4.908
  362    HZ2  LYS  43           HZ2      LYS  43  -3.239 -10.428   5.506
  363    HZ3  LYS  43           HZ3      LYS  43  -2.270 -10.795   4.167
  364    H    LEU  44           HN       LEU  44   4.669  -9.772   3.146
  365    HA   LEU  44           HA       LEU  44   6.137 -12.164   2.368
  366    HB2  LEU  44           HB2      LEU  44   7.149 -10.711   0.633
  367    HB3  LEU  44           HB1      LEU  44   5.401 -10.795   0.546
  368    HG   LEU  44           HG       LEU  44   5.580  -8.562   1.979
  369   HD11  LEU  44          HD11      LEU  44   8.110  -8.496   0.347
  370   HD12  LEU  44          HD12      LEU  44   8.042  -8.634   2.105
  371   HD13  LEU  44          HD13      LEU  44   7.433  -7.183   1.309
  372   HD21  LEU  44          HD21      LEU  44   4.445  -8.735  -0.143
  373   HD22  LEU  44          HD22      LEU  44   5.989  -8.740  -0.998
  374   HD23  LEU  44          HD23      LEU  44   5.469  -7.299  -0.124
  375    H    GLU  45           HN       GLU  45   6.435 -10.014   4.804
  376    HA   GLU  45           HA       GLU  45   9.269 -10.538   5.101
  377    HB2  GLU  45           HB2      GLU  45   9.437  -8.510   3.853
  378    HB3  GLU  45           HB1      GLU  45   8.118  -7.765   4.746
  379    HG2  GLU  45           HG2      GLU  45   9.760  -8.157   6.778
  380    HG3  GLU  45           HG1      GLU  45  10.968  -8.103   5.493
  381    H1   MET  46           HT1      MET  46  -3.627   0.981 -11.418
  382    H2   MET  46           HT2      MET  46  -2.417   1.992 -12.029
  383    H3   MET  46           HT3      MET  46  -2.313   0.319 -12.252
  384    HA   MET  46           HA       MET  46  -2.996   1.338 -14.290
  385    HB2  MET  46           HB2      MET  46  -5.526   0.164 -13.171
  386    HB3  MET  46           HB1      MET  46  -4.833  -0.033 -14.773
  387    HG2  MET  46           HG2      MET  46  -4.573  -2.099 -13.687
  388    HG3  MET  46           HG1      MET  46  -2.980  -1.344 -13.684
  389    HE1  MET  46           HE1      MET  46  -6.019  -2.558 -11.490
  390    HE2  MET  46           HE2      MET  46  -6.196  -0.803 -11.499
  391    HE3  MET  46           HE3      MET  46  -5.759  -1.637 -10.008
  392    H    ALA  47           HN       ALA  47  -5.675   1.748 -11.959
  393    HA   ALA  47           HA       ALA  47  -6.149   4.417 -13.124
  394    HB1  ALA  47           HB1      ALA  47  -8.117   2.498 -11.860
  395    HB2  ALA  47           HB2      ALA  47  -8.002   2.898 -13.574
  396    HB3  ALA  47           HB3      ALA  47  -8.500   4.129 -12.413
  397    H    THR  48           HN       THR  48  -4.331   3.529 -11.043
  398    HA   THR  48           HA       THR  48  -5.323   4.106  -8.473
  399    HB   THR  48           HB       THR  48  -3.017   4.038  -7.742
  400    HG1  THR  48           HG1      THR  48  -1.318   4.102  -9.175
  401   HG21  THR  48          HG21      THR  48  -4.137   1.998  -9.475
  402   HG22  THR  48          HG22      THR  48  -3.289   1.832  -7.937
  403   HG23  THR  48          HG23      THR  48  -2.374   1.951  -9.440
  404    H    THR  49           HN       THR  49  -5.659   5.964  -7.495
  405    HA   THR  49           HA       THR  49  -4.639   8.438  -8.720
  406    HB   THR  49           HB       THR  49  -6.874   8.141  -6.699
  407    HG1  THR  49           HG1      THR  49  -7.201   7.133  -8.866
  408   HG21  THR  49          HG21      THR  49  -7.507  10.396  -7.479
  409   HG22  THR  49          HG22      THR  49  -6.076  10.427  -8.511
  410   HG23  THR  49          HG23      THR  49  -5.898  10.371  -6.757
  411    H    THR  50           HN       THR  50  -3.502   9.930  -7.405
  412    HA   THR  50           HA       THR  50  -1.962   8.779  -5.323
  413    HB   THR  50           HB       THR  50  -2.284  11.725  -5.879
  414    HG1  THR  50           HG1      THR  50  -0.564  11.394  -7.399
  415   HG21  THR  50          HG21      THR  50  -1.043  11.153  -3.841
  416   HG22  THR  50          HG22      THR  50   0.032  11.845  -5.054
  417   HG23  THR  50          HG23      THR  50   0.025  10.103  -4.773
  418    H    LEU  51           HN       LEU  51  -2.639   8.364  -3.363
  419    HA   LEU  51           HA       LEU  51  -4.452  10.253  -2.038
  420    HB2  LEU  51           HB2      LEU  51  -4.587   7.240  -1.795
  421    HB3  LEU  51           HB1      LEU  51  -5.607   8.391  -0.958
  422    HG   LEU  51           HG       LEU  51  -5.621   7.761  -3.913
  423   HD11  LEU  51          HD11      LEU  51  -6.793   6.373  -1.973
  424   HD12  LEU  51          HD12      LEU  51  -7.545   6.616  -3.549
  425   HD13  LEU  51          HD13      LEU  51  -8.018   7.624  -2.181
  426   HD21  LEU  51          HD21      LEU  51  -7.131   9.890  -2.398
  427   HD22  LEU  51          HD22      LEU  51  -7.538   9.347  -4.026
  428   HD23  LEU  51          HD23      LEU  51  -5.987  10.130  -3.719
  429    H    GLY  52           HN       GLY  52  -4.245  10.213   0.297
  430    HA2  GLY  52           HA2      GLY  52  -1.511  10.065   1.102
  431    HA3  GLY  52           HA1      GLY  52  -2.878  10.469   2.130
  432    H    VAL  53           HN       VAL  53  -0.478   8.291   1.614
  433    HA   VAL  53           HA       VAL  53  -1.855   6.220   3.190
  434    HB   VAL  53           HB       VAL  53   0.072   5.740   0.898
  435   HG11  VAL  53          HG11      VAL  53  -0.445   3.326   1.283
  436   HG12  VAL  53          HG12      VAL  53  -1.224   3.792   2.794
  437   HG13  VAL  53          HG13      VAL  53   0.500   4.081   2.566
  438   HG21  VAL  53          HG21      VAL  53  -1.843   4.574  -0.146
  439   HG22  VAL  53          HG22      VAL  53  -2.132   6.299   0.088
  440   HG23  VAL  53          HG23      VAL  53  -2.865   5.126   1.181
  441    H    LYS  54           HN       LYS  54  -0.234   4.899   4.465
  442    HA   LYS  54           HA       LYS  54   2.012   6.652   5.170
  443    HB2  LYS  54           HB2      LYS  54   0.513   4.718   6.926
  444    HB3  LYS  54           HB1      LYS  54   1.877   5.709   7.425
  445    HG2  LYS  54           HG2      LYS  54   0.518   7.721   6.784
  446    HG3  LYS  54           HG1      LYS  54  -0.859   6.630   6.608
  447    HD2  LYS  54           HD2      LYS  54  -1.217   6.706   8.793
  448    HD3  LYS  54           HD1      LYS  54   0.408   6.087   9.095
  449    HE2  LYS  54           HE2      LYS  54  -0.313   8.988   8.671
  450    HE3  LYS  54           HE1      LYS  54  -0.009   8.232  10.233
  451    HZ1  LYS  54           HZ1      LYS  54   1.944   8.555   8.020
  452    HZ2  LYS  54           HZ2      LYS  54   2.260   7.718   9.461
  453    HZ3  LYS  54           HZ3      LYS  54   1.944   9.384   9.497
  454    H    LEU  55           HN       LEU  55   3.978   5.944   4.958
  455    HA   LEU  55           HA       LEU  55   4.491   3.050   4.738
  456    HB2  LEU  55           HB2      LEU  55   5.358   5.329   3.017
  457    HB3  LEU  55           HB1      LEU  55   6.465   3.992   3.245
  458    HG   LEU  55           HG       LEU  55   3.668   3.459   2.317
  459   HD11  LEU  55          HD11      LEU  55   4.493   3.636  -0.004
  460   HD12  LEU  55          HD12      LEU  55   5.994   4.334   0.606
  461   HD13  LEU  55          HD13      LEU  55   4.469   5.192   0.826
  462   HD21  LEU  55          HD21      LEU  55   4.880   1.603   1.162
  463   HD22  LEU  55          HD22      LEU  55   4.971   1.544   2.923
  464   HD23  LEU  55          HD23      LEU  55   6.349   2.123   1.987
  465    H    ASP  56           HN       ASP  56   6.189   2.310   5.917
  466    HA   ASP  56           HA       ASP  56   7.470   4.121   7.793
  467    HB2  ASP  56           HB2      ASP  56   8.121   1.191   7.357
  468    HB3  ASP  56           HB1      ASP  56   8.454   2.156   8.785
  469    H    ASP  57           HN       ASP  57   9.864   4.283   7.898
  470    HA   ASP  57           HA       ASP  57  11.064   4.810   5.453
  471    HB2  ASP  57           HB2      ASP  57  12.075   4.485   8.215
  472    HB3  ASP  57           HB1      ASP  57  13.267   4.284   6.933
  473    HA   PRO  58           HA       PRO  58  13.162   0.389   5.645
  474    HB2  PRO  58           HB2      PRO  58  11.609  -1.481   6.953
  475    HB3  PRO  58           HB1      PRO  58  13.036  -0.700   7.642
  476    HG2  PRO  58           HG2      PRO  58  10.144  -0.038   8.013
  477    HG3  PRO  58           HG1      PRO  58  11.454  -0.057   9.210
  478    HD2  PRO  58           HD2      PRO  58  10.558   2.240   8.170
  479    HD3  PRO  58           HD1      PRO  58  12.283   1.999   8.518
  480    H    THR  59           HN       THR  59   9.607   0.709   5.720
  481    HA   THR  59           HA       THR  59   9.171  -1.384   3.865
  482    HB   THR  59           HB       THR  59   6.919  -0.536   3.556
  483    HG1  THR  59           HG1      THR  59   7.976   1.774   4.794
  484   HG21  THR  59          HG21      THR  59   6.763  -1.739   5.460
  485   HG22  THR  59          HG22      THR  59   6.455  -0.157   6.179
  486   HG23  THR  59          HG23      THR  59   8.071  -0.861   6.251
  487    H    ARG  60           HN       ARG  60   9.559   2.129   3.474
  488    HA   ARG  60           HA       ARG  60   8.995   2.223   0.725
  489    HB2  ARG  60           HB2      ARG  60   9.172   4.203   2.211
  490    HB3  ARG  60           HB1      ARG  60  10.915   3.959   2.285
  491    HG2  ARG  60           HG2      ARG  60  11.011   4.262  -0.182
  492    HG3  ARG  60           HG1      ARG  60   9.294   4.676  -0.151
  493    HD2  ARG  60           HD2      ARG  60  10.628   6.697  -0.140
  494    HD3  ARG  60           HD1      ARG  60   9.799   6.520   1.408
  495    HE   ARG  60           HE       ARG  60  12.665   6.023   0.927
  496   HH11  ARG  60          HH21      ARG  60  10.020   6.656   3.156
  497   HH12  ARG  60          HH22      ARG  60  11.070   6.824   4.529
  498   HH21  ARG  60          HH11      ARG  60  14.014   6.222   2.754
  499   HH22  ARG  60          HH12      ARG  60  13.306   6.583   4.310
  500    H    GLU  61           HN       GLU  61  11.997   1.643   2.491
  501    HA   GLU  61           HA       GLU  61  13.665   1.449   0.209
  502    HB2  GLU  61           HB2      GLU  61  13.991   0.243   2.966
  503    HB3  GLU  61           HB1      GLU  61  15.260   0.358   1.756
  504    HG2  GLU  61           HG2      GLU  61  13.862   2.671   3.091
  505    HG3  GLU  61           HG1      GLU  61  15.485   2.087   3.448
  506    H    ARG  62           HN       ARG  62  11.846  -0.902   2.139
  507    HA   ARG  62           HA       ARG  62  12.698  -3.212   0.758
  508    HB2  ARG  62           HB2      ARG  62  11.327  -2.934   3.002
  509    HB3  ARG  62           HB1      ARG  62   9.943  -3.049   1.925
  510    HG2  ARG  62           HG2      ARG  62  12.117  -5.110   1.866
  511    HG3  ARG  62           HG1      ARG  62  10.811  -5.191   3.048
  512    HD2  ARG  62           HD2      ARG  62   9.514  -6.161   1.525
  513    HD3  ARG  62           HD1      ARG  62   9.632  -4.717   0.519
  514    HE   ARG  62           HE       ARG  62  11.943  -6.266   0.157
  515   HH11  ARG  62          HH21      ARG  62   8.522  -6.418  -0.529
  516   HH12  ARG  62          HH22      ARG  62   8.715  -7.376  -1.959
  517   HH21  ARG  62          HH11      ARG  62  12.213  -7.517  -1.743
  518   HH22  ARG  62          HH12      ARG  62  10.823  -8.001  -2.657
  519    H    LEU  63           HN       LEU  63  10.144  -0.872   0.221
  520    HA   LEU  63           HA       LEU  63   8.777  -2.178  -1.835
  521    HB2  LEU  63           HB2      LEU  63   8.977   0.573  -0.825
  522    HB3  LEU  63           HB1      LEU  63   8.601   0.474  -2.534
  523    HG   LEU  63           HG       LEU  63   6.697  -1.113  -1.858
  524   HD11  LEU  63          HD11      LEU  63   7.129   0.136   0.833
  525   HD12  LEU  63          HD12      LEU  63   7.543  -1.527   0.420
  526   HD13  LEU  63          HD13      LEU  63   5.863  -0.998   0.361
  527   HD21  LEU  63          HD21      LEU  63   6.549   1.754  -0.939
  528   HD22  LEU  63          HD22      LEU  63   5.195   0.725  -1.406
  529   HD23  LEU  63          HD23      LEU  63   6.388   1.213  -2.610
  530    H    LYS  64           HN       LYS  64  11.712  -0.194  -1.863
  531    HA   LYS  64           HA       LYS  64  12.023  -0.077  -4.659
  532    HB2  LYS  64           HB2      LYS  64  13.348   1.324  -3.170
  533    HB3  LYS  64           HB1      LYS  64  14.123  -0.096  -2.486
  534    HG2  LYS  64           HG2      LYS  64  15.671   0.887  -3.974
  535    HG3  LYS  64           HG1      LYS  64  15.059  -0.562  -4.769
  536    HD2  LYS  64           HD2      LYS  64  13.636   0.742  -6.194
  537    HD3  LYS  64           HD1      LYS  64  13.998   2.215  -5.288
  538    HE2  LYS  64           HE2      LYS  64  16.352   2.043  -5.970
  539    HE3  LYS  64           HE1      LYS  64  15.973   0.594  -6.897
  540    HZ1  LYS  64           HZ1      LYS  64  14.807   3.279  -7.401
  541    HZ2  LYS  64           HZ2      LYS  64  14.570   1.889  -8.337
  542    HZ3  LYS  64           HZ3      LYS  64  16.099   2.609  -8.264
  543    H    ALA  65           HN       ALA  65  12.989  -2.406  -2.264
  544    HA   ALA  65           HA       ALA  65  14.368  -4.186  -3.971
  545    HB1  ALA  65           HB1      ALA  65  12.964  -4.694  -1.345
  546    HB2  ALA  65           HB2      ALA  65  14.672  -4.317  -1.577
  547    HB3  ALA  65           HB3      ALA  65  14.019  -5.849  -2.159
  548    H    ALA  66           HN       ALA  66  10.992  -3.851  -3.018
  549    HA   ALA  66           HA       ALA  66  10.048  -6.201  -4.311
  550    HB1  ALA  66           HB1      ALA  66   8.508  -3.674  -3.717
  551    HB2  ALA  66           HB2      ALA  66   8.776  -4.978  -2.561
  552    HB3  ALA  66           HB3      ALA  66   7.836  -5.275  -4.024
  553    H    ALA  67           HN       ALA  67  10.534  -2.874  -5.256
  554    HA   ALA  67           HA       ALA  67   9.296  -2.853  -7.751
  555    HB1  ALA  67           HB1      ALA  67  10.193  -0.891  -6.451
  556    HB2  ALA  67           HB2      ALA  67  10.525  -0.874  -8.183
  557    HB3  ALA  67           HB3      ALA  67  11.791  -1.341  -7.046
  558    H    GLN  68           HN       GLN  68  12.639  -3.527  -6.915
  559    HA   GLN  68           HA       GLN  68  13.451  -4.109  -9.562
  560    HB2  GLN  68           HB2      GLN  68  15.466  -5.032  -8.612
  561    HB3  GLN  68           HB1      GLN  68  15.027  -3.586  -7.753
  562    HG2  GLN  68           HG2      GLN  68  15.477  -4.798  -5.942
  563    HG3  GLN  68           HG1      GLN  68  13.837  -5.394  -6.189
  564   HE21  GLN  68          HE21      GLN  68  14.243  -7.375  -5.252
  565   HE22  GLN  68          HE22      GLN  68  15.244  -8.574  -5.992
  566    H    SER  69           HN       SER  69  11.917  -5.938  -7.068
  567    HA   SER  69           HA       SER  69  12.516  -8.466  -8.042
  568    HB2  SER  69           HB2      SER  69  10.105  -7.563  -6.443
  569    HB3  SER  69           HB1      SER  69  10.543  -9.249  -6.719
  570    HG   SER  69           HG       SER  69  12.198  -7.321  -5.444
  571    H    ILE  70           HN       ILE  70  10.043  -6.134  -8.831
  572    HA   ILE  70           HA       ILE  70   8.865  -7.961 -10.801
  573    HB   ILE  70           HB       ILE  70   7.317  -6.951  -9.172
  574   HG12  ILE  70          HG12      ILE  70   6.844  -5.842 -11.947
  575   HG13  ILE  70          HG11      ILE  70   6.550  -7.513 -11.478
  576   HG21  ILE  70          HG21      ILE  70   6.799  -4.522  -9.340
  577   HG22  ILE  70          HG22      ILE  70   8.238  -4.339 -10.344
  578   HG23  ILE  70          HG23      ILE  70   8.391  -4.888  -8.675
  579   HD11  ILE  70          HD11      ILE  70   4.839  -6.821  -9.934
  580   HD12  ILE  70          HD12      ILE  70   4.511  -6.139 -11.527
  581   HD13  ILE  70          HD13      ILE  70   5.191  -5.123 -10.256
  582    H    ASP  71           HN       ASP  71  11.277  -5.869 -10.675
  583    HA   ASP  71           HA       ASP  71  12.490  -4.656 -12.131
  584    HB2  ASP  71           HB2      ASP  71  12.079  -6.714 -13.563
  585    HB3  ASP  71           HB1      ASP  71  10.802  -5.798 -14.357
  586    H    ARG  72           HN       ARG  72  10.558  -3.257 -10.892
  587    HA   ARG  72           HA       ARG  72   9.726  -1.334 -12.980
  588    HB2  ARG  72           HB2      ARG  72   8.172  -2.109 -10.497
  589    HB3  ARG  72           HB1      ARG  72   7.699  -0.873 -11.654
  590    HG2  ARG  72           HG2      ARG  72   8.127  -3.703 -12.528
  591    HG3  ARG  72           HG1      ARG  72   6.605  -3.200 -11.793
  592    HD2  ARG  72           HD2      ARG  72   7.774  -1.690 -14.104
  593    HD3  ARG  72           HD1      ARG  72   6.827  -3.156 -14.367
  594    HE   ARG  72           HE       ARG  72   5.353  -1.522 -12.679
  595   HH11  ARG  72          HH21      ARG  72   6.568  -1.429 -15.955
  596   HH12  ARG  72          HH22      ARG  72   5.257  -0.462 -16.551
  597   HH21  ARG  72          HH11      ARG  72   3.609  -0.256 -13.466
  598   HH22  ARG  72          HH12      ARG  72   3.572   0.203 -15.135
  599    H    THR  73           HN       THR  73   9.623   0.899 -12.208
  600    HA   THR  73           HA       THR  73  11.665   1.456 -10.268
  601    HB   THR  73           HB       THR  73  10.556   2.878 -12.430
  602    HG1  THR  73           HG1      THR  73  12.323   4.174 -12.060
  603   HG21  THR  73          HG21      THR  73   9.970   5.049 -11.537
  604   HG22  THR  73          HG22      THR  73  10.204   4.473  -9.887
  605   HG23  THR  73          HG23      THR  73   8.881   3.836 -10.864
  606    HA   PRO  74           HA       PRO  74   9.573   1.719  -6.435
  607    HB2  PRO  74           HB2      PRO  74   9.979   4.469  -5.870
  608    HB3  PRO  74           HB1      PRO  74  10.943   3.102  -5.311
  609    HG2  PRO  74           HG2      PRO  74  11.410   4.941  -7.595
  610    HG3  PRO  74           HG1      PRO  74  12.584   4.095  -6.570
  611    HD2  PRO  74           HD2      PRO  74  12.112   3.295  -9.076
  612    HD3  PRO  74           HD1      PRO  74  12.391   2.113  -7.777
  613    H    HIS  75           HN       HIS  75   8.864   4.476  -8.581
  614    HA   HIS  75           HA       HIS  75   6.501   5.291  -7.319
  615    HB2  HIS  75           HB2      HIS  75   7.755   6.599  -9.025
  616    HB3  HIS  75           HB1      HIS  75   7.157   5.499 -10.260
  617    HD1  HIS  75           HD1      HIS  75   5.851   7.298 -11.501
  618    HD2  HIS  75           HD2      HIS  75   4.750   6.913  -7.511
  619    HE1  HIS  75           HE1      HIS  75   3.712   8.598 -11.261
  620    HE2  HIS  75           HE2      HIS  75   3.270   8.606  -8.783
  621    H    TRP  76           HN       TRP  76   6.908   3.091 -10.121
  622    HA   TRP  76           HA       TRP  76   4.126   2.548 -10.338
  623    HB2  TRP  76           HB2      TRP  76   6.113   0.508 -11.227
  624    HB3  TRP  76           HB1      TRP  76   4.627   1.024 -12.008
  625    HD1  TRP  76           HD1      TRP  76   8.316   1.765 -11.807
  626    HE1  TRP  76           HE1      TRP  76   8.964   3.434 -13.656
  627    HE3  TRP  76           HE3      TRP  76   3.638   3.028 -13.428
  628    HZ2  TRP  76           HZ2      TRP  76   7.669   5.069 -15.536
  629    HZ3  TRP  76           HZ3      TRP  76   3.434   4.655 -15.263
  630    HH2  TRP  76           HH2      TRP  76   5.409   5.653 -16.295
  631    H    LEU  77           HN       LEU  77   6.819   1.101  -8.714
  632    HA   LEU  77           HA       LEU  77   5.560  -1.217  -7.807
  633    HB2  LEU  77           HB2      LEU  77   8.006  -0.848  -7.759
  634    HB3  LEU  77           HB1      LEU  77   7.775   0.292  -6.449
  635    HG   LEU  77           HG       LEU  77   8.541  -2.084  -5.855
  636   HD11  LEU  77          HD11      LEU  77   6.071  -1.256  -4.389
  637   HD12  LEU  77          HD12      LEU  77   7.546  -0.292  -4.323
  638   HD13  LEU  77          HD13      LEU  77   7.558  -1.962  -3.757
  639   HD21  LEU  77          HD21      LEU  77   6.833  -3.762  -5.606
  640   HD22  LEU  77          HD22      LEU  77   6.896  -3.242  -7.290
  641   HD23  LEU  77          HD23      LEU  77   5.608  -2.661  -6.235
  642    H    ILE  78           HN       ILE  78   5.756   1.998  -6.400
  643    HA   ILE  78           HA       ILE  78   4.578   1.411  -3.936
  644    HB   ILE  78           HB       ILE  78   4.488   3.926  -5.605
  645   HG12  ILE  78          HG12      ILE  78   5.893   3.352  -2.991
  646   HG13  ILE  78          HG11      ILE  78   6.648   3.159  -4.569
  647   HG21  ILE  78          HG21      ILE  78   2.491   4.026  -4.323
  648   HG22  ILE  78          HG22      ILE  78   3.674   5.070  -3.534
  649   HG23  ILE  78          HG23      ILE  78   3.324   3.475  -2.868
  650   HD11  ILE  78          HD11      ILE  78   5.536   5.746  -3.510
  651   HD12  ILE  78          HD12      ILE  78   6.445   5.513  -5.004
  652   HD13  ILE  78          HD13      ILE  78   7.232   5.270  -3.445
  653    H    LYS  79           HN       LYS  79   3.127   2.305  -7.032
  654    HA   LYS  79           HA       LYS  79   0.420   2.177  -6.271
  655    HB2  LYS  79           HB2      LYS  79   1.565   1.285  -8.930
  656    HB3  LYS  79           HB1      LYS  79  -0.069   1.851  -8.625
  657    HG2  LYS  79           HG2      LYS  79   0.717   4.084  -8.253
  658    HG3  LYS  79           HG1      LYS  79   2.397   3.549  -8.355
  659    HD2  LYS  79           HD2      LYS  79   1.900   2.765 -10.689
  660    HD3  LYS  79           HD1      LYS  79   0.336   3.570 -10.554
  661    HE2  LYS  79           HE2      LYS  79   1.274   5.676 -10.528
  662    HE3  LYS  79           HE1      LYS  79   2.837   5.087  -9.963
  663    HZ1  LYS  79           HZ1      LYS  79   3.320   4.233 -12.109
  664    HZ2  LYS  79           HZ2      LYS  79   2.777   5.820 -12.329
  665    HZ3  LYS  79           HZ3      LYS  79   1.749   4.523 -12.666
  666    H    GLN  80           HN       GLN  80   2.658  -0.250  -7.508
  667    HA   GLN  80           HA       GLN  80   0.825  -2.401  -7.549
  668    HB2  GLN  80           HB2      GLN  80   3.839  -2.340  -7.525
  669    HB3  GLN  80           HB1      GLN  80   2.895  -3.807  -7.734
  670    HG2  GLN  80           HG2      GLN  80   2.683  -1.413  -9.542
  671    HG3  GLN  80           HG1      GLN  80   3.750  -2.785  -9.844
  672   HE21  GLN  80          HE21      GLN  80   1.246  -1.630 -11.158
  673   HE22  GLN  80          HE22      GLN  80   0.252  -3.020 -11.413
  674    H    ALA  81           HN       ALA  81   3.129  -1.281  -5.093
  675    HA   ALA  81           HA       ALA  81   3.054  -3.477  -3.408
  676    HB1  ALA  81           HB1      ALA  81   3.532  -1.853  -1.574
  677    HB2  ALA  81           HB2      ALA  81   3.263  -0.548  -2.730
  678    HB3  ALA  81           HB3      ALA  81   4.584  -1.690  -2.979
  679    H    ILE  82           HN       ILE  82   0.810  -0.759  -3.677
  680    HA   ILE  82           HA       ILE  82  -0.903  -1.965  -1.674
  681    HB   ILE  82           HB       ILE  82  -0.700   0.442  -1.631
  682   HG12  ILE  82          HG12      ILE  82  -3.076   1.085  -1.707
  683   HG13  ILE  82          HG11      ILE  82  -3.441  -0.400  -2.579
  684   HG21  ILE  82          HG21      ILE  82  -1.833   0.426  -4.413
  685   HG22  ILE  82          HG22      ILE  82  -0.192   0.873  -3.945
  686   HG23  ILE  82          HG23      ILE  82  -1.557   1.860  -3.425
  687   HD11  ILE  82          HD11      ILE  82  -3.948  -0.420  -0.135
  688   HD12  ILE  82          HD12      ILE  82  -2.209  -0.360   0.155
  689   HD13  ILE  82          HD13      ILE  82  -2.914  -1.731  -0.702
  690    H    PHE  83           HN       PHE  83  -1.080  -1.362  -5.186
  691    HA   PHE  83           HA       PHE  83  -3.677  -2.509  -5.417
  692    HB2  PHE  83           HB2      PHE  83  -3.309  -1.148  -7.233
  693    HB3  PHE  83           HB1      PHE  83  -1.592  -1.529  -7.310
  694    HD1  PHE  83           HD2      PHE  83  -4.870  -3.277  -7.760
  695    HD2  PHE  83           HD1      PHE  83  -0.877  -2.721  -9.127
  696    HE1  PHE  83           HE2      PHE  83  -5.285  -4.853  -9.603
  697    HE2  PHE  83           HE1      PHE  83  -1.286  -4.297 -10.970
  698    HZ   PHE  83           HZ       PHE  83  -3.491  -5.365 -11.209
  699    H    ASN  84           HN       ASN  84  -0.390  -3.759  -5.921
  700    HA   ASN  84           HA       ASN  84  -1.257  -6.266  -6.883
  701    HB2  ASN  84           HB2      ASN  84   1.102  -5.233  -7.073
  702    HB3  ASN  84           HB1      ASN  84   1.351  -5.856  -5.448
  703   HD21  ASN  84          HD21      ASN  84   3.102  -6.944  -6.648
  704   HD22  ASN  84          HD22      ASN  84   2.755  -8.464  -7.390
  705    H    TYR  85           HN       TYR  85  -0.742  -4.880  -3.683
  706    HA   TYR  85           HA       TYR  85  -0.882  -7.283  -2.231
  707    HB2  TYR  85           HB2      TYR  85  -0.322  -5.261  -1.033
  708    HB3  TYR  85           HB1      TYR  85  -1.830  -4.492  -1.518
  709    HD1  TYR  85           HD1      TYR  85  -0.952  -7.767   0.083
  710    HD2  TYR  85           HD2      TYR  85  -3.259  -4.199   0.285
  711    HE1  TYR  85           HE1      TYR  85  -1.997  -8.572   2.155
  712    HE2  TYR  85           HE2      TYR  85  -4.314  -4.997   2.360
  713    HH   TYR  85           HH       TYR  85  -4.719  -6.989   3.582
  714    H    LEU  86           HN       LEU  86  -3.237  -5.061  -3.496
  715    HA   LEU  86           HA       LEU  86  -5.534  -6.456  -2.626
  716    HB2  LEU  86           HB2      LEU  86  -5.045  -4.253  -4.590
  717    HB3  LEU  86           HB1      LEU  86  -6.626  -4.997  -4.468
  718    HG   LEU  86           HG       LEU  86  -5.712  -2.821  -2.986
  719   HD11  LEU  86          HD11      LEU  86  -7.831  -3.091  -1.781
  720   HD12  LEU  86          HD12      LEU  86  -7.997  -4.709  -2.460
  721   HD13  LEU  86          HD13      LEU  86  -8.012  -3.301  -3.522
  722   HD21  LEU  86          HD21      LEU  86  -5.930  -5.174  -1.123
  723   HD22  LEU  86          HD22      LEU  86  -5.624  -3.488  -0.705
  724   HD23  LEU  86          HD23      LEU  86  -4.408  -4.413  -1.586
  725    H    GLU  87           HN       GLU  87  -3.737  -6.415  -5.687
  726    HA   GLU  87           HA       GLU  87  -5.464  -7.994  -7.216
  727    HB2  GLU  87           HB2      GLU  87  -3.490  -6.700  -8.085
  728    HB3  GLU  87           HB1      GLU  87  -2.446  -7.948  -7.422
  729    HG2  GLU  87           HG2      GLU  87  -3.553  -9.609  -8.877
  730    HG3  GLU  87           HG1      GLU  87  -4.514  -8.314  -9.584
  731    H    LYS  88           HN       LYS  88  -2.883  -8.899  -4.994
  732    HA   LYS  88           HA       LYS  88  -2.858 -11.653  -5.592
  733    HB2  LYS  88           HB2      LYS  88  -1.800  -9.934  -3.448
  734    HB3  LYS  88           HB1      LYS  88  -2.153 -11.581  -2.948
  735    HG2  LYS  88           HG2      LYS  88   0.147 -11.437  -3.609
  736    HG3  LYS  88           HG1      LYS  88  -0.728 -12.411  -4.792
  737    HD2  LYS  88           HD2      LYS  88  -0.769 -10.615  -6.354
  738    HD3  LYS  88           HD1      LYS  88  -0.172  -9.473  -5.151
  739    HE2  LYS  88           HE2      LYS  88   1.445 -11.871  -5.953
  740    HE3  LYS  88           HE1      LYS  88   1.471 -10.394  -6.915
  741    HZ1  LYS  88           HZ1      LYS  88   2.104  -9.205  -4.829
  742    HZ2  LYS  88           HZ2      LYS  88   3.274 -10.287  -5.402
  743    HZ3  LYS  88           HZ3      LYS  88   2.300 -10.713  -4.084
  744    H    LEU  89           HN       LEU  89  -4.658  -9.808  -3.141
  745    HA   LEU  89           HA       LEU  89  -6.074 -12.221  -2.345
  746    HB2  LEU  89           HB2      LEU  89  -7.101 -10.775  -0.619
  747    HB3  LEU  89           HB1      LEU  89  -5.352 -10.829  -0.554
  748    HG   LEU  89           HG       LEU  89  -5.572  -8.611  -1.993
  749   HD11  LEU  89          HD11      LEU  89  -8.111  -8.589  -0.370
  750   HD12  LEU  89          HD12      LEU  89  -8.031  -8.744  -2.125
  751   HD13  LEU  89          HD13      LEU  89  -7.465  -7.268  -1.345
  752   HD21  LEU  89          HD21      LEU  89  -4.430  -8.760   0.133
  753   HD22  LEU  89          HD22      LEU  89  -5.971  -8.779   0.991
  754   HD23  LEU  89          HD23      LEU  89  -5.470  -7.336   0.110
  755    H    GLU  90           HN       GLU  90  -6.458 -10.062  -4.776
  756    HA   GLU  90           HA       GLU  90  -9.274 -10.682  -5.084
  757    HB2  GLU  90           HB2      GLU  90  -9.508  -8.673  -3.793
  758    HB3  GLU  90           HB1      GLU  90  -8.225  -7.874  -4.691
  759    HG2  GLU  90           HG2      GLU  90  -9.932  -8.368  -6.695
  760    HG3  GLU  90           HG1      GLU  90 -11.072  -8.205  -5.361
  Start of MODEL   28
    1    H1   MET   1           HT1      MET   1   3.350   0.524  14.753
    2    H2   MET   1           HT2      MET   1   3.349   2.096  15.382
    3    H3   MET   1           HT3      MET   1   4.713   1.510  14.572
    4    HA   MET   1           HA       MET   1   3.531   1.415  12.502
    5    HB2  MET   1           HB2      MET   1   1.213   2.547  14.091
    6    HB3  MET   1           HB1      MET   1   1.244   2.341  12.347
    7    HG2  MET   1           HG2      MET   1   1.493   0.075  14.310
    8    HG3  MET   1           HG1      MET   1  -0.030   0.606  13.603
    9    HE1  MET   1           HE1      MET   1   0.126  -0.463   9.964
   10    HE2  MET   1           HE2      MET   1   0.497   1.161  10.543
   11    HE3  MET   1           HE3      MET   1  -0.803   0.234  11.291
   12    H    ALA   2           HN       ALA   2   5.417   2.918  12.558
   13    HA   ALA   2           HA       ALA   2   4.728   5.701  13.132
   14    HB1  ALA   2           HB1      ALA   2   6.827   4.998  14.049
   15    HB2  ALA   2           HB2      ALA   2   7.156   6.114  12.723
   16    HB3  ALA   2           HB3      ALA   2   7.359   4.378  12.485
   17    H    THR   3           HN       THR   3   3.191   5.255  11.191
   18    HA   THR   3           HA       THR   3   4.391   5.278   8.592
   19    HB   THR   3           HB       THR   3   2.217   5.261   7.677
   20    HG1  THR   3           HG1      THR   3   1.564   7.107   9.293
   21   HG21  THR   3          HG21      THR   3   1.036   3.552   8.830
   22   HG22  THR   3          HG22      THR   3   1.790   3.981  10.366
   23   HG23  THR   3          HG23      THR   3   2.757   3.262   9.076
   24    H    THR   4           HN       THR   4   5.007   6.943   7.385
   25    HA   THR   4           HA       THR   4   4.552   9.652   8.382
   26    HB   THR   4           HB       THR   4   6.275  10.352   6.797
   27    HG1  THR   4           HG1      THR   4   6.663   7.658   6.022
   28   HG21  THR   4          HG21      THR   4   7.133   9.537   8.894
   29   HG22  THR   4          HG22      THR   4   8.192   8.969   7.602
   30   HG23  THR   4          HG23      THR   4   7.028   7.867   8.337
   31    H    THR   5           HN       THR   5   3.654  11.277   7.022
   32    HA   THR   5           HA       THR   5   1.691  10.225   5.158
   33    HB   THR   5           HB       THR   5   2.016  13.120   5.919
   34    HG1  THR   5           HG1      THR   5   1.346  10.984   7.510
   35   HG21  THR   5          HG21      THR   5  -0.430  11.474   5.262
   36   HG22  THR   5          HG22      THR   5   0.439  12.476   4.101
   37   HG23  THR   5          HG23      THR   5  -0.358  13.223   5.486
   38    H    LEU   6           HN       LEU   6   2.385   9.884   3.190
   39    HA   LEU   6           HA       LEU   6   3.884  12.033   1.804
   40    HB2  LEU   6           HB2      LEU   6   4.330   9.094   1.299
   41    HB3  LEU   6           HB1      LEU   6   5.213  10.433   0.603
   42    HG   LEU   6           HG       LEU   6   5.268   9.713   3.535
   43   HD11  LEU   6          HD11      LEU   6   6.475   7.966   2.788
   44   HD12  LEU   6          HD12      LEU   6   7.748   9.176   2.628
   45   HD13  LEU   6          HD13      LEU   6   6.790   8.712   1.222
   46   HD21  LEU   6          HD21      LEU   6   5.760  12.067   3.069
   47   HD22  LEU   6          HD22      LEU   6   6.995  11.580   1.909
   48   HD23  LEU   6          HD23      LEU   6   7.196  11.204   3.620
   49    H    GLY   7           HN       GLY   7   3.870  11.139  -0.762
   50    HA2  GLY   7           HA2      GLY   7   1.125  11.486  -1.497
   51    HA3  GLY   7           HA1      GLY   7   2.461  11.183  -2.599
   52    H    VAL   8           HN       VAL   8  -0.397   9.965  -1.615
   53    HA   VAL   8           HA       VAL   8   0.325   7.153  -1.668
   54    HB   VAL   8           HB       VAL   8  -1.807   8.518  -0.473
   55   HG11  VAL   8          HG11      VAL   8  -2.789   6.901  -2.819
   56   HG12  VAL   8          HG12      VAL   8  -3.147   8.586  -2.445
   57   HG13  VAL   8          HG13      VAL   8  -3.792   7.299  -1.425
   58   HG21  VAL   8          HG21      VAL   8  -2.554   6.264   0.206
   59   HG22  VAL   8          HG22      VAL   8  -0.824   6.505   0.402
   60   HG23  VAL   8          HG23      VAL   8  -1.430   5.570  -0.959
   61    H    LYS   9           HN       LYS   9  -0.777   5.703  -3.055
   62    HA   LYS   9           HA       LYS   9  -1.390   6.753  -5.719
   63    HB2  LYS   9           HB2      LYS   9  -0.243   4.264  -6.134
   64    HB3  LYS   9           HB1      LYS   9   0.553   5.813  -6.378
   65    HG2  LYS   9           HG2      LYS   9   2.007   4.497  -5.045
   66    HG3  LYS   9           HG1      LYS   9   1.297   5.709  -3.981
   67    HD2  LYS   9           HD2      LYS   9  -0.479   3.675  -3.692
   68    HD3  LYS   9           HD1      LYS   9   1.009   2.778  -3.971
   69    HE2  LYS   9           HE2      LYS   9   1.810   4.673  -2.173
   70    HE3  LYS   9           HE1      LYS   9   0.166   4.312  -1.645
   71    HZ1  LYS   9           HZ1      LYS   9   2.133   2.879  -0.791
   72    HZ2  LYS   9           HZ2      LYS   9   1.997   2.103  -2.292
   73    HZ3  LYS   9           HZ3      LYS   9   0.683   2.124  -1.231
   74    H    LEU  10           HN       LEU  10  -3.630   6.504  -5.017
   75    HA   LEU  10           HA       LEU  10  -4.500   3.687  -5.128
   76    HB2  LEU  10           HB2      LEU  10  -5.518   5.859  -3.301
   77    HB3  LEU  10           HB1      LEU  10  -6.374   4.357  -3.579
   78    HG   LEU  10           HG       LEU  10  -3.586   4.505  -2.436
   79   HD11  LEU  10          HD11      LEU  10  -6.227   4.184  -1.016
   80   HD12  LEU  10          HD12      LEU  10  -5.183   5.603  -0.949
   81   HD13  LEU  10          HD13      LEU  10  -4.630   4.070  -0.276
   82   HD21  LEU  10          HD21      LEU  10  -3.955   2.378  -3.405
   83   HD22  LEU  10          HD22      LEU  10  -5.599   2.295  -2.772
   84   HD23  LEU  10          HD23      LEU  10  -4.226   2.186  -1.672
   85    H    ASP  11           HN       ASP  11  -6.149   3.276  -6.490
   86    HA   ASP  11           HA       ASP  11  -7.162   5.447  -8.133
   87    HB2  ASP  11           HB2      ASP  11  -6.478   3.055  -8.922
   88    HB3  ASP  11           HB1      ASP  11  -8.042   2.569  -8.286
   89    H    ASP  12           HN       ASP  12  -9.581   5.568  -8.477
   90    HA   ASP  12           HA       ASP  12 -10.905   5.966  -6.027
   91    HB2  ASP  12           HB2      ASP  12 -11.746   5.989  -8.879
   92    HB3  ASP  12           HB1      ASP  12 -13.022   5.788  -7.684
   93    HA   PRO  13           HA       PRO  13 -13.221   1.754  -6.810
   94    HB2  PRO  13           HB2      PRO  13 -11.929   0.018  -8.504
   95    HB3  PRO  13           HB1      PRO  13 -13.270   1.058  -8.994
   96    HG2  PRO  13           HG2      PRO  13 -10.330   1.458  -9.356
   97    HG3  PRO  13           HG1      PRO  13 -11.654   1.784 -10.491
   98    HD2  PRO  13           HD2      PRO  13 -10.476   3.750  -9.089
   99    HD3  PRO  13           HD1      PRO  13 -12.212   3.780  -9.461
  100    H    THR  14           HN       THR  14  -9.726   2.027  -6.991
  101    HA   THR  14           HA       THR  14  -9.082  -0.339  -5.586
  102    HB   THR  14           HB       THR  14  -7.537   2.258  -5.792
  103    HG1  THR  14           HG1      THR  14  -7.030  -0.127  -7.231
  104   HG21  THR  14          HG21      THR  14  -6.950   0.543  -3.928
  105   HG22  THR  14          HG22      THR  14  -5.664   1.194  -4.942
  106   HG23  THR  14          HG23      THR  14  -6.306  -0.418  -5.259
  107    H    ARG  15           HN       ARG  15  -9.754   2.977  -4.593
  108    HA   ARG  15           HA       ARG  15  -9.134   2.743  -1.865
  109    HB2  ARG  15           HB2      ARG  15  -9.579   4.872  -3.100
  110    HB3  ARG  15           HB1      ARG  15 -11.288   4.449  -3.135
  111    HG2  ARG  15           HG2      ARG  15 -11.046   5.973  -1.367
  112    HG3  ARG  15           HG1      ARG  15 -11.195   4.388  -0.606
  113    HD2  ARG  15           HD2      ARG  15  -8.739   4.287  -0.403
  114    HD3  ARG  15           HD1      ARG  15  -8.632   5.900  -1.105
  115    HE   ARG  15           HE       ARG  15 -10.336   5.841   1.183
  116   HH11  ARG  15          HH21      ARG  15  -6.996   5.974   0.169
  117   HH12  ARG  15          HH22      ARG  15  -6.444   6.736   1.622
  118   HH21  ARG  15          HH11      ARG  15  -9.629   6.841   3.110
  119   HH22  ARG  15          HH12      ARG  15  -7.951   7.232   3.304
  120    H    GLU  16           HN       GLU  16 -12.119   2.180  -3.669
  121    HA   GLU  16           HA       GLU  16 -13.756   1.464  -1.484
  122    HB2  GLU  16           HB2      GLU  16 -13.870   0.683  -4.402
  123    HB3  GLU  16           HB1      GLU  16 -15.141   0.315  -3.242
  124    HG2  GLU  16           HG2      GLU  16 -14.195   3.060  -4.035
  125    HG3  GLU  16           HG1      GLU  16 -15.690   2.279  -4.550
  126    H    ARG  17           HN       ARG  17 -11.645  -0.389  -3.613
  127    HA   ARG  17           HA       ARG  17 -12.256  -2.959  -2.682
  128    HB2  ARG  17           HB2      ARG  17 -10.896  -2.499  -4.718
  129    HB3  ARG  17           HB1      ARG  17  -9.576  -1.962  -3.686
  130    HG2  ARG  17           HG2      ARG  17  -9.062  -4.172  -4.308
  131    HG3  ARG  17           HG1      ARG  17  -9.626  -4.258  -2.638
  132    HD2  ARG  17           HD2      ARG  17 -11.892  -4.516  -4.304
  133    HD3  ARG  17           HD1      ARG  17 -10.648  -5.578  -4.957
  134    HE   ARG  17           HE       ARG  17 -12.015  -5.830  -2.417
  135   HH11  ARG  17          HH21      ARG  17  -9.265  -6.830  -4.349
  136   HH12  ARG  17          HH22      ARG  17  -9.133  -8.387  -3.581
  137   HH21  ARG  17          HH11      ARG  17 -11.827  -7.882  -1.408
  138   HH22  ARG  17          HH12      ARG  17 -10.566  -8.973  -1.919
  139    H    LEU  18           HN       LEU  18  -9.986  -0.524  -1.543
  140    HA   LEU  18           HA       LEU  18  -8.755  -2.047   0.460
  141    HB2  LEU  18           HB2      LEU  18  -9.014   0.816  -0.179
  142    HB3  LEU  18           HB1      LEU  18  -8.712   0.463   1.511
  143    HG   LEU  18           HG       LEU  18  -6.714  -0.913   0.733
  144   HD11  LEU  18          HD11      LEU  18  -5.801  -0.434  -1.446
  145   HD12  LEU  18          HD12      LEU  18  -7.174   0.605  -1.825
  146   HD13  LEU  18          HD13      LEU  18  -7.413  -1.130  -1.614
  147   HD21  LEU  18          HD21      LEU  18  -6.728   2.052   0.186
  148   HD22  LEU  18          HD22      LEU  18  -5.299   1.063   0.486
  149   HD23  LEU  18          HD23      LEU  18  -6.499   1.288   1.758
  150    H    LYS  19           HN       LYS  19 -11.797  -0.233   0.426
  151    HA   LYS  19           HA       LYS  19 -12.321  -0.365   3.181
  152    HB2  LYS  19           HB2      LYS  19 -13.645   1.035   1.661
  153    HB3  LYS  19           HB1      LYS  19 -14.289  -0.405   0.887
  154    HG2  LYS  19           HG2      LYS  19 -15.964   0.407   2.344
  155    HG3  LYS  19           HG1      LYS  19 -15.287  -1.034   3.100
  156    HD2  LYS  19           HD2      LYS  19 -14.012   0.290   4.638
  157    HD3  LYS  19           HD1      LYS  19 -14.429   1.777   3.783
  158    HE2  LYS  19           HE2      LYS  19 -16.833   1.307   4.335
  159    HE3  LYS  19           HE1      LYS  19 -16.273  -0.011   5.362
  160    HZ1  LYS  19           HZ1      LYS  19 -15.584   2.866   5.684
  161    HZ2  LYS  19           HZ2      LYS  19 -15.011   1.608   6.661
  162    HZ3  LYS  19           HZ3      LYS  19 -16.658   1.984   6.652
  163    H    ALA  20           HN       ALA  20 -12.987  -2.592   0.574
  164    HA   ALA  20           HA       ALA  20 -14.323  -4.574   2.058
  165    HB1  ALA  20           HB1      ALA  20 -13.756  -6.082   0.194
  166    HB2  ALA  20           HB2      ALA  20 -12.665  -4.854  -0.450
  167    HB3  ALA  20           HB3      ALA  20 -14.399  -4.540  -0.370
  168    H    ALA  21           HN       ALA  21 -10.918  -3.985   1.354
  169    HA   ALA  21           HA       ALA  21  -9.893  -6.332   2.562
  170    HB1  ALA  21           HB1      ALA  21  -8.533  -3.654   2.245
  171    HB2  ALA  21           HB2      ALA  21  -8.591  -4.912   1.011
  172    HB3  ALA  21           HB3      ALA  21  -7.744  -5.204   2.531
  173    H    ALA  22           HN       ALA  22 -10.684  -3.113   3.729
  174    HA   ALA  22           HA       ALA  22  -9.686  -3.293   6.336
  175    HB1  ALA  22           HB1      ALA  22 -11.119  -1.462   6.870
  176    HB2  ALA  22           HB2      ALA  22 -12.204  -1.847   5.534
  177    HB3  ALA  22           HB3      ALA  22 -10.585  -1.227   5.206
  178    H    GLN  23           HN       GLN  23 -12.699  -4.242   4.927
  179    HA   GLN  23           HA       GLN  23 -13.990  -5.115   7.288
  180    HB2  GLN  23           HB2      GLN  23 -14.406  -5.902   4.393
  181    HB3  GLN  23           HB1      GLN  23 -15.514  -6.280   5.707
  182    HG2  GLN  23           HG2      GLN  23 -14.723  -3.480   4.955
  183    HG3  GLN  23           HG1      GLN  23 -16.142  -4.297   4.301
  184   HE21  GLN  23          HE21      GLN  23 -14.733  -2.738   7.050
  185   HE22  GLN  23          HE22      GLN  23 -16.149  -2.730   8.041
  186    H    SER  24           HN       SER  24 -11.964  -6.650   4.883
  187    HA   SER  24           HA       SER  24 -12.174  -9.308   5.710
  188    HB2  SER  24           HB2      SER  24 -11.118  -8.381   3.580
  189    HB3  SER  24           HB1      SER  24  -9.687  -8.048   4.551
  190    HG   SER  24           HG       SER  24  -9.336 -10.176   4.806
  191    H    ILE  25           HN       ILE  25 -10.193  -6.651   6.930
  192    HA   ILE  25           HA       ILE  25  -8.923  -8.504   8.819
  193    HB   ILE  25           HB       ILE  25  -7.443  -7.071   7.396
  194   HG12  ILE  25          HG12      ILE  25  -5.963  -6.322   9.237
  195   HG13  ILE  25          HG11      ILE  25  -7.273  -6.600  10.380
  196   HG21  ILE  25          HG21      ILE  25  -8.712  -5.072   7.226
  197   HG22  ILE  25          HG22      ILE  25  -7.206  -4.681   8.057
  198   HG23  ILE  25          HG23      ILE  25  -8.703  -4.848   8.975
  199   HD11  ILE  25          HD11      ILE  25  -7.206  -8.934  10.014
  200   HD12  ILE  25          HD12      ILE  25  -5.538  -8.405  10.233
  201   HD13  ILE  25          HD13      ILE  25  -6.149  -8.752   8.615
  202    H    ASP  26           HN       ASP  26 -11.558  -6.700   8.632
  203    HA   ASP  26           HA       ASP  26 -13.010  -5.721  10.049
  204    HB2  ASP  26           HB2      ASP  26 -12.536  -7.990  11.174
  205    HB3  ASP  26           HB1      ASP  26 -11.586  -7.065  12.332
  206    H    ARG  27           HN       ARG  27 -11.050  -4.022   9.332
  207    HA   ARG  27           HA       ARG  27 -10.683  -2.439  11.794
  208    HB2  ARG  27           HB2      ARG  27  -8.588  -2.889   9.660
  209    HB3  ARG  27           HB1      ARG  27  -8.439  -1.743  10.987
  210    HG2  ARG  27           HG2      ARG  27  -8.591  -3.582  12.593
  211    HG3  ARG  27           HG1      ARG  27  -8.737  -4.727  11.261
  212    HD2  ARG  27           HD2      ARG  27  -6.514  -3.942  10.444
  213    HD3  ARG  27           HD1      ARG  27  -6.370  -2.987  11.921
  214    HE   ARG  27           HE       ARG  27  -6.925  -5.537  12.765
  215   HH11  ARG  27          HH21      ARG  27  -4.429  -4.060  10.805
  216   HH12  ARG  27          HH22      ARG  27  -3.209  -5.205  11.264
  217   HH21  ARG  27          HH11      ARG  27  -5.321  -7.059  13.362
  218   HH22  ARG  27          HH12      ARG  27  -3.718  -6.915  12.719
  219    H    THR  28           HN       THR  28 -10.312  -0.123  11.362
  220    HA   THR  28           HA       THR  28 -12.232   0.851   9.515
  221    HB   THR  28           HB       THR  28 -11.324   1.825  11.824
  222    HG1  THR  28           HG1      THR  28 -12.847   3.183  11.344
  223   HG21  THR  28          HG21      THR  28  -9.803   3.461   9.790
  224   HG22  THR  28          HG22      THR  28  -9.074   2.362  10.962
  225   HG23  THR  28          HG23      THR  28  -9.938   3.796  11.516
  226    HA   PRO  29           HA       PRO  29 -10.169   1.487   5.671
  227    HB2  PRO  29           HB2      PRO  29 -10.866   4.377   5.947
  228    HB3  PRO  29           HB1      PRO  29 -11.124   3.280   4.585
  229    HG2  PRO  29           HG2      PRO  29 -13.135   3.943   6.194
  230    HG3  PRO  29           HG1      PRO  29 -12.980   2.295   5.558
  231    HD2  PRO  29           HD2      PRO  29 -12.435   3.331   8.295
  232    HD3  PRO  29           HD1      PRO  29 -13.026   1.738   7.784
  233    H    HIS  30           HN       HIS  30  -9.510   4.203   7.925
  234    HA   HIS  30           HA       HIS  30  -7.062   4.907   6.698
  235    HB2  HIS  30           HB2      HIS  30  -8.263   5.512   9.385
  236    HB3  HIS  30           HB1      HIS  30  -6.622   6.022   8.997
  237    HD1  HIS  30           HD1      HIS  30  -9.915   7.326   8.964
  238    HD2  HIS  30           HD2      HIS  30  -6.716   7.479   6.310
  239    HE1  HIS  30           HE1      HIS  30 -10.373   9.295   7.470
  240    HE2  HIS  30           HE2      HIS  30  -8.313   9.499   6.034
  241    H    TRP  31           HN       TRP  31  -7.826   2.732   9.385
  242    HA   TRP  31           HA       TRP  31  -5.102   2.157   9.945
  243    HB2  TRP  31           HB2      TRP  31  -7.011   1.747  11.556
  244    HB3  TRP  31           HB1      TRP  31  -7.450   0.359  10.562
  245    HD1  TRP  31           HD1      TRP  31  -5.488  -1.606  10.371
  246    HE1  TRP  31           HE1      TRP  31  -3.812  -2.401  12.157
  247    HE3  TRP  31           HE3      TRP  31  -5.672   2.417  13.519
  248    HZ2  TRP  31           HZ2      TRP  31  -2.719  -1.461  14.575
  249    HZ3  TRP  31           HZ3      TRP  31  -4.282   2.388  15.549
  250    HH2  TRP  31           HH2      TRP  31  -2.837   0.489  16.065
  251    H    LEU  32           HN       LEU  32  -7.590   0.740   7.978
  252    HA   LEU  32           HA       LEU  32  -6.229  -1.543   7.165
  253    HB2  LEU  32           HB2      LEU  32  -8.607  -1.250   6.788
  254    HB3  LEU  32           HB1      LEU  32  -8.280   0.054   5.666
  255    HG   LEU  32           HG       LEU  32  -8.885  -2.263   4.716
  256   HD11  LEU  32          HD11      LEU  32  -7.850  -0.260   3.497
  257   HD12  LEU  32          HD12      LEU  32  -7.735  -1.849   2.744
  258   HD13  LEU  32          HD13      LEU  32  -6.341  -1.170   3.582
  259   HD21  LEU  32          HD21      LEU  32  -7.070  -3.826   4.431
  260   HD22  LEU  32          HD22      LEU  32  -7.340  -3.532   6.149
  261   HD23  LEU  32          HD23      LEU  32  -5.980  -2.769   5.327
  262    H    ILE  33           HN       ILE  33  -6.395   1.625   5.621
  263    HA   ILE  33           HA       ILE  33  -4.883   0.956   3.388
  264    HB   ILE  33           HB       ILE  33  -6.132   3.059   3.555
  265   HG12  ILE  33          HG12      ILE  33  -3.193   3.329   2.955
  266   HG13  ILE  33          HG11      ILE  33  -4.483   2.930   1.827
  267   HG21  ILE  33          HG21      ILE  33  -5.281   4.979   4.744
  268   HG22  ILE  33          HG22      ILE  33  -3.932   4.024   5.360
  269   HG23  ILE  33          HG23      ILE  33  -5.580   3.646   5.860
  270   HD11  ILE  33          HD11      ILE  33  -5.434   5.198   2.237
  271   HD12  ILE  33          HD12      ILE  33  -3.849   5.192   1.465
  272   HD13  ILE  33          HD13      ILE  33  -3.991   5.569   3.182
  273    H    LYS  34           HN       LYS  34  -3.737   2.222   6.547
  274    HA   LYS  34           HA       LYS  34  -0.994   2.054   5.766
  275    HB2  LYS  34           HB2      LYS  34  -0.497   2.276   8.206
  276    HB3  LYS  34           HB1      LYS  34  -1.470   3.564   7.517
  277    HG2  LYS  34           HG2      LYS  34  -3.462   2.643   8.499
  278    HG3  LYS  34           HG1      LYS  34  -2.560   1.248   9.094
  279    HD2  LYS  34           HD2      LYS  34  -2.955   2.918  10.855
  280    HD3  LYS  34           HD1      LYS  34  -1.238   2.683  10.535
  281    HE2  LYS  34           HE2      LYS  34  -1.970   5.075  10.831
  282    HE3  LYS  34           HE1      LYS  34  -1.081   4.728   9.351
  283    HZ1  LYS  34           HZ1      LYS  34  -2.829   5.263   8.091
  284    HZ2  LYS  34           HZ2      LYS  34  -3.416   6.055   9.463
  285    HZ3  LYS  34           HZ3      LYS  34  -3.948   4.488   9.096
  286    H    GLN  35           HN       GLN  35  -3.141  -0.165   7.509
  287    HA   GLN  35           HA       GLN  35  -1.056  -2.027   8.039
  288    HB2  GLN  35           HB2      GLN  35  -2.590  -3.220   9.193
  289    HB3  GLN  35           HB1      GLN  35  -3.500  -1.728   9.082
  290    HG2  GLN  35           HG2      GLN  35  -5.098  -3.226   8.478
  291    HG3  GLN  35           HG1      GLN  35  -4.446  -2.811   6.898
  292   HE21  GLN  35          HE21      GLN  35  -2.518  -4.808   8.964
  293   HE22  GLN  35          HE22      GLN  35  -2.795  -6.294   8.136
  294    H    ALA  36           HN       ALA  36  -3.262  -1.562   5.363
  295    HA   ALA  36           HA       ALA  36  -3.025  -4.049   4.111
  296    HB1  ALA  36           HB1      ALA  36  -3.551  -1.296   3.025
  297    HB2  ALA  36           HB2      ALA  36  -4.696  -2.610   3.292
  298    HB3  ALA  36           HB3      ALA  36  -3.513  -2.723   1.989
  299    H    ILE  37           HN       ILE  37  -1.108  -1.069   3.631
  300    HA   ILE  37           HA       ILE  37   0.611  -2.325   1.748
  301    HB   ILE  37           HB       ILE  37   0.560   0.049   1.713
  302   HG12  ILE  37          HG12      ILE  37   2.966   0.637   1.969
  303   HG13  ILE  37          HG11      ILE  37   3.225  -0.905   2.774
  304   HG21  ILE  37          HG21      ILE  37   1.430  -0.061   4.581
  305   HG22  ILE  37          HG22      ILE  37  -0.069   0.594   3.927
  306   HG23  ILE  37          HG23      ILE  37   1.464   1.404   3.601
  307   HD11  ILE  37          HD11      ILE  37   2.211  -0.599  -0.041
  308   HD12  ILE  37          HD12      ILE  37   2.656  -2.100   0.772
  309   HD13  ILE  37          HD13      ILE  37   3.892  -0.897   0.401
  310    H    PHE  38           HN       PHE  38   0.750  -1.971   5.262
  311    HA   PHE  38           HA       PHE  38   3.345  -3.141   5.524
  312    HB2  PHE  38           HB2      PHE  38   1.080  -2.727   7.499
  313    HB3  PHE  38           HB1      PHE  38   2.625  -3.436   7.950
  314    HD1  PHE  38           HD2      PHE  38   2.948  -0.917   5.438
  315    HD2  PHE  38           HD1      PHE  38   2.564  -1.521   9.630
  316    HE1  PHE  38           HE2      PHE  38   3.849   1.334   5.839
  317    HE2  PHE  38           HE1      PHE  38   3.470   0.730  10.038
  318    HZ   PHE  38           HZ       PHE  38   4.117   2.159   8.141
  319    H    ASN  39           HN       ASN  39   0.044  -4.335   5.523
  320    HA   ASN  39           HA       ASN  39   0.577  -6.967   6.345
  321    HB2  ASN  39           HB2      ASN  39  -1.726  -5.848   6.145
  322    HB3  ASN  39           HB1      ASN  39  -1.622  -6.197   4.424
  323   HD21  ASN  39          HD21      ASN  39  -3.609  -7.165   6.183
  324   HD22  ASN  39          HD22      ASN  39  -3.469  -8.887   6.256
  325    H    TYR  40           HN       TYR  40   0.624  -5.290   3.275
  326    HA   TYR  40           HA       TYR  40   1.018  -7.509   1.629
  327    HB2  TYR  40           HB2      TYR  40   0.563  -5.311   0.676
  328    HB3  TYR  40           HB1      TYR  40   2.069  -4.681   1.330
  329    HD1  TYR  40           HD1      TYR  40   0.946  -7.530  -0.829
  330    HD2  TYR  40           HD2      TYR  40   3.818  -4.464  -0.151
  331    HE1  TYR  40           HE1      TYR  40   2.127  -8.191  -2.881
  332    HE2  TYR  40           HE2      TYR  40   5.004  -5.115  -2.205
  333    HH   TYR  40           HH       TYR  40   5.114  -7.534  -3.576
  334    H    LEU  41           HN       LEU  41   3.233  -5.477   3.432
  335    HA   LEU  41           HA       LEU  41   5.614  -6.772   2.657
  336    HB2  LEU  41           HB2      LEU  41   4.999  -5.120   5.095
  337    HB3  LEU  41           HB1      LEU  41   6.607  -5.607   4.596
  338    HG   LEU  41           HG       LEU  41   4.756  -3.785   3.049
  339   HD11  LEU  41          HD11      LEU  41   7.342  -3.203   4.478
  340   HD12  LEU  41          HD12      LEU  41   5.739  -2.840   5.114
  341   HD13  LEU  41          HD13      LEU  41   6.306  -2.045   3.645
  342   HD21  LEU  41          HD21      LEU  41   6.043  -4.965   1.456
  343   HD22  LEU  41          HD22      LEU  41   7.491  -4.885   2.456
  344   HD23  LEU  41          HD23      LEU  41   6.868  -3.423   1.691
  345    H    GLU  42           HN       GLU  42   3.384  -7.206   5.353
  346    HA   GLU  42           HA       GLU  42   4.931  -9.173   6.715
  347    HB2  GLU  42           HB2      GLU  42   2.016  -8.398   6.878
  348    HB3  GLU  42           HB1      GLU  42   2.727  -9.644   7.891
  349    HG2  GLU  42           HG2      GLU  42   4.279  -8.010   8.828
  350    HG3  GLU  42           HG1      GLU  42   3.593  -6.756   7.799
  351    H    LYS  43           HN       LYS  43   2.379  -9.280   4.326
  352    HA   LYS  43           HA       LYS  43   1.838 -12.056   4.361
  353    HB2  LYS  43           HB2      LYS  43   0.394 -10.203   3.414
  354    HB3  LYS  43           HB1      LYS  43   1.498 -10.128   2.054
  355    HG2  LYS  43           HG2      LYS  43  -0.304 -11.406   1.305
  356    HG3  LYS  43           HG1      LYS  43   0.953 -12.587   1.679
  357    HD2  LYS  43           HD2      LYS  43  -0.103 -13.158   3.748
  358    HD3  LYS  43           HD1      LYS  43  -1.241 -11.819   3.599
  359    HE2  LYS  43           HE2      LYS  43  -1.100 -14.067   1.605
  360    HE3  LYS  43           HE1      LYS  43  -2.127 -14.126   3.036
  361    HZ1  LYS  43           HZ1      LYS  43  -2.319 -11.798   1.261
  362    HZ2  LYS  43           HZ2      LYS  43  -3.506 -12.514   2.230
  363    HZ3  LYS  43           HZ3      LYS  43  -3.047 -13.247   0.777
  364    H    LEU  44           HN       LEU  44   4.021 -10.044   2.399
  365    HA   LEU  44           HA       LEU  44   4.940 -12.418   0.987
  366    HB2  LEU  44           HB2      LEU  44   6.128 -11.011  -0.487
  367    HB3  LEU  44           HB1      LEU  44   4.592 -10.220  -0.205
  368    HG   LEU  44           HG       LEU  44   6.098  -8.994   1.674
  369   HD11  LEU  44          HD11      LEU  44   8.141 -10.155   1.027
  370   HD12  LEU  44          HD12      LEU  44   8.259  -8.427   0.694
  371   HD13  LEU  44          HD13      LEU  44   7.965  -9.560  -0.625
  372   HD21  LEU  44          HD21      LEU  44   4.675  -7.958  -0.047
  373   HD22  LEU  44          HD22      LEU  44   5.970  -8.187  -1.223
  374   HD23  LEU  44          HD23      LEU  44   6.214  -7.123   0.163
  375    H    GLU  45           HN       GLU  45   5.853 -10.378   3.594
  376    HA   GLU  45           HA       GLU  45   7.805 -10.037   4.734
  377    HB2  GLU  45           HB2      GLU  45   8.470 -12.402   5.762
  378    HB3  GLU  45           HB1      GLU  45   7.056 -11.497   6.270
  379    HG2  GLU  45           HG2      GLU  45   5.740 -12.860   4.608
  380    HG3  GLU  45           HG1      GLU  45   7.176 -13.870   4.438
  381    H1   MET  46           HT1      MET  46  -3.368   0.923 -14.573
  382    H2   MET  46           HT2      MET  46  -3.076   2.441 -15.260
  383    H3   MET  46           HT3      MET  46  -4.577   2.108 -14.553
  384    HA   MET  46           HA       MET  46  -3.457   1.826 -12.387
  385    HB2  MET  46           HB2      MET  46  -1.113   2.972 -13.926
  386    HB3  MET  46           HB1      MET  46  -1.167   2.738 -12.186
  387    HG2  MET  46           HG2      MET  46  -1.410   0.506 -14.189
  388    HG3  MET  46           HG1      MET  46   0.111   1.014 -13.460
  389    HE1  MET  46           HE1      MET  46  -0.078  -0.116  -9.846
  390    HE2  MET  46           HE2      MET  46  -0.439   1.519 -10.398
  391    HE3  MET  46           HE3      MET  46   0.862   0.601 -11.156
  392    H    ALA  47           HN       ALA  47  -5.313   3.351 -12.348
  393    HA   ALA  47           HA       ALA  47  -4.604   6.141 -12.902
  394    HB1  ALA  47           HB1      ALA  47  -6.700   5.478 -13.855
  395    HB2  ALA  47           HB2      ALA  47  -7.039   6.567 -12.511
  396    HB3  ALA  47           HB3      ALA  47  -7.257   4.828 -12.313
  397    H    THR  48           HN       THR  48  -3.100   5.568 -10.944
  398    HA   THR  48           HA       THR  48  -4.282   5.581  -8.350
  399    HB   THR  48           HB       THR  48  -2.100   5.522  -7.448
  400    HG1  THR  48           HG1      THR  48  -1.434   7.384  -9.094
  401   HG21  THR  48          HG21      THR  48  -0.950   3.837  -8.654
  402   HG22  THR  48          HG22      THR  48  -1.695   4.331 -10.174
  403   HG23  THR  48          HG23      THR  48  -2.674   3.579  -8.914
  404    H    THR  49           HN       THR  49  -4.858   7.216  -7.070
  405    HA   THR  49           HA       THR  49  -4.375   9.948  -7.998
  406    HB   THR  49           HB       THR  49  -6.095  10.638  -6.413
  407    HG1  THR  49           HG1      THR  49  -6.534   7.938  -5.687
  408   HG21  THR  49          HG21      THR  49  -6.959   9.886  -8.525
  409   HG22  THR  49          HG22      THR  49  -8.031   9.295  -7.254
  410   HG23  THR  49          HG23      THR  49  -6.874   8.201  -8.012
  411    H    THR  50           HN       THR  50  -3.440  11.512  -6.604
  412    HA   THR  50           HA       THR  50  -1.500  10.383  -4.763
  413    HB   THR  50           HB       THR  50  -1.783  13.304  -5.433
  414    HG1  THR  50           HG1      THR  50  -0.898  11.171  -7.039
  415   HG21  THR  50          HG21      THR  50   0.644  11.594  -4.870
  416   HG22  THR  50          HG22      THR  50  -0.190  12.573  -3.662
  417   HG23  THR  50          HG23      THR  50   0.599  13.350  -5.035
  418    H    LEU  51           HN       LEU  51  -2.207  10.005  -2.798
  419    HA   LEU  51           HA       LEU  51  -3.670  12.145  -1.361
  420    HB2  LEU  51           HB2      LEU  51  -4.171   9.204  -0.931
  421    HB3  LEU  51           HB1      LEU  51  -5.031  10.540  -0.203
  422    HG   LEU  51           HG       LEU  51  -5.093   9.900  -3.155
  423   HD11  LEU  51          HD11      LEU  51  -6.327   8.150  -2.463
  424   HD12  LEU  51          HD12      LEU  51  -7.582   9.373  -2.262
  425   HD13  LEU  51          HD13      LEU  51  -6.629   8.851  -0.873
  426   HD21  LEU  51          HD21      LEU  51  -5.553  12.246  -2.622
  427   HD22  LEU  51          HD22      LEU  51  -6.797  11.743  -1.477
  428   HD23  LEU  51          HD23      LEU  51  -7.000  11.419  -3.198
  429    H    GLY  52           HN       GLY  52  -3.676  11.188   1.186
  430    HA2  GLY  52           HA2      GLY  52  -0.927  11.459   1.935
  431    HA3  GLY  52           HA1      GLY  52  -2.270  11.148   3.024
  432    H    VAL  53           HN       VAL  53   0.566   9.907   2.004
  433    HA   VAL  53           HA       VAL  53  -0.202   7.107   1.972
  434    HB   VAL  53           HB       VAL  53   1.952   8.470   0.815
  435   HG11  VAL  53          HG11      VAL  53   2.904   6.769   3.114
  436   HG12  VAL  53          HG12      VAL  53   3.294   8.457   2.787
  437   HG13  VAL  53          HG13      VAL  53   3.915   7.186   1.732
  438   HG21  VAL  53          HG21      VAL  53   2.660   6.229   0.065
  439   HG22  VAL  53          HG22      VAL  53   0.933   6.499  -0.117
  440   HG23  VAL  53          HG23      VAL  53   1.530   5.515   1.213
  441    H    LYS  54           HN       LYS  54   0.878   5.599   3.310
  442    HA   LYS  54           HA       LYS  54   1.507   6.558   6.005
  443    HB2  LYS  54           HB2      LYS  54   0.328   4.071   6.340
  444    HB3  LYS  54           HB1      LYS  54  -0.451   5.622   6.633
  445    HG2  LYS  54           HG2      LYS  54  -1.920   4.371   5.257
  446    HG3  LYS  54           HG1      LYS  54  -1.190   5.603   4.231
  447    HD2  LYS  54           HD2      LYS  54   0.556   3.555   3.880
  448    HD3  LYS  54           HD1      LYS  54  -0.942   2.669   4.136
  449    HE2  LYS  54           HE2      LYS  54  -1.722   4.624   2.393
  450    HE3  LYS  54           HE1      LYS  54  -0.083   4.257   1.852
  451    HZ1  LYS  54           HZ1      LYS  54  -2.068   2.873   0.960
  452    HZ2  LYS  54           HZ2      LYS  54  -1.943   2.054   2.439
  453    HZ3  LYS  54           HZ3      LYS  54  -0.628   2.087   1.379
  454    H    LEU  55           HN       LEU  55   3.746   6.298   5.297
  455    HA   LEU  55           HA       LEU  55   4.571   3.466   5.318
  456    HB2  LEU  55           HB2      LEU  55   5.617   5.678   3.557
  457    HB3  LEU  55           HB1      LEU  55   6.457   4.160   3.791
  458    HG   LEU  55           HG       LEU  55   3.671   4.374   2.651
  459   HD11  LEU  55          HD11      LEU  55   6.307   4.056   1.222
  460   HD12  LEU  55          HD12      LEU  55   5.285   5.493   1.199
  461   HD13  LEU  55          HD13      LEU  55   4.708   3.989   0.481
  462   HD21  LEU  55          HD21      LEU  55   4.012   2.214   3.559
  463   HD22  LEU  55          HD22      LEU  55   5.654   2.128   2.923
  464   HD23  LEU  55          HD23      LEU  55   4.279   2.070   1.822
  465    H    ASP  56           HN       ASP  56   6.204   2.984   6.671
  466    HA   ASP  56           HA       ASP  56   7.260   5.082   8.378
  467    HB2  ASP  56           HB2      ASP  56   6.540   2.676   9.094
  468    HB3  ASP  56           HB1      ASP  56   8.090   2.184   8.429
  469    H    ASP  57           HN       ASP  57   9.683   5.152   8.714
  470    HA   ASP  57           HA       ASP  57  10.991   5.595   6.259
  471    HB2  ASP  57           HB2      ASP  57  11.808   5.616   9.102
  472    HB3  ASP  57           HB1      ASP  57  13.105   5.330   7.946
  473    HA   PRO  58           HA       PRO  58  13.266   1.345   6.942
  474    HB2  PRO  58           HB2      PRO  58  11.928  -0.418   8.579
  475    HB3  PRO  58           HB1      PRO  58  13.295   0.573   9.096
  476    HG2  PRO  58           HG2      PRO  58  10.366   1.032   9.483
  477    HG3  PRO  58           HG1      PRO  58  11.703   1.296  10.619
  478    HD2  PRO  58           HD2      PRO  58  10.563   3.328   9.282
  479    HD3  PRO  58           HD1      PRO  58  12.302   3.307   9.640
  480    H    THR  59           HN       THR  59   9.777   1.647   7.128
  481    HA   THR  59           HA       THR  59   9.096  -0.655   5.643
  482    HB   THR  59           HB       THR  59   7.596   1.954   5.939
  483    HG1  THR  59           HG1      THR  59   6.758  -0.314   7.282
  484   HG21  THR  59          HG21      THR  59   6.977   0.316   4.018
  485   HG22  THR  59          HG22      THR  59   5.704   0.954   5.055
  486   HG23  THR  59          HG23      THR  59   6.317  -0.678   5.316
  487    H    ARG  60           HN       ARG  60   9.819   2.681   4.763
  488    HA   ARG  60           HA       ARG  60   9.182   2.556   2.031
  489    HB2  ARG  60           HB2      ARG  60   9.669   4.630   3.342
  490    HB3  ARG  60           HB1      ARG  60  11.367   4.175   3.366
  491    HG2  ARG  60           HG2      ARG  60  11.166   5.763   1.654
  492    HG3  ARG  60           HG1      ARG  60  11.270   4.205   0.833
  493    HD2  ARG  60           HD2      ARG  60   8.797   4.182   0.666
  494    HD3  ARG  60           HD1      ARG  60   8.765   5.792   1.382
  495    HE   ARG  60           HE       ARG  60  10.453   5.701  -0.907
  496   HH11  ARG  60          HH21      ARG  60   7.114   5.897   0.098
  497   HH12  ARG  60          HH22      ARG  60   6.581   6.669  -1.356
  498   HH21  ARG  60          HH11      ARG  60   9.766   6.708  -2.836
  499   HH22  ARG  60          HH12      ARG  60   8.099   7.132  -3.036
  500    H    GLU  61           HN       GLU  61  12.169   1.896   3.797
  501    HA   GLU  61           HA       GLU  61  13.769   1.235   1.573
  502    HB2  GLU  61           HB2      GLU  61  13.971   0.314   4.447
  503    HB3  GLU  61           HB1      GLU  61  15.228   0.107   3.235
  504    HG2  GLU  61           HG2      GLU  61  14.162   2.731   4.257
  505    HG3  GLU  61           HG1      GLU  61  15.706   1.993   4.681
  506    H    ARG  62           HN       ARG  62  11.679  -0.665   3.680
  507    HA   ARG  62           HA       ARG  62  12.245  -3.217   2.674
  508    HB2  ARG  62           HB2      ARG  62  10.890  -2.784   4.722
  509    HB3  ARG  62           HB1      ARG  62   9.581  -2.197   3.703
  510    HG2  ARG  62           HG2      ARG  62   9.018  -4.408   4.250
  511    HG3  ARG  62           HG1      ARG  62   9.616  -4.470   2.590
  512    HD2  ARG  62           HD2      ARG  62  11.836  -4.780   4.310
  513    HD3  ARG  62           HD1      ARG  62  10.569  -5.856   4.891
  514    HE   ARG  62           HE       ARG  62  12.031  -6.050   2.404
  515   HH11  ARG  62          HH21      ARG  62   9.133  -7.010   4.114
  516   HH12  ARG  62          HH22      ARG  62   9.041  -8.569   3.343
  517   HH21  ARG  62          HH11      ARG  62  11.887  -8.098   1.368
  518   HH22  ARG  62          HH12      ARG  62  10.586  -9.175   1.792
  519    H    LEU  63           HN       LEU  63  10.005  -0.712   1.607
  520    HA   LEU  63           HA       LEU  63   8.744  -2.165  -0.430
  521    HB2  LEU  63           HB2      LEU  63   9.046   0.678   0.275
  522    HB3  LEU  63           HB1      LEU  63   8.738   0.367  -1.422
  523    HG   LEU  63           HG       LEU  63   6.720  -0.993  -0.683
  524   HD11  LEU  63          HD11      LEU  63   5.810  -0.572   1.507
  525   HD12  LEU  63          HD12      LEU  63   7.196   0.434   1.923
  526   HD13  LEU  63          HD13      LEU  63   7.411  -1.296   1.655
  527   HD21  LEU  63          HD21      LEU  63   6.775   1.952  -0.045
  528   HD22  LEU  63          HD22      LEU  63   5.332   0.992  -0.374
  529   HD23  LEU  63          HD23      LEU  63   6.535   1.238  -1.640
  530    H    LYS  64           HN       LYS  64  11.813  -0.394  -0.363
  531    HA   LYS  64           HA       LYS  64  12.334  -0.482  -3.120
  532    HB2  LYS  64           HB2      LYS  64  13.682   0.867  -1.571
  533    HB3  LYS  64           HB1      LYS  64  14.302  -0.600  -0.831
  534    HG2  LYS  64           HG2      LYS  64  15.990   0.222  -2.267
  535    HG3  LYS  64           HG1      LYS  64  15.301  -1.199  -3.049
  536    HD2  LYS  64           HD2      LYS  64  14.050   0.170  -4.574
  537    HD3  LYS  64           HD1      LYS  64  14.487   1.637  -3.694
  538    HE2  LYS  64           HE2      LYS  64  16.865   1.207  -4.250
  539    HE3  LYS  64           HE1      LYS  64  16.359  -0.177  -5.216
  540    HZ1  LYS  64           HZ1      LYS  64  15.615   2.661  -5.703
  541    HZ2  LYS  64           HZ2      LYS  64  15.069   1.341  -6.610
  542    HZ3  LYS  64           HZ3      LYS  64  16.711   1.744  -6.611
  543    H    ALA  65           HN       ALA  65  12.988  -2.776  -0.567
  544    HA   ALA  65           HA       ALA  65  14.277  -4.741  -2.104
  545    HB1  ALA  65           HB1      ALA  65  13.680  -6.291  -0.285
  546    HB2  ALA  65           HB2      ALA  65  12.608  -5.065   0.391
  547    HB3  ALA  65           HB3      ALA  65  14.348  -4.778   0.324
  548    H    ALA  66           HN       ALA  66  10.877  -4.120  -1.386
  549    HA   ALA  66           HA       ALA  66   9.815  -6.407  -2.669
  550    HB1  ALA  66           HB1      ALA  66   8.501  -3.719  -2.274
  551    HB2  ALA  66           HB2      ALA  66   8.536  -5.014  -1.078
  552    HB3  ALA  66           HB3      ALA  66   7.685  -5.247  -2.606
  553    H    ALA  67           HN       ALA  67  10.661  -3.170  -3.741
  554    HA   ALA  67           HA       ALA  67   9.663  -3.255  -6.353
  555    HB1  ALA  67           HB1      ALA  67  11.129  -1.435  -6.831
  556    HB2  ALA  67           HB2      ALA  67  12.204  -1.881  -5.506
  557    HB3  ALA  67           HB3      ALA  67  10.597  -1.241  -5.160
  558    H    GLN  68           HN       GLN  68  12.642  -4.315  -4.960
  559    HA   GLN  68           HA       GLN  68  13.928  -5.137  -7.346
  560    HB2  GLN  68           HB2      GLN  68  14.325  -5.995  -4.468
  561    HB3  GLN  68           HB1      GLN  68  15.421  -6.385  -5.789
  562    HG2  GLN  68           HG2      GLN  68  14.716  -3.578  -4.982
  563    HG3  GLN  68           HG1      GLN  68  16.115  -4.448  -4.356
  564   HE21  GLN  68          HE21      GLN  68  14.721  -2.811  -7.065
  565   HE22  GLN  68          HE22      GLN  68  16.127  -2.813  -8.068
  566    H    SER  69           HN       SER  69  11.858  -6.687  -4.994
  567    HA   SER  69           HA       SER  69  12.018  -9.330  -5.885
  568    HB2  SER  69           HB2      SER  69  10.998  -8.495  -3.727
  569    HB3  SER  69           HB1      SER  69   9.593  -7.997  -4.664
  570    HG   SER  69           HG       SER  69   9.331 -10.193  -5.283
  571    H    ILE  70           HN       ILE  70  10.136  -6.590  -7.065
  572    HA   ILE  70           HA       ILE  70   8.828  -8.367  -9.004
  573    HB   ILE  70           HB       ILE  70   7.357  -6.969  -7.537
  574   HG12  ILE  70          HG12      ILE  70   5.897  -6.126  -9.364
  575   HG13  ILE  70          HG11      ILE  70   7.208  -6.409 -10.506
  576   HG21  ILE  70          HG21      ILE  70   8.649  -4.990  -7.295
  577   HG22  ILE  70          HG22      ILE  70   7.148  -4.555  -8.115
  578   HG23  ILE  70          HG23      ILE  70   8.645  -4.705  -9.035
  579   HD11  ILE  70          HD11      ILE  70   7.084  -8.746 -10.202
  580   HD12  ILE  70          HD12      ILE  70   5.428  -8.175 -10.408
  581   HD13  ILE  70          HD13      ILE  70   6.030  -8.578  -8.799
  582    H    ASP  71           HN       ASP  71  11.491  -6.608  -8.765
  583    HA   ASP  71           HA       ASP  71  12.939  -5.584 -10.157
  584    HB2  ASP  71           HB2      ASP  71  12.477  -7.803 -11.356
  585    HB3  ASP  71           HB1      ASP  71  11.479  -6.860 -12.459
  586    H    ARG  72           HN       ARG  72  11.007  -3.885  -9.374
  587    HA   ARG  72           HA       ARG  72  10.648  -2.238 -11.793
  588    HB2  ARG  72           HB2      ARG  72   8.539  -2.746  -9.684
  589    HB3  ARG  72           HB1      ARG  72   8.404  -1.546 -10.963
  590    HG2  ARG  72           HG2      ARG  72   8.558  -3.308 -12.646
  591    HG3  ARG  72           HG1      ARG  72   8.705  -4.515 -11.371
  592    HD2  ARG  72           HD2      ARG  72   6.470  -3.794 -10.535
  593    HD3  ARG  72           HD1      ARG  72   6.333  -2.753 -11.956
  594    HE   ARG  72           HE       ARG  72   6.915  -5.235 -12.956
  595   HH11  ARG  72          HH21      ARG  72   4.394  -3.936 -10.906
  596   HH12  ARG  72          HH22      ARG  72   3.198  -5.074 -11.436
  597   HH21  ARG  72          HH11      ARG  72   5.358  -6.738 -13.659
  598   HH22  ARG  72          HH12      ARG  72   3.746  -6.670 -13.019
  599    H    THR  73           HN       THR  73  10.318   0.079 -11.302
  600    HA   THR  73           HA       THR  73  12.256   0.965  -9.425
  601    HB   THR  73           HB       THR  73  11.319   2.024 -11.705
  602    HG1  THR  73           HG1      THR  73  12.992   3.177 -11.180
  603   HG21  THR  73          HG21      THR  73   9.915   3.631  -9.569
  604   HG22  THR  73          HG22      THR  73   9.120   2.610 -10.769
  605   HG23  THR  73          HG23      THR  73  10.021   4.038 -11.280
  606    HA   PRO  74           HA       PRO  74  10.213   1.495  -5.556
  607    HB2  PRO  74           HB2      PRO  74  10.956   4.382  -5.752
  608    HB3  PRO  74           HB1      PRO  74  11.190   3.247  -4.417
  609    HG2  PRO  74           HG2      PRO  74  13.219   3.912  -6.000
  610    HG3  PRO  74           HG1      PRO  74  13.029   2.248  -5.416
  611    HD2  PRO  74           HD2      PRO  74  12.511   3.379  -8.120
  612    HD3  PRO  74           HD1      PRO  74  13.067   1.758  -7.659
  613    H    HIS  75           HN       HIS  75   9.583   4.292  -7.717
  614    HA   HIS  75           HA       HIS  75   7.144   4.994  -6.474
  615    HB2  HIS  75           HB2      HIS  75   8.363   5.662  -9.136
  616    HB3  HIS  75           HB1      HIS  75   6.724   6.178  -8.746
  617    HD1  HIS  75           HD1      HIS  75  10.027   7.438  -8.661
  618    HD2  HIS  75           HD2      HIS  75   6.817   7.577  -6.020
  619    HE1  HIS  75           HE1      HIS  75  10.496   9.378  -7.133
  620    HE2  HIS  75           HE2      HIS  75   8.445   9.567  -5.684
  621    H    TRP  76           HN       TRP  76   7.872   2.892  -9.227
  622    HA   TRP  76           HA       TRP  76   5.142   2.364  -9.801
  623    HB2  TRP  76           HB2      TRP  76   7.051   1.978 -11.419
  624    HB3  TRP  76           HB1      TRP  76   7.463   0.553 -10.463
  625    HD1  TRP  76           HD1      TRP  76   5.484  -1.398 -10.347
  626    HE1  TRP  76           HE1      TRP  76   3.784  -2.099 -12.151
  627    HE3  TRP  76           HE3      TRP  76   5.721   2.731 -13.348
  628    HZ2  TRP  76           HZ2      TRP  76   2.697  -1.054 -14.532
  629    HZ3  TRP  76           HZ3      TRP  76   4.326   2.799 -15.373
  630    HH2  TRP  76           HH2      TRP  76   2.846   0.946 -15.953
  631    H    LEU  77           HN       LEU  77   7.615   0.868  -7.872
  632    HA   LEU  77           HA       LEU  77   6.222  -1.422  -7.131
  633    HB2  LEU  77           HB2      LEU  77   8.603  -1.185  -6.744
  634    HB3  LEU  77           HB1      LEU  77   8.305   0.093  -5.585
  635    HG   LEU  77           HG       LEU  77   8.872  -2.259  -4.702
  636   HD11  LEU  77          HD11      LEU  77   7.871  -0.281  -3.420
  637   HD12  LEU  77          HD12      LEU  77   7.731  -1.890  -2.716
  638   HD13  LEU  77          HD13      LEU  77   6.347  -1.162  -3.528
  639   HD21  LEU  77          HD21      LEU  77   7.038  -3.807  -4.453
  640   HD22  LEU  77          HD22      LEU  77   7.308  -3.474  -6.163
  641   HD23  LEU  77          HD23      LEU  77   5.958  -2.715  -5.319
  642    H    ILE  78           HN       ILE  78   6.444   1.685  -5.476
  643    HA   ILE  78           HA       ILE  78   4.914   0.977  -3.273
  644    HB   ILE  78           HB       ILE  78   6.196   3.061  -3.385
  645   HG12  ILE  78          HG12      ILE  78   3.264   3.359  -2.769
  646   HG13  ILE  78          HG11      ILE  78   4.552   2.907  -1.658
  647   HG21  ILE  78          HG21      ILE  78   5.376   5.031  -4.516
  648   HG22  ILE  78          HG22      ILE  78   4.012   4.117  -5.159
  649   HG23  ILE  78          HG23      ILE  78   5.652   3.727  -5.671
  650   HD11  ILE  78          HD11      ILE  78   5.537   5.168  -1.998
  651   HD12  ILE  78          HD12      ILE  78   3.951   5.166  -1.227
  652   HD13  ILE  78          HD13      ILE  78   4.102   5.591  -2.932
  653    H    LYS  79           HN       LYS  79   3.784   2.359  -6.390
  654    HA   LYS  79           HA       LYS  79   1.038   2.208  -5.618
  655    HB2  LYS  79           HB2      LYS  79   0.547   2.513  -8.046
  656    HB3  LYS  79           HB1      LYS  79   1.555   3.757  -7.327
  657    HG2  LYS  79           HG2      LYS  79   3.520   2.817  -8.339
  658    HG3  LYS  79           HG1      LYS  79   2.587   1.455  -8.963
  659    HD2  LYS  79           HD2      LYS  79   3.015   3.160 -10.685
  660    HD3  LYS  79           HD1      LYS  79   1.292   2.951 -10.368
  661    HE2  LYS  79           HE2      LYS  79   1.964   5.326 -10.588
  662    HE3  LYS  79           HE1      LYS  79   1.241   4.947  -9.027
  663    HZ1  LYS  79           HZ1      LYS  79   3.076   5.597  -7.995
  664    HZ2  LYS  79           HZ2      LYS  79   3.659   6.179  -9.470
  665    HZ3  LYS  79           HZ3      LYS  79   4.065   4.618  -8.955
  666    H    GLN  80           HN       GLN  80   3.150   0.014  -7.428
  667    HA   GLN  80           HA       GLN  80   1.036  -1.796  -8.012
  668    HB2  GLN  80           HB2      GLN  80   2.547  -2.979  -9.206
  669    HB3  GLN  80           HB1      GLN  80   3.473  -1.501  -9.059
  670    HG2  GLN  80           HG2      GLN  80   5.059  -3.032  -8.508
  671    HG3  GLN  80           HG1      GLN  80   4.420  -2.656  -6.911
  672   HE21  GLN  80          HE21      GLN  80   2.466  -4.565  -9.036
  673   HE22  GLN  80          HE22      GLN  80   2.722  -6.077  -8.249
  674    H    ALA  81           HN       ALA  81   3.261  -1.457  -5.330
  675    HA   ALA  81           HA       ALA  81   2.981  -3.975  -4.151
  676    HB1  ALA  81           HB1      ALA  81   3.538  -1.259  -2.984
  677    HB2  ALA  81           HB2      ALA  81   4.669  -2.579  -3.285
  678    HB3  ALA  81           HB3      ALA  81   3.481  -2.715  -1.990
  679    H    ILE  82           HN       ILE  82   1.109  -0.977  -3.574
  680    HA   ILE  82           HA       ILE  82  -0.635  -2.268  -1.738
  681    HB   ILE  82           HB       ILE  82  -0.549   0.104  -1.631
  682   HG12  ILE  82          HG12      ILE  82  -2.946   0.735  -1.867
  683   HG13  ILE  82          HG11      ILE  82  -3.229  -0.779  -2.717
  684   HG21  ILE  82          HG21      ILE  82  -1.422   0.098  -4.500
  685   HG22  ILE  82          HG22      ILE  82   0.087   0.709  -3.827
  686   HG23  ILE  82          HG23      ILE  82  -1.433   1.531  -3.475
  687   HD11  ILE  82          HD11      ILE  82  -2.207  -0.571   0.105
  688   HD12  ILE  82          HD12      ILE  82  -2.676  -2.040  -0.751
  689   HD13  ILE  82          HD13      ILE  82  -3.892  -0.830  -0.342
  690    H    PHE  83           HN       PHE  83  -0.765  -1.807  -5.240
  691    HA   PHE  83           HA       PHE  83  -3.375  -2.925  -5.548
  692    HB2  PHE  83           HB2      PHE  83  -1.102  -2.487  -7.504
  693    HB3  PHE  83           HB1      PHE  83  -2.659  -3.157  -7.976
  694    HD1  PHE  83           HD2      PHE  83  -2.945  -0.710  -5.384
  695    HD2  PHE  83           HD1      PHE  83  -2.569  -1.191  -9.594
  696    HE1  PHE  83           HE2      PHE  83  -3.811   1.568  -5.717
  697    HE2  PHE  83           HE1      PHE  83  -3.438   1.085  -9.933
  698    HZ   PHE  83           HZ       PHE  83  -4.063   2.466  -7.993
  699    H    ASN  84           HN       ASN  84  -0.095  -4.177  -5.582
  700    HA   ASN  84           HA       ASN  84  -0.684  -6.776  -6.470
  701    HB2  ASN  84           HB2      ASN  84   1.647  -5.734  -6.273
  702    HB3  ASN  84           HB1      ASN  84   1.550  -6.087  -4.551
  703   HD21  ASN  84          HD21      ASN  84   3.525  -7.116  -6.211
  704   HD22  ASN  84          HD22      ASN  84   3.320  -8.829  -6.334
  705    H    TYR  85           HN       TYR  85  -0.698  -5.170  -3.365
  706    HA   TYR  85           HA       TYR  85  -1.111  -7.428  -1.774
  707    HB2  TYR  85           HB2      TYR  85  -0.618  -5.279  -0.750
  708    HB3  TYR  85           HB1      TYR  85  -2.112  -4.598  -1.385
  709    HD1  TYR  85           HD1      TYR  85  -1.055  -7.552   0.661
  710    HD2  TYR  85           HD2      TYR  85  -3.855  -4.399   0.095
  711    HE1  TYR  85           HE1      TYR  85  -2.263  -8.275   2.674
  712    HE2  TYR  85           HE2      TYR  85  -5.071  -5.112   2.114
  713    HH   TYR  85           HH       TYR  85  -5.351  -6.935   3.562
  714    H    LEU  86           HN       LEU  86  -3.287  -5.321  -3.529
  715    HA   LEU  86           HA       LEU  86  -5.688  -6.595  -2.771
  716    HB2  LEU  86           HB2      LEU  86  -5.061  -4.889  -5.172
  717    HB3  LEU  86           HB1      LEU  86  -6.674  -5.373  -4.682
  718    HG   LEU  86           HG       LEU  86  -4.798  -3.620  -3.088
  719   HD11  LEU  86          HD11      LEU  86  -7.379  -2.953  -4.485
  720   HD12  LEU  86          HD12      LEU  86  -5.772  -2.594  -5.115
  721   HD13  LEU  86          HD13      LEU  86  -6.320  -1.842  -3.616
  722   HD21  LEU  86          HD21      LEU  86  -6.092  -4.820  -1.522
  723   HD22  LEU  86          HD22      LEU  86  -7.544  -4.700  -2.514
  724   HD23  LEU  86          HD23      LEU  86  -6.901  -3.265  -1.717
  725    H    GLU  87           HN       GLU  87  -3.481  -6.996  -5.504
  726    HA   GLU  87           HA       GLU  87  -5.066  -8.916  -6.884
  727    HB2  GLU  87           HB2      GLU  87  -2.127  -8.226  -7.047
  728    HB3  GLU  87           HB1      GLU  87  -2.885  -9.432  -8.074
  729    HG2  GLU  87           HG2      GLU  87  -4.382  -7.732  -8.982
  730    HG3  GLU  87           HG1      GLU  87  -3.637  -6.515  -7.949
  731    H    LYS  88           HN       LYS  88  -2.505  -9.112  -4.503
  732    HA   LYS  88           HA       LYS  88  -2.024 -11.894  -4.598
  733    HB2  LYS  88           HB2      LYS  88  -0.561 -10.070  -3.613
  734    HB3  LYS  88           HB1      LYS  88  -1.641 -10.057  -2.232
  735    HG2  LYS  88           HG2      LYS  88   0.179 -11.365  -1.577
  736    HG3  LYS  88           HG1      LYS  88  -1.089 -12.528  -1.974
  737    HD2  LYS  88           HD2      LYS  88  -0.081 -13.027  -4.077
  738    HD3  LYS  88           HD1      LYS  88   1.044 -11.677  -3.925
  739    HE2  LYS  88           HE2      LYS  88   1.019 -13.938  -1.948
  740    HE3  LYS  88           HE1      LYS  88   1.930 -14.036  -3.455
  741    HZ1  LYS  88           HZ1      LYS  88   2.295 -11.677  -1.751
  742    HZ2  LYS  88           HZ2      LYS  88   3.395 -12.435  -2.790
  743    HZ3  LYS  88           HZ3      LYS  88   3.036 -13.126  -1.287
  744    H    LEU  89           HN       LEU  89  -4.181  -9.910  -2.585
  745    HA   LEU  89           HA       LEU  89  -5.133 -12.311  -1.237
  746    HB2  LEU  89           HB2      LEU  89  -6.263 -10.920   0.293
  747    HB3  LEU  89           HB1      LEU  89  -4.720 -10.146  -0.002
  748    HG   LEU  89           HG       LEU  89  -6.243  -8.859  -1.825
  749   HD11  LEU  89          HD11      LEU  89  -8.298  -9.990  -1.142
  750   HD12  LEU  89          HD12      LEU  89  -8.369  -8.267  -0.774
  751   HD13  LEU  89          HD13      LEU  89  -8.063  -9.431   0.515
  752   HD21  LEU  89          HD21      LEU  89  -4.741  -7.912  -0.122
  753   HD22  LEU  89          HD22      LEU  89  -6.009  -8.128   1.085
  754   HD23  LEU  89          HD23      LEU  89  -6.256  -7.022  -0.267
  755    H    GLU  90           HN       GLU  90  -6.037 -10.139  -3.750
  756    HA   GLU  90           HA       GLU  90  -7.988  -9.720  -4.853
  757    HB2  GLU  90           HB2      GLU  90  -8.676 -12.041  -5.994
  758    HB3  GLU  90           HB1      GLU  90  -7.289 -11.089  -6.484
  759    HG2  GLU  90           HG2      GLU  90  -5.957 -12.559  -4.855
  760    HG3  GLU  90           HG1      GLU  90  -7.367 -13.620  -4.877
  Start of MODEL   29
    1    H1   MET   1           HT1      MET   1   2.980   2.284  13.281
    2    H2   MET   1           HT2      MET   1   3.249   0.615  13.334
    3    H3   MET   1           HT3      MET   1   3.520   1.472  11.899
    4    HA   MET   1           HA       MET   1   5.004   1.812  14.424
    5    HB2  MET   1           HB2      MET   1   6.919   0.942  12.920
    6    HB3  MET   1           HB1      MET   1   5.779  -0.219  13.579
    7    HG2  MET   1           HG2      MET   1   4.554  -0.132  11.401
    8    HG3  MET   1           HG1      MET   1   5.869   0.860  10.770
    9    HE1  MET   1           HE1      MET   1   4.862  -2.620  12.258
   10    HE2  MET   1           HE2      MET   1   5.727  -3.638  11.107
   11    HE3  MET   1           HE3      MET   1   4.507  -2.499  10.536
   12    H    ALA   2           HN       ALA   2   6.759   2.227  11.543
   13    HA   ALA   2           HA       ALA   2   6.944   5.072  12.071
   14    HB1  ALA   2           HB1      ALA   2   8.754   4.981  10.344
   15    HB2  ALA   2           HB2      ALA   2   8.473   3.244  10.227
   16    HB3  ALA   2           HB3      ALA   2   9.020   3.949  11.749
   17    H    THR   3           HN       THR   3   4.578   5.099  11.361
   18    HA   THR   3           HA       THR   3   3.901   4.820   8.633
   19    HB   THR   3           HB       THR   3   2.050   4.693  10.003
   20    HG1  THR   3           HG1      THR   3   0.801   6.165   9.142
   21   HG21  THR   3          HG21      THR   3   2.954   5.390  12.083
   22   HG22  THR   3          HG22      THR   3   1.533   6.391  11.790
   23   HG23  THR   3          HG23      THR   3   3.147   7.050  11.521
   24    H    THR   4           HN       THR   4   5.240   5.909   7.297
   25    HA   THR   4           HA       THR   4   5.619   8.783   7.636
   26    HB   THR   4           HB       THR   4   6.712   7.045   5.414
   27    HG1  THR   4           HG1      THR   4   7.277   6.249   7.561
   28   HG21  THR   4          HG21      THR   4   6.847   9.504   5.143
   29   HG22  THR   4          HG22      THR   4   8.436   8.749   5.271
   30   HG23  THR   4          HG23      THR   4   7.745   9.596   6.656
   31    H    THR   5           HN       THR   5   4.598  10.267   6.441
   32    HA   THR   5           HA       THR   5   2.364   9.452   4.830
   33    HB   THR   5           HB       THR   5   2.327  12.120   4.611
   34    HG1  THR   5           HG1      THR   5   3.197  12.910   6.679
   35   HG21  THR   5          HG21      THR   5   1.055  12.157   6.760
   36   HG22  THR   5          HG22      THR   5   1.604  10.509   7.062
   37   HG23  THR   5          HG23      THR   5   0.572  10.854   5.675
   38    H    LEU   6           HN       LEU   6   3.241   8.525   2.984
   39    HA   LEU   6           HA       LEU   6   4.638  10.394   1.167
   40    HB2  LEU   6           HB2      LEU   6   4.756   7.373   1.153
   41    HB3  LEU   6           HB1      LEU   6   5.635   8.448   0.084
   42    HG   LEU   6           HG       LEU   6   6.041   8.204   3.066
   43   HD11  LEU   6          HD11      LEU   6   7.882   7.443   0.813
   44   HD12  LEU   6          HD12      LEU   6   6.855   6.305   1.685
   45   HD13  LEU   6          HD13      LEU   6   8.127   7.177   2.539
   46   HD21  LEU   6          HD21      LEU   6   6.453  10.475   2.374
   47   HD22  LEU   6          HD22      LEU   6   7.425   9.921   1.011
   48   HD23  LEU   6          HD23      LEU   6   7.995   9.669   2.661
   49    H    GLY   7           HN       GLY   7   3.882  10.488  -0.998
   50    HA2  GLY   7           HA2      GLY   7   1.114  10.170  -1.326
   51    HA3  GLY   7           HA1      GLY   7   2.257  10.474  -2.621
   52    H    VAL   8           HN       VAL   8  -0.023   8.367  -1.502
   53    HA   VAL   8           HA       VAL   8   1.173   5.952  -2.611
   54    HB   VAL   8           HB       VAL   8  -0.489   6.104  -0.535
   55   HG11  VAL   8          HG11      VAL   8  -2.298   7.165  -1.824
   56   HG12  VAL   8          HG12      VAL   8  -2.781   5.639  -1.085
   57   HG13  VAL   8          HG13      VAL   8  -2.416   5.708  -2.809
   58   HG21  VAL   8          HG21      VAL   8   0.561   4.060  -1.338
   59   HG22  VAL   8          HG22      VAL   8  -0.641   3.936  -2.621
   60   HG23  VAL   8          HG23      VAL   8  -1.132   3.772  -0.936
   61    H    LYS   9           HN       LYS   9  -0.122   4.708  -4.203
   62    HA   LYS   9           HA       LYS   9  -1.614   6.478  -5.993
   63    HB2  LYS   9           HB2      LYS   9   0.520   4.484  -6.779
   64    HB3  LYS   9           HB1      LYS   9  -0.501   5.362  -7.915
   65    HG2  LYS   9           HG2      LYS   9   0.409   7.482  -7.092
   66    HG3  LYS   9           HG1      LYS   9   1.429   6.604  -5.955
   67    HD2  LYS   9           HD2      LYS   9   2.581   5.525  -7.841
   68    HD3  LYS   9           HD1      LYS   9   1.553   6.418  -8.966
   69    HE2  LYS   9           HE2      LYS   9   3.378   7.714  -6.947
   70    HE3  LYS   9           HE1      LYS   9   3.809   7.431  -8.631
   71    HZ1  LYS   9           HZ1      LYS   9   1.427   9.007  -7.837
   72    HZ2  LYS   9           HZ2      LYS   9   2.162   8.928  -9.357
   73    HZ3  LYS   9           HZ3      LYS   9   2.946   9.714  -8.082
   74    H    LEU  10           HN       LEU  10  -3.509   5.554  -5.025
   75    HA   LEU  10           HA       LEU  10  -4.095   2.881  -6.127
   76    HB2  LEU  10           HB2      LEU  10  -5.574   2.431  -4.177
   77    HB3  LEU  10           HB1      LEU  10  -3.871   2.434  -3.808
   78    HG   LEU  10           HG       LEU  10  -4.371   4.932  -3.080
   79   HD11  LEU  10          HD11      LEU  10  -7.051   3.572  -2.950
   80   HD12  LEU  10          HD12      LEU  10  -6.645   5.119  -3.695
   81   HD13  LEU  10          HD13      LEU  10  -6.625   4.951  -1.940
   82   HD21  LEU  10          HD21      LEU  10  -4.796   4.093  -0.797
   83   HD22  LEU  10          HD22      LEU  10  -3.482   3.244  -1.610
   84   HD23  LEU  10          HD23      LEU  10  -5.067   2.483  -1.466
   85    H    ASP  11           HN       ASP  11  -6.635   2.567  -5.842
   86    HA   ASP  11           HA       ASP  11  -7.751   4.875  -7.268
   87    HB2  ASP  11           HB2      ASP  11  -9.130   2.208  -6.957
   88    HB3  ASP  11           HB1      ASP  11  -9.382   3.428  -8.192
   89    H    ASP  12           HN       ASP  12  -9.294   6.150  -6.322
   90    HA   ASP  12           HA       ASP  12  -9.925   6.083  -3.646
   91    HB2  ASP  12           HB2      ASP  12 -10.911   7.511  -5.971
   92    HB3  ASP  12           HB1      ASP  12 -12.209   7.193  -4.824
   93    HA   PRO  13           HA       PRO  13 -14.064   3.627  -4.713
   94    HB2  PRO  13           HB2      PRO  13 -13.580   1.839  -6.803
   95    HB3  PRO  13           HB1      PRO  13 -14.553   3.308  -6.909
   96    HG2  PRO  13           HG2      PRO  13 -11.706   2.861  -7.690
   97    HG3  PRO  13           HG1      PRO  13 -12.955   3.830  -8.495
   98    HD2  PRO  13           HD2      PRO  13 -11.040   4.989  -7.042
   99    HD3  PRO  13           HD1      PRO  13 -12.708   5.604  -7.007
  100    H    THR  14           HN       THR  14 -10.878   2.186  -5.519
  101    HA   THR  14           HA       THR  14 -11.478  -0.245  -4.163
  102    HB   THR  14           HB       THR  14  -9.605   0.164  -5.960
  103    HG1  THR  14           HG1      THR  14  -8.385  -1.599  -4.711
  104   HG21  THR  14          HG21      THR  14  -7.351   0.156  -4.714
  105   HG22  THR  14          HG22      THR  14  -8.239   0.910  -3.390
  106   HG23  THR  14          HG23      THR  14  -8.151   1.707  -4.960
  107    H    ARG  15           HN       ARG  15 -10.372   2.872  -3.171
  108    HA   ARG  15           HA       ARG  15  -9.123   2.176  -0.754
  109    HB2  ARG  15           HB2      ARG  15  -9.034   4.436  -1.738
  110    HB3  ARG  15           HB1      ARG  15 -10.744   4.657  -1.378
  111    HG2  ARG  15           HG2      ARG  15 -10.269   4.469   1.011
  112    HG3  ARG  15           HG1      ARG  15  -8.553   4.253   0.652
  113    HD2  ARG  15           HD2      ARG  15  -8.635   6.474  -0.527
  114    HD3  ARG  15           HD1      ARG  15 -10.257   6.680   0.129
  115    HE   ARG  15           HE       ARG  15  -9.353   7.113   2.190
  116   HH11  ARG  15          HH21      ARG  15  -6.884   5.788   0.095
  117   HH12  ARG  15          HH22      ARG  15  -5.574   6.203   1.147
  118   HH21  ARG  15          HH11      ARG  15  -7.622   7.682   3.583
  119   HH22  ARG  15          HH12      ARG  15  -5.996   7.291   3.136
  120    H    GLU  16           HN       GLU  16 -12.490   2.745  -1.652
  121    HA   GLU  16           HA       GLU  16 -13.622   2.342   0.914
  122    HB2  GLU  16           HB2      GLU  16 -14.750   1.827  -1.849
  123    HB3  GLU  16           HB1      GLU  16 -15.695   1.711  -0.372
  124    HG2  GLU  16           HG2      GLU  16 -15.264   4.069   0.090
  125    HG3  GLU  16           HG1      GLU  16 -14.315   4.183  -1.390
  126    H    ARG  17           HN       ARG  17 -12.856   0.143  -1.756
  127    HA   ARG  17           HA       ARG  17 -13.772  -2.245  -0.579
  128    HB2  ARG  17           HB2      ARG  17 -12.951  -1.830  -3.003
  129    HB3  ARG  17           HB1      ARG  17 -11.344  -2.142  -2.359
  130    HG2  ARG  17           HG2      ARG  17 -12.847  -4.248  -1.397
  131    HG3  ARG  17           HG1      ARG  17 -13.472  -3.993  -3.027
  132    HD2  ARG  17           HD2      ARG  17 -11.734  -5.439  -3.447
  133    HD3  ARG  17           HD1      ARG  17 -10.932  -3.881  -3.653
  134    HE   ARG  17           HE       ARG  17  -9.728  -4.253  -1.719
  135   HH11  ARG  17          HH21      ARG  17 -12.164  -6.737  -2.100
  136   HH12  ARG  17          HH22      ARG  17 -11.497  -7.766  -0.877
  137   HH21  ARG  17          HH11      ARG  17  -8.864  -5.602  -0.065
  138   HH22  ARG  17          HH12      ARG  17  -9.633  -7.114   0.288
  139    H    LEU  18           HN       LEU  18 -10.790  -0.453  -0.314
  140    HA   LEU  18           HA       LEU  18  -9.277  -2.322   1.141
  141    HB2  LEU  18           HB2      LEU  18  -9.126   0.527   0.492
  142    HB3  LEU  18           HB1      LEU  18  -8.426   0.136   2.045
  143    HG   LEU  18           HG       LEU  18  -6.991  -1.568   0.893
  144   HD11  LEU  18          HD11      LEU  18  -6.722  -1.417  -1.518
  145   HD12  LEU  18          HD12      LEU  18  -8.031  -0.241  -1.603
  146   HD13  LEU  18          HD13      LEU  18  -8.366  -1.897  -1.099
  147   HD21  LEU  18          HD21      LEU  18  -6.841   1.362   0.378
  148   HD22  LEU  18          HD22      LEU  18  -5.651   0.292  -0.362
  149   HD23  LEU  18          HD23      LEU  18  -5.824   0.340   1.390
  150    H    LYS  19           HN       LYS  19 -11.708   0.056   2.076
  151    HA   LYS  19           HA       LYS  19 -11.323  -0.097   4.855
  152    HB2  LYS  19           HB2      LYS  19 -12.808   1.594   3.785
  153    HB3  LYS  19           HB1      LYS  19 -13.962   0.311   3.438
  154    HG2  LYS  19           HG2      LYS  19 -14.132  -0.135   5.868
  155    HG3  LYS  19           HG1      LYS  19 -13.075   1.243   6.163
  156    HD2  LYS  19           HD2      LYS  19 -14.759   2.655   4.927
  157    HD3  LYS  19           HD1      LYS  19 -15.833   1.254   4.951
  158    HE2  LYS  19           HE2      LYS  19 -14.720   2.745   7.325
  159    HE3  LYS  19           HE1      LYS  19 -16.400   2.684   6.796
  160    HZ1  LYS  19           HZ1      LYS  19 -15.994   1.221   8.679
  161    HZ2  LYS  19           HZ2      LYS  19 -14.832   0.368   7.799
  162    HZ3  LYS  19           HZ3      LYS  19 -16.454   0.330   7.316
  163    H    ALA  20           HN       ALA  20 -13.190  -2.003   2.609
  164    HA   ALA  20           HA       ALA  20 -14.389  -3.764   4.430
  165    HB1  ALA  20           HB1      ALA  20 -14.687  -5.286   2.562
  166    HB2  ALA  20           HB2      ALA  20 -13.465  -4.423   1.628
  167    HB3  ALA  20           HB3      ALA  20 -14.990  -3.633   2.028
  168    H    ALA  21           HN       ALA  21 -11.233  -3.792   2.841
  169    HA   ALA  21           HA       ALA  21 -10.328  -6.255   3.898
  170    HB1  ALA  21           HB1      ALA  21  -8.084  -5.488   3.328
  171    HB2  ALA  21           HB2      ALA  21  -8.680  -3.841   3.125
  172    HB3  ALA  21           HB3      ALA  21  -9.205  -5.109   2.019
  173    H    ALA  22           HN       ALA  22 -10.153  -2.900   5.004
  174    HA   ALA  22           HA       ALA  22  -8.695  -3.295   7.353
  175    HB1  ALA  22           HB1      ALA  22  -9.467  -1.167   8.034
  176    HB2  ALA  22           HB2      ALA  22 -10.916  -1.299   7.038
  177    HB3  ALA  22           HB3      ALA  22  -9.339  -1.097   6.278
  178    H    GLN  23           HN       GLN  23 -12.095  -3.595   6.659
  179    HA   GLN  23           HA       GLN  23 -12.962  -4.024   9.307
  180    HB2  GLN  23           HB2      GLN  23 -14.176  -4.804   6.656
  181    HB3  GLN  23           HB1      GLN  23 -14.998  -5.001   8.201
  182    HG2  GLN  23           HG2      GLN  23 -13.987  -2.376   7.127
  183    HG3  GLN  23           HG1      GLN  23 -15.645  -2.949   6.970
  184   HE21  GLN  23          HE21      GLN  23 -13.225  -1.690   9.118
  185   HE22  GLN  23          HE22      GLN  23 -14.271  -1.384  10.460
  186    H    SER  24           HN       SER  24 -11.915  -6.261   6.742
  187    HA   SER  24           HA       SER  24 -12.395  -8.596   8.301
  188    HB2  SER  24           HB2      SER  24 -10.835  -9.698   6.611
  189    HB3  SER  24           HB1      SER  24 -12.273  -8.931   5.946
  190    HG   SER  24           HG       SER  24 -10.019  -7.325   6.140
  191    H    ILE  25           HN       ILE  25 -10.047  -6.179   8.358
  192    HA   ILE  25           HA       ILE  25  -8.133  -7.802   9.884
  193    HB   ILE  25           HB       ILE  25  -7.809  -5.086   8.564
  194   HG12  ILE  25          HG12      ILE  25  -6.431  -7.660   7.820
  195   HG13  ILE  25          HG11      ILE  25  -7.967  -7.178   7.105
  196   HG21  ILE  25          HG21      ILE  25  -5.365  -5.444   9.024
  197   HG22  ILE  25          HG22      ILE  25  -5.834  -6.756  10.105
  198   HG23  ILE  25          HG23      ILE  25  -6.353  -5.106  10.444
  199   HD11  ILE  25          HD11      ILE  25  -5.544  -5.414   7.039
  200   HD12  ILE  25          HD12      ILE  25  -7.010  -5.309   6.062
  201   HD13  ILE  25          HD13      ILE  25  -5.871  -6.631   5.806
  202    H    ASP  26           HN       ASP  26 -10.761  -6.096  10.336
  203    HA   ASP  26           HA       ASP  26 -11.783  -4.898  11.904
  204    HB2  ASP  26           HB2      ASP  26 -11.382  -5.495  14.255
  205    HB3  ASP  26           HB1      ASP  26 -11.505  -6.905  13.218
  206    H    ARG  27           HN       ARG  27  -9.871  -3.405  10.600
  207    HA   ARG  27           HA       ARG  27  -9.165  -1.526  12.768
  208    HB2  ARG  27           HB2      ARG  27  -7.434  -2.196  10.379
  209    HB3  ARG  27           HB1      ARG  27  -7.089  -0.946  11.568
  210    HG2  ARG  27           HG2      ARG  27  -7.067  -2.722  13.316
  211    HG3  ARG  27           HG1      ARG  27  -7.191  -3.915  12.025
  212    HD2  ARG  27           HD2      ARG  27  -4.911  -3.807  12.444
  213    HD3  ARG  27           HD1      ARG  27  -5.115  -2.749  11.049
  214    HE   ARG  27           HE       ARG  27  -5.232  -0.924  12.877
  215   HH11  ARG  27          HH21      ARG  27  -3.194  -3.762  12.914
  216   HH12  ARG  27          HH22      ARG  27  -2.029  -3.077  14.001
  217   HH21  ARG  27          HH11      ARG  27  -3.670   0.012  14.295
  218   HH22  ARG  27          HH12      ARG  27  -2.295  -0.929  14.783
  219    H    THR  28           HN       THR  28  -8.804   0.708  11.979
  220    HA   THR  28           HA       THR  28 -10.933   1.477  10.214
  221    HB   THR  28           HB       THR  28  -9.718   2.661  12.398
  222    HG1  THR  28           HG1      THR  28 -11.750   3.255  12.007
  223   HG21  THR  28          HG21      THR  28  -9.089   4.424  10.034
  224   HG22  THR  28          HG22      THR  28  -7.878   3.452  10.869
  225   HG23  THR  28          HG23      THR  28  -8.733   4.728  11.734
  226    HA   PRO  29           HA       PRO  29  -9.033   1.934   6.268
  227    HB2  PRO  29           HB2      PRO  29  -9.625   4.860   6.443
  228    HB3  PRO  29           HB1      PRO  29  -9.975   3.714   5.143
  229    HG2  PRO  29           HG2      PRO  29 -11.903   4.498   6.787
  230    HG3  PRO  29           HG1      PRO  29 -11.800   2.809   6.255
  231    HD2  PRO  29           HD2      PRO  29 -11.090   4.012   8.888
  232    HD3  PRO  29           HD1      PRO  29 -11.776   2.418   8.521
  233    H    HIS  30           HN       HIS  30  -8.032   4.405   8.635
  234    HA   HIS  30           HA       HIS  30  -5.715   5.186   7.163
  235    HB2  HIS  30           HB2      HIS  30  -6.698   5.692   9.944
  236    HB3  HIS  30           HB1      HIS  30  -5.037   6.104   9.522
  237    HD1  HIS  30           HD1      HIS  30  -7.912   7.879   9.969
  238    HD2  HIS  30           HD2      HIS  30  -5.422   7.470   6.656
  239    HE1  HIS  30           HE1      HIS  30  -8.341   9.909   8.548
  240    HE2  HIS  30           HE2      HIS  30  -6.752   9.703   6.604
  241    H    TRP  31           HN       TRP  31  -6.222   3.018   9.924
  242    HA   TRP  31           HA       TRP  31  -3.479   2.333  10.180
  243    HB2  TRP  31           HB2      TRP  31  -5.644   0.412  10.946
  244    HB3  TRP  31           HB1      TRP  31  -4.111   0.719  11.746
  245    HD1  TRP  31           HD1      TRP  31  -7.095   0.694  13.079
  246    HE1  TRP  31           HE1      TRP  31  -7.810   2.730  14.478
  247    HE3  TRP  31           HE3      TRP  31  -3.770   4.140  11.266
  248    HZ2  TRP  31           HZ2      TRP  31  -7.068   5.439  14.769
  249    HZ3  TRP  31           HZ3      TRP  31  -3.842   6.427  12.159
  250    HH2  TRP  31           HH2      TRP  31  -5.457   7.063  13.874
  251    H    LEU  32           HN       LEU  32  -6.179   1.325   8.375
  252    HA   LEU  32           HA       LEU  32  -5.325  -1.085   7.305
  253    HB2  LEU  32           HB2      LEU  32  -7.570  -0.532   7.014
  254    HB3  LEU  32           HB1      LEU  32  -7.201   1.085   6.475
  255    HG   LEU  32           HG       LEU  32  -8.215  -0.483   4.778
  256   HD11  LEU  32          HD11      LEU  32  -7.486   1.043   3.373
  257   HD12  LEU  32          HD12      LEU  32  -5.922   0.235   3.291
  258   HD13  LEU  32          HD13      LEU  32  -6.206   1.486   4.499
  259   HD21  LEU  32          HD21      LEU  32  -5.513  -1.764   5.018
  260   HD22  LEU  32          HD22      LEU  32  -6.508  -1.913   3.570
  261   HD23  LEU  32          HD23      LEU  32  -7.104  -2.520   5.116
  262    H    ILE  33           HN       ILE  33  -4.668   2.204   6.381
  263    HA   ILE  33           HA       ILE  33  -3.423   1.673   3.897
  264    HB   ILE  33           HB       ILE  33  -2.879   3.974   5.788
  265   HG12  ILE  33          HG12      ILE  33  -4.634   3.929   3.330
  266   HG13  ILE  33          HG11      ILE  33  -5.253   3.724   4.966
  267   HG21  ILE  33          HG21      ILE  33  -1.100   3.573   4.105
  268   HG22  ILE  33          HG22      ILE  33  -1.929   5.115   3.888
  269   HG23  ILE  33          HG23      ILE  33  -2.309   3.754   2.833
  270   HD11  ILE  33          HD11      ILE  33  -4.207   5.951   5.505
  271   HD12  ILE  33          HD12      ILE  33  -5.583   5.981   4.404
  272   HD13  ILE  33          HD13      ILE  33  -3.945   6.144   3.772
  273    H    LYS  34           HN       LYS  34  -2.045   2.406   7.099
  274    HA   LYS  34           HA       LYS  34   0.609   1.763   6.314
  275    HB2  LYS  34           HB2      LYS  34   1.232   1.982   8.576
  276    HB3  LYS  34           HB1      LYS  34  -0.128   3.079   8.397
  277    HG2  LYS  34           HG2      LYS  34  -1.604   1.491   9.447
  278    HG3  LYS  34           HG1      LYS  34  -0.311   0.297   9.524
  279    HD2  LYS  34           HD2      LYS  34   0.964   1.950  10.947
  280    HD3  LYS  34           HD1      LYS  34  -0.527   2.893  11.031
  281    HE2  LYS  34           HE2      LYS  34   0.178   0.888  12.760
  282    HE3  LYS  34           HE1      LYS  34  -1.460   1.491  12.510
  283    HZ1  LYS  34           HZ1      LYS  34  -0.218  -0.827  11.121
  284    HZ2  LYS  34           HZ2      LYS  34  -1.770  -0.236  10.813
  285    HZ3  LYS  34           HZ3      LYS  34  -1.404  -0.907  12.320
  286    H    GLN  35           HN       GLN  35  -1.980  -0.093   7.723
  287    HA   GLN  35           HA       GLN  35  -0.515  -2.441   8.259
  288    HB2  GLN  35           HB2      GLN  35  -2.734  -1.725   9.234
  289    HB3  GLN  35           HB1      GLN  35  -3.469  -2.224   7.718
  290    HG2  GLN  35           HG2      GLN  35  -3.743  -3.959   9.285
  291    HG3  GLN  35           HG1      GLN  35  -2.556  -4.487   8.093
  292   HE21  GLN  35          HE21      GLN  35  -1.392  -5.913   9.303
  293   HE22  GLN  35          HE22      GLN  35  -0.519  -5.481  10.734
  294    H    ALA  36           HN       ALA  36  -2.434  -1.376   5.477
  295    HA   ALA  36           HA       ALA  36  -2.507  -3.802   4.086
  296    HB1  ALA  36           HB1      ALA  36  -2.508  -0.994   2.988
  297    HB2  ALA  36           HB2      ALA  36  -3.919  -1.949   3.443
  298    HB3  ALA  36           HB3      ALA  36  -2.924  -2.445   2.075
  299    H    ILE  37           HN       ILE  37  -0.137  -1.158   3.970
  300    HA   ILE  37           HA       ILE  37   1.397  -2.430   1.956
  301    HB   ILE  37           HB       ILE  37   1.450   0.043   2.533
  302   HG12  ILE  37          HG12      ILE  37   3.925   0.217   2.021
  303   HG13  ILE  37          HG11      ILE  37   3.987  -1.538   2.146
  304   HG21  ILE  37          HG21      ILE  37   2.420   0.863   4.370
  305   HG22  ILE  37          HG22      ILE  37   3.702  -0.347   4.360
  306   HG23  ILE  37          HG23      ILE  37   2.120  -0.745   5.030
  307   HD11  ILE  37          HD11      ILE  37   2.018  -1.380   0.400
  308   HD12  ILE  37          HD12      ILE  37   3.707  -1.307  -0.097
  309   HD13  ILE  37          HD13      ILE  37   2.770   0.178   0.059
  310    H    PHE  38           HN       PHE  38   1.522  -2.482   5.490
  311    HA   PHE  38           HA       PHE  38   3.910  -4.070   5.597
  312    HB2  PHE  38           HB2      PHE  38   1.763  -3.773   7.726
  313    HB3  PHE  38           HB1      PHE  38   3.398  -4.369   7.968
  314    HD1  PHE  38           HD1      PHE  38   4.655  -2.172   6.126
  315    HD2  PHE  38           HD2      PHE  38   1.932  -2.079   9.396
  316    HE1  PHE  38           HE1      PHE  38   5.376   0.119   6.657
  317    HE2  PHE  38           HE2      PHE  38   2.646   0.213   9.930
  318    HZ   PHE  38           HZ       PHE  38   4.369   1.315   8.559
  319    H    ASN  39           HN       ASN  39   0.445  -4.667   5.625
  320    HA   ASN  39           HA       ASN  39   0.531  -7.432   6.118
  321    HB2  ASN  39           HB2      ASN  39  -1.493  -5.687   4.743
  322    HB3  ASN  39           HB1      ASN  39  -1.660  -7.433   4.770
  323   HD21  ASN  39          HD21      ASN  39  -3.596  -5.875   5.818
  324   HD22  ASN  39          HD22      ASN  39  -3.612  -6.024   7.541
  325    H    TYR  40           HN       TYR  40   0.659  -5.443   3.249
  326    HA   TYR  40           HA       TYR  40   0.583  -7.426   1.316
  327    HB2  TYR  40           HB2      TYR  40   0.483  -5.128   0.628
  328    HB3  TYR  40           HB1      TYR  40   2.007  -4.757   1.420
  329    HD1  TYR  40           HD2      TYR  40   0.758  -7.129  -1.190
  330    HD2  TYR  40           HD1      TYR  40   3.798  -4.411   0.021
  331    HE1  TYR  40           HE2      TYR  40   1.939  -7.508  -3.311
  332    HE2  TYR  40           HE1      TYR  40   4.985  -4.783  -2.097
  333    HH   TYR  40           HH       TYR  40   5.134  -6.235  -3.888
  334    H    LEU  41           HN       LEU  41   3.152  -6.138   3.279
  335    HA   LEU  41           HA       LEU  41   5.199  -7.741   2.115
  336    HB2  LEU  41           HB2      LEU  41   5.196  -6.228   4.712
  337    HB3  LEU  41           HB1      LEU  41   6.603  -6.964   3.968
  338    HG   LEU  41           HG       LEU  41   5.001  -4.640   2.907
  339   HD11  LEU  41          HD11      LEU  41   6.540  -4.078   4.692
  340   HD12  LEU  41          HD12      LEU  41   7.119  -3.442   3.152
  341   HD13  LEU  41          HD13      LEU  41   7.852  -4.891   3.841
  342   HD21  LEU  41          HD21      LEU  41   7.218  -6.225   1.624
  343   HD22  LEU  41          HD22      LEU  41   6.748  -4.606   1.107
  344   HD23  LEU  41          HD23      LEU  41   5.593  -5.933   1.001
  345    H    GLU  42           HN       GLU  42   3.183  -7.962   4.992
  346    HA   GLU  42           HA       GLU  42   4.433 -10.212   6.142
  347    HB2  GLU  42           HB2      GLU  42   2.866  -8.649   7.310
  348    HB3  GLU  42           HB1      GLU  42   1.543  -9.392   6.424
  349    HG2  GLU  42           HG2      GLU  42   2.044 -11.542   7.471
  350    HG3  GLU  42           HG1      GLU  42   3.372 -10.797   8.358
  351    H    LYS  43           HN       LYS  43   1.772  -9.932   3.825
  352    HA   LYS  43           HA       LYS  43   1.011 -12.657   3.895
  353    HB2  LYS  43           HB2      LYS  43   0.652 -10.617   1.692
  354    HB3  LYS  43           HB1      LYS  43  -0.145 -12.181   1.758
  355    HG2  LYS  43           HG2      LYS  43  -0.476  -9.999   3.806
  356    HG3  LYS  43           HG1      LYS  43  -1.587 -10.309   2.473
  357    HD2  LYS  43           HD2      LYS  43  -1.887 -12.629   3.389
  358    HD3  LYS  43           HD1      LYS  43  -0.944 -12.127   4.793
  359    HE2  LYS  43           HE2      LYS  43  -3.463 -10.745   3.878
  360    HE3  LYS  43           HE1      LYS  43  -3.428 -12.014   5.101
  361    HZ1  LYS  43           HZ1      LYS  43  -1.958 -10.620   6.436
  362    HZ2  LYS  43           HZ2      LYS  43  -3.427  -9.843   6.128
  363    HZ3  LYS  43           HZ3      LYS  43  -2.036  -9.395   5.273
  364    H    LEU  44           HN       LEU  44   3.150 -10.887   1.622
  365    HA   LEU  44           HA       LEU  44   3.809 -13.392   0.327
  366    HB2  LEU  44           HB2      LEU  44   5.203 -12.068  -1.182
  367    HB3  LEU  44           HB1      LEU  44   3.572 -11.442  -1.082
  368    HG   LEU  44           HG       LEU  44   4.757  -9.863   0.749
  369   HD11  LEU  44          HD11      LEU  44   6.965 -10.961   0.293
  370   HD12  LEU  44          HD12      LEU  44   6.944  -9.211   0.087
  371   HD13  LEU  44          HD13      LEU  44   6.904 -10.264  -1.327
  372   HD21  LEU  44          HD21      LEU  44   4.869  -8.164  -0.986
  373   HD22  LEU  44          HD22      LEU  44   3.411  -9.138  -1.157
  374   HD23  LEU  44          HD23      LEU  44   4.783  -9.408  -2.233
  375    H    GLU  45           HN       GLU  45   5.248 -11.194   2.595
  376    HA   GLU  45           HA       GLU  45   7.198 -11.093   3.698
  377    HB2  GLU  45           HB2      GLU  45   5.821 -13.041   4.705
  378    HB3  GLU  45           HB1      GLU  45   7.035 -14.081   3.965
  379    HG2  GLU  45           HG2      GLU  45   8.780 -13.102   5.255
  380    HG3  GLU  45           HG1      GLU  45   7.713 -11.828   5.833
  381    H1   MET  46           HT1      MET  46  -2.822   2.617 -13.678
  382    H2   MET  46           HT2      MET  46  -3.329   1.005 -13.625
  383    H3   MET  46           HT3      MET  46  -3.353   1.947 -12.218
  384    HA   MET  46           HA       MET  46  -4.948   2.492 -14.630
  385    HB2  MET  46           HB2      MET  46  -6.881   1.756 -13.115
  386    HB3  MET  46           HB1      MET  46  -5.876   0.504 -13.824
  387    HG2  MET  46           HG2      MET  46  -4.612   0.422 -11.659
  388    HG3  MET  46           HG1      MET  46  -5.837   1.499 -10.986
  389    HE1  MET  46           HE1      MET  46  -5.039  -2.045 -12.408
  390    HE2  MET  46           HE2      MET  46  -6.031  -2.968 -11.278
  391    HE3  MET  46           HE3      MET  46  -4.775  -1.887 -10.672
  392    H    ALA  47           HN       ALA  47  -6.657   2.989 -11.802
  393    HA   ALA  47           HA       ALA  47  -6.527   5.844 -12.164
  394    HB1  ALA  47           HB1      ALA  47  -8.308   5.866 -10.422
  395    HB2  ALA  47           HB2      ALA  47  -8.175   4.110 -10.336
  396    HB3  ALA  47           HB3      ALA  47  -8.685   4.883 -11.836
  397    H    THR  48           HN       THR  48  -4.144   5.630 -11.485
  398    HA   THR  48           HA       THR  48  -3.494   5.244  -8.761
  399    HB   THR  48           HB       THR  48  -1.665   4.962 -10.142
  400    HG1  THR  48           HG1      THR  48  -0.216   6.440  -9.471
  401   HG21  THR  48          HG21      THR  48  -2.485   5.795 -12.205
  402   HG22  THR  48          HG22      THR  48  -0.976   6.649 -11.882
  403   HG23  THR  48          HG23      THR  48  -2.522   7.451 -11.601
  404    H    THR  49           HN       THR  49  -4.758   6.439  -7.427
  405    HA   THR  49           HA       THR  49  -4.872   9.338  -7.724
  406    HB   THR  49           HB       THR  49  -6.094   7.680  -5.511
  407    HG1  THR  49           HG1      THR  49  -6.733   6.924  -7.642
  408   HG21  THR  49          HG21      THR  49  -6.040  10.137  -5.226
  409   HG22  THR  49          HG22      THR  49  -7.685   9.513  -5.365
  410   HG23  THR  49          HG23      THR  49  -6.923  10.310  -6.742
  411    H    THR  50           HN       THR  50  -3.710  10.718  -6.513
  412    HA   THR  50           HA       THR  50  -1.576   9.681  -4.892
  413    HB   THR  50           HB       THR  50  -1.316  12.339  -4.630
  414    HG1  THR  50           HG1      THR  50  -2.029  13.086  -6.858
  415   HG21  THR  50          HG21      THR  50   0.019  12.285  -6.739
  416   HG22  THR  50          HG22      THR  50  -0.652  10.687  -7.070
  417   HG23  THR  50          HG23      THR  50   0.360  10.942  -5.649
  418    H    LEU  51           HN       LEU  51  -2.451   8.850  -3.031
  419    HA   LEU  51           HA       LEU  51  -3.715  10.808  -1.211
  420    HB2  LEU  51           HB2      LEU  51  -4.123   7.812  -1.238
  421    HB3  LEU  51           HB1      LEU  51  -4.901   8.952  -0.157
  422    HG   LEU  51           HG       LEU  51  -5.314   8.792  -3.144
  423   HD11  LEU  51          HD11      LEU  51  -7.228   8.157  -0.913
  424   HD12  LEU  51          HD12      LEU  51  -6.302   6.948  -1.801
  425   HD13  LEU  51          HD13      LEU  51  -7.487   7.945  -2.644
  426   HD21  LEU  51          HD21      LEU  51  -5.527  11.076  -2.421
  427   HD22  LEU  51          HD22      LEU  51  -6.545  10.594  -1.064
  428   HD23  LEU  51          HD23      LEU  51  -7.136  10.418  -2.716
  429    H    GLY  52           HN       GLY  52  -2.935  10.830   0.937
  430    HA2  GLY  52           HA2      GLY  52  -0.226  10.224   1.279
  431    HA3  GLY  52           HA1      GLY  52  -1.341  10.617   2.574
  432    H    VAL  53           HN       VAL  53   0.724   8.310   1.416
  433    HA   VAL  53           HA       VAL  53  -0.692   6.009   2.506
  434    HB   VAL  53           HB       VAL  53   0.969   6.022   0.422
  435   HG11  VAL  53          HG11      VAL  53   2.871   6.904   1.709
  436   HG12  VAL  53          HG12      VAL  53   3.211   5.347   0.954
  437   HG13  VAL  53          HG13      VAL  53   2.861   5.432   2.681
  438   HG21  VAL  53          HG21      VAL  53  -0.259   4.074   1.211
  439   HG22  VAL  53          HG22      VAL  53   0.931   3.830   2.488
  440   HG23  VAL  53          HG23      VAL  53   1.400   3.636   0.799
  441    H    LYS  54           HN       LYS  54   0.487   4.629   4.075
  442    HA   LYS  54           HA       LYS  54   2.129   6.231   5.891
  443    HB2  LYS  54           HB2      LYS  54  -0.179   4.428   6.622
  444    HB3  LYS  54           HB1      LYS  54   0.918   5.165   7.790
  445    HG2  LYS  54           HG2      LYS  54   0.224   7.392   7.003
  446    HG3  LYS  54           HG1      LYS  54  -0.869   6.627   5.852
  447    HD2  LYS  54           HD2      LYS  54  -2.118   5.627   7.727
  448    HD3  LYS  54           HD1      LYS  54  -1.023   6.428   8.855
  449    HE2  LYS  54           HE2      LYS  54  -2.812   7.821   6.866
  450    HE3  LYS  54           HE1      LYS  54  -3.111   7.680   8.597
  451    HZ1  LYS  54           HZ1      LYS  54  -0.655   8.954   7.535
  452    HZ2  LYS  54           HZ2      LYS  54  -1.321   9.092   9.085
  453    HZ3  LYS  54           HZ3      LYS  54  -2.085   9.827   7.767
  454    H    LEU  55           HN       LEU  55   3.936   5.152   4.904
  455    HA   LEU  55           HA       LEU  55   4.285   2.435   5.992
  456    HB2  LEU  55           HB2      LEU  55   5.718   1.866   4.039
  457    HB3  LEU  55           HB1      LEU  55   4.022   2.021   3.670
  458    HG   LEU  55           HG       LEU  55   4.743   4.472   2.963
  459   HD11  LEU  55          HD11      LEU  55   7.285   2.872   2.813
  460   HD12  LEU  55          HD12      LEU  55   7.026   4.442   3.574
  461   HD13  LEU  55          HD13      LEU  55   6.987   4.295   1.818
  462   HD21  LEU  55          HD21      LEU  55   5.086   3.616   0.673
  463   HD22  LEU  55          HD22      LEU  55   3.700   2.886   1.482
  464   HD23  LEU  55          HD23      LEU  55   5.207   1.983   1.330
  465    H    ASP  56           HN       ASP  56   6.783   1.903   5.726
  466    HA   ASP  56           HA       ASP  56   8.093   4.136   7.110
  467    HB2  ASP  56           HB2      ASP  56   9.340   1.416   6.906
  468    HB3  ASP  56           HB1      ASP  56   9.476   2.607   8.189
  469    H    ASP  57           HN       ASP  57   9.760   5.228   6.169
  470    HA   ASP  57           HA       ASP  57  10.380   5.061   3.497
  471    HB2  ASP  57           HB2      ASP  57  11.613   6.362   5.824
  472    HB3  ASP  57           HB1      ASP  57  12.743   6.032   4.513
  473    HA   PRO  58           HA       PRO  58  14.279   2.252   4.577
  474    HB2  PRO  58           HB2      PRO  58  13.638   0.528   6.677
  475    HB3  PRO  58           HB1      PRO  58  14.740   1.903   6.776
  476    HG2  PRO  58           HG2      PRO  58  11.863   1.721   7.558
  477    HG3  PRO  58           HG1      PRO  58  13.196   2.574   8.362
  478    HD2  PRO  58           HD2      PRO  58  11.397   3.901   6.904
  479    HD3  PRO  58           HD1      PRO  58  13.115   4.357   6.866
  480    H    THR  59           HN       THR  59  10.961   1.164   5.363
  481    HA   THR  59           HA       THR  59  11.314  -1.334   4.029
  482    HB   THR  59           HB       THR  59   9.483  -0.638   5.833
  483    HG1  THR  59           HG1      THR  59   8.181  -2.410   4.514
  484   HG21  THR  59          HG21      THR  59   7.250  -0.652   4.497
  485   HG22  THR  59          HG22      THR  59   8.227   0.026   3.195
  486   HG23  THR  59          HG23      THR  59   8.100   0.874   4.735
  487    H    ARG  60           HN       ARG  60  10.504   1.877   3.046
  488    HA   ARG  60           HA       ARG  60   9.200   1.314   0.625
  489    HB2  ARG  60           HB2      ARG  60   9.322   3.569   1.631
  490    HB3  ARG  60           HB1      ARG  60  11.041   3.631   1.258
  491    HG2  ARG  60           HG2      ARG  60  10.540   3.508  -1.127
  492    HG3  ARG  60           HG1      ARG  60   8.812   3.450  -0.764
  493    HD2  ARG  60           HD2      ARG  60   9.098   5.639   0.434
  494    HD3  ARG  60           HD1      ARG  60  10.734   5.707  -0.219
  495    HE   ARG  60           HE       ARG  60   9.869   6.256  -2.273
  496   HH11  ARG  60          HH21      ARG  60   7.287   5.120  -0.202
  497   HH12  ARG  60          HH22      ARG  60   6.022   5.651  -1.258
  498   HH21  ARG  60          HH11      ARG  60   8.206   6.978  -3.670
  499   HH22  ARG  60          HH12      ARG  60   6.548   6.718  -3.238
  500    H    GLU  61           HN       GLU  61  12.612   1.548   1.510
  501    HA   GLU  61           HA       GLU  61  13.664   1.078  -1.081
  502    HB2  GLU  61           HB2      GLU  61  14.790   0.486   1.664
  503    HB3  GLU  61           HB1      GLU  61  15.696   0.246   0.176
  504    HG2  GLU  61           HG2      GLU  61  15.493   2.621  -0.336
  505    HG3  GLU  61           HG1      GLU  61  14.582   2.865   1.154
  506    H    ARG  62           HN       ARG  62  12.719  -1.040   1.586
  507    HA   ARG  62           HA       ARG  62  13.421  -3.504   0.412
  508    HB2  ARG  62           HB2      ARG  62  12.616  -3.013   2.832
  509    HB3  ARG  62           HB1      ARG  62  10.996  -3.184   2.170
  510    HG2  ARG  62           HG2      ARG  62  12.320  -5.414   1.226
  511    HG3  ARG  62           HG1      ARG  62  12.946  -5.213   2.863
  512    HD2  ARG  62           HD2      ARG  62  11.083  -6.500   3.261
  513    HD3  ARG  62           HD1      ARG  62  10.420  -4.877   3.461
  514    HE   ARG  62           HE       ARG  62   9.194  -5.150   1.525
  515   HH11  ARG  62          HH21      ARG  62  11.459  -7.790   1.884
  516   HH12  ARG  62          HH22      ARG  62  10.728  -8.762   0.651
  517   HH21  ARG  62          HH11      ARG  62   8.237  -6.423  -0.140
  518   HH22  ARG  62          HH12      ARG  62   8.903  -7.979  -0.509
  519    H    LEU  63           HN       LEU  63  10.614  -1.445   0.142
  520    HA   LEU  63           HA       LEU  63   8.946  -3.160  -1.333
  521    HB2  LEU  63           HB2      LEU  63   9.051  -0.309  -0.668
  522    HB3  LEU  63           HB1      LEU  63   8.314  -0.634  -2.220
  523    HG   LEU  63           HG       LEU  63   6.732  -2.199  -1.071
  524   HD11  LEU  63          HD11      LEU  63   6.490  -2.044   1.342
  525   HD12  LEU  63          HD12      LEU  63   7.903  -0.995   1.429
  526   HD13  LEU  63          HD13      LEU  63   8.080  -2.671   0.911
  527   HD21  LEU  63          HD21      LEU  63   6.858   0.727  -0.527
  528   HD22  LEU  63          HD22      LEU  63   5.575  -0.236   0.204
  529   HD23  LEU  63          HD23      LEU  63   5.748  -0.185  -1.548
  530    H    LYS  64           HN       LYS  64  11.587  -1.009  -2.239
  531    HA   LYS  64           HA       LYS  64  11.203  -1.093  -5.019
  532    HB2  LYS  64           HB2      LYS  64  12.837   0.430  -3.894
  533    HB3  LYS  64           HB1      LYS  64  13.868  -0.966  -3.602
  534    HG2  LYS  64           HG2      LYS  64  13.974  -1.338  -6.056
  535    HG3  LYS  64           HG1      LYS  64  13.067   0.157  -6.281
  536    HD2  LYS  64           HD2      LYS  64  14.886   1.328  -4.994
  537    HD3  LYS  64           HD1      LYS  64  15.810  -0.173  -5.078
  538    HE2  LYS  64           HE2      LYS  64  14.884   1.543  -7.377
  539    HE3  LYS  64           HE1      LYS  64  16.540   1.264  -6.848
  540    HZ1  LYS  64           HZ1      LYS  64  16.131  -0.058  -8.762
  541    HZ2  LYS  64           HZ2      LYS  64  14.716  -0.710  -8.105
  542    HZ3  LYS  64           HZ3      LYS  64  16.218  -1.107  -7.438
  543    H    ALA  65           HN       ALA  65  12.866  -3.195  -2.790
  544    HA   ALA  65           HA       ALA  65  13.909  -5.038  -4.633
  545    HB1  ALA  65           HB1      ALA  65  14.062  -6.599  -2.781
  546    HB2  ALA  65           HB2      ALA  65  12.924  -5.637  -1.839
  547    HB3  ALA  65           HB3      ALA  65  14.515  -4.986  -2.228
  548    H    ALA  66           HN       ALA  66  10.763  -4.782  -3.048
  549    HA   ALA  66           HA       ALA  66   9.636  -7.141  -4.124
  550    HB1  ALA  66           HB1      ALA  66   7.472  -6.175  -3.553
  551    HB2  ALA  66           HB2      ALA  66   8.215  -4.591  -3.334
  552    HB3  ALA  66           HB3      ALA  66   8.618  -5.913  -2.239
  553    H    ALA  67           HN       ALA  67   9.764  -3.771  -5.206
  554    HA   ALA  67           HA       ALA  67   8.278  -4.013  -7.558
  555    HB1  ALA  67           HB1      ALA  67   9.239  -1.953  -8.218
  556    HB2  ALA  67           HB2      ALA  67  10.671  -2.229  -7.229
  557    HB3  ALA  67           HB3      ALA  67   9.123  -1.891  -6.459
  558    H    GLN  68           HN       GLN  68  11.633  -4.615  -6.865
  559    HA   GLN  68           HA       GLN  68  12.466  -5.090  -9.519
  560    HB2  GLN  68           HB2      GLN  68  13.601  -5.986  -6.866
  561    HB3  GLN  68           HB1      GLN  68  14.402  -6.264  -8.410
  562    HG2  GLN  68           HG2      GLN  68  13.632  -3.550  -7.365
  563    HG3  GLN  68           HG1      GLN  68  15.231  -4.272  -7.181
  564   HE21  GLN  68          HE21      GLN  68  12.949  -2.845  -9.390
  565   HE22  GLN  68          HE22      GLN  68  14.042  -2.652 -10.717
  566    H    SER  69           HN       SER  69  11.233  -7.252  -6.974
  567    HA   SER  69           HA       SER  69  11.502  -9.603  -8.553
  568    HB2  SER  69           HB2      SER  69   9.947 -10.637  -6.879
  569    HB3  SER  69           HB1      SER  69  11.348  -9.854  -6.156
  570    HG   SER  69           HG       SER  69   9.282  -8.118  -6.404
  571    H    ILE  70           HN       ILE  70   9.381  -6.989  -8.604
  572    HA   ILE  70           HA       ILE  70   7.327  -8.427 -10.138
  573    HB   ILE  70           HB       ILE  70   7.253  -5.700  -8.803
  574   HG12  ILE  70          HG12      ILE  70   5.630  -8.135  -8.084
  575   HG13  ILE  70          HG11      ILE  70   7.204  -7.813  -7.362
  576   HG21  ILE  70          HG21      ILE  70   4.786  -5.828  -9.272
  577   HG22  ILE  70          HG22      ILE  70   5.139  -7.162 -10.370
  578   HG23  ILE  70          HG23      ILE  70   5.809  -5.562 -10.682
  579   HD11  ILE  70          HD11      ILE  70   4.965  -5.822  -7.282
  580   HD12  ILE  70          HD12      ILE  70   6.433  -5.867  -6.304
  581   HD13  ILE  70          HD13      ILE  70   5.172  -7.075  -6.059
  582    H    ASP  71           HN       ASP  71  10.098  -6.950 -10.569
  583    HA   ASP  71           HA       ASP  71  11.227  -5.838 -12.119
  584    HB2  ASP  71           HB2      ASP  71  10.822  -6.385 -14.473
  585    HB3  ASP  71           HB1      ASP  71  10.785  -7.807 -13.450
  586    H    ARG  72           HN       ARG  72   9.464  -4.189 -10.809
  587    HA   ARG  72           HA       ARG  72   8.927  -2.232 -12.956
  588    HB2  ARG  72           HB2      ARG  72   7.148  -2.750 -10.565
  589    HB3  ARG  72           HB1      ARG  72   6.917  -1.475 -11.753
  590    HG2  ARG  72           HG2      ARG  72   6.738  -3.249 -13.501
  591    HG3  ARG  72           HG1      ARG  72   6.736  -4.440 -12.202
  592    HD2  ARG  72           HD2      ARG  72   4.483  -4.124 -12.599
  593    HD3  ARG  72           HD1      ARG  72   4.783  -3.028 -11.251
  594    HE   ARG  72           HE       ARG  72   5.082  -1.314 -13.173
  595   HH11  ARG  72          HH21      ARG  72   2.779  -3.940 -13.090
  596   HH12  ARG  72          HH22      ARG  72   1.672  -3.183 -14.187
  597   HH21  ARG  72          HH11      ARG  72   3.597  -0.280 -14.600
  598   HH22  ARG  72          HH12      ARG  72   2.129  -1.097 -15.043
  599    H    THR  73           HN       THR  73   8.748   0.016 -12.133
  600    HA   THR  73           HA       THR  73  10.954   0.594 -10.383
  601    HB   THR  73           HB       THR  73   9.786   1.891 -12.547
  602    HG1  THR  73           HG1      THR  73  11.697   2.754 -12.431
  603   HG21  THR  73          HG21      THR  73   9.413   3.675 -10.145
  604   HG22  THR  73          HG22      THR  73   8.088   2.858 -10.974
  605   HG23  THR  73          HG23      THR  73   9.062   4.054 -11.831
  606    HA   PRO  74           HA       PRO  74   9.101   1.167  -6.419
  607    HB2  PRO  74           HB2      PRO  74   9.954   4.029  -6.570
  608    HB3  PRO  74           HB1      PRO  74  10.193   2.849  -5.276
  609    HG2  PRO  74           HG2      PRO  74  12.191   3.460  -6.907
  610    HG3  PRO  74           HG1      PRO  74  11.929   1.785  -6.391
  611    HD2  PRO  74           HD2      PRO  74  11.346   3.071  -9.016
  612    HD3  PRO  74           HD1      PRO  74  11.877   1.416  -8.660
  613    H    HIS  75           HN       HIS  75   8.331   3.755  -8.751
  614    HA   HIS  75           HA       HIS  75   6.086   4.728  -7.289
  615    HB2  HIS  75           HB2      HIS  75   7.120   5.140 -10.065
  616    HB3  HIS  75           HB1      HIS  75   5.492   5.681  -9.664
  617    HD1  HIS  75           HD1      HIS  75   8.388   7.303 -10.162
  618    HD2  HIS  75           HD2      HIS  75   6.040   6.968  -6.746
  619    HE1  HIS  75           HE1      HIS  75   8.995   9.277  -8.734
  620    HE2  HIS  75           HE2      HIS  75   7.404   9.176  -6.791
  621    H    TRP  76           HN       TRP  76   6.395   2.548 -10.070
  622    HA   TRP  76           HA       TRP  76   3.609   2.096 -10.327
  623    HB2  TRP  76           HB2      TRP  76   5.601  -0.003 -11.097
  624    HB3  TRP  76           HB1      TRP  76   4.104   0.443 -11.901
  625    HD1  TRP  76           HD1      TRP  76   7.069   0.157 -13.235
  626    HE1  TRP  76           HE1      TRP  76   7.973   2.129 -14.616
  627    HE3  TRP  76           HE3      TRP  76   4.083   3.882 -11.388
  628    HZ2  TRP  76           HZ2      TRP  76   7.488   4.900 -14.880
  629    HZ3  TRP  76           HZ3      TRP  76   4.369   6.160 -12.257
  630    HH2  TRP  76           HH2      TRP  76   6.037   6.659 -13.968
  631    H    LEU  77           HN       LEU  77   6.209   0.835  -8.526
  632    HA   LEU  77           HA       LEU  77   5.136  -1.494  -7.476
  633    HB2  LEU  77           HB2      LEU  77   7.422  -1.152  -7.180
  634    HB3  LEU  77           HB1      LEU  77   7.203   0.487  -6.626
  635    HG   LEU  77           HG       LEU  77   8.068  -1.183  -4.944
  636   HD11  LEU  77          HD11      LEU  77   7.479   0.389  -3.525
  637   HD12  LEU  77          HD12      LEU  77   5.848  -0.275  -3.450
  638   HD13  LEU  77          HD13      LEU  77   6.244   0.957  -4.646
  639   HD21  LEU  77          HD21      LEU  77   5.261  -2.212  -5.197
  640   HD22  LEU  77          HD22      LEU  77   6.238  -2.466  -3.752
  641   HD23  LEU  77          HD23      LEU  77   6.777  -3.107  -5.304
  642    H    ILE  78           HN       ILE  78   4.773   1.833  -6.528
  643    HA   ILE  78           HA       ILE  78   3.486   1.394  -4.046
  644    HB   ILE  78           HB       ILE  78   3.157   3.752  -5.914
  645   HG12  ILE  78          HG12      ILE  78   4.900   3.520  -3.459
  646   HG13  ILE  78          HG11      ILE  78   5.496   3.278  -5.099
  647   HG21  ILE  78          HG21      ILE  78   1.347   3.501  -4.235
  648   HG22  ILE  78          HG22      ILE  78   2.315   4.957  -4.003
  649   HG23  ILE  78          HG23      ILE  78   2.568   3.556  -2.963
  650   HD11  ILE  78          HD11      ILE  78   4.656   5.599  -5.609
  651   HD12  ILE  78          HD12      ILE  78   6.034   5.488  -4.514
  652   HD13  ILE  78          HD13      ILE  78   4.420   5.794  -3.871
  653    H    LYS  79           HN       LYS  79   2.183   2.279  -7.241
  654    HA   LYS  79           HA       LYS  79  -0.520   1.872  -6.469
  655    HB2  LYS  79           HB2      LYS  79  -1.110   2.162  -8.733
  656    HB3  LYS  79           HB1      LYS  79   0.350   3.122  -8.549
  657    HG2  LYS  79           HG2      LYS  79   1.666   1.392  -9.597
  658    HG3  LYS  79           HG1      LYS  79   0.257   0.338  -9.687
  659    HD2  LYS  79           HD2      LYS  79  -0.832   2.113 -11.114
  660    HD3  LYS  79           HD1      LYS  79   0.744   2.909 -11.177
  661    HE2  LYS  79           HE2      LYS  79  -0.176   0.899 -12.869
  662    HE3  LYS  79           HE1      LYS  79   1.479   1.493 -12.736
  663    HZ1  LYS  79           HZ1      LYS  79   0.290  -0.808 -11.273
  664    HZ2  LYS  79           HZ2      LYS  79   1.832  -0.190 -10.967
  665    HZ3  LYS  79           HZ3      LYS  79   1.480  -0.876 -12.472
  666    H    GLN  80           HN       GLN  80   1.902  -0.197  -7.880
  667    HA   GLN  80           HA       GLN  80   0.237  -2.406  -8.440
  668    HB2  GLN  80           HB2      GLN  80   2.533  -1.861  -9.381
  669    HB3  GLN  80           HB1      GLN  80   3.190  -2.480  -7.873
  670    HG2  GLN  80           HG2      GLN  80   3.304  -4.175  -9.512
  671    HG3  GLN  80           HG1      GLN  80   2.081  -4.627  -8.326
  672   HE21  GLN  80          HE21      GLN  80   0.772  -5.894  -9.565
  673   HE22  GLN  80          HE22      GLN  80  -0.063  -5.336 -10.976
  674    H    ALA  81           HN       ALA  81   2.230  -1.532  -5.644
  675    HA   ALA  81           HA       ALA  81   2.079  -3.965  -4.276
  676    HB1  ALA  81           HB1      ALA  81   2.332  -1.180  -3.153
  677    HB2  ALA  81           HB2      ALA  81   3.653  -2.253  -3.614
  678    HB3  ALA  81           HB3      ALA  81   2.615  -2.670  -2.251
  679    H    ILE  82           HN       ILE  82  -0.037  -1.120  -4.137
  680    HA   ILE  82           HA       ILE  82  -1.687  -2.268  -2.136
  681    HB   ILE  82           HB       ILE  82  -1.511   0.205  -2.694
  682   HG12  ILE  82          HG12      ILE  82  -3.960   0.602  -2.184
  683   HG13  ILE  82          HG11      ILE  82  -4.185  -1.138  -2.327
  684   HG21  ILE  82          HG21      ILE  82  -2.398   1.127  -4.525
  685   HG22  ILE  82          HG22      ILE  82  -3.785   0.041  -4.528
  686   HG23  ILE  82          HG23      ILE  82  -2.246  -0.495  -5.200
  687   HD11  ILE  82          HD11      ILE  82  -2.214  -1.182  -0.577
  688   HD12  ILE  82          HD12      ILE  82  -3.890  -0.958  -0.082
  689   HD13  ILE  82          HD13      ILE  82  -2.818   0.435  -0.220
  690    H    PHE  83           HN       PHE  83  -1.808  -2.272  -5.675
  691    HA   PHE  83           HA       PHE  83  -4.328  -3.636  -5.798
  692    HB2  PHE  83           HB2      PHE  83  -2.159  -3.507  -7.921
  693    HB3  PHE  83           HB1      PHE  83  -3.837  -3.961  -8.173
  694    HD1  PHE  83           HD1      PHE  83  -4.910  -1.678  -6.314
  695    HD2  PHE  83           HD2      PHE  83  -2.181  -1.793  -9.579
  696    HE1  PHE  83           HE1      PHE  83  -5.432   0.669  -6.830
  697    HE2  PHE  83           HE2      PHE  83  -2.698   0.555 -10.098
  698    HZ   PHE  83           HZ       PHE  83  -4.324   1.789  -8.722
  699    H    ASN  84           HN       ASN  84  -0.934  -4.543  -5.831
  700    HA   ASN  84           HA       ASN  84  -1.272  -7.282  -6.357
  701    HB2  ASN  84           HB2      ASN  84   0.902  -5.745  -4.967
  702    HB3  ASN  84           HB1      ASN  84   0.911  -7.498  -5.011
  703   HD21  ASN  84          HD21      ASN  84   2.975  -6.100  -6.045
  704   HD22  ASN  84          HD22      ASN  84   2.979  -6.233  -7.769
  705    H    TYR  85           HN       TYR  85  -1.225  -5.323  -3.468
  706    HA   TYR  85           HA       TYR  85  -1.328  -7.325  -1.553
  707    HB2  TYR  85           HB2      TYR  85  -1.019  -5.056  -0.839
  708    HB3  TYR  85           HB1      TYR  85  -2.498  -4.535  -1.632
  709    HD1  TYR  85           HD2      TYR  85  -1.487  -7.042   0.954
  710    HD2  TYR  85           HD1      TYR  85  -4.256  -4.039  -0.235
  711    HE1  TYR  85           HE2      TYR  85  -2.708  -7.333   3.067
  712    HE2  TYR  85           HE1      TYR  85  -5.482  -4.323   1.876
  713    HH   TYR  85           HH       TYR  85  -5.779  -5.808   3.641
  714    H    LEU  86           HN       LEU  86  -3.765  -5.784  -3.504
  715    HA   LEU  86           HA       LEU  86  -5.951  -7.204  -2.357
  716    HB2  LEU  86           HB2      LEU  86  -5.808  -5.674  -4.938
  717    HB3  LEU  86           HB1      LEU  86  -7.276  -6.287  -4.201
  718    HG   LEU  86           HG       LEU  86  -5.472  -4.130  -3.115
  719   HD11  LEU  86          HD11      LEU  86  -6.946  -3.412  -4.899
  720   HD12  LEU  86          HD12      LEU  86  -7.468  -2.740  -3.354
  721   HD13  LEU  86          HD13      LEU  86  -8.330  -4.108  -4.058
  722   HD21  LEU  86          HD21      LEU  86  -7.830  -5.517  -1.856
  723   HD22  LEU  86          HD22      LEU  86  -7.216  -3.954  -1.321
  724   HD23  LEU  86          HD23      LEU  86  -6.188  -5.383  -1.225
  725    H    GLU  87           HN       GLU  87  -3.960  -7.582  -5.234
  726    HA   GLU  87           HA       GLU  87  -5.399  -9.699  -6.409
  727    HB2  GLU  87           HB2      GLU  87  -3.675  -8.282  -7.541
  728    HB3  GLU  87           HB1      GLU  87  -2.440  -9.158  -6.650
  729    HG2  GLU  87           HG2      GLU  87  -3.140 -11.239  -7.721
  730    HG3  GLU  87           HG1      GLU  87  -4.372 -10.356  -8.622
  731    H    LYS  88           HN       LYS  88  -2.747  -9.689  -4.063
  732    HA   LYS  88           HA       LYS  88  -2.223 -12.468  -4.166
  733    HB2  LYS  88           HB2      LYS  88  -1.718 -10.502  -1.927
  734    HB3  LYS  88           HB1      LYS  88  -1.059 -12.129  -2.007
  735    HG2  LYS  88           HG2      LYS  88  -0.505  -9.933  -3.992
  736    HG3  LYS  88           HG1      LYS  88   0.561 -10.408  -2.671
  737    HD2  LYS  88           HD2      LYS  88   0.686 -12.686  -3.664
  738    HD3  LYS  88           HD1      LYS  88  -0.274 -12.102  -5.025
  739    HE2  LYS  88           HE2      LYS  88   2.395 -10.977  -4.181
  740    HE3  LYS  88           HE1      LYS  88   2.150 -12.120  -5.500
  741    HZ1  LYS  88           HZ1      LYS  88   0.761 -10.487  -6.614
  742    HZ2  LYS  88           HZ2      LYS  88   2.298  -9.850  -6.312
  743    HZ3  LYS  88           HZ3      LYS  88   0.988  -9.391  -5.347
  744    H    LEU  89           HN       LEU  89  -4.199 -10.549  -1.874
  745    HA   LEU  89           HA       LEU  89  -5.100 -13.003  -0.628
  746    HB2  LEU  89           HB2      LEU  89  -6.405 -11.571   0.872
  747    HB3  LEU  89           HB1      LEU  89  -4.721 -11.099   0.812
  748    HG   LEU  89           HG       LEU  89  -5.726  -9.402  -1.027
  749   HD11  LEU  89          HD11      LEU  89  -8.033 -10.280  -0.601
  750   HD12  LEU  89          HD12      LEU  89  -7.843  -8.543  -0.377
  751   HD13  LEU  89          HD13      LEU  89  -7.922  -9.607   1.026
  752   HD21  LEU  89          HD21      LEU  89  -5.693  -7.711   0.718
  753   HD22  LEU  89          HD22      LEU  89  -4.332  -8.817   0.890
  754   HD23  LEU  89          HD23      LEU  89  -5.729  -8.964   1.958
  755    H    GLU  90           HN       GLU  90  -6.334 -10.587  -2.809
  756    HA   GLU  90           HA       GLU  90  -8.225 -10.299  -3.964
  757    HB2  GLU  90           HB2      GLU  90  -7.052 -12.319  -5.026
  758    HB3  GLU  90           HB1      GLU  90  -8.318 -13.292  -4.280
  759    HG2  GLU  90           HG2      GLU  90 -10.016 -12.197  -5.515
  760    HG3  GLU  90           HG1      GLU  90  -8.905 -10.950  -6.065
  Start of MODEL   30
    1    H1   MET   1           HT1      MET   1   5.289   0.196  13.683
    2    H2   MET   1           HT2      MET   1   6.792   0.334  12.923
    3    H3   MET   1           HT3      MET   1   5.774  -0.961  12.547
    4    HA   MET   1           HA       MET   1   5.746   0.701  10.798
    5    HB2  MET   1           HB2      MET   1   3.193   0.529  12.415
    6    HB3  MET   1           HB1      MET   1   3.284   1.090  10.752
    7    HG2  MET   1           HG2      MET   1   4.098  -1.105  10.057
    8    HG3  MET   1           HG1      MET   1   4.003  -1.662  11.727
    9    HE1  MET   1           HE1      MET   1   2.639  -3.158   9.295
   10    HE2  MET   1           HE2      MET   1   1.069  -3.566   9.989
   11    HE3  MET   1           HE3      MET   1   2.532  -3.716  10.964
   12    H    ALA   2           HN       ALA   2   6.811   2.616  10.892
   13    HA   ALA   2           HA       ALA   2   5.610   4.752  12.545
   14    HB1  ALA   2           HB1      ALA   2   8.474   4.380  11.659
   15    HB2  ALA   2           HB2      ALA   2   7.851   4.278  13.306
   16    HB3  ALA   2           HB3      ALA   2   7.857   5.825  12.460
   17    H    THR   3           HN       THR   3   4.469   4.137  10.187
   18    HA   THR   3           HA       THR   3   5.549   5.429   7.932
   19    HB   THR   3           HB       THR   3   3.366   5.109   6.906
   20    HG1  THR   3           HG1      THR   3   1.919   3.874   8.643
   21   HG21  THR   3          HG21      THR   3   4.077   2.749   8.651
   22   HG22  THR   3          HG22      THR   3   4.858   3.157   7.124
   23   HG23  THR   3          HG23      THR   3   3.155   2.698   7.148
   24    H    THR   4           HN       THR   4   5.068   7.344   6.979
   25    HA   THR   4           HA       THR   4   3.752   9.369   8.670
   26    HB   THR   4           HB       THR   4   5.947   9.775   6.615
   27    HG1  THR   4           HG1      THR   4   6.794   8.727   8.417
   28   HG21  THR   4          HG21      THR   4   4.593  11.775   6.869
   29   HG22  THR   4          HG22      THR   4   6.153  12.016   7.655
   30   HG23  THR   4          HG23      THR   4   4.722  11.672   8.625
   31    H    THR   5           HN       THR   5   2.638  11.125   7.403
   32    HA   THR   5           HA       THR   5   1.101   9.976   5.251
   33    HB   THR   5           HB       THR   5   0.300  12.566   5.336
   34    HG1  THR   5           HG1      THR   5   0.874  13.507   7.139
   35   HG21  THR   5          HG21      THR   5  -0.521  10.356   7.223
   36   HG22  THR   5          HG22      THR   5  -1.177  10.663   5.615
   37   HG23  THR   5          HG23      THR   5  -1.453  11.821   6.917
   38    H    LEU   6           HN       LEU   6   2.275   9.783   3.404
   39    HA   LEU   6           HA       LEU   6   3.372  12.265   2.265
   40    HB2  LEU   6           HB2      LEU   6   4.875  10.226   1.128
   41    HB3  LEU   6           HB1      LEU   6   5.417  11.384   2.326
   42    HG   LEU   6           HG       LEU   6   4.543   9.687   4.067
   43   HD11  LEU   6          HD11      LEU   6   4.811   7.886   1.668
   44   HD12  LEU   6          HD12      LEU   6   3.302   8.300   2.483
   45   HD13  LEU   6          HD13      LEU   6   4.539   7.375   3.334
   46   HD21  LEU   6          HD21      LEU   6   6.911  10.199   3.669
   47   HD22  LEU   6          HD22      LEU   6   6.946   8.995   2.380
   48   HD23  LEU   6          HD23      LEU   6   6.657   8.496   4.047
   49    H    GLY   7           HN       GLY   7   3.744  11.983  -0.178
   50    HA2  GLY   7           HA2      GLY   7   1.238  11.320  -1.360
   51    HA3  GLY   7           HA1      GLY   7   2.686  11.828  -2.216
   52    H    VAL   8           HN       VAL   8   0.544   9.389  -1.855
   53    HA   VAL   8           HA       VAL   8   2.436   7.398  -2.920
   54    HB   VAL   8           HB       VAL   8   0.254   6.935  -0.895
   55   HG11  VAL   8          HG11      VAL   8   0.262   5.064  -2.401
   56   HG12  VAL   8          HG12      VAL   8   0.983   4.583  -0.865
   57   HG13  VAL   8          HG13      VAL   8   2.013   4.915  -2.257
   58   HG21  VAL   8          HG21      VAL   8   2.099   6.161   0.546
   59   HG22  VAL   8          HG22      VAL   8   2.247   7.860   0.095
   60   HG23  VAL   8          HG23      VAL   8   3.244   6.645  -0.706
   61    H    LYS   9           HN       LYS   9   1.401   5.753  -4.244
   62    HA   LYS   9           HA       LYS   9  -0.758   6.893  -5.825
   63    HB2  LYS   9           HB2      LYS   9   0.773   4.345  -6.339
   64    HB3  LYS   9           HB1      LYS   9  -0.152   5.293  -7.493
   65    HG2  LYS   9           HG2      LYS   9   2.429   6.108  -6.175
   66    HG3  LYS   9           HG1      LYS   9   2.219   5.598  -7.849
   67    HD2  LYS   9           HD2      LYS   9   0.832   7.995  -6.663
   68    HD3  LYS   9           HD1      LYS   9   2.396   8.086  -7.471
   69    HE2  LYS   9           HE2      LYS   9   0.955   8.609  -9.188
   70    HE3  LYS   9           HE1      LYS   9   1.153   6.872  -9.412
   71    HZ1  LYS   9           HZ1      LYS   9  -0.941   6.447  -8.510
   72    HZ2  LYS   9           HZ2      LYS   9  -1.192   7.799  -9.495
   73    HZ3  LYS   9           HZ3      LYS   9  -1.069   7.986  -7.818
   74    H    LEU  10           HN       LEU  10  -2.659   6.523  -4.754
   75    HA   LEU  10           HA       LEU  10  -3.409   3.697  -4.408
   76    HB2  LEU  10           HB2      LEU  10  -3.208   5.694  -2.358
   77    HB3  LEU  10           HB1      LEU  10  -4.893   5.251  -2.554
   78    HG   LEU  10           HG       LEU  10  -2.706   3.222  -2.110
   79   HD11  LEU  10          HD11      LEU  10  -4.295   4.837  -0.170
   80   HD12  LEU  10          HD12      LEU  10  -2.599   4.354  -0.111
   81   HD13  LEU  10          HD13      LEU  10  -3.865   3.173   0.223
   82   HD21  LEU  10          HD21      LEU  10  -5.708   3.144  -2.029
   83   HD22  LEU  10          HD22      LEU  10  -4.691   1.879  -1.342
   84   HD23  LEU  10          HD23      LEU  10  -4.622   2.224  -3.070
   85    H    ASP  11           HN       ASP  11  -5.493   3.187  -5.003
   86    HA   ASP  11           HA       ASP  11  -6.856   5.151  -6.664
   87    HB2  ASP  11           HB2      ASP  11  -6.702   2.254  -6.544
   88    HB3  ASP  11           HB1      ASP  11  -8.377   2.789  -6.591
   89    H    ASP  12           HN       ASP  12  -8.850   6.031  -6.210
   90    HA   ASP  12           HA       ASP  12  -9.684   6.287  -3.563
   91    HB2  ASP  12           HB2      ASP  12 -10.839   7.000  -6.196
   92    HB3  ASP  12           HB1      ASP  12 -11.984   6.882  -4.864
   93    HA   PRO  13           HA       PRO  13 -13.209   3.034  -4.445
   94    HB2  PRO  13           HB2      PRO  13 -12.613   1.239  -6.453
   95    HB3  PRO  13           HB1      PRO  13 -13.672   2.638  -6.650
   96    HG2  PRO  13           HG2      PRO  13 -10.793   2.320  -7.387
   97    HG3  PRO  13           HG1      PRO  13 -12.099   3.129  -8.275
   98    HD2  PRO  13           HD2      PRO  13 -10.275   4.516  -6.873
   99    HD3  PRO  13           HD1      PRO  13 -11.968   5.040  -6.978
  100    H    THR  14           HN       THR  14  -9.857   2.216  -5.188
  101    HA   THR  14           HA       THR  14  -9.920  -0.316  -3.901
  102    HB   THR  14           HB       THR  14  -8.026   1.196  -5.414
  103    HG1  THR  14           HG1      THR  14  -8.126  -1.498  -4.506
  104   HG21  THR  14          HG21      THR  14  -6.871   1.714  -3.343
  105   HG22  THR  14          HG22      THR  14  -5.946   0.535  -4.273
  106   HG23  THR  14          HG23      THR  14  -6.894   0.014  -2.880
  107    H    ARG  15           HN       ARG  15  -9.421   2.962  -2.846
  108    HA   ARG  15           HA       ARG  15  -8.235   2.410  -0.343
  109    HB2  ARG  15           HB2      ARG  15  -8.353   4.681  -1.395
  110    HB3  ARG  15           HB1      ARG  15 -10.072   4.718  -1.031
  111    HG2  ARG  15           HG2      ARG  15  -9.578   4.581   1.352
  112    HG3  ARG  15           HG1      ARG  15  -7.849   4.533   0.994
  113    HD2  ARG  15           HD2      ARG  15  -8.145   6.738  -0.176
  114    HD3  ARG  15           HD1      ARG  15  -9.781   6.784   0.477
  115    HE   ARG  15           HE       ARG  15  -8.917   7.201   2.588
  116   HH11  ARG  15          HH21      ARG  15  -6.350   6.503   0.319
  117   HH12  ARG  15          HH22      ARG  15  -5.095   7.146   1.327
  118   HH21  ARG  15          HH11      ARG  15  -7.267   8.056   3.934
  119   HH22  ARG  15          HH12      ARG  15  -5.621   8.034   3.390
  120    H    GLU  16           HN       GLU  16 -11.561   2.611  -1.484
  121    HA   GLU  16           HA       GLU  16 -12.867   2.219   0.970
  122    HB2  GLU  16           HB2      GLU  16 -13.700   1.253  -1.778
  123    HB3  GLU  16           HB1      GLU  16 -14.757   1.384  -0.378
  124    HG2  GLU  16           HG2      GLU  16 -13.358   3.663  -1.758
  125    HG3  GLU  16           HG1      GLU  16 -15.068   3.256  -1.893
  126    H    ARG  17           HN       ARG  17 -11.503  -0.029  -1.380
  127    HA   ARG  17           HA       ARG  17 -12.276  -2.436  -0.153
  128    HB2  ARG  17           HB2      ARG  17 -11.343  -2.360  -2.423
  129    HB3  ARG  17           HB1      ARG  17  -9.788  -1.856  -1.780
  130    HG2  ARG  17           HG2      ARG  17  -9.783  -4.216  -2.365
  131    HG3  ARG  17           HG1      ARG  17  -9.551  -3.990  -0.632
  132    HD2  ARG  17           HD2      ARG  17 -11.182  -5.821  -1.464
  133    HD3  ARG  17           HD1      ARG  17 -11.659  -4.793  -0.114
  134    HE   ARG  17           HE       ARG  17 -12.505  -3.925  -2.756
  135   HH11  ARG  17          HH21      ARG  17 -13.312  -5.691   0.149
  136   HH12  ARG  17          HH22      ARG  17 -15.024  -5.516  -0.053
  137   HH21  ARG  17          HH11      ARG  17 -14.773  -3.673  -3.036
  138   HH22  ARG  17          HH12      ARG  17 -15.858  -4.365  -1.874
  139    H    LEU  18           HN       LEU  18  -9.554  -0.274   0.383
  140    HA   LEU  18           HA       LEU  18  -8.124  -1.850   2.204
  141    HB2  LEU  18           HB2      LEU  18  -8.225   1.025   1.523
  142    HB3  LEU  18           HB1      LEU  18  -7.621   0.650   3.124
  143    HG   LEU  18           HG       LEU  18  -5.954  -0.899   2.026
  144   HD11  LEU  18          HD11      LEU  18  -6.746   0.566  -0.480
  145   HD12  LEU  18          HD12      LEU  18  -7.193  -1.100  -0.118
  146   HD13  LEU  18          HD13      LEU  18  -5.495  -0.664  -0.307
  147   HD21  LEU  18          HD21      LEU  18  -4.535   1.017   1.198
  148   HD22  LEU  18          HD22      LEU  18  -5.171   1.176   2.835
  149   HD23  LEU  18          HD23      LEU  18  -5.921   2.062   1.507
  150    H    LYS  19           HN       LYS  19 -10.861   0.382   2.684
  151    HA   LYS  19           HA       LYS  19 -10.874   0.252   5.494
  152    HB2  LYS  19           HB2      LYS  19 -12.252   1.867   4.164
  153    HB3  LYS  19           HB1      LYS  19 -13.322   0.531   3.748
  154    HG2  LYS  19           HG2      LYS  19 -13.723   0.172   6.174
  155    HG3  LYS  19           HG1      LYS  19 -12.774   1.620   6.502
  156    HD2  LYS  19           HD2      LYS  19 -14.384   2.888   5.056
  157    HD3  LYS  19           HD1      LYS  19 -15.377   1.430   4.998
  158    HE2  LYS  19           HE2      LYS  19 -14.670   3.103   7.399
  159    HE3  LYS  19           HE1      LYS  19 -16.268   2.794   6.725
  160    HZ1  LYS  19           HZ1      LYS  19 -14.532   0.725   7.972
  161    HZ2  LYS  19           HZ2      LYS  19 -16.114   0.506   7.416
  162    HZ3  LYS  19           HZ3      LYS  19 -15.818   1.503   8.752
  163    H    ALA  20           HN       ALA  20 -12.309  -1.763   3.050
  164    HA   ALA  20           HA       ALA  20 -13.728  -3.517   4.742
  165    HB1  ALA  20           HB1      ALA  20 -12.582  -3.908   1.980
  166    HB2  ALA  20           HB2      ALA  20 -14.249  -3.528   2.413
  167    HB3  ALA  20           HB3      ALA  20 -13.577  -5.112   2.800
  168    H    ALA  21           HN       ALA  21 -10.437  -3.438   3.541
  169    HA   ALA  21           HA       ALA  21  -9.613  -5.915   4.653
  170    HB1  ALA  21           HB1      ALA  21  -8.498  -4.379   2.842
  171    HB2  ALA  21           HB2      ALA  21  -7.510  -5.388   3.894
  172    HB3  ALA  21           HB3      ALA  21  -7.692  -3.668   4.242
  173    H    ALA  22           HN       ALA  22  -9.746  -2.611   5.795
  174    HA   ALA  22           HA       ALA  22  -8.250  -2.802   8.145
  175    HB1  ALA  22           HB1      ALA  22  -9.100  -0.696   7.090
  176    HB2  ALA  22           HB2      ALA  22  -9.338  -0.787   8.835
  177    HB3  ALA  22           HB3      ALA  22 -10.690  -1.089   7.744
  178    H    GLN  23           HN       GLN  23 -11.721  -3.078   7.719
  179    HA   GLN  23           HA       GLN  23 -12.279  -3.807  10.394
  180    HB2  GLN  23           HB2      GLN  23 -14.470  -4.501   9.566
  181    HB3  GLN  23           HB1      GLN  23 -13.998  -2.980   8.865
  182    HG2  GLN  23           HG2      GLN  23 -14.711  -3.920   6.962
  183    HG3  GLN  23           HG1      GLN  23 -13.090  -4.611   6.965
  184   HE21  GLN  23          HE21      GLN  23 -13.612  -6.454   5.874
  185   HE22  GLN  23          HE22      GLN  23 -14.607  -7.702   6.541
  186    H    SER  24           HN       SER  24 -11.331  -5.544   7.567
  187    HA   SER  24           HA       SER  24 -12.067  -8.078   8.446
  188    HB2  SER  24           HB2      SER  24 -11.573  -7.476   6.068
  189    HB3  SER  24           HB1      SER  24  -9.863  -7.395   6.486
  190    HG   SER  24           HG       SER  24 -10.241  -9.419   5.676
  191    H    ILE  25           HN       ILE  25  -9.155  -6.153   8.851
  192    HA   ILE  25           HA       ILE  25  -7.839  -8.355  10.246
  193    HB   ILE  25           HB       ILE  25  -6.564  -7.120   8.525
  194   HG12  ILE  25          HG12      ILE  25  -4.511  -6.779   9.845
  195   HG13  ILE  25          HG11      ILE  25  -5.460  -6.793  11.326
  196   HG21  ILE  25          HG21      ILE  25  -5.738  -4.847   9.076
  197   HG22  ILE  25          HG22      ILE  25  -6.878  -4.808  10.422
  198   HG23  ILE  25          HG23      ILE  25  -7.473  -4.923   8.766
  199   HD11  ILE  25          HD11      ILE  25  -5.301  -9.112   9.421
  200   HD12  ILE  25          HD12      ILE  25  -6.001  -9.094  11.040
  201   HD13  ILE  25          HD13      ILE  25  -4.260  -8.912  10.830
  202    H    ASP  26           HN       ASP  26  -9.817  -5.816  11.002
  203    HA   ASP  26           HA       ASP  26 -10.628  -5.101  12.977
  204    HB2  ASP  26           HB2      ASP  26 -10.339  -6.355  14.821
  205    HB3  ASP  26           HB1      ASP  26  -9.337  -7.364  13.800
  206    H    ARG  27           HN       ARG  27  -8.673  -3.725  11.377
  207    HA   ARG  27           HA       ARG  27  -7.526  -1.947  13.440
  208    HB2  ARG  27           HB2      ARG  27  -6.476  -2.701  10.719
  209    HB3  ARG  27           HB1      ARG  27  -5.891  -1.293  11.592
  210    HG2  ARG  27           HG2      ARG  27  -4.865  -2.565  13.226
  211    HG3  ARG  27           HG1      ARG  27  -5.872  -3.978  12.901
  212    HD2  ARG  27           HD2      ARG  27  -4.581  -4.673  11.170
  213    HD3  ARG  27           HD1      ARG  27  -4.165  -3.033  10.681
  214    HE   ARG  27           HE       ARG  27  -2.251  -3.233  11.881
  215   HH11  ARG  27          HH21      ARG  27  -4.539  -5.553  13.187
  216   HH12  ARG  27          HH22      ARG  27  -3.386  -6.252  14.278
  217   HH21  ARG  27          HH11      ARG  27  -0.738  -4.177  13.322
  218   HH22  ARG  27          HH12      ARG  27  -1.239  -5.471  14.358
  219    H    THR  28           HN       THR  28  -7.529   0.322  12.989
  220    HA   THR  28           HA       THR  28  -9.895   1.181  11.615
  221    HB   THR  28           HB       THR  28  -8.790   2.210  13.756
  222    HG1  THR  28           HG1      THR  28 -10.403   3.492  13.324
  223   HG21  THR  28          HG21      THR  28  -6.597   2.645  12.654
  224   HG22  THR  28          HG22      THR  28  -7.317   4.078  13.388
  225   HG23  THR  28          HG23      THR  28  -7.393   3.849  11.641
  226    HA   PRO  29           HA       PRO  29  -8.648   1.961   7.449
  227    HB2  PRO  29           HB2      PRO  29  -9.184   4.834   8.113
  228    HB3  PRO  29           HB1      PRO  29  -9.640   3.910   6.675
  229    HG2  PRO  29           HG2      PRO  29 -11.405   4.354   8.627
  230    HG3  PRO  29           HG1      PRO  29 -11.362   2.808   7.761
  231    HD2  PRO  29           HD2      PRO  29 -10.539   3.438  10.529
  232    HD3  PRO  29           HD1      PRO  29 -11.042   1.890   9.823
  233    H    HIS  30           HN       HIS  30  -7.494   4.710   9.469
  234    HA   HIS  30           HA       HIS  30  -5.237   5.227   7.883
  235    HB2  HIS  30           HB2      HIS  30  -5.981   5.932  10.697
  236    HB3  HIS  30           HB1      HIS  30  -4.354   6.280  10.116
  237    HD1  HIS  30           HD1      HIS  30  -7.160   8.133  10.678
  238    HD2  HIS  30           HD2      HIS  30  -4.920   7.502   7.231
  239    HE1  HIS  30           HE1      HIS  30  -7.696  10.070   9.165
  240    HE2  HIS  30           HE2      HIS  30  -6.146   9.790   7.197
  241    H    TRP  31           HN       TRP  31  -5.540   3.250  10.822
  242    HA   TRP  31           HA       TRP  31  -2.810   2.542  10.938
  243    HB2  TRP  31           HB2      TRP  31  -4.480   2.280  12.829
  244    HB3  TRP  31           HB1      TRP  31  -5.107   0.873  11.975
  245    HD1  TRP  31           HD1      TRP  31  -3.082  -1.086  11.473
  246    HE1  TRP  31           HE1      TRP  31  -1.292  -1.916  13.123
  247    HE3  TRP  31           HE3      TRP  31  -3.132   2.814  14.781
  248    HZ2  TRP  31           HZ2      TRP  31  -0.069  -1.053  15.502
  249    HZ3  TRP  31           HZ3      TRP  31  -1.620   2.728  16.721
  250    HH2  TRP  31           HH2      TRP  31  -0.121   0.833  17.073
  251    H    LEU  32           HN       LEU  32  -5.618   1.171   9.439
  252    HA   LEU  32           HA       LEU  32  -4.508  -1.211   8.506
  253    HB2  LEU  32           HB2      LEU  32  -6.913  -0.818   8.504
  254    HB3  LEU  32           HB1      LEU  32  -6.719   0.439   7.302
  255    HG   LEU  32           HG       LEU  32  -7.578  -1.869   6.539
  256   HD11  LEU  32          HD11      LEU  32  -6.862  -0.048   5.034
  257   HD12  LEU  32          HD12      LEU  32  -6.550  -1.658   4.386
  258   HD13  LEU  32          HD13      LEU  32  -5.227  -0.709   5.064
  259   HD21  LEU  32          HD21      LEU  32  -5.896  -3.200   7.721
  260   HD22  LEU  32          HD22      LEU  32  -4.638  -2.499   6.704
  261   HD23  LEU  32          HD23      LEU  32  -5.888  -3.514   5.985
  262    H    ILE  33           HN       ILE  33  -4.579   1.997   7.098
  263    HA   ILE  33           HA       ILE  33  -3.597   1.290   4.576
  264    HB   ILE  33           HB       ILE  33  -3.213   3.865   6.110
  265   HG12  ILE  33          HG12      ILE  33  -5.076   3.220   3.818
  266   HG13  ILE  33          HG11      ILE  33  -5.554   3.157   5.511
  267   HG21  ILE  33          HG21      ILE  33  -1.475   3.693   4.443
  268   HG22  ILE  33          HG22      ILE  33  -2.683   4.867   3.919
  269   HG23  ILE  33          HG23      ILE  33  -2.659   3.251   3.212
  270   HD11  ILE  33          HD11      ILE  33  -4.687   5.568   3.946
  271   HD12  ILE  33          HD12      ILE  33  -4.938   5.563   5.691
  272   HD13  ILE  33          HD13      ILE  33  -6.286   5.226   4.604
  273    H    LYS  34           HN       LYS  34  -1.886   2.227   7.548
  274    HA   LYS  34           HA       LYS  34   0.741   1.969   6.542
  275    HB2  LYS  34           HB2      LYS  34   0.229   1.029   9.320
  276    HB3  LYS  34           HB1      LYS  34   1.453   2.139   8.726
  277    HG2  LYS  34           HG2      LYS  34  -0.300   3.871   8.495
  278    HG3  LYS  34           HG1      LYS  34  -1.450   2.753   9.223
  279    HD2  LYS  34           HD2      LYS  34   1.058   3.831  10.511
  280    HD3  LYS  34           HD1      LYS  34  -0.598   4.312  10.884
  281    HE2  LYS  34           HE2      LYS  34  -1.004   1.862  11.460
  282    HE3  LYS  34           HE1      LYS  34   0.749   1.678  11.417
  283    HZ1  LYS  34           HZ1      LYS  34   0.823   3.552  13.070
  284    HZ2  LYS  34           HZ2      LYS  34   0.176   2.100  13.646
  285    HZ3  LYS  34           HZ3      LYS  34  -0.853   3.379  13.240
  286    H    GLN  35           HN       GLN  35  -1.406  -0.308   8.117
  287    HA   GLN  35           HA       GLN  35   0.244  -2.582   8.101
  288    HB2  GLN  35           HB2      GLN  35  -1.539  -2.615   9.604
  289    HB3  GLN  35           HB1      GLN  35  -2.694  -2.081   8.398
  290    HG2  GLN  35           HG2      GLN  35  -3.151  -4.354   8.955
  291    HG3  GLN  35           HG1      GLN  35  -2.525  -4.293   7.310
  292   HE21  GLN  35          HE21      GLN  35  -1.892  -6.424   7.346
  293   HE22  GLN  35          HE22      GLN  35  -0.524  -6.979   8.260
  294    H    ALA  36           HN       ALA  36  -2.105  -1.399   5.754
  295    HA   ALA  36           HA       ALA  36  -2.338  -3.692   4.176
  296    HB1  ALA  36           HB1      ALA  36  -3.049  -2.066   2.385
  297    HB2  ALA  36           HB2      ALA  36  -2.700  -0.779   3.540
  298    HB3  ALA  36           HB3      ALA  36  -3.937  -1.982   3.906
  299    H    ILE  37           HN       ILE  37  -0.227  -0.851   3.678
  300    HA   ILE  37           HA       ILE  37   1.025  -2.035   1.417
  301    HB   ILE  37           HB       ILE  37   1.002   0.421   1.850
  302   HG12  ILE  37          HG12      ILE  37   3.411   0.779   1.165
  303   HG13  ILE  37          HG11      ILE  37   3.653  -0.949   1.404
  304   HG21  ILE  37          HG21      ILE  37   3.213  -0.103   3.821
  305   HG22  ILE  37          HG22      ILE  37   1.548   0.251   4.281
  306   HG23  ILE  37          HG23      ILE  37   2.491   1.449   3.395
  307   HD11  ILE  37          HD11      ILE  37   2.225  -1.500  -0.365
  308   HD12  ILE  37          HD12      ILE  37   3.192  -0.149  -0.957
  309   HD13  ILE  37          HD13      ILE  37   1.533   0.121  -0.423
  310    H    PHE  38           HN       PHE  38   1.640  -2.019   4.849
  311    HA   PHE  38           HA       PHE  38   4.165  -3.325   4.734
  312    HB2  PHE  38           HB2      PHE  38   2.202  -2.627   6.850
  313    HB3  PHE  38           HB1      PHE  38   3.252  -3.998   7.188
  314    HD1  PHE  38           HD1      PHE  38   3.499  -0.510   5.878
  315    HD2  PHE  38           HD2      PHE  38   5.220  -3.586   8.261
  316    HE1  PHE  38           HE1      PHE  38   5.290   1.027   6.565
  317    HE2  PHE  38           HE2      PHE  38   7.014  -2.052   8.953
  318    HZ   PHE  38           HZ       PHE  38   7.049   0.257   8.105
  319    H    ASN  39           HN       ASN  39   0.834  -4.369   4.711
  320    HA   ASN  39           HA       ASN  39   1.291  -7.065   5.385
  321    HB2  ASN  39           HB2      ASN  39  -0.963  -5.853   5.319
  322    HB3  ASN  39           HB1      ASN  39  -0.931  -6.131   3.579
  323   HD21  ASN  39          HD21      ASN  39  -0.968  -7.675   6.714
  324   HD22  ASN  39          HD22      ASN  39  -1.630  -9.173   6.184
  325    H    TYR  40           HN       TYR  40   1.291  -5.252   2.384
  326    HA   TYR  40           HA       TYR  40   1.606  -7.400   0.625
  327    HB2  TYR  40           HB2      TYR  40   1.197  -5.280  -0.371
  328    HB3  TYR  40           HB1      TYR  40   2.507  -4.521   0.527
  329    HD1  TYR  40           HD1      TYR  40   2.376  -7.567  -1.635
  330    HD2  TYR  40           HD2      TYR  40   4.087  -3.732  -0.972
  331    HE1  TYR  40           HE1      TYR  40   3.867  -7.906  -3.556
  332    HE2  TYR  40           HE2      TYR  40   5.584  -4.063  -2.898
  333    HH   TYR  40           HH       TYR  40   6.292  -5.499  -4.454
  334    H    LEU  41           HN       LEU  41   3.886  -5.417   2.394
  335    HA   LEU  41           HA       LEU  41   6.214  -6.781   1.546
  336    HB2  LEU  41           HB2      LEU  41   5.761  -5.037   3.956
  337    HB3  LEU  41           HB1      LEU  41   7.328  -5.538   3.345
  338    HG   LEU  41           HG       LEU  41   5.339  -3.773   1.917
  339   HD11  LEU  41          HD11      LEU  41   8.029  -3.195   3.132
  340   HD12  LEU  41          HD12      LEU  41   6.464  -2.632   3.718
  341   HD13  LEU  41          HD13      LEU  41   7.081  -2.066   2.166
  342   HD21  LEU  41          HD21      LEU  41   7.994  -4.887   1.040
  343   HD22  LEU  41          HD22      LEU  41   7.239  -3.483   0.287
  344   HD23  LEU  41          HD23      LEU  41   6.430  -5.049   0.242
  345    H    GLU  42           HN       GLU  42   3.997  -7.188   4.210
  346    HA   GLU  42           HA       GLU  42   5.515  -8.934   5.814
  347    HB2  GLU  42           HB2      GLU  42   3.430  -7.709   6.500
  348    HB3  GLU  42           HB1      GLU  42   2.503  -8.848   5.536
  349    HG2  GLU  42           HG2      GLU  42   3.358 -10.682   6.955
  350    HG3  GLU  42           HG1      GLU  42   4.179  -9.484   7.953
  351    H    LYS  43           HN       LYS  43   3.326  -9.494   3.111
  352    HA   LYS  43           HA       LYS  43   3.196 -12.303   3.345
  353    HB2  LYS  43           HB2      LYS  43   2.402 -10.283   1.376
  354    HB3  LYS  43           HB1      LYS  43   2.816 -11.838   0.668
  355    HG2  LYS  43           HG2      LYS  43   0.463 -11.782   1.097
  356    HG3  LYS  43           HG1      LYS  43   1.216 -12.921   2.214
  357    HD2  LYS  43           HD2      LYS  43   1.233 -11.111   3.932
  358    HD3  LYS  43           HD1      LYS  43   0.307 -10.108   2.812
  359    HE2  LYS  43           HE2      LYS  43  -1.500 -11.718   2.812
  360    HE3  LYS  43           HE1      LYS  43  -0.562 -12.811   3.830
  361    HZ1  LYS  43           HZ1      LYS  43  -1.656 -10.158   4.565
  362    HZ2  LYS  43           HZ2      LYS  43  -0.549 -11.007   5.526
  363    HZ3  LYS  43           HZ3      LYS  43  -2.079 -11.666   5.218
  364    H    LEU  44           HN       LEU  44   5.272 -10.235   1.330
  365    HA   LEU  44           HA       LEU  44   6.736 -12.536   0.362
  366    HB2  LEU  44           HB2      LEU  44   8.094 -10.864  -0.857
  367    HB3  LEU  44           HB1      LEU  44   6.378 -10.744  -1.186
  368    HG   LEU  44           HG       LEU  44   6.640  -8.924   0.825
  369   HD11  LEU  44          HD11      LEU  44   9.141  -8.677  -0.838
  370   HD12  LEU  44          HD12      LEU  44   9.097  -9.243   0.832
  371   HD13  LEU  44          HD13      LEU  44   8.604  -7.593   0.447
  372   HD21  LEU  44          HD21      LEU  44   7.002  -8.461  -2.131
  373   HD22  LEU  44          HD22      LEU  44   6.555  -7.234  -0.946
  374   HD23  LEU  44          HD23      LEU  44   5.466  -8.583  -1.271
  375    H    GLU  45           HN       GLU  45   7.122 -10.011   2.704
  376    HA   GLU  45           HA       GLU  45   8.828  -9.294   4.015
  377    HB2  GLU  45           HB2      GLU  45   9.533 -11.242   5.602
  378    HB3  GLU  45           HB1      GLU  45   7.887 -10.636   5.613
  379    HG2  GLU  45           HG2      GLU  45   7.250 -12.531   4.137
  380    HG3  GLU  45           HG1      GLU  45   8.887 -13.158   4.315
  381    H1   MET  46           HT1      MET  46  -4.912   0.234 -13.702
  382    H2   MET  46           HT2      MET  46  -6.415   0.459 -12.963
  383    H3   MET  46           HT3      MET  46  -5.461  -0.870 -12.542
  384    HA   MET  46           HA       MET  46  -5.356   0.808 -10.828
  385    HB2  MET  46           HB2      MET  46  -2.812   0.579 -12.453
  386    HB3  MET  46           HB1      MET  46  -2.894   1.149 -10.793
  387    HG2  MET  46           HG2      MET  46  -3.708  -1.019 -10.068
  388    HG3  MET  46           HG1      MET  46  -3.679  -1.600 -11.733
  389    HE1  MET  46           HE1      MET  46  -2.293  -3.109  -9.350
  390    HE2  MET  46           HE2      MET  46  -0.729  -3.537 -10.043
  391    HE3  MET  46           HE3      MET  46  -2.194  -3.684 -11.014
  392    H    ALA  47           HN       ALA  47  -6.356   2.749 -10.908
  393    HA   ALA  47           HA       ALA  47  -5.126   4.845 -12.592
  394    HB1  ALA  47           HB1      ALA  47  -7.995   4.535 -11.700
  395    HB2  ALA  47           HB2      ALA  47  -7.377   4.417 -13.347
  396    HB3  ALA  47           HB3      ALA  47  -7.351   5.966 -12.505
  397    H    THR  48           HN       THR  48  -3.996   4.214 -10.233
  398    HA   THR  48           HA       THR  48  -5.044   5.526  -7.978
  399    HB   THR  48           HB       THR  48  -2.864   5.170  -6.957
  400    HG1  THR  48           HG1      THR  48  -1.503   3.883  -8.782
  401   HG21  THR  48          HG21      THR  48  -3.624   2.820  -8.696
  402   HG22  THR  48          HG22      THR  48  -4.396   3.248  -7.169
  403   HG23  THR  48          HG23      THR  48  -2.702   2.756  -7.193
  404    H    THR  49           HN       THR  49  -4.519   7.424  -7.015
  405    HA   THR  49           HA       THR  49  -3.168   9.428  -8.704
  406    HB   THR  49           HB       THR  49  -5.364   9.871  -6.658
  407    HG1  THR  49           HG1      THR  49  -6.221   8.861  -8.480
  408   HG21  THR  49          HG21      THR  49  -3.954  11.838  -6.883
  409   HG22  THR  49          HG22      THR  49  -5.506  12.129  -7.670
  410   HG23  THR  49          HG23      THR  49  -4.080  11.759  -8.640
  411    H    THR  50           HN       THR  50  -2.022  11.156  -7.441
  412    HA   THR  50           HA       THR  50  -0.508   9.991  -5.286
  413    HB   THR  50           HB       THR  50   0.340  12.558  -5.368
  414    HG1  THR  50           HG1      THR  50  -0.149  13.517  -7.207
  415   HG21  THR  50          HG21      THR  50   1.071  10.367  -7.314
  416   HG22  THR  50          HG22      THR  50   1.774  10.634  -5.718
  417   HG23  THR  50          HG23      THR  50   2.038  11.809  -7.005
  418    H    LEU  51           HN       LEU  51  -1.686   9.806  -3.438
  419    HA   LEU  51           HA       LEU  51  -2.744  12.298  -2.283
  420    HB2  LEU  51           HB2      LEU  51  -4.297  10.288  -1.168
  421    HB3  LEU  51           HB1      LEU  51  -4.807  11.462  -2.364
  422    HG   LEU  51           HG       LEU  51  -3.962   9.753  -4.107
  423   HD11  LEU  51          HD11      LEU  51  -4.276   7.954  -1.713
  424   HD12  LEU  51          HD12      LEU  51  -2.757   8.334  -2.525
  425   HD13  LEU  51          HD13      LEU  51  -4.014   7.439  -3.379
  426   HD21  LEU  51          HD21      LEU  51  -6.321  10.312  -3.722
  427   HD22  LEU  51          HD22      LEU  51  -6.387   9.109  -2.434
  428   HD23  LEU  51          HD23      LEU  51  -6.100   8.604  -4.099
  429    H    GLY  52           HN       GLY  52  -3.048  12.106   0.129
  430    HA2  GLY  52           HA2      GLY  52  -0.603  11.335   1.331
  431    HA3  GLY  52           HA1      GLY  52  -2.043  11.876   2.181
  432    H    VAL  53           HN       VAL  53   0.039   9.393   1.828
  433    HA   VAL  53           HA       VAL  53  -1.899   7.442   2.882
  434    HB   VAL  53           HB       VAL  53   0.274   6.938   0.855
  435   HG11  VAL  53          HG11      VAL  53   0.234   5.067   2.362
  436   HG12  VAL  53          HG12      VAL  53  -0.494   4.599   0.825
  437   HG13  VAL  53          HG13      VAL  53  -1.519   4.947   2.217
  438   HG21  VAL  53          HG21      VAL  53  -1.586   6.195  -0.583
  439   HG22  VAL  53          HG22      VAL  53  -1.703   7.896  -0.134
  440   HG23  VAL  53          HG23      VAL  53  -2.720   6.700   0.669
  441    H    LYS  54           HN       LYS  54  -0.892   5.776   4.209
  442    HA   LYS  54           HA       LYS  54   1.290   6.882   5.783
  443    HB2  LYS  54           HB2      LYS  54  -0.281   4.362   6.311
  444    HB3  LYS  54           HB1      LYS  54   0.654   5.307   7.460
  445    HG2  LYS  54           HG2      LYS  54  -1.903   6.167   6.120
  446    HG3  LYS  54           HG1      LYS  54  -1.729   5.631   7.791
  447    HD2  LYS  54           HD2      LYS  54  -0.294   8.022   6.647
  448    HD3  LYS  54           HD1      LYS  54  -1.854   8.122   7.462
  449    HE2  LYS  54           HE2      LYS  54  -0.437   8.578   9.206
  450    HE3  LYS  54           HE1      LYS  54  -0.588   6.828   9.362
  451    HZ1  LYS  54           HZ1      LYS  54   1.510   6.491   8.450
  452    HZ2  LYS  54           HZ2      LYS  54   1.734   7.830   9.459
  453    HZ3  LYS  54           HZ3      LYS  54   1.591   8.046   7.787
  454    H    LEU  55           HN       LEU  55   3.186   6.474   4.716
  455    HA   LEU  55           HA       LEU  55   3.876   3.633   4.365
  456    HB2  LEU  55           HB2      LEU  55   3.713   5.632   2.316
  457    HB3  LEU  55           HB1      LEU  55   5.390   5.163   2.511
  458    HG   LEU  55           HG       LEU  55   3.169   3.170   2.064
  459   HD11  LEU  55          HD11      LEU  55   4.794   4.754   0.127
  460   HD12  LEU  55          HD12      LEU  55   3.089   4.303   0.063
  461   HD13  LEU  55          HD13      LEU  55   4.333   3.098  -0.265
  462   HD21  LEU  55          HD21      LEU  55   6.169   3.036   1.988
  463   HD22  LEU  55          HD22      LEU  55   5.129   1.789   1.304
  464   HD23  LEU  55          HD23      LEU  55   5.066   2.139   3.031
  465    H    ASP  56           HN       ASP  56   5.939   3.074   4.973
  466    HA   ASP  56           HA       ASP  56   7.353   5.005   6.630
  467    HB2  ASP  56           HB2      ASP  56   7.125   2.116   6.518
  468    HB3  ASP  56           HB1      ASP  56   8.816   2.601   6.533
  469    H    ASP  57           HN       ASP  57   9.355   5.848   6.163
  470    HA   ASP  57           HA       ASP  57  10.190   6.071   3.514
  471    HB2  ASP  57           HB2      ASP  57  11.380   6.766   6.141
  472    HB3  ASP  57           HB1      ASP  57  12.493   6.662   4.781
  473    HA   PRO  58           HA       PRO  58  13.665   2.768   4.407
  474    HB2  PRO  58           HB2      PRO  58  13.035   0.985   6.416
  475    HB3  PRO  58           HB1      PRO  58  14.120   2.365   6.611
  476    HG2  PRO  58           HG2      PRO  58  11.236   2.101   7.350
  477    HG3  PRO  58           HG1      PRO  58  12.556   2.888   8.235
  478    HD2  PRO  58           HD2      PRO  58  10.756   4.304   6.830
  479    HD3  PRO  58           HD1      PRO  58  12.458   4.799   6.934
  480    H    THR  59           HN       THR  59  10.300   2.008   5.145
  481    HA   THR  59           HA       THR  59  10.319  -0.522   3.856
  482    HB   THR  59           HB       THR  59   8.454   1.011   5.377
  483    HG1  THR  59           HG1      THR  59   7.908  -1.592   4.498
  484   HG21  THR  59          HG21      THR  59   7.315   1.585   3.309
  485   HG22  THR  59          HG22      THR  59   6.359   0.421   4.227
  486   HG23  THR  59          HG23      THR  59   7.292  -0.111   2.829
  487    H    ARG  60           HN       ARG  60   9.867   2.768   2.806
  488    HA   ARG  60           HA       ARG  60   8.674   2.244   0.300
  489    HB2  ARG  60           HB2      ARG  60   8.843   4.512   1.344
  490    HB3  ARG  60           HB1      ARG  60  10.566   4.509   0.991
  491    HG2  ARG  60           HG2      ARG  60  10.065   4.357  -1.403
  492    HG3  ARG  60           HG1      ARG  60   8.340   4.372  -1.032
  493    HD2  ARG  60           HD2      ARG  60   8.708   6.581   0.105
  494    HD3  ARG  60           HD1      ARG  60  10.343   6.564  -0.552
  495    HE   ARG  60           HE       ARG  60   9.493   6.952  -2.676
  496   HH11  ARG  60          HH21      ARG  60   6.916   6.463  -0.360
  497   HH12  ARG  60          HH22      ARG  60   5.682   7.123  -1.383
  498   HH21  ARG  60          HH11      ARG  60   7.869   7.821  -4.044
  499   HH22  ARG  60          HH12      ARG  60   6.230   7.902  -3.485
  500    H    GLU  61           HN       GLU  61  12.007   2.381   1.447
  501    HA   GLU  61           HA       GLU  61  13.321   1.986  -1.002
  502    HB2  GLU  61           HB2      GLU  61  14.123   0.974   1.740
  503    HB3  GLU  61           HB1      GLU  61  15.189   1.114   0.349
  504    HG2  GLU  61           HG2      GLU  61  13.815   3.391   1.754
  505    HG3  GLU  61           HG1      GLU  61  15.513   2.947   1.915
  506    H    ARG  62           HN       ARG  62  11.906  -0.243   1.334
  507    HA   ARG  62           HA       ARG  62  12.638  -2.659   0.096
  508    HB2  ARG  62           HB2      ARG  62  11.725  -2.582   2.369
  509    HB3  ARG  62           HB1      ARG  62  10.174  -2.042   1.744
  510    HG2  ARG  62           HG2      ARG  62  10.131  -4.406   2.317
  511    HG3  ARG  62           HG1      ARG  62   9.879  -4.161   0.589
  512    HD2  ARG  62           HD2      ARG  62  11.496  -6.026   1.417
  513    HD3  ARG  62           HD1      ARG  62  11.935  -5.034   0.029
  514    HE   ARG  62           HE       ARG  62  12.901  -4.108   2.604
  515   HH11  ARG  62          HH21      ARG  62  13.559  -5.989  -0.264
  516   HH12  ARG  62          HH22      ARG  62  15.282  -5.869  -0.117
  517   HH21  ARG  62          HH11      ARG  62  15.190  -3.937   2.810
  518   HH22  ARG  62          HH12      ARG  62  16.210  -4.705   1.640
  519    H    LEU  63           HN       LEU  63   9.958  -0.441  -0.434
  520    HA   LEU  63           HA       LEU  63   8.499  -1.996  -2.253
  521    HB2  LEU  63           HB2      LEU  63   8.649   0.876  -1.572
  522    HB3  LEU  63           HB1      LEU  63   8.038   0.511  -3.173
  523    HG   LEU  63           HG       LEU  63   6.347  -1.009  -2.075
  524   HD11  LEU  63          HD11      LEU  63   7.163   0.443   0.431
  525   HD12  LEU  63          HD12      LEU  63   7.582  -1.231   0.069
  526   HD13  LEU  63          HD13      LEU  63   5.891  -0.766   0.258
  527   HD21  LEU  63          HD21      LEU  63   4.959   0.929  -1.248
  528   HD22  LEU  63          HD22      LEU  63   5.598   1.076  -2.885
  529   HD23  LEU  63          HD23      LEU  63   6.362   1.952  -1.558
  530    H    LYS  64           HN       LYS  64  11.263   0.205  -2.732
  531    HA   LYS  64           HA       LYS  64  11.296   0.077  -5.539
  532    HB2  LYS  64           HB2      LYS  64  12.698   1.655  -4.190
  533    HB3  LYS  64           HB1      LYS  64  13.733   0.294  -3.769
  534    HG2  LYS  64           HG2      LYS  64  14.166  -0.060  -6.187
  535    HG3  LYS  64           HG1      LYS  64  13.243   1.403  -6.526
  536    HD2  LYS  64           HD2      LYS  64  14.846   2.647  -5.056
  537    HD3  LYS  64           HD1      LYS  64  15.816   1.174  -4.976
  538    HE2  LYS  64           HE2      LYS  64  15.137   2.781  -7.436
  539    HE3  LYS  64           HE1      LYS  64  16.720   2.608  -6.682
  540    HZ1  LYS  64           HZ1      LYS  64  15.169   0.444  -8.005
  541    HZ2  LYS  64           HZ2      LYS  64  16.657   0.236  -7.230
  542    HZ3  LYS  64           HZ3      LYS  64  16.556   1.198  -8.617
  543    H    ALA  65           HN       ALA  65  12.680  -1.975  -3.096
  544    HA   ALA  65           HA       ALA  65  14.064  -3.753  -4.793
  545    HB1  ALA  65           HB1      ALA  65  12.917  -4.128  -2.029
  546    HB2  ALA  65           HB2      ALA  65  14.590  -3.777  -2.464
  547    HB3  ALA  65           HB3      ALA  65  13.888  -5.347  -2.854
  548    H    ALA  66           HN       ALA  66  10.777  -3.619  -3.582
  549    HA   ALA  66           HA       ALA  66   9.907  -6.079  -4.689
  550    HB1  ALA  66           HB1      ALA  66   8.817  -4.515  -2.887
  551    HB2  ALA  66           HB2      ALA  66   7.813  -5.508  -3.938
  552    HB3  ALA  66           HB3      ALA  66   8.030  -3.794  -4.292
  553    H    ALA  67           HN       ALA  67  10.093  -2.781  -5.840
  554    HA   ALA  67           HA       ALA  67   8.595  -2.956  -8.190
  555    HB1  ALA  67           HB1      ALA  67   9.476  -0.859  -7.144
  556    HB2  ALA  67           HB2      ALA  67   9.715  -0.961  -8.889
  557    HB3  ALA  67           HB3      ALA  67  11.060  -1.278  -7.794
  558    H    GLN  68           HN       GLN  68  12.058  -3.297  -7.750
  559    HA   GLN  68           HA       GLN  68  12.608  -4.030 -10.426
  560    HB2  GLN  68           HB2      GLN  68  14.781  -4.780  -9.597
  561    HB3  GLN  68           HB1      GLN  68  14.346  -3.249  -8.896
  562    HG2  GLN  68           HG2      GLN  68  15.021  -4.195  -6.990
  563    HG3  GLN  68           HG1      GLN  68  13.395  -4.873  -7.003
  564   HE21  GLN  68          HE21      GLN  68  13.860  -6.740  -5.943
  565   HE22  GLN  68          HE22      GLN  68  14.866  -7.987  -6.596
  566    H    SER  69           HN       SER  69  11.662  -5.760  -7.587
  567    HA   SER  69           HA       SER  69  12.325  -8.306  -8.464
  568    HB2  SER  69           HB2      SER  69  11.812  -7.649  -6.089
  569    HB3  SER  69           HB1      SER  69  10.107  -7.604  -6.529
  570    HG   SER  69           HG       SER  69  10.075  -9.751  -6.717
  571    H    ILE  70           HN       ILE  70   9.435  -6.336  -8.871
  572    HA   ILE  70           HA       ILE  70   8.090  -8.517 -10.271
  573    HB   ILE  70           HB       ILE  70   6.825  -7.253  -8.566
  574   HG12  ILE  70          HG12      ILE  70   4.791  -6.866  -9.902
  575   HG13  ILE  70          HG11      ILE  70   5.751  -6.902 -11.376
  576   HG21  ILE  70          HG21      ILE  70   6.057  -4.962  -9.121
  577   HG22  ILE  70          HG22      ILE  70   7.202  -4.948 -10.462
  578   HG23  ILE  70          HG23      ILE  70   7.788  -5.076  -8.804
  579   HD11  ILE  70          HD11      ILE  70   5.529  -9.217  -9.472
  580   HD12  ILE  70          HD12      ILE  70   6.235  -9.214 -11.088
  581   HD13  ILE  70          HD13      ILE  70   4.498  -8.993 -10.884
  582    H    ASP  71           HN       ASP  71  10.121  -6.023 -11.025
  583    HA   ASP  71           HA       ASP  71  10.956  -5.325 -12.993
  584    HB2  ASP  71           HB2      ASP  71  10.666  -6.569 -14.842
  585    HB3  ASP  71           HB1      ASP  71   9.669  -7.577 -13.816
  586    H    ARG  72           HN       ARG  72   9.034  -3.901 -11.415
  587    HA   ARG  72           HA       ARG  72   7.919  -2.116 -13.492
  588    HB2  ARG  72           HB2      ARG  72   6.861  -2.826 -10.762
  589    HB3  ARG  72           HB1      ARG  72   6.307  -1.408 -11.639
  590    HG2  ARG  72           HG2      ARG  72   5.257  -2.666 -13.273
  591    HG3  ARG  72           HG1      ARG  72   6.218  -4.105 -12.923
  592    HD2  ARG  72           HD2      ARG  72   4.899  -4.728 -11.181
  593    HD3  ARG  72           HD1      ARG  72   4.525  -3.067 -10.732
  594    HE   ARG  72           HE       ARG  72   2.614  -3.246 -11.936
  595   HH11  ARG  72          HH21      ARG  72   4.863  -5.619 -13.204
  596   HH12  ARG  72          HH22      ARG  72   3.710  -6.305 -14.299
  597   HH21  ARG  72          HH11      ARG  72   1.093  -4.164 -13.373
  598   HH22  ARG  72          HH12      ARG  72   1.564  -5.476 -14.396
  599    H    THR  73           HN       THR  73   7.900   0.162 -12.994
  600    HA   THR  73           HA       THR  73  10.313   0.993 -11.672
  601    HB   THR  73           HB       THR  73   9.172   2.016 -13.812
  602    HG1  THR  73           HG1      THR  73  10.528   3.654 -13.529
  603   HG21  THR  73          HG21      THR  73   7.029   2.538 -12.665
  604   HG22  THR  73          HG22      THR  73   7.781   3.947 -13.412
  605   HG23  THR  73          HG23      THR  73   7.889   3.710 -11.668
  606    HA   PRO  74           HA       PRO  74   9.092   1.804  -7.498
  607    HB2  PRO  74           HB2      PRO  74   9.678   4.666  -8.169
  608    HB3  PRO  74           HB1      PRO  74  10.122   3.737  -6.731
  609    HG2  PRO  74           HG2      PRO  74  11.890   4.145  -8.685
  610    HG3  PRO  74           HG1      PRO  74  11.819   2.599  -7.822
  611    HD2  PRO  74           HD2      PRO  74  10.995   3.252 -10.586
  612    HD3  PRO  74           HD1      PRO  74  11.481   1.695  -9.889
  613    H    HIS  75           HN       HIS  75   7.986   4.566  -9.528
  614    HA   HIS  75           HA       HIS  75   5.740   5.137  -7.942
  615    HB2  HIS  75           HB2      HIS  75   6.481   5.801 -10.769
  616    HB3  HIS  75           HB1      HIS  75   4.873   6.199 -10.169
  617    HD1  HIS  75           HD1      HIS  75   7.686   7.995 -10.804
  618    HD2  HIS  75           HD2      HIS  75   5.551   7.394  -7.283
  619    HE1  HIS  75           HE1      HIS  75   8.305   9.919  -9.307
  620    HE2  HIS  75           HE2      HIS  75   6.840   9.649  -7.276
  621    H    TRP  76           HN       TRP  76   6.003   3.142 -10.874
  622    HA   TRP  76           HA       TRP  76   3.260   2.483 -10.985
  623    HB2  TRP  76           HB2      TRP  76   4.927   2.187 -12.873
  624    HB3  TRP  76           HB1      TRP  76   5.522   0.769 -12.017
  625    HD1  TRP  76           HD1      TRP  76   3.454  -1.144 -11.513
  626    HE1  TRP  76           HE1      TRP  76   1.653  -1.942 -13.167
  627    HE3  TRP  76           HE3      TRP  76   3.595   2.744 -14.829
  628    HZ2  TRP  76           HZ2      TRP  76   0.457  -1.060 -15.553
  629    HZ3  TRP  76           HZ3      TRP  76   2.089   2.686 -16.774
  630    HH2  TRP  76           HH2      TRP  76   0.553   0.821 -17.127
  631    H    LEU  77           HN       LEU  77   6.042   1.058  -9.486
  632    HA   LEU  77           HA       LEU  77   4.887  -1.297  -8.550
  633    HB2  LEU  77           HB2      LEU  77   7.298  -0.952  -8.547
  634    HB3  LEU  77           HB1      LEU  77   7.130   0.310  -7.345
  635    HG   LEU  77           HG       LEU  77   7.942  -2.013  -6.583
  636   HD11  LEU  77          HD11      LEU  77   7.263  -0.180  -5.077
  637   HD12  LEU  77          HD12      LEU  77   6.921  -1.785  -4.431
  638   HD13  LEU  77          HD13      LEU  77   5.616  -0.810  -5.106
  639   HD21  LEU  77          HD21      LEU  77   6.235  -3.314  -7.763
  640   HD22  LEU  77          HD22      LEU  77   4.990  -2.590  -6.747
  641   HD23  LEU  77          HD23      LEU  77   6.222  -3.627  -6.028
  642    H    ILE  78           HN       ILE  78   5.037   1.903  -7.132
  643    HA   ILE  78           HA       ILE  78   4.023   1.223  -4.618
  644    HB   ILE  78           HB       ILE  78   3.690   3.804  -6.156
  645   HG12  ILE  78          HG12      ILE  78   5.542   3.128  -3.864
  646   HG13  ILE  78          HG11      ILE  78   6.017   3.052  -5.557
  647   HG21  ILE  78          HG21      ILE  78   1.950   3.666  -4.487
  648   HG22  ILE  78          HG22      ILE  78   3.180   4.818  -3.964
  649   HG23  ILE  78          HG23      ILE  78   3.127   3.203  -3.257
  650   HD11  ILE  78          HD11      ILE  78   5.195   5.484  -3.999
  651   HD12  ILE  78          HD12      ILE  78   5.447   5.468  -5.744
  652   HD13  ILE  78          HD13      ILE  78   6.788   5.110  -4.656
  653    H    LYS  79           HN       LYS  79   2.335   2.198  -7.595
  654    HA   LYS  79           HA       LYS  79  -0.298   1.981  -6.595
  655    HB2  LYS  79           HB2      LYS  79   0.201   1.035  -9.374
  656    HB3  LYS  79           HB1      LYS  79  -1.004   2.165  -8.779
  657    HG2  LYS  79           HG2      LYS  79   0.778   3.866  -8.544
  658    HG3  LYS  79           HG1      LYS  79   1.909   2.729  -9.273
  659    HD2  LYS  79           HD2      LYS  79  -0.578   3.853 -10.561
  660    HD3  LYS  79           HD1      LYS  79   1.084   4.308 -10.930
  661    HE2  LYS  79           HE2      LYS  79   1.449   1.849 -11.508
  662    HE3  LYS  79           HE1      LYS  79  -0.307   1.702 -11.479
  663    HZ1  LYS  79           HZ1      LYS  79  -0.313   3.603 -13.120
  664    HZ2  LYS  79           HZ2      LYS  79   0.270   2.125 -13.700
  665    HZ3  LYS  79           HZ3      LYS  79   1.353   3.356 -13.291
  666    H    GLN  80           HN       GLN  80   1.811  -0.336  -8.164
  667    HA   GLN  80           HA       GLN  80   0.120  -2.579  -8.154
  668    HB2  GLN  80           HB2      GLN  80   1.907  -2.646  -9.651
  669    HB3  GLN  80           HB1      GLN  80   3.069  -2.135  -8.440
  670    HG2  GLN  80           HG2      GLN  80   3.479  -4.419  -8.998
  671    HG3  GLN  80           HG1      GLN  80   2.854  -4.342  -7.353
  672   HE21  GLN  80          HE21      GLN  80   2.152  -6.448  -7.367
  673   HE22  GLN  80          HE22      GLN  80   0.777  -6.973  -8.286
  674    H    ALA  81           HN       ALA  81   2.486  -1.443  -5.801
  675    HA   ALA  81           HA       ALA  81   2.671  -3.739  -4.222
  676    HB1  ALA  81           HB1      ALA  81   3.411  -2.126  -2.432
  677    HB2  ALA  81           HB2      ALA  81   3.086  -0.833  -3.586
  678    HB3  ALA  81           HB3      ALA  81   4.302  -2.057  -3.952
  679    H    ILE  82           HN       ILE  82   0.612  -0.857  -3.731
  680    HA   ILE  82           HA       ILE  82  -0.664  -2.018  -1.470
  681    HB   ILE  82           HB       ILE  82  -0.595   0.438  -1.905
  682   HG12  ILE  82          HG12      ILE  82  -2.996   0.839  -1.218
  683   HG13  ILE  82          HG11      ILE  82  -3.271  -0.883  -1.458
  684   HG21  ILE  82          HG21      ILE  82  -2.817  -0.049  -3.873
  685   HG22  ILE  82          HG22      ILE  82  -1.146   0.275  -4.335
  686   HG23  ILE  82          HG23      ILE  82  -2.067   1.491  -3.450
  687   HD11  ILE  82          HD11      ILE  82  -1.853  -1.463   0.311
  688   HD12  ILE  82          HD12      ILE  82  -2.794  -0.094   0.904
  689   HD13  ILE  82          HD13      ILE  82  -1.131   0.144   0.370
  690    H    PHE  83           HN       PHE  83  -1.278  -1.989  -4.903
  691    HA   PHE  83           HA       PHE  83  -3.826  -3.251  -4.791
  692    HB2  PHE  83           HB2      PHE  83  -1.850  -2.586  -6.904
  693    HB3  PHE  83           HB1      PHE  83  -2.924  -3.937  -7.244
  694    HD1  PHE  83           HD1      PHE  83  -3.108  -0.446  -5.931
  695    HD2  PHE  83           HD2      PHE  83  -4.883  -3.488  -8.319
  696    HE1  PHE  83           HE1      PHE  83  -4.869   1.124  -6.618
  697    HE2  PHE  83           HE2      PHE  83  -6.648  -1.921  -9.011
  698    HZ   PHE  83           HZ       PHE  83  -6.641   0.388  -8.160
  699    H    ASN  84           HN       ASN  84  -0.515  -4.354  -4.763
  700    HA   ASN  84           HA       ASN  84  -1.025  -7.040  -5.441
  701    HB2  ASN  84           HB2      ASN  84   1.251  -5.880  -5.390
  702    HB3  ASN  84           HB1      ASN  84   1.222  -6.140  -3.647
  703   HD21  ASN  84          HD21      ASN  84   1.222  -7.715  -6.769
  704   HD22  ASN  84          HD22      ASN  84   1.856  -9.222  -6.225
  705    H    TYR  85           HN       TYR  85  -0.988  -5.227  -2.440
  706    HA   TYR  85           HA       TYR  85  -1.335  -7.372  -0.681
  707    HB2  TYR  85           HB2      TYR  85  -0.887  -5.264   0.322
  708    HB3  TYR  85           HB1      TYR  85  -2.180  -4.477  -0.574
  709    HD1  TYR  85           HD1      TYR  85  -2.112  -7.530   1.579
  710    HD2  TYR  85           HD2      TYR  85  -3.748  -3.661   0.924
  711    HE1  TYR  85           HE1      TYR  85  -3.611  -7.844   3.499
  712    HE2  TYR  85           HE2      TYR  85  -5.251  -3.967   2.849
  713    HH   TYR  85           HH       TYR  85  -5.988  -5.393   4.402
  714    H    LEU  86           HN       LEU  86  -3.579  -5.349  -2.448
  715    HA   LEU  86           HA       LEU  86  -5.933  -6.665  -1.594
  716    HB2  LEU  86           HB2      LEU  86  -5.441  -4.942  -4.013
  717    HB3  LEU  86           HB1      LEU  86  -7.020  -5.413  -3.410
  718    HG   LEU  86           HG       LEU  86  -5.010  -3.670  -1.982
  719   HD11  LEU  86          HD11      LEU  86  -7.692  -3.062  -3.203
  720   HD12  LEU  86          HD12      LEU  86  -6.119  -2.521  -3.789
  721   HD13  LEU  86          HD13      LEU  86  -6.731  -1.941  -2.240
  722   HD21  LEU  86          HD21      LEU  86  -7.680  -4.745  -1.105
  723   HD22  LEU  86          HD22      LEU  86  -6.904  -3.352  -0.354
  724   HD23  LEU  86          HD23      LEU  86  -6.118  -4.930  -0.307
  725    H    GLU  87           HN       GLU  87  -3.758  -7.089  -4.298
  726    HA   GLU  87           HA       GLU  87  -5.284  -8.833  -5.877
  727    HB2  GLU  87           HB2      GLU  87  -3.190  -7.647  -6.572
  728    HB3  GLU  87           HB1      GLU  87  -2.273  -8.776  -5.587
  729    HG2  GLU  87           HG2      GLU  87  -3.069 -10.626  -6.984
  730    HG3  GLU  87           HG1      GLU  87  -3.965  -9.478  -7.977
  731    H    LYS  88           HN       LYS  88  -3.107  -9.434  -3.168
  732    HA   LYS  88           HA       LYS  88  -3.042 -12.246  -3.405
  733    HB2  LYS  88           HB2      LYS  88  -2.203 -10.246  -1.432
  734    HB3  LYS  88           HB1      LYS  88  -2.638 -11.799  -0.732
  735    HG2  LYS  88           HG2      LYS  88  -0.285 -11.776  -1.172
  736    HG3  LYS  88           HG1      LYS  88  -1.059 -12.897  -2.292
  737    HD2  LYS  88           HD2      LYS  88  -1.054 -11.075  -4.000
  738    HD3  LYS  88           HD1      LYS  88  -0.108 -10.095  -2.878
  739    HE2  LYS  88           HE2      LYS  88   1.676 -11.728  -2.898
  740    HE3  LYS  88           HE1      LYS  88   0.716 -12.805  -3.911
  741    HZ1  LYS  88           HZ1      LYS  88   1.845 -10.167  -4.652
  742    HZ2  LYS  88           HZ2      LYS  88   0.723 -11.001  -5.609
  743    HZ3  LYS  88           HZ3      LYS  88   2.244 -11.680  -5.308
  744    H    LEU  89           HN       LEU  89  -5.097 -10.127  -1.421
  745    HA   LEU  89           HA       LEU  89  -6.604 -12.404  -0.442
  746    HB2  LEU  89           HB2      LEU  89  -7.920 -10.705   0.787
  747    HB3  LEU  89           HB1      LEU  89  -6.201 -10.633   1.116
  748    HG   LEU  89           HG       LEU  89  -6.411  -8.795  -0.883
  749   HD11  LEU  89          HD11      LEU  89  -8.907  -8.488   0.777
  750   HD12  LEU  89          HD12      LEU  89  -8.877  -9.052  -0.894
  751   HD13  LEU  89          HD13      LEU  89  -8.341  -7.417  -0.505
  752   HD21  LEU  89          HD21      LEU  89  -6.766  -8.341   2.076
  753   HD22  LEU  89          HD22      LEU  89  -6.287  -7.118   0.899
  754   HD23  LEU  89          HD23      LEU  89  -5.233  -8.496   1.217
  755    H    GLU  90           HN       GLU  90  -6.885  -9.937  -2.832
  756    HA   GLU  90           HA       GLU  90  -8.538  -9.172  -4.176
  757    HB2  GLU  90           HB2      GLU  90  -9.399 -11.232  -5.619
  758    HB3  GLU  90           HB1      GLU  90  -7.784 -10.568  -5.780
  759    HG2  GLU  90           HG2      GLU  90  -7.036 -12.359  -4.154
  760    HG3  GLU  90           HG1      GLU  90  -8.627 -13.085  -4.377